0 B8R0.23 BC(CC(=O)O)C(=O)O Amb28287358 [0,0,0,0,0,0|1,0,0]=1 1 B8R0.23 C=C(Br)CC(N)C(=O)O Amb24557771 [0,0,0,0,0,0|3,0,0]=3 2 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O Amb22746251 [0,0,0,0,0,0|3,0,0]=3 3 B8R0.23 C=C(Br)C[C@H](N)C(=O)O Amb25918807 [0,0,0,0,0,0|3,0,0]=3 4 B8R0.23 C=C(Br)[C@@H](O)CC(=O)O Amb27392180 [0,0,0,0,0,0|2,0,0]=2 5 B8R0.23 C=C(C)C(C)CC(=O)O Amb18642614 [0,0,0,0,0,0|3,0,0]=3 6 B8R0.23 C=C(C)C(C)CC(C)=O Amb27607290 [0,0,0,0,0,0|4,0,0]=4 7 B8R0.23 C=C(C)C(N)CC(=O)O Amb2697570 [0,0,0,0,0,0|3,0,0]=3 8 B8R0.23 C=C(C)C(N)CC(N)=O Amb24401112 [0,0,0,0,0,0|4,0,0]=4 9 B8R0.23 C=C(C)C(O)CC(=O)O Amb18642756 [0,0,0,0,0,0|2,0,0]=2 10 B8R0.23 C=C(C)C(O)CC(C)=O Amb27605750 [0,0,0,0,0,0|3,0,0]=3 11 B8R0.23 C=C(C)CC(=O)C(=O)O Amb28073130 [0,0,0,0,0,0|2,0,2]=4 12 B8R0.23 C=C(C)CC(C)C(=O)O Amb24471924 [0,0,0,0,0,0|3,0,0]=3 13 B8R0.23 C=C(C)CC(C)C(C)=O Amb28203090 [0,0,0,0,0,0|4,0,0]=4 14 B8R0.23 C=C(C)CC(Cl)C(C)=O Amb27458140 [0,0,0,0,0,0|4,0,0]=4 15 B8R0.23 C=C(C)CC(N)C(=O)O Amb6280366 [0,0,0,0,0,0|3,0,0]=3 16 B8R0.23 C=C(C)CC(N)C(N)=O Amb26326676 [0,0,0,0,0,0|4,0,0]=4 17 B8R0.23 C=C(C)CC(O)C(=C)C Amb4035848 [0,0,0,0,0,0|4,0,0]=4 18 B8R0.23 C=C(C)CC(O)C(=O)O Amb24534477 [0,0,0,0,0,0|2,0,0]=2 19 B8R0.23 C=C(C)C[C@@H](C)C(=O)O Amb24340253 [0,0,0,0,0,0|3,0,0]=3 20 B8R0.23 C=C(C)C[C@@H](N)C(=O)O Amb22801689 [0,0,0,0,0,0|3,0,0]=3 21 B8R0.23 C=C(C)C[C@H](C)C(=O)O Amb10843988 [0,0,0,0,0,0|3,0,0]=3 22 B8R0.23 C=C(C)C[C@H](N)C(=O)O Amb25757900 [0,0,0,0,0,0|3,0,0]=3 23 B8R0.23 C=C(C)[C@@H](O)CC(=O)O Amb25789715 [0,0,0,0,0,0|2,0,0]=2 24 B8R0.23 C=C(C)[C@@H](O)CC(C)=O Amb26477424 [0,0,0,0,0,0|3,0,0]=3 25 B8R0.23 C=C(C)[C@H](C)CC(=O)O Amb27447241 [0,0,0,0,0,0|3,0,0]=3 26 B8R0.23 C=C(C)[C@H](O)CC(=O)O Amb28286173 [0,0,0,0,0,0|2,0,0]=2 27 B8R0.23 C=C(C)[C@H](O)CC(C)=O Amb27409964 [0,0,0,0,0,0|3,0,0]=3 28 B8R0.23 C=C(CC(=O)Cl)C(=O)Cl Amb17938995 [0,0,0,0,0,0|3,0,1]=4 29 B8R0.23 C=C(CC(=O)O)C(=O)O Amb6608656 [0,0,0,0,0,0|1,0,1]=2 30 B8R0.23 C=C(CC(=O)O)C(C)=O Amb27831643 [0,0,0,0,0,0|2,0,1]=3 31 B8R0.23 C=C(CC(=O)O)C(N)=O Amb22011744 [0,0,0,0,0,0|2,0,1]=3 32 B8R0.23 C=C(CN(C)O)C(=O)O Amb27640409 [0,0,0,0,0,0|3,0,1]=4 33 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb24411473 [0,0,0,0,0,0|3,0,0]=3 34 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb28935021 [0,0,0,0,0,0|3,0,0]=3 35 B8R0.23 C=C(Cl)CC(N)C(N)=O Amb33308519 [0,0,0,0,0,0|4,0,0]=4 36 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660529 [0,0,0,0,0,0|3,0,0]=3 37 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660530 [0,0,0,0,0,0|3,0,0]=3 38 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb28059492 [0,0,0,0,0,0|3,0,0]=3 39 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb32656263 [0,0,0,0,0,0|3,0,0]=3 40 B8R0.23 C=C(F)CC(C)C(=O)O Amb27975781 [0,0,0,0,0,0|3,0,0]=3 41 B8R0.23 C=C(F)CC(Cl)C(=O)O Amb27876022 [0,0,0,0,0,0|3,0,0]=3 42 B8R0.23 C=C(F)C[C@@H](N)C(=O)O Amb27771842 [0,0,0,0,0,0|3,0,0]=3 43 B8R0.23 C=C(NC(C)=O)C(=O)O Amb8513049 [0,0,0,0,0,0|3,0,1]=4 44 B8R0.23 C=C(O)CC(O)C(O)O Amb24730260 [0,0,0,0,0,0|1,0,2]=3 45 B8R0.23 CC(=O)C(=O)CC(=O)O Amb17593364 [0,0,0,0,0,0|1,0,2]=3 46 B8R0.23 CC(=O)C(Br)CC(=O)O Amb27834306 [0,0,0,0,0,0|2,0,0]=2 47 B8R0.23 CC(=O)C(C)CC(=O)O Amb18292788 [0,0,0,0,0,0|2,0,0]=2 48 B8R0.23 CC(=O)C(C)NC(N)=O Amb27778024 [0,0,0,0,0,0|4,0,0]=4 49 B8R0.23 CC(=O)C(C)SC(=O)Cl Amb32679654 [0,0,0,0,0,0|4,0,0]=4 50 B8R0.23 CC(=O)C(Cl)CC(C)O Amb27454439 [0,0,0,0,0,0|3,0,1]=4 51 B8R0.23 CC(=O)C(Cl)C[N+](=O)[O-] Amb27954705 [0,0,0,0,0,0|3,0,1]=4 52 B8R0.23 CC(=O)C(N)CC(=O)O Amb2697582 [0,0,0,0,0,0|2,0,0]=2 53 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [0,0,0,0,0,0|3,0,0]=3 54 B8R0.23 CC(=O)C(O)CC(=O)O Amb25341886 [0,0,0,0,0,0|1,0,0]=1 55 B8R0.23 CC(=O)C(O)CC(C)C Amb26845888 [0,0,0,0,0,0|3,0,1]=4 56 B8R0.23 CC(=O)CC(=O)C(=O)O Amb18642736 [0,0,0,0,0,0|1,0,2]=3 57 B8R0.23 CC(=O)CC(=O)C(C)=O Amb25806867 [0,0,0,0,0,0|2,0,2]=4 58 B8R0.23 CC(=O)CC(C)C(=O)O Amb3939893 [0,0,0,0,0,0|2,0,0]=2 59 B8R0.23 CC(=O)CC(C)C(C)=O Amb26490545 [0,0,0,0,0,0|3,0,0]=3 60 B8R0.23 CC(=O)CC(C)[N+](=O)[O-] Amb27210764 [0,0,0,0,0,0|3,0,1]=4 61 B8R0.23 CC(=O)CC(N)C(=O)O Amb18832532 [0,0,0,0,0,0|2,0,0]=2 62 B8R0.23 CC(=O)CC(N)C(=O)O Amb22546289 [0,0,0,0,0,0|2,0,0]=2 63 B8R0.23 CC(=O)CC(N)C(N)=O Amb27485103 [0,0,0,0,0,0|3,0,0]=3 64 B8R0.23 CC(=O)CC(O)C(=O)O Amb22500917 [0,0,0,0,0,0|1,0,0]=1 65 B8R0.23 CC(=O)CN(C)C(C)=O Amb27267241 [0,0,0,0,0,0|4,0,0]=4 66 B8R0.23 CC(=O)C[C@@H](N)C(=O)O Amb22745939 [0,0,0,0,0,0|2,0,0]=2 67 B8R0.23 CC(=O)C[C@@H](O)C(=O)O Amb26845481 [0,0,0,0,0,0|1,0,0]=1 68 B8R0.23 CC(=O)C[C@@H](O)C(C)C Amb25135567 [0,0,0,0,0,0|3,0,1]=4 69 B8R0.23 CC(=O)C[C@H](C)C(=O)O Amb26318005 [0,0,0,0,0,0|2,0,0]=2 70 B8R0.23 CC(=O)C[C@H](C)C(C)=O Amb28051038 [0,0,0,0,0,0|3,0,0]=3 71 B8R0.23 CC(=O)C[C@H](N)C(=O)O Amb27832342 [0,0,0,0,0,0|2,0,0]=2 72 B8R0.23 CC(=O)C[C@H](O)C(=O)O Amb24358758 [0,0,0,0,0,0|1,0,0]=1 73 B8R0.23 CC(=O)N(C)CC(=O)O Amb33526797 [0,0,0,0,0,0|3,0,0]=3 74 B8R0.23 CC(=O)N(C)CC(N)=O Amb8999134 [0,0,0,0,0,0|4,0,0]=4 75 B8R0.23 CC(=O)N(Cl)CC(=O)O Amb28366945 [0,0,0,0,0,0|3,0,0]=3 76 B8R0.23 CC(=O)NC(Br)C(C)=O Amb28285135 [0,0,0,0,0,0|4,0,0]=4 77 B8R0.23 CC(=O)NC(C)C(=O)O Amb9745652 [0,0,0,0,0,0|3,0,0]=3 78 B8R0.23 CC(=O)NC(C)C(C)=O Amb3093787 [0,0,0,0,0,0|4,0,0]=4 79 B8R0.23 CC(=O)NC(C)C(N)=O Amb4018750 [0,0,0,0,0,0|4,0,0]=4 80 B8R0.23 CC(=O)N[C@@H](C)C(=O)O Amb8390375 [0,0,0,0,0,0|3,0,0]=3 81 B8R0.23 CC(=O)N[C@@H](C)C(N)=O Amb22168264 [0,0,0,0,0,0|4,0,0]=4 82 B8R0.23 CC(=O)N[C@H](C)C(=O)O Amb19944277 [0,0,0,0,0,0|3,0,0]=3 83 B8R0.23 CC(=O)OC(C)C(=O)Cl Amb25920188 [0,0,0,0,0,0|4,0,0]=4 84 B8R0.23 CC(=O)OC(C)C(=O)O Amb22360672 [0,0,0,0,0,0|3,0,0]=3 85 B8R0.23 CC(=O)OC(C)C(C)=O Amb4021650 [0,0,0,0,0,0|4,0,0]=4 86 B8R0.23 CC(=O)OC(C)C(N)=O Amb27179906 [0,0,0,0,0,0|4,0,0]=4 87 B8R0.23 CC(=O)O[C@@H](C)C(=O)Cl Amb3939242 [0,0,0,0,0,0|4,0,0]=4 88 B8R0.23 CC(=O)O[C@@H](C)C(=O)O Amb3938984 [0,0,0,0,0,0|3,0,0]=3 89 B8R0.23 CC(=O)O[C@@H](C)C(C)=O Amb26074254 [0,0,0,0,0,0|4,0,0]=4 90 B8R0.23 CC(=O)O[C@H](C)C(=O)Cl Amb27411067 [0,0,0,0,0,0|4,0,0]=4 91 B8R0.23 CC(=O)O[C@H](C)C(=O)O Amb26458759 [0,0,0,0,0,0|3,0,0]=3 92 B8R0.23 CC(=O)O[C@H](C)C(N)=O Amb27227531 [0,0,0,0,0,0|4,0,0]=4 93 B8R0.23 CC(=O)S[C@@H](C)C(=O)O Amb26639910 [0,0,0,0,0,0|3,0,0]=3 94 B8R0.23 CC(=O)S[C@H](C)C(=O)O Amb28118658 [0,0,0,0,0,0|3,0,0]=3 95 B8R0.23 CC(=O)[C@@H](N)CC(N)=O Amb28044564 [0,0,0,0,0,0|3,0,0]=3 96 B8R0.23 CC(=O)[C@@H](O)CC(=O)O Amb28398474 [0,0,0,0,0,0|1,0,0]=1 97 B8R0.23 CC(=O)[C@@H](O)CC(C)C Amb28202353 [0,0,0,0,0,0|3,0,1]=4 98 B8R0.23 CC(=O)[C@H](C)CC(=O)O Amb25360184 [0,0,0,0,0,0|2,0,0]=2 99 B8R0.23 CC(=O)\C(Br)=C\C(=O)O Amb27983634 [0,0,0,0,0,0|2,0,2]=4 100 B8R0.23 CC(=O)\C(C)=C\C(=O)O Amb27838567 [0,0,0,0,0,0|2,0,2]=4 101 B8R0.23 CC(=O)\C=C(/C)C(=O)O Amb18642577 [0,0,0,0,0,0|2,0,2]=4 102 B8R0.23 CC(=O)\C=C(/N)C(=O)O Amb28206217 [0,0,0,0,0,0|2,0,2]=4 103 B8R0.23 CC(=O)\C=C(/O)C(=O)O Amb28122229 [0,0,0,0,0,0|1,0,2]=3 104 B8R0.23 CC(=O)\C=C(\Br)C(=O)O Amb27419942 [0,0,0,0,0,0|2,0,2]=4 105 B8R0.23 CC(=O)\C=C(\O)C(=O)O Amb25856143 [0,0,0,0,0,0|1,0,2]=3 106 B8R0.23 CC(=S)NC(C)C(=O)O Amb27876447 [0,0,0,0,0,0|3,1,0]=4 107 B8R0.23 CC(Br)CC(C)C(=O)O Amb27760411 [0,0,0,0,0,0|3,0,1]=4 108 B8R0.23 CC(C)=C(C)CC(=O)O Amb18642613 [0,0,0,0,0,0|3,0,1]=4 109 B8R0.23 CC(C)=CC(O)C(=O)O Amb28346343 [0,0,0,0,0,0|2,0,1]=3 110 B8R0.23 CC(C)=C[C@@H](O)C(=O)O Amb27228179 [0,0,0,0,0,0|2,0,1]=3 111 B8R0.23 CC(C)=C[C@H](O)C(=O)O Amb27473652 [0,0,0,0,0,0|2,0,1]=3 112 B8R0.23 CC(C)C(C)CC(=O)O Amb10844380 [0,0,0,0,0,0|3,0,1]=4 113 B8R0.23 CC(C)C(Cl)CC(=O)O Amb27974166 [0,0,0,0,0,0|3,0,1]=4 114 B8R0.23 CC(C)C(N)CC(=O)O Amb2436060 [0,0,0,0,0,0|3,0,1]=4 115 B8R0.23 CC(C)C(N)CC(=O)O Amb31307617 [0,0,0,0,0,0|3,0,1]=4 116 B8R0.23 CC(C)C(O)CC(=O)O Amb17231878 [0,0,0,0,0,0|2,0,1]=3 117 B8R0.23 CC(C)CC(Br)C(=O)O Amb16233356 [0,0,0,0,0,0|3,0,1]=4 118 B8R0.23 CC(C)CC(C)C(=O)O Amb18975244 [0,0,0,0,0,0|3,0,1]=4 119 B8R0.23 CC(C)CC(Cl)C(=O)O Amb17593753 [0,0,0,0,0,0|3,0,1]=4 120 B8R0.23 CC(C)CC(F)C(=O)O Amb24565634 [0,0,0,0,0,0|3,0,1]=4 121 B8R0.23 CC(C)CC(N)C(=O)O Amb9703094 [0,0,0,0,0,0|3,0,1]=4 122 B8R0.23 CC(C)CC(O)C(=O)O Amb2694726 [0,0,0,0,0,0|2,0,1]=3 123 B8R0.23 CC(C)CC(O)C(=O)[O-] Amb33872314 [0,0,0,0,0,0|2,0,2]=4 124 B8R0.23 CC(C)CC(O)[PH](=O)O Amb27255267 [0,0,0,0,0,0|3,0,1]=4 125 B8R0.23 CC(C)CC(S)C(=O)O Amb18296292 [0,0,0,0,0,0|2,1,1]=4 126 B8R0.23 CC(C)C[C@@H](C)C(=O)O Amb10844070 [0,0,0,0,0,0|3,0,1]=4 127 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O Amb22800398 [0,0,0,0,0,0|3,0,1]=4 128 B8R0.23 CC(C)C[C@@H](F)C(=O)O Amb24616998 [0,0,0,0,0,0|3,0,1]=4 129 B8R0.23 CC(C)C[C@@H](N)C(=O)O Amb2720579 [0,0,0,0,0,0|3,0,1]=4 130 B8R0.23 CC(C)C[C@@H](O)C(=O)O Amb8630052 [0,0,0,0,0,0|2,0,1]=3 131 B8R0.23 CC(C)C[C@@H](S)C(=O)O Amb27786874 [0,0,0,0,0,0|2,1,1]=4 132 B8R0.23 CC(C)C[C@H](Br)C(=O)O Amb22226489 [0,0,0,0,0,0|3,0,1]=4 133 B8R0.23 CC(C)C[C@H](C)C(=O)O Amb10844071 [0,0,0,0,0,0|3,0,1]=4 134 B8R0.23 CC(C)C[C@H](Cl)C(=O)O Amb22388637 [0,0,0,0,0,0|3,0,1]=4 135 B8R0.23 CC(C)C[C@H](F)C(=O)O Amb10841083 [0,0,0,0,0,0|3,0,1]=4 136 B8R0.23 CC(C)C[C@H](N)C(=O)O Amb3499446 [0,0,0,0,0,0|3,0,1]=4 137 B8R0.23 CC(C)C[C@H](O)C(=O)O Amb16232074 [0,0,0,0,0,0|2,0,1]=3 138 B8R0.23 CC(C)[C@@H](C)CC(=O)O Amb27785773 [0,0,0,0,0,0|3,0,1]=4 139 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb16184030 [0,0,0,0,0,0|3,0,1]=4 140 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb22226647 [0,0,0,0,0,0|3,0,1]=4 141 B8R0.23 CC(C)[C@@H](O)CC(=O)O Amb25761246 [0,0,0,0,0,0|2,0,1]=3 142 B8R0.23 CC(C)[C@@H](O)CC(N)=O Amb27443470 [0,0,0,0,0,0|3,0,1]=4 143 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb16184024 [0,0,0,0,0,0|3,0,1]=4 144 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb20240790 [0,0,0,0,0,0|3,0,1]=4 145 B8R0.23 CC(C)[C@H](O)CC(=O)O Amb24561913 [0,0,0,0,0,0|2,0,1]=3 146 B8R0.23 CC(CC(=N)N)C(N)=O Amb27209796 [0,0,0,0,0,0|4,0,0]=4 147 B8R0.23 CC(CC(=O)Cl)C(=O)Cl Amb22167294 [0,0,0,0,0,0|3,0,0]=3 148 B8R0.23 CC(CC(=O)O)C(=O)O Amb1935053 [0,0,0,0,0,0|1,0,0]=1 149 B8R0.23 CC(CC(=O)O)C(F)F Amb27441233 [0,0,0,0,0,0|3,0,1]=4 150 B8R0.23 CC(CC(=O)O)C(N)=O Amb25737942 [0,0,0,0,0,0|2,0,0]=2 151 B8R0.23 CC(CC(=O)O)C(N)N Amb27481204 [0,0,0,0,0,0|3,0,1]=4 152 B8R0.23 CC(CC(=O)O)N(C)C Amb8428133 [0,0,0,0,0,0|4,0,0]=4 153 B8R0.23 CC(CC(=O)O)N(C)C Amb9173357 [0,0,0,0,0,0|4,0,0]=4 154 B8R0.23 CC(CC(=O)O)N(C)O Amb27639550 [0,0,0,0,0,0|3,0,0]=3 155 B8R0.23 CC(CC(F)F)C(=O)O Amb22896466 [0,0,0,0,0,0|3,0,1]=4 156 B8R0.23 CC(CC(N)=O)C(=O)O Amb27596628 [0,0,0,0,0,0|2,0,0]=2 157 B8R0.23 CC(CC(N)=O)C(N)=O Amb2720769 [0,0,0,0,0,0|3,0,0]=3 158 B8R0.23 CC(CN(C)C)C(=O)O Amb8428203 [0,0,0,0,0,0|4,0,0]=4 159 B8R0.23 CC(CN(C)C)C(=O)O Amb9173365 [0,0,0,0,0,0|4,0,0]=4 160 B8R0.23 CC(CN(C)N)C(=O)O Amb28145156 [0,0,0,0,0,0|4,0,0]=4 161 B8R0.23 CC(CS(=O)O)C(=O)O Amb28118949 [0,0,0,0,0,0|2,0,0]=2 162 B8R0.23 CC(CS(C)=O)C(=O)O Amb18974546 [0,0,0,0,0,0|3,0,0]=3 163 B8R0.23 CC(CS(C)=O)C(N)=O Amb27981416 [0,0,0,0,0,0|4,0,0]=4 164 B8R0.23 CC(C[PH](=O)O)C(=O)O Amb27477749 [0,0,0,0,0,0|2,0,0]=2 165 B8R0.23 CC(Cl)CC(N)C(=O)O Amb28325413 [0,0,0,0,0,0|3,0,1]=4 166 B8R0.23 CC(N)C(O)CC(=O)O Amb27796214 [0,0,0,0,0,0|2,0,1]=3 167 B8R0.23 CC(N)C(O)CC(N)=O Amb28184577 [0,0,0,0,0,0|3,0,1]=4 168 B8R0.23 CC(N)C(O)C[PH](=O)O Amb28130506 [0,0,0,0,0,0|3,0,1]=4 169 B8R0.23 CC(N)CC(N)C(=O)O Amb28144636 [0,0,0,0,0,0|3,0,1]=4 170 B8R0.23 CC(N)CC(O)C(=O)O Amb27975686 [0,0,0,0,0,0|2,0,1]=3 171 B8R0.23 CC(N)[C@@H](O)C[PH](=O)O Amb27841881 [0,0,0,0,0,0|3,0,1]=4 172 B8R0.23 CC(NC(=N)N)C(=O)O Amb22522920 [0,0,0,0,0,0|4,0,0]=4 173 B8R0.23 CC(NC(=S)S)C(=O)O Amb25336384 [0,0,0,0,0,0|2,2,0]=4 174 B8R0.23 CC(NC(N)=O)C(=O)O Amb9745673 [0,0,0,0,0,0|3,0,0]=3 175 B8R0.23 CC(N[N+](=O)[O-])C(=O)O Amb27873513 [0,0,0,0,0,0|3,0,1]=4 176 B8R0.23 CC(O)C(N)CC(=O)O Amb27424723 [0,0,0,0,0,0|2,0,1]=3 177 B8R0.23 CC(O)C(N)CC(N)=O Amb27246007 [0,0,0,0,0,0|3,0,1]=4 178 B8R0.23 CC(O)CC(=O)C(=O)O Amb25789747 [0,0,0,0,0,0|1,0,3]=4 179 B8R0.23 CC(O)CC(N)C(=O)O Amb18642918 [0,0,0,0,0,0|2,0,1]=3 180 B8R0.23 CC(O)CC(N)C(N)=O Amb33065888 [0,0,0,0,0,0|3,0,1]=4 181 B8R0.23 CC(O)C[C@@H](N)C(=O)O Amb26985188 [0,0,0,0,0,0|2,0,1]=3 182 B8R0.23 CC(O)C[C@H](N)C(=O)O Amb27185464 [0,0,0,0,0,0|2,0,1]=3 183 B8R0.23 CC(OC(=O)Cl)C(=O)O Amb27241520 [0,0,0,0,0,0|3,0,0]=3 184 B8R0.23 CC(O[N+](=O)[O-])C(=O)O Amb27947983 [0,0,0,0,0,0|3,0,1]=4 185 B8R0.23 CC(\N=C(/N)S)C(=O)O Amb22229340 [0,0,0,0,0,0|3,1,0]=4 186 B8R0.23 CN(C)CC(N)C(=O)O Amb23558085 [0,0,0,0,0,0|4,0,0]=4 187 B8R0.23 CN(C)CC(N)C(=O)O Amb32644516 [0,0,0,0,0,0|4,0,0]=4 188 B8R0.23 CN(C)CC(N)C(=O)O Amb33756799 [0,0,0,0,0,0|4,0,0]=4 189 B8R0.23 CN(C)CC(O)C(=O)O Amb27856754 [0,0,0,0,0,0|3,0,0]=3 190 B8R0.23 CN(C)C[C@@H](N)C(=O)O Amb19889770 [0,0,0,0,0,0|4,0,0]=4 191 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb24078627 [0,0,0,0,0,0|4,0,0]=4 192 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb8515079 [0,0,0,0,0,0|4,0,0]=4 193 B8R0.23 CN(C)C[C@H](O)C(=O)O Amb24372674 [0,0,0,0,0,0|3,0,0]=3 194 B8R0.23 CN(CC(=O)O)C(=N)N Amb22167307 [0,0,0,0,0,0|4,0,0]=4 195 B8R0.23 CN(CC(=O)O)C(=N)N Amb3940365 [0,0,0,0,0,0|4,0,0]=4 196 B8R0.23 CN(CC(=O)O)C(=N)N Amb5638543 [0,0,0,0,0,0|4,0,0]=4 197 B8R0.23 CN(CC(=O)O)C(=O)Cl Amb27484119 [0,0,0,0,0,0|3,0,0]=3 198 B8R0.23 CN(CC(=O)O)C(=S)S Amb1042470 [0,0,0,0,0,0|2,2,0]=4 199 B8R0.23 CN(CC(=O)O)C(N)=O Amb2371395 [0,0,0,0,0,0|3,0,0]=3 200 B8R0.23 CN(CC(=O)O)S(C)=O Amb27862060 [0,0,0,0,0,0|4,0,0]=4 201 B8R0.23 CN(CC(=O)O)[N+](=O)[O-] Amb27154042 [0,0,0,0,0,0|3,0,1]=4 202 B8R0.23 CS(=N)C[C@H](N)C(=O)O Amb27838573 [0,0,0,0,0,0|4,0,0]=4 203 B8R0.23 CS(=O)CC(N)C(=O)O Amb18125279 [0,0,0,0,0,0|3,0,0]=3 204 B8R0.23 CS(=O)CC(N)C(N)=O Amb27608115 [0,0,0,0,0,0|4,0,0]=4 205 B8R0.23 CS(=O)C[C@@H](N)C(=O)O Amb22745418 [0,0,0,0,0,0|3,0,0]=3 206 B8R0.23 CS(=O)C[C@H](N)C(=O)O Amb16232229 [0,0,0,0,0,0|3,0,0]=3 207 B8R0.23 C[C@@H](CC(=O)O)C(=O)O Amb22226742 [0,0,0,0,0,0|1,0,0]=1 208 B8R0.23 C[C@@H](CC(F)F)C(=O)O Amb33749533 [0,0,0,0,0,0|3,0,1]=4 209 B8R0.23 C[C@@H](Cl)C[C@H](N)C(=O)O Amb27863035 [0,0,0,0,0,0|3,0,1]=4 210 B8R0.23 C[C@@H](NC(N)=O)C(=O)O Amb27242972 [0,0,0,0,0,0|3,0,0]=3 211 B8R0.23 C[C@@H](NC(N)=O)C(N)=O Amb27394390 [0,0,0,0,0,0|4,0,0]=4 212 B8R0.23 C[C@@H](O)C[C@@H](N)C(=O)O Amb27254158 [0,0,0,0,0,0|2,0,1]=3 213 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O Amb22168848 [0,0,0,0,0,0|2,0,1]=3 214 B8R0.23 C[C@@H](OC(N)=O)C(=O)O Amb35655773 [0,0,0,0,0,0|3,0,0]=3 215 B8R0.23 C[C@H](CC(=O)O)C(=O)O Amb22225399 [0,0,0,0,0,0|1,0,0]=1 216 B8R0.23 C[C@H](CC(=O)O)C(Cl)Cl Amb28292581 [0,0,0,0,0,0|3,0,1]=4 217 B8R0.23 C[C@H](CC(=O)O)C(N)=O Amb28133461 [0,0,0,0,0,0|2,0,0]=2 218 B8R0.23 C[C@H](CC(=O)O)S(C)=O Amb27410588 [0,0,0,0,0,0|3,0,0]=3 219 B8R0.23 C[C@H](CC(F)F)C(=O)O Amb33727762 [0,0,0,0,0,0|3,0,1]=4 220 B8R0.23 C[C@H](N)C(O)CC(=O)O Amb27622153 [0,0,0,0,0,0|2,0,1]=3 221 B8R0.23 C[C@H](N)C[C@@H](O)C(=O)O Amb27231129 [0,0,0,0,0,0|2,0,1]=3 222 B8R0.23 C[C@H](N)C[C@H](N)C(=O)O Amb27815088 [0,0,0,0,0,0|3,0,1]=4 223 B8R0.23 C[C@H](N)C[C@H](O)C(=O)O Amb27180466 [0,0,0,0,0,0|2,0,1]=3 224 B8R0.23 C[C@H](N)[C@H](O)CC(=O)O Amb27975677 [0,0,0,0,0,0|2,0,1]=3 225 B8R0.23 C[C@H](NC(=N)N)C(=O)O Amb24388432 [0,0,0,0,0,0|4,0,0]=4 226 B8R0.23 C[C@H](NC(=O)Cl)C(=O)Cl Amb28292733 [0,0,0,0,0,0|4,0,0]=4 227 B8R0.23 C[C@H](NC(N)=O)C(=O)O Amb545023 [0,0,0,0,0,0|3,0,0]=3 228 B8R0.23 C[C@H](NS(C)=O)C(=O)O Amb27212723 [0,0,0,0,0,0|4,0,0]=4 229 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O Amb16184021 [0,0,0,0,0,0|2,0,1]=3 230 B8R0.23 C[S@@](=O)C[C@H](N)C(=O)O Amb35789128 [0,0,0,0,0,0|3,0,0]=3 231 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb33756818 [0,0,0,0,0,0|3,0,0]=3 232 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb35788678 [0,0,0,0,0,0|3,0,0]=3 233 B8R0.23 C\C(=C/C(=O)O)C(=O)O Amb9703112 [0,0,0,0,0,0|1,0,2]=3 234 B8R0.23 C\C(=C/C(=O)O)C(N)=O Amb28350555 [0,0,0,0,0,0|2,0,2]=4 235 B8R0.23 C\C(=C/C(N)=O)C(=O)O Amb28060883 [0,0,0,0,0,0|2,0,2]=4 236 B8R0.23 C\C(=C\C(=O)O)C(=O)O Amb8391132 [0,0,0,0,0,0|1,0,2]=3 237 B8R0.23 C\C(Cl)=C/C(C)C(=O)O Amb28285105 [0,0,0,0,0,0|3,0,1]=4 238 B8R0.23 C\C(Cl)=C/C(Cl)C(=O)O Amb28128482 [0,0,0,0,0,0|3,0,1]=4 239 B8R0.23 NC(=O)C(=S)CC(O)=S Amb28323012 [0,0,0,0,0,0|1,2,1]=4 240 B8R0.23 NC(=O)C(N)CC(=O)O Amb18124347 [0,0,0,0,0,0|2,0,0]=2 241 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666212 [0,0,0,0,0,0|2,0,0]=2 242 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666239 [0,0,0,0,0,0|2,0,0]=2 243 B8R0.23 NC(=O)C(O)CC(=O)[O-] Amb33068981 [0,0,0,0,0,0|1,0,1]=2 244 B8R0.23 NC(=O)CC(Br)C(=O)O Amb26012685 [0,0,0,0,0,0|2,0,0]=2 245 B8R0.23 NC(=O)CC(Cl)C(=O)O Amb27478086 [0,0,0,0,0,0|2,0,0]=2 246 B8R0.23 NC(=O)CC(N)C(=O)O Amb2725509 [0,0,0,0,0,0|2,0,0]=2 247 B8R0.23 NC(=O)CC(N)C(=O)O Amb3940878 [0,0,0,0,0,0|2,0,0]=2 248 B8R0.23 NC(=O)CC(N)C(N)=O Amb18289248 [0,0,0,0,0,0|3,0,0]=3 249 B8R0.23 NC(=O)CC(O)C(=O)O Amb27807542 [0,0,0,0,0,0|1,0,0]=1 250 B8R0.23 NC(=O)CC(O)C(N)=O Amb27961515 [0,0,0,0,0,0|2,0,0]=2 251 B8R0.23 NC(=O)CC(S)C(=O)O Amb27494183 [0,0,0,0,0,0|1,1,0]=2 252 B8R0.23 NC(=O)C[C@@H](Br)C(=O)O Amb27858620 [0,0,0,0,0,0|2,0,0]=2 253 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb10071271 [0,0,0,0,0,0|2,0,0]=2 254 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb17749060 [0,0,0,0,0,0|2,0,0]=2 255 B8R0.23 NC(=O)C[C@@H](N)C(N)=O Amb28423711 [0,0,0,0,0,0|3,0,0]=3 256 B8R0.23 NC(=O)C[C@@H](O)C(=O)O Amb24681022 [0,0,0,0,0,0|1,0,0]=1 257 B8R0.23 NC(=O)C[C@@H](O)C(N)=O Amb27258074 [0,0,0,0,0,0|2,0,0]=2 258 B8R0.23 NC(=O)C[C@@H](S)C(=O)O Amb27234637 [0,0,0,0,0,0|1,1,0]=2 259 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb3940760 [0,0,0,0,0,0|2,0,0]=2 260 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb8513755 [0,0,0,0,0,0|2,0,0]=2 261 B8R0.23 NC(=O)C[C@H](N)C(N)=O Amb16183882 [0,0,0,0,0,0|3,0,0]=3 262 B8R0.23 NC(=O)C[C@H](S)C(=O)O Amb27253643 [0,0,0,0,0,0|1,1,0]=2 263 B8R0.23 NC(=O)N(N)CC(=O)O Amb6296397 [0,0,0,0,0,0|3,0,0]=3 264 B8R0.23 NC(=O)NC(=O)C(=O)O Amb18124345 [0,0,0,0,0,0|2,0,2]=4 265 B8R0.23 NC(=O)NC(O)C(=O)O Amb24592607 [0,0,0,0,0,0|2,0,0]=2 266 B8R0.23 NC(=O)N[C@@H](O)C(=O)O Amb28287313 [0,0,0,0,0,0|2,0,0]=2 267 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb19334954 [0,0,0,0,0,0|2,0,0]=2 268 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb31291739 [0,0,0,0,0,0|2,0,0]=2 269 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb32652393 [0,0,0,0,0,0|2,0,0]=2 270 B8R0.23 NC(=O)[C@H](N)CC(=O)O Amb27768775 [0,0,0,0,0,0|2,0,0]=2 271 B8R0.23 NC(=O)\C(N)=C\C(=O)O Amb28046027 [0,0,0,0,0,0|2,0,2]=4 272 B8R0.23 NC(=O)\C=C(/Cl)C(=O)O Amb27815058 [0,0,0,0,0,0|2,0,2]=4 273 B8R0.23 NC(=O)\C=C(\F)C(=O)O Amb27447226 [0,0,0,0,0,0|2,0,2]=4 274 B8R0.23 NC(=S)C[C@H](N)C(=O)O Amb28410343 [0,0,0,0,0,0|2,1,0]=3 275 B8R0.23 NC(C=C(Cl)Cl)C(=O)O Amb22350718 [0,0,0,0,0,0|3,0,1]=4 276 B8R0.23 NC(C=S(=O)=O)C(=O)O Amb27231764 [0,0,0,0,0,0|2,0,2]=4 277 B8R0.23 NC(CB(O)O)C(=O)O Amb28285179 [0,0,0,0,0,0|2,0,1]=3 278 B8R0.23 NC(CB(O)O)C(=O)O Amb33803309 [0,0,0,0,0,0|2,0,1]=3 279 B8R0.23 NC(CC(=O)O)C(=O)O Amb9702780 [0,0,0,0,0,0|1,0,0]=1 280 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22167994 [0,0,0,0,0,0|1,0,1]=2 281 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22337568 [0,0,0,0,0,0|1,0,1]=2 282 B8R0.23 NC(CC(=O)O)C(Cl)Cl Amb27964120 [0,0,0,0,0,0|3,0,1]=4 283 B8R0.23 NC(CC(=O)O)C(F)F Amb23570587 [0,0,0,0,0,0|3,0,1]=4 284 B8R0.23 NC(CC(Cl)Cl)C(=O)O Amb27791749 [0,0,0,0,0,0|3,0,1]=4 285 B8R0.23 NC(CC(F)F)C(=O)O Amb13952714 [0,0,0,0,0,0|3,0,1]=4 286 B8R0.23 NC(CC(F)F)C(=O)O Amb33546007 [0,0,0,0,0,0|3,0,1]=4 287 B8R0.23 NC(CS(=O)O)C(=O)O Amb541272 [0,0,0,0,0,0|2,0,0]=2 288 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb34163080 [0,0,0,0,0,0|1,0,0]=1 289 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb3940320 [0,0,0,0,0,0|1,0,0]=1 290 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] Amb22801032 [0,0,0,0,0,0|1,0,1]=2 291 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb20240565 [0,0,0,0,0,0|1,0,1]=2 292 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb22748769 [0,0,0,0,0,0|1,0,1]=2 293 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] Amb22757383 [0,0,0,0,0,0|1,0,2]=3 294 B8R0.23 N[C@@H](CC(F)F)C(=O)O Amb26944439 [0,0,0,0,0,0|3,0,1]=4 295 B8R0.23 N[C@@H](CC(F)F)C(=O)O Amb33482837 [0,0,0,0,0,0|3,0,1]=4 296 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb6600148 [0,0,0,0,0,0|2,0,0]=2 297 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb9809803 [0,0,0,0,0,0|2,0,0]=2 298 B8R0.23 N[C@@H](C[SH](=O)=O)C(=O)O Amb27858626 [0,0,0,0,0,0|2,0,1]=3 299 B8R0.23 N[C@H](CC(=O)O)C(=O)O Amb6599992 [0,0,0,0,0,0|1,0,0]=1 300 B8R0.23 N[C@H](CC(F)F)C(=O)O Amb25117310 [0,0,0,0,0,0|3,0,1]=4 301 B8R0.23 N[C@H](CC(F)F)C(=O)O Amb33743521 [0,0,0,0,0,0|3,0,1]=4 302 B8R0.23 O=C(Cl)CC(Cl)C(=O)Cl Amb28122555 [0,0,0,0,0,0|3,0,0]=3 303 B8R0.23 O=C(O)C(=O)C[PH](=O)O Amb27218009 [0,0,0,0,0,0|1,0,2]=3 304 B8R0.23 O=C(O)C(O)CC(F)F Amb25274709 [0,0,0,0,0,0|2,0,1]=3 305 B8R0.23 O=C(O)C(O)CC(O)O Amb28397948 [0,0,0,0,0,0|0,0,2]=2 306 B8R0.23 O=C(O)C(O)C[N+](=O)[O-] Amb6883775 [0,0,0,0,0,0|1,0,1]=2 307 B8R0.23 O=C(O)CC(=O)C(=O)O Amb3909986 [0,0,0,0,0,0|0,0,2]=2 308 B8R0.23 O=C(O)CC(=S)C(=O)O Amb25304511 [0,0,0,0,0,0|0,1,1]=2 309 B8R0.23 O=C(O)CC(Br)C(=O)O Amb3941503 [0,0,0,0,0,0|1,0,0]=1 310 B8R0.23 O=C(O)CC(Cl)=C(Cl)Cl Amb2227973 [0,0,0,0,0,0|3,0,1]=4 311 B8R0.23 O=C(O)CC(Cl)C(=O)O Amb9825869 [0,0,0,0,0,0|1,0,0]=1 312 B8R0.23 O=C(O)CC(O)C(=O)O Amb8513238 [0,0,0,0,0,0|0,0,0]=0 313 B8R0.23 O=C(O)CC(O)C(Cl)Cl Amb27985520 [0,0,0,0,0,0|2,0,1]=3 314 B8R0.23 O=C(O)CC(S)C(=O)O Amb2779994 [0,0,0,0,0,0|0,1,0]=1 315 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O Amb22504149 [0,0,0,0,0,0|1,0,0]=1 316 B8R0.23 O=C(O)C[C@@H](Cl)C(=O)O Amb20242424 [0,0,0,0,0,0|1,0,0]=1 317 B8R0.23 O=C(O)C[C@@H](F)C(=O)O Amb27173500 [0,0,0,0,0,0|1,0,0]=1 318 B8R0.23 O=C(O)C[C@@H](O)C(=O)O Amb4166311 [0,0,0,0,0,0|0,0,0]=0 319 B8R0.23 O=C(O)C[C@@H](O)C(F)F Amb33337779 [0,0,0,0,0,0|2,0,1]=3 320 B8R0.23 O=C(O)C[C@H](Br)C(=O)O Amb8629197 [0,0,0,0,0,0|1,0,0]=1 321 B8R0.23 O=C(O)C[C@H](Cl)C(=O)O Amb20242425 [0,0,0,0,0,0|1,0,0]=1 322 B8R0.23 O=C(O)C[C@H](F)C(=O)O Amb27167819 [0,0,0,0,0,0|1,0,0]=1 323 B8R0.23 O=C(O)C[C@H](O)C(=O)O Amb6599993 [0,0,0,0,0,0|0,0,0]=0 324 B8R0.23 O=C(O)C[C@H](O)C(F)F Amb33485299 [0,0,0,0,0,0|2,0,1]=3 325 B8R0.23 O=C(O)[C@H](Cl)CC(Cl)Cl Amb27831354 [0,0,0,0,0,0|3,0,1]=4 326 B8R0.23 O=C(O)\C=C(/Br)C(=O)O Amb31275762 [0,0,0,0,0,0|1,0,2]=3 327 B8R0.23 O=C(O)\C=C(/Cl)C(=O)O Amb4007497 [0,0,0,0,0,0|1,0,2]=3 328 B8R0.23 O=C(O)\C=C(/F)C(=O)O Amb26860064 [0,0,0,0,0,0|1,0,2]=3 329 B8R0.23 O=C(O)\C=C(/I)C(=O)O Amb10755055 [0,0,0,0,0,0|1,0,2]=3 330 B8R0.23 O=C(O)\C=C(\Br)C(=O)O Amb25746120 [0,0,0,0,0,0|1,0,2]=3 331 B8R0.23 O=C(O)\C=C(\F)C(=O)O Amb18124397 [0,0,0,0,0,0|1,0,2]=3 332 B8R0.23 O=C([O-])CC(O)C(=O)[O-] Amb30876864 [0,0,0,0,0,0|0,0,2]=2 333 B8R0.23 O=C([O-])C[C@H](O)C(=O)[O-] Amb22351833 [0,0,0,0,0,0|0,0,2]=2 334 B7R0.2 C#CC(C)CC(=O)O Amb27246384 [1,0,0,0,0,0|2,0,1]=4 335 B7R0.2 C#C[C@H](O)CC(=O)O Amb28285208 [1,0,0,0,0,0|1,0,1]=3 336 B7R0.2 C=C(Br)CC(O)CO Amb27206509 [1,0,0,0,0,0|2,0,1]=4 337 B7R0.2 C=C(Br)C[C@@H](C)C=O Amb28381143 [1,0,0,0,0,0|3,0,0]=4 338 B7R0.2 C=C(C)CC(C)C=O Amb18641711 [1,0,0,0,0,0|3,0,0]=4 339 B7R0.2 C=C(Cl)C[C@H](O)CO Amb24560451 [1,0,0,0,0,0|2,0,1]=4 340 B7R0.2 C=CC(C)CC(=O)O Amb18641774 [1,0,0,0,0,0|2,0,0]=3 341 B7R0.2 C=CC(C)CC(C)=O Amb27759897 [1,0,0,0,0,0|3,0,0]=4 342 B7R0.2 C=CC(C)CC(N)=O Amb27168118 [1,0,0,0,0,0|3,0,0]=4 343 B7R0.2 C=CC(N)CC(=O)O Amb22641963 [1,0,0,0,0,0|2,0,0]=3 344 B7R0.2 C=CC(N)CC(=O)O Amb31307621 [1,0,0,0,0,0|2,0,0]=3 345 B7R0.2 C=CC(O)CC(=O)O Amb18641866 [1,0,0,0,0,0|1,0,0]=2 346 B7R0.2 C=CC(O)CC(N)=S Amb27814663 [1,0,0,0,0,0|2,1,0]=4 347 B7R0.2 C=C[C@@H](C)CC(=O)O Amb27868377 [1,0,0,0,0,0|2,0,0]=3 348 B7R0.2 C=C[C@@H](N)CC(=O)O Amb28315938 [1,0,0,0,0,0|2,0,0]=3 349 B7R0.2 C=C[C@@H](O)C[C@H](C)O Amb28318465 [1,0,0,0,0,0|2,0,1]=4 350 B7R0.2 C=C[C@H](C)CC(=O)O Amb25791667 [1,0,0,0,0,0|2,0,0]=3 351 B7R0.2 C=C[C@H](O)CC(=C)C Amb27854005 [1,0,0,0,0,0|3,0,0]=4 352 B7R0.2 CC(=O)CC(N)CO Amb27240210 [1,0,0,0,0,0|2,0,1]=4 353 B7R0.2 CC(=O)CC(O)CCl Amb27827457 [1,0,0,0,0,0|2,0,1]=4 354 B7R0.2 CC(=O)C[C@@H](C)C=O Amb27470883 [1,0,0,0,0,0|2,0,0]=3 355 B7R0.2 CC(=O)C[C@@H](O)CCl Amb27817734 [1,0,0,0,0,0|2,0,1]=4 356 B7R0.2 CC(=O)C[C@H](C)C=O Amb24379584 [1,0,0,0,0,0|2,0,0]=3 357 B7R0.2 CC(=O)C[C@H](O)CO Amb28316148 [1,0,0,0,0,0|1,0,1]=3 358 B7R0.2 CC(=O)N[C@H](C)C=O Amb27838347 [1,0,0,0,0,0|3,0,0]=4 359 B7R0.2 CC(=O)OC(C)C=O Amb18641863 [1,0,0,0,0,0|3,0,0]=4 360 B7R0.2 CC(=O)O[C@H](C)C=O Amb28422009 [1,0,0,0,0,0|3,0,0]=4 361 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [1,0,0,0,0,0|2,0,1]=4 362 B7R0.2 CC(C)CC(O)C=O Amb27250174 [1,0,0,0,0,0|2,0,1]=4 363 B7R0.2 CC(CC(=O)O)NN Amb28346224 [1,0,0,0,0,0|3,0,0]=4 364 B7R0.2 CC(CC(=O)O)NN Amb33141007 [1,0,0,0,0,0|3,0,0]=4 365 B7R0.2 CC(CF)CC(=O)O Amb25990964 [1,0,0,0,0,0|2,0,1]=4 366 B7R0.2 CC(CN)CC(=O)O Amb18124263 [1,0,0,0,0,0|2,0,1]=4 367 B7R0.2 CC(CN)CC(=O)O Amb20669501 [1,0,0,0,0,0|2,0,1]=4 368 B7R0.2 CC(CN)CC(=O)O Amb32752805 [1,0,0,0,0,0|2,0,1]=4 369 B7R0.2 CC(CO)CC(=O)O Amb18198168 [1,0,0,0,0,0|1,0,1]=3 370 B7R0.2 CC(CO)CC(=O)[O-] Amb33329956 [1,0,0,0,0,0|1,0,2]=4 371 B7R0.2 CC(O)C[C@H](O)CO Amb27397070 [1,0,0,0,0,0|1,0,2]=4 372 B7R0.2 CCC(C)CC(=O)O Amb2689581 [1,0,0,0,0,0|2,0,1]=4 373 B7R0.2 CCC(N)CC(=O)O Amb1993862 [1,0,0,0,0,0|2,0,1]=4 374 B7R0.2 CCC(N)CC(=O)O Amb8631361 [1,0,0,0,0,0|2,0,1]=4 375 B7R0.2 CCC(O)CC(=O)O Amb10844270 [1,0,0,0,0,0|1,0,1]=3 376 B7R0.2 CCC(O)CC(C)=O Amb25065181 [1,0,0,0,0,0|2,0,1]=4 377 B7R0.2 CCN(O)CC(=O)O Amb28195485 [1,0,0,0,0,0|2,0,1]=4 378 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [1,0,0,0,0,0|2,0,1]=4 379 B7R0.2 CC[C@@H](N)CC(=O)O Amb22225305 [1,0,0,0,0,0|2,0,1]=4 380 B7R0.2 CC[C@@H](N)CC(=O)O Amb8397198 [1,0,0,0,0,0|2,0,1]=4 381 B7R0.2 CC[C@@H](O)CC(=O)O Amb27601320 [1,0,0,0,0,0|1,0,1]=3 382 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [1,0,0,0,0,0|2,0,1]=4 383 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [1,0,0,0,0,0|2,0,1]=4 384 B7R0.2 CC[C@H](N)CC(=O)O Amb22226650 [1,0,0,0,0,0|2,0,1]=4 385 B7R0.2 CC[C@H](N)CC(=O)O Amb8397197 [1,0,0,0,0,0|2,0,1]=4 386 B7R0.2 CC[C@H](O)CC(=O)O Amb33189078 [1,0,0,0,0,0|1,0,1]=3 387 B7R0.2 CC[C@H](O)CC(C)=O Amb26980782 [1,0,0,0,0,0|2,0,1]=4 388 B7R0.2 CN(C=O)CC(N)=O Amb27471534 [1,0,0,0,0,0|3,0,0]=4 389 B7R0.2 CN(CC(=O)O)N=O Amb17618622 [1,0,0,0,0,0|3,0,0]=4 390 B7R0.2 CN(CO)CC(=O)O Amb27663224 [1,0,0,0,0,0|2,0,1]=4 391 B7R0.2 CNC(C)CC(=O)O Amb21959674 [1,0,0,0,0,0|3,0,0]=4 392 B7R0.2 CNC(C)CC(=O)O Amb9398363 [1,0,0,0,0,0|3,0,0]=4 393 B7R0.2 CN[C@H](C)CC(=O)O Amb25339129 [1,0,0,0,0,0|3,0,0]=4 394 B7R0.2 COC(C)CC(=O)O Amb4001695 [1,0,0,0,0,0|3,0,0]=4 395 B7R0.2 CO[C@H](C)CC(=O)O Amb27266082 [1,0,0,0,0,0|3,0,0]=4 396 B7R0.2 CSC(C)CC(=O)O Amb18967824 [1,0,0,0,0,0|3,0,0]=4 397 B7R0.2 CS[C@H](C)CC(=O)O Amb27648548 [1,0,0,0,0,0|3,0,0]=4 398 B7R0.2 C[C@@H](CN)CC(=O)O Amb26864355 [1,0,0,0,0,0|2,0,1]=4 399 B7R0.2 C[C@@H](CN)CC(=O)O Amb32656230 [1,0,0,0,0,0|2,0,1]=4 400 B7R0.2 C[C@H](CN)CC(=O)O Amb26887694 [1,0,0,0,0,0|2,0,1]=4 401 B7R0.2 C[C@H](CN)CC(=O)O Amb32663834 [1,0,0,0,0,0|2,0,1]=4 402 B7R0.2 C[C@H](CO)CC(=O)O Amb28040661 [1,0,0,0,0,0|1,0,1]=3 403 B7R0.2 C[C@H](O)C[C@H](O)CO Amb27472671 [1,0,0,0,0,0|1,0,2]=4 404 B7R0.2 C\C(CC(=O)O)=N/O Amb28388976 [1,0,0,0,0,0|2,0,1]=4 405 B7R0.2 C\C=C(\Cl)CC(=O)O Amb25174797 [1,0,0,0,0,0|2,0,1]=4 406 B7R0.2 N#CC(N)CC(=O)O Amb27985578 [1,0,0,0,0,0|2,0,1]=4 407 B7R0.2 N#CC(O)CC(N)=O Amb28063048 [1,0,0,0,0,0|2,0,1]=4 408 B7R0.2 NC(=O)CC(Br)CO Amb28384721 [1,0,0,0,0,0|2,0,1]=4 409 B7R0.2 NC(=O)CC(O)CO Amb25662216 [1,0,0,0,0,0|1,0,1]=3 410 B7R0.2 NC(=O)C[C@@H](O)CCl Amb27173051 [1,0,0,0,0,0|2,0,1]=4 411 B7R0.2 NC(=O)C[C@H](O)CO Amb8388588 [1,0,0,0,0,0|1,0,1]=3 412 B7R0.2 NC(=S)CC(O)CO Amb27793984 [1,0,0,0,0,0|1,1,1]=4 413 B7R0.2 NC(C=O)CC(=O)O Amb27669608 [1,0,0,0,0,0|1,0,0]=2 414 B7R0.2 NC(CF)CC(=O)O Amb24428065 [1,0,0,0,0,0|2,0,1]=4 415 B7R0.2 NC(CS)CC(=O)O Amb25090412 [1,0,0,0,0,0|1,1,1]=4 416 B7R0.2 NCC(N)CC(=O)O Amb19515145 [1,0,0,0,0,0|2,0,1]=4 417 B7R0.2 NCC(N)CC(=O)O Amb21858324 [1,0,0,0,0,0|2,0,1]=4 418 B7R0.2 NCC(O)CC(=O)O Amb32663899 [1,0,0,0,0,0|1,0,1]=3 419 B7R0.2 NCC(O)CC(=O)O Amb33544754 [1,0,0,0,0,0|1,0,1]=3 420 B7R0.2 NCC(O)CS(=O)O Amb27831981 [1,0,0,0,0,0|2,0,1]=4 421 B7R0.2 NC[C@@H](F)CC(=O)O Amb27481078 [1,0,0,0,0,0|2,0,1]=4 422 B7R0.2 NC[C@@H](N)CC(=O)O Amb10603267 [1,0,0,0,0,0|2,0,1]=4 423 B7R0.2 NC[C@@H](O)CC(=O)O Amb32665211 [1,0,0,0,0,0|1,0,1]=3 424 B7R0.2 NC[C@@H](O)CC(=O)O Amb8386098 [1,0,0,0,0,0|1,0,1]=3 425 B7R0.2 NC[C@@H](O)CC(N)=O Amb27838875 [1,0,0,0,0,0|2,0,1]=4 426 B7R0.2 NC[C@@H](O)C[PH](=O)O Amb27596096 [1,0,0,0,0,0|2,0,1]=4 427 B7R0.2 NC[C@H](O)CC(=O)O Amb8628962 [1,0,0,0,0,0|1,0,1]=3 428 B7R0.2 N[C@@H](CO)CC(=O)O Amb16184020 [1,0,0,0,0,0|1,0,1]=3 429 B7R0.2 N[C@@H](CO)CC(=O)O Amb22388520 [1,0,0,0,0,0|1,0,1]=3 430 B7R0.2 N[C@H](C=O)CC(=O)O Amb28428447 [1,0,0,0,0,0|1,0,0]=2 431 B7R0.2 N[C@H](CO)CC(=O)O Amb2694944 [1,0,0,0,0,0|1,0,1]=3 432 B7R0.2 N[C@H](CS)CC(=O)O Amb28326106 [1,0,0,0,0,0|1,1,1]=4 433 B7R0.2 N\C(CC(=O)O)=N/O Amb8384544 [1,0,0,0,0,0|2,0,1]=4 434 B7R0.2 O=C(O)CC(O)CBr Amb27592126 [1,0,0,0,0,0|1,0,1]=3 435 B7R0.2 O=C(O)CC(O)CF Amb26557587 [1,0,0,0,0,0|1,0,1]=3 436 B7R0.2 O=C(O)CC(O)CO Amb28120003 [1,0,0,0,0,0|0,0,1]=2 437 B7R0.2 O=C(O)CC(O)CS Amb27244674 [1,0,0,0,0,0|0,1,1]=3 438 B7R0.2 O=C(O)C[C@@H](O)CF Amb33377449 [1,0,0,0,0,0|1,0,1]=3 439 B7R0.2 O=C(O)C[C@H](O)CBr Amb28325607 [1,0,0,0,0,0|1,0,1]=3 440 B7R0.2 O=C(O)C[C@H](O)CCl Amb27830780 [1,0,0,0,0,0|1,0,1]=3 441 B7R0.2 O=C(O)C[C@H](O)CF Amb33377451 [1,0,0,0,0,0|1,0,1]=3 442 B7R0.2 O=C(O)C[C@H](O)CO Amb26353423 [1,0,0,0,0,0|0,0,1]=2 443 B7R0.2 O=C(O)C\C(Cl)=C\Cl Amb27812877 [1,0,0,0,0,0|2,0,1]=4 444 B7R0.2 O=C([O-])CC(O)CO Amb24117078 [1,0,0,0,0,0|0,0,2]=3 445 B7R0.2 O=CN(O)CC(=O)O Amb25367291 [1,0,0,0,0,0|1,0,0]=2 446 B7R0.2 O=C\C(Cl)=C/C(=O)O Amb27852924 [1,0,0,0,0,0|1,0,2]=4 447 B7R0.5 C#CCC(C)C(=O)O Amb18633959 [1,0,0,0,0,0|2,0,1]=4 448 B7R0.5 C#CCC(N)C(=O)O Amb19944472 [1,0,0,0,0,0|2,0,1]=4 449 B7R0.5 C#CCC(N)C(=O)O Amb9721758 [1,0,0,0,0,0|2,0,1]=4 450 B7R0.5 C#CCC(O)C(=O)O Amb27154881 [1,0,0,0,0,0|1,0,1]=3 451 B7R0.5 C#CCC(O)C(C)=O Amb27442415 [1,0,0,0,0,0|2,0,1]=4 452 B7R0.5 C#CC[C@@H](N)C(=O)O Amb16183954 [1,0,0,0,0,0|2,0,1]=4 453 B7R0.5 C#CC[C@@H](N)C(=O)O Amb22748688 [1,0,0,0,0,0|2,0,1]=4 454 B7R0.5 C#CC[C@H](C)C(=O)O Amb10844036 [1,0,0,0,0,0|2,0,1]=4 455 B7R0.5 C#CC[C@H](N)C(=O)O Amb8396606 [1,0,0,0,0,0|2,0,1]=4 456 B7R0.5 C=C(CCO)C(=O)O Amb27173904 [1,0,0,0,0,0|1,0,2]=4 457 B7R0.5 C=C(O)C(O)\C=C\C Amb28140639 [1,0,0,0,0,0|2,0,1]=4 458 B7R0.5 C=CCC(=C)C(=O)O Amb18641687 [1,0,0,0,0,0|2,0,1]=4 459 B7R0.5 C=CCC(=O)C(=O)O Amb25890017 [1,0,0,0,0,0|1,0,2]=4 460 B7R0.5 C=CCC(Br)C(C)=O Amb27760403 [1,0,0,0,0,0|3,0,0]=4 461 B7R0.5 C=CCC(C)C(=O)O Amb33545044 [1,0,0,0,0,0|2,0,0]=3 462 B7R0.5 C=CCC(C)C(C)=O Amb19373098 [1,0,0,0,0,0|3,0,0]=4 463 B7R0.5 C=CCC(C)C(N)=O Amb27788519 [1,0,0,0,0,0|3,0,0]=4 464 B7R0.5 C=CCC(Cl)C(=O)Cl Amb27463323 [1,0,0,0,0,0|3,0,0]=4 465 B7R0.5 C=CCC(Cl)C(=O)O Amb25056173 [1,0,0,0,0,0|2,0,0]=3 466 B7R0.5 C=CCC(F)C(=O)O Amb28071391 [1,0,0,0,0,0|2,0,0]=3 467 B7R0.5 C=CCC(F)C(C)=O Amb19889753 [1,0,0,0,0,0|3,0,0]=4 468 B7R0.5 C=CCC(N)C(=O)Cl Amb27413912 [1,0,0,0,0,0|3,0,0]=4 469 B7R0.5 C=CCC(N)C(=O)O Amb21856826 [1,0,0,0,0,0|2,0,0]=3 470 B7R0.5 C=CCC(N)C(=O)O Amb9729145 [1,0,0,0,0,0|2,0,0]=3 471 B7R0.5 C=CCC(N)C(C)=O Amb27194092 [1,0,0,0,0,0|3,0,0]=4 472 B7R0.5 C=CCC(N)C(N)=O Amb26585896 [1,0,0,0,0,0|3,0,0]=4 473 B7R0.5 C=CCC(O)C(=C)C Amb4035448 [1,0,0,0,0,0|3,0,0]=4 474 B7R0.5 C=CCC(O)C(C)=O Amb26451431 [1,0,0,0,0,0|2,0,0]=3 475 B7R0.5 C=CC[C@@H](N)C(=O)O Amb22745310 [1,0,0,0,0,0|2,0,0]=3 476 B7R0.5 C=CC[C@@H](N)C(=O)O Amb8389451 [1,0,0,0,0,0|2,0,0]=3 477 B7R0.5 C=CC[C@@H](N)C(N)=O Amb27838370 [1,0,0,0,0,0|3,0,0]=4 478 B7R0.5 C=CC[C@H](C)C(C)=O Amb26641913 [1,0,0,0,0,0|3,0,0]=4 479 B7R0.5 C=CC[C@H](N)C(=O)Cl Amb28120452 [1,0,0,0,0,0|3,0,0]=4 480 B7R0.5 C=CC[C@H](N)C(=O)O Amb10982568 [1,0,0,0,0,0|2,0,0]=3 481 B7R0.5 C=CC[C@H](N)C(=O)O Amb2699115 [1,0,0,0,0,0|2,0,0]=3 482 B7R0.5 C=CC[C@H](O)[C@H](C)O Amb28366034 [1,0,0,0,0,0|2,0,1]=4 483 B7R0.5 CC#CC(O)C(=O)O Amb27451308 [1,0,0,0,0,0|1,0,2]=4 484 B7R0.5 CC(=O)C(=O)CC=O Amb24524264 [1,0,0,0,0,0|1,0,2]=4 485 B7R0.5 CC(=O)C(Br)CCO Amb27858653 [1,0,0,0,0,0|2,0,1]=4 486 B7R0.5 CC(=O)C(C)CCO Amb13881368 [1,0,0,0,0,0|2,0,1]=4 487 B7R0.5 CC(=O)C(C)NC=O Amb23442778 [1,0,0,0,0,0|3,0,0]=4 488 B7R0.5 CC(=O)C(C)OC=O Amb26492625 [1,0,0,0,0,0|3,0,0]=4 489 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [1,0,0,0,0,0|2,0,0]=3 490 B7R0.5 CC(=O)C(Cl)CCO Amb4017890 [1,0,0,0,0,0|2,0,1]=4 491 B7R0.5 CC(=O)C(N)CCO Amb25087112 [1,0,0,0,0,0|2,0,1]=4 492 B7R0.5 CC(=O)C(S)CCO Amb25831127 [1,0,0,0,0,0|1,1,1]=4 493 B7R0.5 CC(=O)N(C)CC=O Amb17080668 [1,0,0,0,0,0|3,0,0]=4 494 B7R0.5 CC(=O)[C@@H](N)CCO Amb28410323 [1,0,0,0,0,0|2,0,1]=4 495 B7R0.5 CC(=O)[C@H](O)CC=O Amb27446551 [1,0,0,0,0,0|1,0,0]=2 496 B7R0.5 CC(CC#N)C(=O)O Amb17334056 [1,0,0,0,0,0|2,0,1]=4 497 B7R0.5 CC(CC=O)C(=O)O Amb27952476 [1,0,0,0,0,0|1,0,0]=2 498 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [1,0,0,0,0,0|2,0,1]=4 499 B7R0.5 CC(CCF)C(=O)O Amb24678386 [1,0,0,0,0,0|2,0,1]=4 500 B7R0.5 CC(CCN)C(=O)O Amb20667970 [1,0,0,0,0,0|2,0,1]=4 501 B7R0.5 CC(CCN)C(=O)O Amb538221 [1,0,0,0,0,0|2,0,1]=4 502 B7R0.5 CC(CCO)C(=O)O Amb18641949 [1,0,0,0,0,0|1,0,1]=3 503 B7R0.5 CC(CCO)C(=O)[O-] Amb33330478 [1,0,0,0,0,0|1,0,2]=4 504 B7R0.5 CC(CCO)C(N)=O Amb28280962 [1,0,0,0,0,0|2,0,1]=4 505 B7R0.5 CC(CNO)C(=O)O Amb28315956 [1,0,0,0,0,0|2,0,0]=3 506 B7R0.5 CC(CSS)C(=O)O Amb27437183 [1,0,0,0,0,0|2,1,0]=4 507 B7R0.5 CC(N=C=O)C(=O)O Amb33471295 [1,0,0,0,0,0|2,0,1]=4 508 B7R0.5 CC(NC=O)C(=O)O Amb1144629 [1,0,0,0,0,0|2,0,0]=3 509 B7R0.5 CC(NCO)C(=O)O Amb27468253 [1,0,0,0,0,0|2,0,1]=4 510 B7R0.5 CC(OC=O)C(=O)O Amb27872094 [1,0,0,0,0,0|2,0,0]=3 511 B7R0.5 CC(\N=N\O)C(=O)O Amb28251041 [1,0,0,0,0,0|3,0,0]=4 512 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [1,0,0,0,0,0|2,0,1]=4 513 B7R0.5 CCCC(C)C(=O)O Amb3938958 [1,0,0,0,0,0|2,0,1]=4 514 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [1,0,0,0,0,0|2,0,1]=4 515 B7R0.5 CCCC(F)C(=O)O Amb25842008 [1,0,0,0,0,0|2,0,1]=4 516 B7R0.5 CCCC(N)C(=O)O Amb6262055 [1,0,0,0,0,0|2,0,1]=4 517 B7R0.5 CCCC(O)C(=O)O Amb2818222 [1,0,0,0,0,0|1,0,1]=3 518 B7R0.5 CCCC(O)C(C)=O Amb22495823 [1,0,0,0,0,0|2,0,1]=4 519 B7R0.5 CCCC(O)C(N)=O Amb24116553 [1,0,0,0,0,0|2,0,1]=4 520 B7R0.5 CCCC(S)C(=O)O Amb18124440 [1,0,0,0,0,0|1,1,1]=4 521 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [1,0,0,0,0,0|2,0,1]=4 522 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [1,0,0,0,0,0|2,0,1]=4 523 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [1,0,0,0,0,0|2,0,1]=4 524 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [1,0,0,0,0,0|1,0,1]=3 525 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [1,0,0,0,0,0|2,0,1]=4 526 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [1,0,0,0,0,0|2,0,1]=4 527 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [1,0,0,0,0,0|2,0,1]=4 528 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [1,0,0,0,0,0|2,0,1]=4 529 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [1,0,0,0,0,0|2,0,1]=4 530 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [1,0,0,0,0,0|1,0,1]=3 531 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [1,0,0,0,0,0|2,0,1]=4 532 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [1,0,0,0,0,0|1,1,1]=4 533 B7R0.5 CCNC(O)C(=O)O Amb27259098 [1,0,0,0,0,0|2,0,1]=4 534 B7R0.5 CNCC(C)C(=O)O Amb13952364 [1,0,0,0,0,0|3,0,0]=4 535 B7R0.5 CNCC(C)C(=O)O Amb9400281 [1,0,0,0,0,0|3,0,0]=4 536 B7R0.5 CNCC(N)C(=O)O Amb10845350 [1,0,0,0,0,0|3,0,0]=4 537 B7R0.5 CNCC(O)C(=O)O Amb26894610 [1,0,0,0,0,0|2,0,0]=3 538 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [1,0,0,0,0,0|3,0,0]=4 539 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [1,0,0,0,0,0|3,0,0]=4 540 B7R0.5 COCC(Br)C(=O)O Amb17594709 [1,0,0,0,0,0|3,0,0]=4 541 B7R0.5 COCC(C)C(=O)O Amb33545090 [1,0,0,0,0,0|3,0,0]=4 542 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [1,0,0,0,0,0|3,0,0]=4 543 B7R0.5 COCC(N)C(=O)O Amb33551350 [1,0,0,0,0,0|3,0,0]=4 544 B7R0.5 COCC(N)C(=O)O Amb6752055 [1,0,0,0,0,0|3,0,0]=4 545 B7R0.5 COCC(O)C(=O)O Amb18124273 [1,0,0,0,0,0|2,0,0]=3 546 B7R0.5 COCC(O)C(N)=O Amb28069186 [1,0,0,0,0,0|3,0,0]=4 547 B7R0.5 COCC(S)C(=O)O Amb27763656 [1,0,0,0,0,0|2,1,0]=4 548 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [1,0,0,0,0,0|3,0,0]=4 549 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [1,0,0,0,0,0|3,0,0]=4 550 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [1,0,0,0,0,0|3,0,0]=4 551 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [1,0,0,0,0,0|3,0,0]=4 552 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [1,0,0,0,0,0|3,0,0]=4 553 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [1,0,0,0,0,0|3,0,0]=4 554 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [1,0,0,0,0,0|2,0,0]=3 555 B7R0.5 CSCC(C)C(=O)O Amb18967825 [1,0,0,0,0,0|3,0,0]=4 556 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [1,0,0,0,0,0|3,0,0]=4 557 B7R0.5 CSCC(N)C(=O)O Amb33804791 [1,0,0,0,0,0|3,0,0]=4 558 B7R0.5 CSCC(N)C(=O)O Amb6280829 [1,0,0,0,0,0|3,0,0]=4 559 B7R0.5 CSCC(O)C(=O)O Amb25131873 [1,0,0,0,0,0|2,0,0]=3 560 B7R0.5 CSCC(O)C(C)=O Amb25983211 [1,0,0,0,0,0|3,0,0]=4 561 B7R0.5 CSCC(O)C(N)=O Amb27168145 [1,0,0,0,0,0|3,0,0]=4 562 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [1,0,0,0,0,0|3,0,0]=4 563 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [1,0,0,0,0,0|3,0,0]=4 564 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [1,0,0,0,0,0|3,0,0]=4 565 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [1,0,0,0,0,0|2,0,1]=4 566 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [1,0,0,0,0,0|2,0,1]=4 567 B7R0.5 C[C@@H](N=C=O)C(=O)O Amb33189209 [1,0,0,0,0,0|2,0,1]=4 568 B7R0.5 C[C@@H](NC=O)C(N)=O Amb27837549 [1,0,0,0,0,0|3,0,0]=4 569 B7R0.5 C[C@@H](O)[C@@H](O)CC=O Amb27643485 [1,0,0,0,0,0|1,0,1]=3 570 B7R0.5 C[C@@H](O)[C@H](O)CC=O Amb27798254 [1,0,0,0,0,0|1,0,1]=3 571 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [1,0,0,0,0,0|2,0,1]=4 572 B7R0.5 C[C@H](N=C=O)C(=O)O Amb33471333 [1,0,0,0,0,0|2,0,1]=4 573 B7R0.5 C[C@H](NC=O)C(=O)O Amb28323701 [1,0,0,0,0,0|2,0,0]=3 574 B7R0.5 C[C@H](NCO)C(=O)O Amb24401217 [1,0,0,0,0,0|2,0,1]=4 575 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [1,0,0,0,0,0|3,0,0]=4 576 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [1,0,0,0,0,0|3,0,0]=4 577 B7R0.5 C\C(=C/C=O)C(=O)O Amb27165186 [1,0,0,0,0,0|1,0,2]=4 578 B7R0.5 C\C=C\C(Br)C(=O)O Amb27451575 [1,0,0,0,0,0|2,0,1]=4 579 B7R0.5 C\C=C\C(O)C(=O)O Amb30585115 [1,0,0,0,0,0|1,0,1]=3 580 B7R0.5 C\C=C\C(O)C(C)=O Amb25912951 [1,0,0,0,0,0|2,0,1]=4 581 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [1,0,0,0,0,0|2,0,1]=4 582 B7R0.5 C\C=C\[C@@H](O)C(=O)O Amb28368832 [1,0,0,0,0,0|1,0,1]=3 583 B7R0.5 C\C=C\[C@H](O)C(=O)O Amb27162651 [1,0,0,0,0,0|1,0,1]=3 584 B7R0.5 N#CCC(N)C(=O)O Amb18641766 [1,0,0,0,0,0|2,0,1]=4 585 B7R0.5 N#CC[C@@H](N)C(=O)O Amb26397494 [1,0,0,0,0,0|2,0,1]=4 586 B7R0.5 N#CC[C@H](N)C(=O)O Amb16183916 [1,0,0,0,0,0|2,0,1]=4 587 B7R0.5 NC(=O)C(N)CCO Amb24481392 [1,0,0,0,0,0|2,0,1]=4 588 B7R0.5 NC(=O)C(N)CNO Amb27396201 [1,0,0,0,0,0|3,0,0]=4 589 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [1,0,0,0,0,0|2,0,1]=4 590 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [1,0,0,0,0,0|2,0,1]=4 591 B7R0.5 NC(CCF)C(=O)O Amb25889337 [1,0,0,0,0,0|2,0,1]=4 592 B7R0.5 NC(CCF)C(=O)O Amb28934889 [1,0,0,0,0,0|2,0,1]=4 593 B7R0.5 NC(CCO)C(=O)O Amb8514287 [1,0,0,0,0,0|1,0,1]=3 594 B7R0.5 NC(CCS)C(=O)O Amb19267093 [1,0,0,0,0,0|1,1,1]=4 595 B7R0.5 NC(CCS)C(=O)O Amb3499433 [1,0,0,0,0,0|1,1,1]=4 596 B7R0.5 NC(CNO)C(=O)O Amb4092732 [1,0,0,0,0,0|2,0,0]=3 597 B7R0.5 NC(CO[SiH3])C(=O)O Amb27461306 [1,0,0,0,0,0|3,0,0]=4 598 B7R0.5 NC(\C=C\F)C(=O)O Amb27666430 [1,0,0,0,0,0|2,0,1]=4 599 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [1,0,0,0,0,0|2,0,1]=4 600 B7R0.5 NCCC(F)C(=O)O Amb10838221 [1,0,0,0,0,0|2,0,1]=4 601 B7R0.5 NCCC(F)C(=O)O Amb22229524 [1,0,0,0,0,0|2,0,1]=4 602 B7R0.5 NCCC(N)C(=O)O Amb2697841 [1,0,0,0,0,0|2,0,1]=4 603 B7R0.5 NCCC(N)C(=O)O Amb8514694 [1,0,0,0,0,0|2,0,1]=4 604 B7R0.5 NCCC(O)C(=O)O Amb16232090 [1,0,0,0,0,0|1,0,1]=3 605 B7R0.5 NCCC(O)C(N)=O Amb28121985 [1,0,0,0,0,0|2,0,1]=4 606 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [1,0,0,0,0,0|2,0,1]=4 607 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [1,0,0,0,0,0|2,0,1]=4 608 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [1,0,0,0,0,0|2,0,1]=4 609 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [1,0,0,0,0,0|2,0,1]=4 610 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [1,0,0,0,0,0|1,0,1]=3 611 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [1,0,0,0,0,0|2,0,1]=4 612 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [1,0,0,0,0,0|2,0,1]=4 613 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [1,0,0,0,0,0|2,0,1]=4 614 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [1,0,0,0,0,0|2,0,1]=4 615 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [1,0,0,0,0,0|2,0,1]=4 616 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [1,0,0,0,0,0|1,0,1]=3 617 B7R0.5 NCC[C@H](O)C(N)=O Amb27390493 [1,0,0,0,0,0|2,0,1]=4 618 B7R0.5 NNCC(O)C(=O)[O-] Amb27956514 [1,0,0,0,0,0|2,0,1]=4 619 B7R0.5 NOCC(N)C(=O)O Amb24184086 [1,0,0,0,0,0|3,0,0]=4 620 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [1,0,0,0,0,0|2,0,1]=4 621 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [1,0,0,0,0,0|2,0,1]=4 622 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [1,0,0,0,0,0|1,0,1]=3 623 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [1,0,0,0,0,0|1,0,1]=3 624 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [1,0,0,0,0,0|1,1,1]=4 625 B7R0.5 N[C@@H](\C=C/F)C(=O)O Amb27447269 [1,0,0,0,0,0|2,0,1]=4 626 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [1,0,0,0,0,0|1,0,0]=2 627 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [1,0,0,0,0,0|2,0,1]=4 628 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [1,0,0,0,0,0|2,0,1]=4 629 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [1,0,0,0,0,0|1,0,1]=3 630 B7R0.5 N[C@H](C[SH]=O)C(=O)O Amb27596028 [1,0,0,0,0,0|2,0,0]=3 631 B7R0.5 O=C(O)C(=O)CCO Amb25677024 [1,0,0,0,0,0|0,0,3]=4 632 B7R0.5 O=C(O)C(Br)CCBr Amb19889695 [1,0,0,0,0,0|2,0,1]=4 633 B7R0.5 O=C(O)C(Br)CCO Amb28325416 [1,0,0,0,0,0|1,0,1]=3 634 B7R0.5 O=C(O)C(Cl)CCCl Amb18126030 [1,0,0,0,0,0|2,0,1]=4 635 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [1,0,0,0,0,0|1,0,1]=3 636 B7R0.5 O=C(O)C(O)CCF Amb28071189 [1,0,0,0,0,0|1,0,1]=3 637 B7R0.5 O=C(O)C(O)CCO Amb24689942 [1,0,0,0,0,0|0,0,1]=2 638 B7R0.5 O=C(O)C(O)CNO Amb27405525 [1,0,0,0,0,0|1,0,0]=2 639 B7R0.5 O=C(O)C(S)CCS Amb27634893 [1,0,0,0,0,0|0,2,1]=4 640 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [1,0,0,0,0,0|1,0,1]=3 641 B7R0.5 O=CCC(=O)C(=O)O Amb26326260 [1,0,0,0,0,0|0,0,2]=3 642 B7R0.5 O=C\C=C(/Br)C(=O)O Amb28320595 [1,0,0,0,0,0|1,0,2]=4 643 B7R0.5 O=C\C=C(/Cl)C(=O)O Amb27784434 [1,0,0,0,0,0|1,0,2]=4 644 B7R0.6 C=C(Br)CCC(=O)O Amb18648212 [1,0,0,0,0,0|2,0,0]=3 645 B7R0.6 C=C(C)CCC(=O)O Amb18641793 [1,0,0,0,0,0|2,0,0]=3 646 B7R0.6 C=C(C)CCC(C)=O Amb9024770 [1,0,0,0,0,0|3,0,0]=4 647 B7R0.6 C=C(C)CCC(N)=O Amb27838318 [1,0,0,0,0,0|3,0,0]=4 648 B7R0.6 C=C(C)NCC(=O)O Amb9173757 [1,0,0,0,0,0|3,0,0]=4 649 B7R0.6 C=C(Cl)CCC(=O)O Amb18642971 [1,0,0,0,0,0|2,0,0]=3 650 B7R0.6 C=C(Cl)CCC(C)=O Amb28316194 [1,0,0,0,0,0|3,0,0]=4 651 B7R0.6 C=C(N)CCC(=O)O Amb27629351 [1,0,0,0,0,0|2,0,0]=3 652 B7R0.6 C=C(O)\C=C\C(=O)O Amb26391061 [1,0,0,0,0,0|1,0,2]=4 653 B7R0.6 CC(=O)CCB(O)O Amb25095502 [1,0,0,0,0,0|2,0,1]=4 654 B7R0.6 CC(=O)CCC(=O)O Amb534169 [1,0,0,0,0,0|1,0,0]=2 655 B7R0.6 CC(=O)CCC(=S)Cl Amb28049019 [1,0,0,0,0,0|2,1,0]=4 656 B7R0.6 CC(=O)CCC(C)=O Amb2793010 [1,0,0,0,0,0|2,0,0]=3 657 B7R0.6 CC(=O)CCC(C)=S Amb27226729 [1,0,0,0,0,0|2,1,0]=4 658 B7R0.6 CC(=O)CCC(C)O Amb25829594 [1,0,0,0,0,0|2,0,1]=4 659 B7R0.6 CC(=O)CCC(N)=O Amb17142854 [1,0,0,0,0,0|2,0,0]=3 660 B7R0.6 CC(=O)CCC(O)=S Amb27267983 [1,0,0,0,0,0|1,1,0]=3 661 B7R0.6 CC(=O)CC[C@@H](C)O Amb22351150 [1,0,0,0,0,0|2,0,1]=4 662 B7R0.6 CC(=O)CC[N+](=O)[O-] Amb18198961 [1,0,0,0,0,0|2,0,1]=4 663 B7R0.6 CC(=O)CNC(C)=O Amb6297294 [1,0,0,0,0,0|3,0,0]=4 664 B7R0.6 CC(=O)COC(C)=O Amb8517567 [1,0,0,0,0,0|3,0,0]=4 665 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [1,0,0,0,0,0|2,0,0]=3 666 B7R0.6 CC(=O)NCC(N)=O Amb17231824 [1,0,0,0,0,0|3,0,0]=4 667 B7R0.6 CC(=O)OCC(=O)Cl Amb3939160 [1,0,0,0,0,0|3,0,0]=4 668 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [1,0,0,0,0,0|2,0,0]=3 669 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [1,0,0,0,0,0|3,0,0]=4 670 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [1,0,0,0,0,0|3,0,0]=4 671 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [1,0,0,0,0,0|3,0,0]=4 672 B7R0.6 CC(=O)\C=C\C(=O)O Amb2722867 [1,0,0,0,0,0|1,0,2]=4 673 B7R0.6 CC(=O)\N=C\C(=O)O Amb27262053 [1,0,0,0,0,0|2,0,1]=4 674 B7R0.6 CC(=S)NCC(=O)O Amb24325138 [1,0,0,0,0,0|2,1,0]=4 675 B7R0.6 CC(=S)SCC(=O)O Amb25963237 [1,0,0,0,0,0|2,1,0]=4 676 B7R0.6 CC(Br)CCC(=O)O Amb18124528 [1,0,0,0,0,0|2,0,1]=4 677 B7R0.6 CC(C)=CCC(=O)O Amb6274419 [1,0,0,0,0,0|2,0,1]=4 678 B7R0.6 CC(C)CCC(=O)O Amb1153016 [1,0,0,0,0,0|2,0,1]=4 679 B7R0.6 CC(I)CCC(=O)O Amb25938596 [1,0,0,0,0,0|2,0,1]=4 680 B7R0.6 CC(N)CCC(=O)O Amb17593212 [1,0,0,0,0,0|2,0,1]=4 681 B7R0.6 CC(N)CCC(=O)O Amb19515603 [1,0,0,0,0,0|2,0,1]=4 682 B7R0.6 CC(O)CCC(=O)O Amb18294804 [1,0,0,0,0,0|1,0,1]=3 683 B7R0.6 CC(O)CCC(=O)[O-] Amb32729478 [1,0,0,0,0,0|1,0,2]=4 684 B7R0.6 CC(S)CCC(=O)O Amb8471198 [1,0,0,0,0,0|1,1,1]=4 685 B7R0.6 CN(C)CCC(=O)O Amb19888182 [1,0,0,0,0,0|3,0,0]=4 686 B7R0.6 CN(C)CCC(=O)O Amb6633385 [1,0,0,0,0,0|3,0,0]=4 687 B7R0.6 CN(N)CCC(=O)O Amb2698078 [1,0,0,0,0,0|3,0,0]=4 688 B7R0.6 CN(O)CCC(N)=O Amb27390605 [1,0,0,0,0,0|3,0,0]=4 689 B7R0.6 CS(=O)CCC(=O)O Amb18523762 [1,0,0,0,0,0|2,0,0]=3 690 B7R0.6 CS(=O)NCC(=O)O Amb25237322 [1,0,0,0,0,0|3,0,0]=4 691 B7R0.6 C[C@@H](N)CCC(=O)O Amb25960628 [1,0,0,0,0,0|2,0,1]=4 692 B7R0.6 C[C@@H](N)CCC(=O)O Amb35753110 [1,0,0,0,0,0|2,0,1]=4 693 B7R0.6 C[C@H](N)CCC(=O)O Amb25047328 [1,0,0,0,0,0|2,0,1]=4 694 B7R0.6 C[C@H](N)CCC(=O)O Amb35752545 [1,0,0,0,0,0|2,0,1]=4 695 B7R0.6 C[C@H](O)CCC(=O)O Amb27656596 [1,0,0,0,0,0|1,0,1]=3 696 B7R0.6 C[C@H](S)CCC(=O)O Amb27170326 [1,0,0,0,0,0|1,1,1]=4 697 B7R0.6 C[S+](C)CCC(=O)O Amb8390782 [1,0,0,0,0,0|3,0,0]=4 698 B7R0.6 C\C(Cl)=C\CC(=O)O Amb27975492 [1,0,0,0,0,0|2,0,1]=4 699 B7R0.6 N=C(N)CCC(N)=O Amb25680023 [1,0,0,0,0,0|3,0,0]=4 700 B7R0.6 N=C(N)NCC(=O)O Amb16231404 [1,0,0,0,0,0|3,0,0]=4 701 B7R0.6 N=C(N)NCC(=O)O Amb2781642 [1,0,0,0,0,0|3,0,0]=4 702 B7R0.6 N=C(N)SCC(=O)O Amb33544354 [1,0,0,0,0,0|3,0,0]=4 703 B7R0.6 NC(=O)CCC(=O)Cl Amb28240580 [1,0,0,0,0,0|2,0,0]=3 704 B7R0.6 NC(=O)CCC(=O)O Amb2967294 [1,0,0,0,0,0|1,0,0]=2 705 B7R0.6 NC(=O)CCC(N)=O Amb1353209 [1,0,0,0,0,0|2,0,0]=3 706 B7R0.6 NC(=O)CCC(O)O Amb27254204 [1,0,0,0,0,0|1,0,2]=4 707 B7R0.6 NC(=O)CO[PH](=O)O Amb27392553 [1,0,0,0,0,0|3,0,0]=4 708 B7R0.6 NC(=O)NCC(=O)O Amb6366364 [1,0,0,0,0,0|2,0,0]=3 709 B7R0.6 NC(=O)\C=C/C(=O)O Amb2719749 [1,0,0,0,0,0|1,0,2]=4 710 B7R0.6 NC(=O)\C=C\C(=O)O Amb9277095 [1,0,0,0,0,0|1,0,2]=4 711 B7R0.6 NC(=O)\N=C\C(=O)O Amb27592464 [1,0,0,0,0,0|2,0,1]=4 712 B7R0.6 NC(=S)CCC(=O)O Amb18102382 [1,0,0,0,0,0|1,1,0]=3 713 B7R0.6 NC(=S)NCC(=O)O Amb9786290 [1,0,0,0,0,0|2,1,0]=4 714 B7R0.6 O=C(Cl)CCC(=O)Cl Amb3940240 [1,0,0,0,0,0|2,0,0]=3 715 B7R0.6 O=C(O)C#CC(=O)O Amb6297768 [1,0,0,0,0,0|0,0,2]=3 716 B7R0.6 O=C(O)CC=C(Cl)Cl Amb17593875 [1,0,0,0,0,0|2,0,1]=4 717 B7R0.6 O=C(O)CCB(O)O Amb24640288 [1,0,0,0,0,0|1,0,1]=3 718 B7R0.6 O=C(O)CCC(=O)O Amb22168124 [1,0,0,0,0,0|0,0,0]=1 719 B7R0.6 O=C(O)CCC(=O)O Amb2792874 [1,0,0,0,0,0|0,0,0]=1 720 B7R0.6 O=C(O)CCC(Cl)Cl Amb25059214 [1,0,0,0,0,0|2,0,1]=4 721 B7R0.6 O=C(O)CCC(F)F Amb20623135 [1,0,0,0,0,0|2,0,1]=4 722 B7R0.6 O=C(O)CCN(F)F Amb28370344 [1,0,0,0,0,0|3,0,0]=4 723 B7R0.6 O=C(O)CCP(O)O Amb27424479 [1,0,0,0,0,0|1,0,1]=3 724 B7R0.6 O=C(O)CCS(=O)O Amb27144832 [1,0,0,0,0,0|1,0,0]=2 725 B7R0.6 O=C(O)CC[N+](=O)[O-] Amb10843224 [1,0,0,0,0,0|1,0,1]=3 726 B7R0.6 O=C(O)CC[SH](=O)=O Amb27410689 [1,0,0,0,0,0|1,0,1]=3 727 B7R0.6 O=C(O)CNC(=O)S Amb27424662 [1,0,0,0,0,0|1,1,0]=3 728 B7R0.6 O=C(O)CN[N+](=O)[O-] Amb26397226 [1,0,0,0,0,0|2,0,1]=4 729 B7R0.6 O=C(O)COC(=O)Cl Amb27199161 [1,0,0,0,0,0|2,0,0]=3 730 B7R0.6 O=C(O)\C=C/C(=O)O Amb2792876 [1,0,0,0,0,0|0,0,2]=3 731 B7R0.6 O=C(O)\C=C\C(=O)Cl Amb25890079 [1,0,0,0,0,0|1,0,2]=4 732 B7R0.6 O=C(O)\C=C\C(=O)O Amb6608657 [1,0,0,0,0,0|0,0,2]=3 733 B7R0.6 O=C(O)\C=C\C(=O)O Amb8513055 [1,0,0,0,0,0|0,0,2]=3 734 B7R0.6 O=C(O)\C=C\C(=O)S Amb27468769 [1,0,0,0,0,0|0,1,2]=4 735 B7R0.6 O=C([O-])C#CC(=O)O Amb19748298 [1,0,0,0,0,0|0,0,3]=4 736 B7R0.6 O=C([O-])C#CC(=O)O Amb2721628 [1,0,0,0,0,0|0,0,3]=4 737 B7R0.6 O=C([O-])C#CC(=O)O Amb33620293 [1,0,0,0,0,0|0,0,3]=4 738 B7R0.6 O=C([O-])CCC(=O)[O-] Amb33512742 [1,0,0,0,0,0|0,0,2]=3 739 B7R0.6 O=C([O-])CCC(=O)[O-] Amb8514379 [1,0,0,0,0,0|0,0,2]=3 740 B7R0.6 O=C([O-])\C=C/C(=O)O Amb22168115 [1,0,0,0,0,0|0,0,3]=4 741 B7R0.6 O=C([O-])\C=C/C(=O)O Amb9787714 [1,0,0,0,0,0|0,0,3]=4 742 B7R0.6 [BH3-]C(=O)NCC(=O)O Amb27478291 [1,0,0,0,0,0|2,0,0]=3 743 B9R0.10 CC(C)(C)C(O)CC(=O)O Amb17232006 [0,1,0,0,0,0|2,0,1]=4 744 B9R0.10 CC(C)(C)[C@@H](O)CC(=O)O Amb24505172 [0,1,0,0,0,0|2,0,1]=4 745 B9R0.10 CC(C)(C)[C@H](O)CC(=O)O Amb25889023 [0,1,0,0,0,0|2,0,1]=4 746 B9R0.10 CC(C)(F)C(O)CC(=O)O Amb33272209 [0,1,0,0,0,0|2,0,1]=4 747 B9R0.10 CC(C)(F)[C@@H](O)CC(=O)O Amb33272208 [0,1,0,0,0,0|2,0,1]=4 748 B9R0.10 CC(C)(F)[C@H](O)CC(=O)O Amb33225482 [0,1,0,0,0,0|2,0,1]=4 749 B9R0.10 CC(CC(=O)O)C(C)(C)O Amb27815005 [0,1,0,0,0,0|2,0,1]=4 750 B9R0.10 CC(CC(=O)O)S(=O)(=O)O Amb27634850 [0,1,0,0,0,0|2,0,0]=3 751 B9R0.10 CC(F)(F)C(O)CC(=O)O Amb32809827 [0,1,0,0,0,0|2,0,1]=4 752 B9R0.10 CC(F)(F)[C@@H](O)CC(=O)O Amb33482321 [0,1,0,0,0,0|2,0,1]=4 753 B9R0.10 CC(F)(F)[C@H](O)CC(=O)O Amb32809834 [0,1,0,0,0,0|2,0,1]=4 754 B9R0.10 CP(=O)(O)C(N)CC(=O)O Amb27831332 [0,1,0,0,0,0|2,0,0]=3 755 B9R0.10 CP(=O)(O)C(N)CC(N)=O Amb27615069 [0,1,0,0,0,0|3,0,0]=4 756 B9R0.10 C[C@H](CC(=O)O)P(=O)(O)O Amb27645396 [0,1,0,0,0,0|2,0,0]=3 757 B9R0.10 O=C(O)CC(O)C(Cl)(Cl)Cl Amb2782906 [0,1,0,0,0,0|2,0,1]=4 758 B9R0.10 O=C(O)CC(O)C(F)(F)F Amb5720894 [0,1,0,0,0,0|2,0,1]=4 759 B9R0.10 O=C(O)C[C@H](O)C(F)(F)F Amb10838307 [0,1,0,0,0,0|2,0,1]=4 760 B9R0.11 C=C(Br)CC(C)(C)C(=O)O Amb25887722 [0,1,0,0,0,0|3,0,0]=4 761 B9R0.11 C=C(C)C(C)(C)CC(=O)O Amb25703730 [0,1,0,0,0,0|3,0,0]=4 762 B9R0.11 C=C(C)C(C)(N)CC(=O)O Amb22641962 [0,1,0,0,0,0|3,0,0]=4 763 B9R0.11 C=C(C)C(C)(N)CC(=O)O Amb31307620 [0,1,0,0,0,0|3,0,0]=4 764 B9R0.11 C=C(C)C(F)(F)CC(=O)O Amb32810021 [0,1,0,0,0,0|3,0,0]=4 765 B9R0.11 C=C(C)CC(C)(C)C(=O)O Amb27619182 [0,1,0,0,0,0|3,0,0]=4 766 B9R0.11 C=C(C)CC(C)(N)C(=O)O Amb27838051 [0,1,0,0,0,0|3,0,0]=4 767 B9R0.11 C=C(C)CC(C)(O)C(=O)O Amb24763776 [0,1,0,0,0,0|2,0,0]=3 768 B9R0.11 C=C(C)CC(C)(O)C(C)=O Amb27800763 [0,1,0,0,0,0|3,0,0]=4 769 B9R0.11 C=C(C)CC(F)(F)C(=O)O Amb26356276 [0,1,0,0,0,0|3,0,0]=4 770 B9R0.11 C=C(C)C[C@](C)(O)C(=O)O Amb27618953 [0,1,0,0,0,0|2,0,0]=3 771 B9R0.11 C=C(F)C[C@](C)(N)C(=O)O Amb27440834 [0,1,0,0,0,0|3,0,0]=4 772 B9R0.11 CC(=O)C(C)(C)CC(=O)O Amb594714 [0,1,0,0,0,0|2,0,0]=3 773 B9R0.11 CC(=O)C(C)(C)CC(N)=O Amb26055921 [0,1,0,0,0,0|3,0,0]=4 774 B9R0.11 CC(=O)CC(C)(C)C(=O)O Amb18644092 [0,1,0,0,0,0|2,0,0]=3 775 B9R0.11 CC(=O)CC(C)(C)C(=O)S Amb28201149 [0,1,0,0,0,0|2,1,0]=4 776 B9R0.11 CC(=O)CC(C)(S)C(=O)O Amb27984551 [0,1,0,0,0,0|1,1,0]=3 777 B9R0.11 CC(=O)C[C@](C)(O)C(=O)O Amb27170683 [0,1,0,0,0,0|1,0,0]=2 778 B9R0.11 CC(=O)NC(C)(C)C(=O)O Amb13952726 [0,1,0,0,0,0|3,0,0]=4 779 B9R0.11 CC(=O)NC(C)(N)C(=O)O Amb27881127 [0,1,0,0,0,0|3,0,0]=4 780 B9R0.11 CC(=O)OC(C)(C)C(=O)O Amb18644243 [0,1,0,0,0,0|3,0,0]=4 781 B9R0.11 CC(=O)SC(C)(C)C(=O)O Amb17607677 [0,1,0,0,0,0|3,0,0]=4 782 B9R0.11 CC(=O)SC(F)(F)C(=O)O Amb27252817 [0,1,0,0,0,0|3,0,0]=4 783 B9R0.11 CC(C)(CC(=O)O)C(=O)Cl Amb27449457 [0,1,0,0,0,0|2,0,0]=3 784 B9R0.11 CC(C)(CC(=O)O)C(=O)O Amb9787793 [0,1,0,0,0,0|1,0,0]=2 785 B9R0.11 CC(C)(CC(=O)O)C(N)=S Amb17466449 [0,1,0,0,0,0|2,1,0]=4 786 B9R0.11 CC(C)(CC(N)=S)C(=O)O Amb27614963 [0,1,0,0,0,0|2,1,0]=4 787 B9R0.11 CC(C)(NC(N)=O)C(=O)O Amb9825347 [0,1,0,0,0,0|3,0,0]=4 788 B9R0.11 CC(C)C(C)(O)CC(=O)O Amb18991699 [0,1,0,0,0,0|2,0,1]=4 789 B9R0.11 CC(C)CC(C)(O)C(=O)O Amb18523766 [0,1,0,0,0,0|2,0,1]=4 790 B9R0.11 CC(C)[C@](C)(O)CC(=O)O Amb27810826 [0,1,0,0,0,0|2,0,1]=4 791 B9R0.11 CC(Cl)(CC(=O)O)C(=O)O Amb18126463 [0,1,0,0,0,0|1,0,0]=2 792 B9R0.11 CC(Cl)(CS(=O)O)C(=O)O Amb27781534 [0,1,0,0,0,0|2,0,0]=3 793 B9R0.11 CC(N)(CC(=O)O)C(=O)O Amb10807406 [0,1,0,0,0,0|1,0,0]=2 794 B9R0.11 CC(N)(CC(=O)O)[PH](=O)O Amb25701546 [0,1,0,0,0,0|2,0,0]=3 795 B9R0.11 CC(N)(CC(N)=O)C(=O)O Amb28131361 [0,1,0,0,0,0|2,0,0]=3 796 B9R0.11 CC(O)(CC(=O)O)C(=O)O Amb6366309 [0,1,0,0,0,0|0,0,0]=1 797 B9R0.11 CC(O)(CC(F)F)C(=O)O Amb27254585 [0,1,0,0,0,0|2,0,1]=4 798 B9R0.11 CC(O)CC(C)(N)C(=O)O Amb28289237 [0,1,0,0,0,0|2,0,1]=4 799 B9R0.11 CN(O)C(C)(C)CC(=O)O Amb30025601 [0,1,0,0,0,0|3,0,0]=4 800 B9R0.11 CN(O)CC(C)(O)C(=O)O Amb28349124 [0,1,0,0,0,0|2,0,0]=3 801 B9R0.11 CN(O)CC(F)(F)C(=O)O Amb33169729 [0,1,0,0,0,0|3,0,0]=4 802 B9R0.11 CS(=O)C(C)(C)CC(=O)O Amb28128345 [0,1,0,0,0,0|3,0,0]=4 803 B9R0.11 CS(=O)CC(C)(C)C(=O)O Amb28049647 [0,1,0,0,0,0|3,0,0]=4 804 B9R0.11 CS(=O)CC(C)(O)C(=O)O Amb27984742 [0,1,0,0,0,0|2,0,0]=3 805 B9R0.11 CS(=O)CC(F)(F)C(=O)O Amb33169820 [0,1,0,0,0,0|3,0,0]=4 806 B9R0.11 C[C@@](N)(CC(N)=O)C(=O)O Amb22225025 [0,1,0,0,0,0|2,0,0]=3 807 B9R0.11 C[C@@](O)(CC(F)F)C(=O)O Amb27165726 [0,1,0,0,0,0|2,0,1]=4 808 B9R0.11 C[C@](N)(CC(=O)O)C(=O)O Amb10601663 [0,1,0,0,0,0|1,0,0]=2 809 B9R0.11 C[C@](N)(CC(N)=O)C(=O)O Amb27195940 [0,1,0,0,0,0|2,0,0]=3 810 B9R0.11 C[C@](O)(CC(=O)O)C(=O)O Amb26398856 [0,1,0,0,0,0|0,0,0]=1 811 B9R0.11 C[C@](O)(CC(F)F)C(=O)O Amb27657615 [0,1,0,0,0,0|2,0,1]=4 812 B9R0.11 NC(=O)CC(N)(O)C(=O)O Amb27794741 [0,1,0,0,0,0|1,0,0]=2 813 B9R0.11 NC(=O)C[C@@](N)(O)C(=O)O Amb28348701 [0,1,0,0,0,0|1,0,0]=2 814 B9R0.11 O=C(O)CC(Cl)(Cl)C(=O)O Amb27971430 [0,1,0,0,0,0|1,0,0]=2 815 B9R0.11 O=C(O)CC(F)(F)C(=O)O Amb2732193 [0,1,0,0,0,0|1,0,0]=2 816 B9R0.23 C=C(Br)C[C@@H](N)C(=O)OC Amb27248287 [0,1,0,0,0,0|3,0,0]=4 817 B9R0.23 C=C(C)CC(C)C(=O)OC Amb27857780 [0,1,0,0,0,0|3,0,0]=4 818 B9R0.23 C=C(C)CC(Cl)C(=O)OC Amb28051409 [0,1,0,0,0,0|3,0,0]=4 819 B9R0.23 C=C(C)CC(N)C(=O)OC Amb26654974 [0,1,0,0,0,0|3,0,0]=4 820 B9R0.23 C=C(C)CC(O)C(=O)OC Amb24464009 [0,1,0,0,0,0|2,0,0]=3 821 B9R0.23 C=C(C)C[C@@H](O)C(=O)OC Amb27219810 [0,1,0,0,0,0|2,0,0]=3 822 B9R0.23 C=C(CC(=O)O)C(=O)OC Amb4034427 [0,1,0,0,0,0|1,0,1]=3 823 B9R0.23 C=C(CC)C(N)CC(=O)O Amb25068441 [0,1,0,0,0,0|3,0,0]=4 824 B9R0.23 C=C(Cl)CC(N)C(=O)OC Amb18645938 [0,1,0,0,0,0|3,0,0]=4 825 B9R0.23 C=CC(=O)N(C)CC(=O)O Amb6267159 [0,1,0,0,0,0|3,0,0]=4 826 B9R0.23 C=CC(=O)N(O)CC(=O)O Amb27175200 [0,1,0,0,0,0|2,0,0]=3 827 B9R0.23 CC(=O)C[C@@H](O)[C@@H](O)CO Amb25767917 [0,1,0,0,0,0|1,0,2]=4 828 B9R0.23 CC(C=O)C(C)CC(=O)O Amb27838156 [0,1,0,0,0,0|2,0,1]=4 829 B9R0.23 CC(CC(=O)O)C(N)CO Amb27843636 [0,1,0,0,0,0|2,0,1]=4 830 B9R0.23 CC(O)CC(O)C(O)C=O Amb25713186 [0,1,0,0,0,0|1,0,2]=4 831 B9R0.23 CCC(=O)N(C)CC(=O)O Amb1113094 [0,1,0,0,0,0|3,0,0]=4 832 B9R0.23 CCC(C)C(O)CC(=O)O Amb18310690 [0,1,0,0,0,0|2,0,1]=4 833 B9R0.23 CCC(C)[C@@H](O)CC(=O)O Amb33318493 [0,1,0,0,0,0|2,0,1]=4 834 B9R0.23 CCC(C)[C@H](O)CC(=O)O Amb33318492 [0,1,0,0,0,0|2,0,1]=4 835 B9R0.23 CCS(=O)C(C)CC(=O)O Amb19012075 [0,1,0,0,0,0|3,0,0]=4 836 B9R0.23 CC[C@H](O)[C@@H](N)CC(=O)O Amb27469484 [0,1,0,0,0,0|2,0,1]=4 837 B9R0.23 CN(CC(=O)O)C(=O)CCl Amb21956220 [0,1,0,0,0,0|3,0,0]=4 838 B9R0.23 CN(CC(=O)O)C(=O)CN Amb21929346 [0,1,0,0,0,0|3,0,0]=4 839 B9R0.23 CN(CC(=O)O)C(=O)CO Amb25848387 [0,1,0,0,0,0|2,0,0]=3 840 B9R0.23 CN(CC(=O)O)C(=O)CS Amb27406788 [0,1,0,0,0,0|2,1,0]=4 841 B9R0.23 CNC(=O)C(C)CC(N)=O Amb17334220 [0,1,0,0,0,0|3,0,0]=4 842 B9R0.23 CNC(=O)C(N)CC(=O)O Amb18862479 [0,1,0,0,0,0|2,0,0]=3 843 B9R0.23 CNC(=O)C(N)CC(N)=O Amb18968977 [0,1,0,0,0,0|3,0,0]=4 844 B9R0.23 COC(=O)C(=O)CC(C)=O Amb1155424 [0,1,0,0,0,0|1,0,2]=4 845 B9R0.23 COC(=O)C(Br)CC(=O)O Amb18656999 [0,1,0,0,0,0|1,0,0]=2 846 B9R0.23 COC(=O)C(C)CC(=O)O Amb18644248 [0,1,0,0,0,0|1,0,0]=2 847 B9R0.23 COC(=O)C(C)CC(C)=O Amb27465860 [0,1,0,0,0,0|2,0,0]=3 848 B9R0.23 COC(=O)C(C)CS(=O)Cl Amb32720544 [0,1,0,0,0,0|3,0,0]=4 849 B9R0.23 COC(=O)C(C)CS(=O)[O-] Amb32754342 [0,1,0,0,0,0|2,0,1]=4 850 B9R0.23 COC(=O)C(C)CS(N)=O Amb32720545 [0,1,0,0,0,0|3,0,0]=4 851 B9R0.23 COC(=O)C(C)C[PH](=O)O Amb27826336 [0,1,0,0,0,0|2,0,0]=3 852 B9R0.23 COC(=O)C(C)NC(C)=O Amb24650565 [0,1,0,0,0,0|3,0,0]=4 853 B9R0.23 COC(=O)C(C)NC(N)=O Amb20407420 [0,1,0,0,0,0|3,0,0]=4 854 B9R0.23 COC(=O)C(Cl)CC(=O)O Amb27589899 [0,1,0,0,0,0|1,0,0]=2 855 B9R0.23 COC(=O)C(Cl)CS(=O)Cl Amb32720436 [0,1,0,0,0,0|3,0,0]=4 856 B9R0.23 COC(=O)C(Cl)CS(=O)[O-] Amb32755396 [0,1,0,0,0,0|2,0,1]=4 857 B9R0.23 COC(=O)C(Cl)CS(N)=O Amb32720437 [0,1,0,0,0,0|3,0,0]=4 858 B9R0.23 COC(=O)C(Cl)NC(C)=O Amb28193243 [0,1,0,0,0,0|3,0,0]=4 859 B9R0.23 COC(=O)C(F)CC(=O)O Amb27837974 [0,1,0,0,0,0|1,0,0]=2 860 B9R0.23 COC(=O)C(N)CC(=O)O Amb18644309 [0,1,0,0,0,0|1,0,0]=2 861 B9R0.23 COC(=O)C(N)CC(C)=O Amb25367296 [0,1,0,0,0,0|2,0,0]=3 862 B9R0.23 COC(=O)C(N)CC(C)O Amb33065512 [0,1,0,0,0,0|2,0,1]=4 863 B9R0.23 COC(=O)C(N)CC(N)=O Amb16243083 [0,1,0,0,0,0|2,0,0]=3 864 B9R0.23 COC(=O)C(N)CC(N)=O Amb17601698 [0,1,0,0,0,0|2,0,0]=3 865 B9R0.23 COC(=O)C(O)CC(=O)O Amb17615865 [0,1,0,0,0,0|0,0,0]=1 866 B9R0.23 COC(=O)C(O)CC(C)C Amb19306745 [0,1,0,0,0,0|2,0,1]=4 867 B9R0.23 COC(=O)C(O)CC(F)F Amb32811459 [0,1,0,0,0,0|2,0,1]=4 868 B9R0.23 COC(=O)C(O)CC(N)=O Amb27655536 [0,1,0,0,0,0|1,0,0]=2 869 B9R0.23 COC(=O)N(C)CC(=O)O Amb6668732 [0,1,0,0,0,0|2,0,0]=3 870 B9R0.23 COC(=O)[C@@H](Br)CC(N)=O Amb27789593 [0,1,0,0,0,0|2,0,0]=3 871 B9R0.23 COC(=O)[C@@H](C)NC(C)=O Amb17621817 [0,1,0,0,0,0|3,0,0]=4 872 B9R0.23 COC(=O)[C@@H](C)OC(C)=O Amb28314265 [0,1,0,0,0,0|3,0,0]=4 873 B9R0.23 COC(=O)[C@@H](F)CC(=O)O Amb27406311 [0,1,0,0,0,0|1,0,0]=2 874 B9R0.23 COC(=O)[C@@H](N)CC(=O)O Amb22746069 [0,1,0,0,0,0|1,0,0]=2 875 B9R0.23 COC(=O)[C@@H](N)CC(=O)O Amb8390387 [0,1,0,0,0,0|1,0,0]=2 876 B9R0.23 COC(=O)[C@@H](N)CC(=O)[O-] Amb22231950 [0,1,0,0,0,0|1,0,1]=3 877 B9R0.23 COC(=O)[C@@H](N)CC(N)=O Amb8390381 [0,1,0,0,0,0|2,0,0]=3 878 B9R0.23 COC(=O)[C@@H](O)CC(=O)O Amb17615867 [0,1,0,0,0,0|0,0,0]=1 879 B9R0.23 COC(=O)[C@H](C)CC(=O)Cl Amb28050543 [0,1,0,0,0,0|2,0,0]=3 880 B9R0.23 COC(=O)[C@H](C)CC(=O)O Amb24561954 [0,1,0,0,0,0|1,0,0]=2 881 B9R0.23 COC(=O)[C@H](C)NC(C)=O Amb4034849 [0,1,0,0,0,0|3,0,0]=4 882 B9R0.23 COC(=O)[C@H](C)NC(N)=O Amb27948545 [0,1,0,0,0,0|3,0,0]=4 883 B9R0.23 COC(=O)[C@H](Cl)CC(=O)O Amb27232518 [0,1,0,0,0,0|1,0,0]=2 884 B9R0.23 COC(=O)[C@H](N)CC(=O)O Amb19944281 [0,1,0,0,0,0|1,0,0]=2 885 B9R0.23 COC(=O)[C@H](N)CC(N)=O Amb19883963 [0,1,0,0,0,0|2,0,0]=3 886 B9R0.23 COC(=O)[C@H](N)CC(N)=O Amb27597987 [0,1,0,0,0,0|2,0,0]=3 887 B9R0.23 COC(=O)[C@H](O)C=C(C)C Amb27432220 [0,1,0,0,0,0|2,0,1]=4 888 B9R0.23 COC(=O)[C@H](O)CC(=O)O Amb17615866 [0,1,0,0,0,0|0,0,0]=1 889 B9R0.23 COC(=O)[C@H](O)CC(C)C Amb26022448 [0,1,0,0,0,0|2,0,1]=4 890 B9R0.23 COC(=O)[C@H](O)CC(N)=O Amb27623997 [0,1,0,0,0,0|1,0,0]=2 891 B9R0.23 COC(=O)\C(Br)=C\C(=O)O Amb15695379 [0,1,0,0,0,0|1,0,2]=4 892 B9R0.23 COC(=O)\C(C)=C\C(=O)O Amb27221493 [0,1,0,0,0,0|1,0,2]=4 893 B9R0.23 COC(=O)\C(F)=C\C(=O)O Amb28288995 [0,1,0,0,0,0|1,0,2]=4 894 B9R0.23 COC(=O)\C(O)=C\C(C)=O Amb1981446 [0,1,0,0,0,0|1,0,2]=4 895 B9R0.23 COC(=S)N(C)CC(=O)O Amb24514158 [0,1,0,0,0,0|2,1,0]=4 896 B9R0.23 COC(C)C(C)CC(=O)O Amb18202340 [0,1,0,0,0,0|2,0,1]=4 897 B9R0.23 COC(C)C(N)CC(=O)O Amb26567214 [0,1,0,0,0,0|2,0,1]=4 898 B9R0.23 CO[C@H](C)[C@H](N)CC(=O)O Amb35788177 [0,1,0,0,0,0|2,0,1]=4 899 B9R0.23 CO[C@H](C)[C@H](N)CC(=O)O Amb35789671 [0,1,0,0,0,0|2,0,1]=4 900 B9R0.23 C[C@@H](N)C[C@@H](O)C(=O)NO Amb27620269 [0,1,0,0,0,0|2,0,1]=4 901 B9R0.23 C[C@H](C=O)[C@@H](C)CC(=O)O Amb27874077 [0,1,0,0,0,0|2,0,1]=4 902 B9R0.23 C\C(=C/N)C(N)CC(=O)O Amb28075172 [0,1,0,0,0,0|3,0,0]=4 903 B9R0.23 C\C(=N/O)C(O)CC(=O)O Amb27223478 [0,1,0,0,0,0|1,0,0]=2 904 B9R0.23 C\C=C(\C)C(N)CC(=O)O Amb28245387 [0,1,0,0,0,0|3,0,0]=4 905 B9R0.23 NC(=O)C[C@@H](O)[C@H](O)CO Amb27788545 [0,1,0,0,0,0|1,0,2]=4 906 B9R0.23 NC(=O)C[C@H](O)[C@H](O)CO Amb27759937 [0,1,0,0,0,0|1,0,2]=4 907 B9R0.23 NC(CC(=O)O)C(O)CF Amb28071644 [0,1,0,0,0,0|2,0,1]=4 908 B9R0.23 NC(CO)C(N)CC(=O)O Amb27804493 [0,1,0,0,0,0|2,0,1]=4 909 B9R0.23 NNC(=O)C(N)CC(=O)O Amb26438038 [0,1,0,0,0,0|2,0,0]=3 910 B9R0.23 NNC(=O)C(N)CC(=O)O Amb35750707 [0,1,0,0,0,0|2,0,0]=3 911 B9R0.23 NNC(=O)C(N)CC(N)=O Amb27265356 [0,1,0,0,0,0|3,0,0]=4 912 B9R0.23 N[C@@H](CO)[C@H](N)CC(=O)O Amb27594534 [0,1,0,0,0,0|2,0,1]=4 913 B9R0.23 N[C@H](CC(=O)O)C(=O)NO Amb27413035 [0,1,0,0,0,0|1,0,0]=2 914 B9R0.23 O=C(O)CC(Br)C(=O)CBr Amb15772353 [0,1,0,0,0,0|2,0,0]=3 915 B9R0.23 O=C(O)CC(S)C(=O)CS Amb27758589 [0,1,0,0,0,0|0,2,0]=3 916 B9R0.23 O=C(O)C[C@@H](O)[C@@H](O)CO Amb24726353 [0,1,0,0,0,0|0,0,2]=3 917 B9R0.39 C#CC(NC(C)=O)C(=O)O Amb27411184 [0,1,0,0,0,0|3,0,0]=4 918 B9R0.39 C#C[C@@H](NC(C)=O)C(=O)O Amb27393972 [0,1,0,0,0,0|3,0,0]=4 919 B9R0.39 C=C(C)C(CC)CC(=O)O Amb27655611 [0,1,0,0,0,0|3,0,0]=4 920 B9R0.39 C=C(C)C(CN)CC(=O)O Amb33199956 [0,1,0,0,0,0|3,0,0]=4 921 B9R0.39 C=C(C)CC(C#N)C(=O)O Amb35741470 [0,1,0,0,0,0|3,0,0]=4 922 B9R0.39 C=C(C)CC(OC)C(=O)O Amb26386702 [0,1,0,0,0,0|2,0,0]=3 923 B9R0.39 C=C(C)C[C@@H](CC)C(=O)O Amb27785162 [0,1,0,0,0,0|3,0,0]=4 924 B9R0.39 C=C[C@@H](NC(C)=O)C(=O)O Amb28050121 [0,1,0,0,0,0|3,0,0]=4 925 B9R0.39 CC(=N)N[C@@H](CO)C(=O)O Amb27192588 [0,1,0,0,0,0|3,0,0]=4 926 B9R0.39 CC(=O)CC(C=O)C(=O)O Amb28048038 [0,1,0,0,0,0|1,0,1]=3 927 B9R0.39 CC(=O)C\C(=N\O)C(C)=O Amb27256458 [0,1,0,0,0,0|2,0,1]=4 928 B9R0.39 CC(=O)N(CC(=O)O)N=O Amb27391141 [0,1,0,0,0,0|2,0,1]=4 929 B9R0.39 CC(=O)NC(CCl)C(=O)O Amb27494110 [0,1,0,0,0,0|3,0,0]=4 930 B9R0.39 CC(=O)NC(CN)C(=O)O Amb28128874 [0,1,0,0,0,0|3,0,0]=4 931 B9R0.39 CC(=O)NC(CO)C(=O)O Amb1115493 [0,1,0,0,0,0|2,0,0]=3 932 B9R0.39 CC(=O)NC(CO)C(N)=O Amb4018749 [0,1,0,0,0,0|3,0,0]=4 933 B9R0.39 CC(=O)NC(CS)C(=O)O Amb1112748 [0,1,0,0,0,0|2,1,0]=4 934 B9R0.39 CC(=O)N[C@@H](CO)C(=O)O Amb22746917 [0,1,0,0,0,0|2,0,0]=3 935 B9R0.39 CC(=O)N[C@@H](CO)C(N)=O Amb28461160 [0,1,0,0,0,0|3,0,0]=4 936 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O Amb2684240 [0,1,0,0,0,0|2,1,0]=4 937 B9R0.39 CC(=O)N[C@H](CCl)C(=O)O Amb27171775 [0,1,0,0,0,0|3,0,0]=4 938 B9R0.39 CC(=O)N[C@H](CS)C(=O)O Amb25887589 [0,1,0,0,0,0|2,1,0]=4 939 B9R0.39 CC(=O)OC(CCl)C(=O)O Amb27796012 [0,1,0,0,0,0|3,0,0]=4 940 B9R0.39 CC(=O)O[C@@H](CN)C(=O)O Amb27874054 [0,1,0,0,0,0|3,0,0]=4 941 B9R0.39 CC(C)CC(CO)C(=O)O Amb18124780 [0,1,0,0,0,0|2,0,1]=4 942 B9R0.39 CC(C)CC(ON)C(=O)O Amb18644321 [0,1,0,0,0,0|2,0,1]=4 943 B9R0.39 CC(C)CC(ON)C(=O)O Amb33484371 [0,1,0,0,0,0|2,0,1]=4 944 B9R0.39 CC(C)C[C@@H](ON)C(=O)O Amb27975779 [0,1,0,0,0,0|2,0,1]=4 945 B9R0.39 CC(O)CC(C#N)C(=O)O Amb35741473 [0,1,0,0,0,0|2,0,1]=4 946 B9R0.39 CCC(CC(=O)Cl)C(=O)Cl Amb26921552 [0,1,0,0,0,0|3,0,0]=4 947 B9R0.39 CCC(CC(=O)O)C(=O)O Amb10071696 [0,1,0,0,0,0|1,0,0]=2 948 B9R0.39 CCC(CC(=O)O)C(C)O Amb18831453 [0,1,0,0,0,0|2,0,1]=4 949 B9R0.39 CCC(CC(C)=O)C(=O)O Amb18644109 [0,1,0,0,0,0|2,0,0]=3 950 B9R0.39 CCC(CC(C)=O)C(C)=O Amb27403023 [0,1,0,0,0,0|3,0,0]=4 951 B9R0.39 CCC(CC(C)O)C(=O)O Amb27254121 [0,1,0,0,0,0|2,0,1]=4 952 B9R0.39 CCC(NC(C)=O)C(=O)O Amb2099651 [0,1,0,0,0,0|3,0,0]=4 953 B9R0.39 CCC(NC(N)=O)C(=O)O Amb435947 [0,1,0,0,0,0|3,0,0]=4 954 B9R0.39 CCC(OC(N)=O)C(=O)O Amb28283574 [0,1,0,0,0,0|3,0,0]=4 955 B9R0.39 CCN(CC(=O)O)C(C)=O Amb17399887 [0,1,0,0,0,0|3,0,0]=4 956 B9R0.39 CCN(CC(=O)O)C(N)=O Amb18999255 [0,1,0,0,0,0|3,0,0]=4 957 B9R0.39 CC[C@@H](CC(=O)O)C(=O)O Amb27830576 [0,1,0,0,0,0|1,0,0]=2 958 B9R0.39 CC[C@@H](NC(C)=O)C(=O)O Amb3941467 [0,1,0,0,0,0|3,0,0]=4 959 B9R0.39 CC[C@H](CC(=O)O)C(=O)O Amb24643194 [0,1,0,0,0,0|1,0,0]=2 960 B9R0.39 CC[C@H](NC(C)=O)C(=O)O Amb3990111 [0,1,0,0,0,0|3,0,0]=4 961 B9R0.39 CC[C@H](OC(C)=O)C(=O)O Amb27948340 [0,1,0,0,0,0|3,0,0]=4 962 B9R0.39 CC\C(=C/C(=O)O)C(=O)O Amb27421975 [0,1,0,0,0,0|1,0,2]=4 963 B9R0.39 CN(C)C(CO)CC(=O)O Amb18202308 [0,1,0,0,0,0|3,0,0]=4 964 B9R0.39 CNC(CC(=O)O)C(=O)O Amb1905634 [0,1,0,0,0,0|1,0,0]=2 965 B9R0.39 CNC(CC(=O)O)C(=O)O Amb30867747 [0,1,0,0,0,0|1,0,0]=2 966 B9R0.39 CNC(CC(=O)O)C(C)=O Amb18611382 [0,1,0,0,0,0|2,0,0]=3 967 B9R0.39 CNC(CC(N)=O)C(=O)O Amb18644255 [0,1,0,0,0,0|2,0,0]=3 968 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O Amb3499450 [0,1,0,0,0,0|1,0,0]=2 969 B9R0.39 CN[C@H](CC(=O)O)C(=O)O Amb8515692 [0,1,0,0,0,0|1,0,0]=2 970 B9R0.39 CN[C@H](CC(N)=O)C(=O)O Amb28049962 [0,1,0,0,0,0|2,0,0]=3 971 B9R0.39 COC(C=C(C)C)C(=O)O Amb20621506 [0,1,0,0,0,0|2,0,1]=4 972 B9R0.39 COC(CC(=O)O)C(C)=O Amb27952022 [0,1,0,0,0,0|1,0,0]=2 973 B9R0.39 COC(CC(=O)O)C(N)=O Amb23536075 [0,1,0,0,0,0|1,0,0]=2 974 B9R0.39 COC(CC(C)C)C(=O)O Amb26656466 [0,1,0,0,0,0|2,0,1]=4 975 B9R0.39 COC(CC(F)F)C(=O)O Amb32811478 [0,1,0,0,0,0|2,0,1]=4 976 B9R0.39 COC(CN(C)C)C(=O)O Amb27196900 [0,1,0,0,0,0|3,0,0]=4 977 B9R0.39 CO[C@@H](CC(C)C)C(=O)O Amb28126876 [0,1,0,0,0,0|2,0,1]=4 978 B9R0.39 CO[C@H](CC(=O)O)C(=O)O Amb27849552 [0,1,0,0,0,0|0,0,0]=1 979 B9R0.39 CO\C(=C/C(=O)O)C(C)=O Amb28345759 [0,1,0,0,0,0|1,0,2]=4 980 B9R0.39 CO\C(=C\C(N)=O)C(=O)O Amb27786138 [0,1,0,0,0,0|1,0,2]=4 981 B9R0.39 CS(=O)NC(CO)C(=O)O Amb28193924 [0,1,0,0,0,0|3,0,0]=4 982 B9R0.39 CSC(CC(=O)O)C(=O)O Amb18646024 [0,1,0,0,0,0|0,1,0]=2 983 B9R0.39 C[NH2+]C(CC(=O)[O-])C(=O)[O-] Amb33512929 [0,1,0,0,0,0|1,0,2]=4 984 B9R0.39 C\C(Cl)=C/C(ON)C(=O)O Amb27252200 [0,1,0,0,0,0|2,0,1]=4 985 B9R0.39 C\C=C(/CC(=O)O)C(=O)O Amb8631758 [0,1,0,0,0,0|1,0,1]=3 986 B9R0.39 C\C=C(\CC(=O)O)C(=O)O Amb25292254 [0,1,0,0,0,0|1,0,1]=3 987 B9R0.39 N#C\C(=C\C(=O)O)C(=O)O Amb28074279 [0,1,0,0,0,0|1,0,2]=4 988 B9R0.39 N=CC(CC(=O)O)C(=O)O Amb27653604 [0,1,0,0,0,0|1,0,0]=2 989 B9R0.39 NC(=O)CC(CO)C(=O)O Amb28411495 [0,1,0,0,0,0|1,0,0]=2 990 B9R0.39 NC(=O)CC(NO)C(=O)O Amb27168203 [0,1,0,0,0,0|1,0,0]=2 991 B9R0.39 NC(=O)C[C@H](NO)C(=O)O Amb28364297 [0,1,0,0,0,0|1,0,0]=2 992 B9R0.39 NC(=O)N(CC(=O)O)N=O Amb25683110 [0,1,0,0,0,0|2,0,1]=4 993 B9R0.39 NC(=O)NC(CF)C(=O)O Amb28187932 [0,1,0,0,0,0|3,0,0]=4 994 B9R0.39 NC(=O)NC(CO)C(=O)O Amb1055147 [0,1,0,0,0,0|2,0,0]=3 995 B9R0.39 NC(=O)NC(CS)C(=O)O Amb1119403 [0,1,0,0,0,0|2,1,0]=4 996 B9R0.39 NC(=O)N[C@@H](CF)C(=O)O Amb26454171 [0,1,0,0,0,0|3,0,0]=4 997 B9R0.39 NC(=O)N[C@@H](CS)C(=O)O Amb17610484 [0,1,0,0,0,0|2,1,0]=4 998 B9R0.39 NCC(CC(=O)O)C(=O)O Amb22546423 [0,1,0,0,0,0|1,0,0]=2 999 B9R0.39 NCC(CC(=O)O)C(=O)O Amb24538047 [0,1,0,0,0,0|1,0,0]=2 1000 B9R0.39 NNC(CC(=O)O)C(=O)O Amb28070991 [0,1,0,0,0,0|1,0,0]=2 1001 B9R0.39 NN[C@@H](CC(=O)O)C(=O)O Amb24117193 [0,1,0,0,0,0|1,0,0]=2 1002 B9R0.39 N\C=C(\CC(=O)O)C(=O)O Amb28050321 [0,1,0,0,0,0|1,0,1]=3 1003 B9R0.39 O=C(O)CC(CBr)C(=O)O Amb22752144 [0,1,0,0,0,0|1,0,0]=2 1004 B9R0.39 O=C(O)CC(CF)C(=O)O Amb33379249 [0,1,0,0,0,0|1,0,0]=2 1005 B9R0.39 O=C(O)CC(NCl)C(=O)O Amb27953217 [0,1,0,0,0,0|1,0,0]=2 1006 B9R0.39 O=C(O)CC(NO)C(=O)O Amb24685872 [0,1,0,0,0,0|0,0,0]=1 1007 B9R0.39 O=C(O)CC(NS)C(=O)O Amb25808901 [0,1,0,0,0,0|0,1,0]=2 1008 B9R0.39 O=C(O)C[C@H](NCl)C(=O)O Amb27401859 [0,1,0,0,0,0|1,0,0]=2 1009 B9R0.39 O=C(O)C[C@H](NO)C(=O)O Amb24117497 [0,1,0,0,0,0|0,0,0]=1 1010 B9R0.39 O=C(O)C[C@H](NO)C(=O)O Amb24630025 [0,1,0,0,0,0|0,0,0]=1 1011 B9R0.39 O=C(O)C\C(=N/O)C(=O)O Amb24117074 [0,1,0,0,0,0|0,0,1]=2 1012 B9R0.39 O=C(O)C\C(=N\O)C(=O)O Amb27828721 [0,1,0,0,0,0|0,0,1]=2 1013 B9R0.39 O=C\C(=C/C(=O)O)C(=O)O Amb18644051 [0,1,0,0,0,0|0,0,3]=4 1014 B9R0.42 C#CC(=O)N[C@@H](C)C(=O)O Amb28060769 [0,1,0,0,0,0|3,0,0]=4 1015 B9R0.42 C#C[C@@H](O)C[C@@H](N)C(=O)O Amb28321822 [0,1,0,0,0,0|2,0,1]=4 1016 B9R0.42 C=C(C)C(O)CC(=O)OC Amb27839501 [0,1,0,0,0,0|2,0,0]=3 1017 B9R0.42 C=C(C)[C@@H](O)CC(=O)CC Amb28126621 [0,1,0,0,0,0|3,0,0]=4 1018 B9R0.42 C=C(C)[C@@H](O)CC(=O)OC Amb33199529 [0,1,0,0,0,0|2,0,0]=3 1019 B9R0.42 C=C(C)[C@H](O)CC(=O)CC Amb27760878 [0,1,0,0,0,0|3,0,0]=4 1020 B9R0.42 C=C(C)[C@H](O)CC(=O)OC Amb33199525 [0,1,0,0,0,0|2,0,0]=3 1021 B9R0.42 C=C(CC(=O)NC)C(=O)O Amb22269311 [0,1,0,0,0,0|2,0,1]=4 1022 B9R0.42 C=C(CC(=O)OC)C(=O)O Amb4035034 [0,1,0,0,0,0|1,0,1]=3 1023 B9R0.42 C=C(CC)CC(N)C(=O)O Amb28064280 [0,1,0,0,0,0|3,0,0]=4 1024 B9R0.42 C=C(CC)C[C@@H](N)C(=O)O Amb26340266 [0,1,0,0,0,0|3,0,0]=4 1025 B9R0.42 C=C(CC)C[C@H](N)C(=O)O Amb25694434 [0,1,0,0,0,0|3,0,0]=4 1026 B9R0.42 C=C(Cl)C(O)CC(=O)OC Amb28050635 [0,1,0,0,0,0|2,0,0]=3 1027 B9R0.42 C=CC(=O)NC(O)C(=O)O Amb3940875 [0,1,0,0,0,0|2,0,0]=3 1028 B9R0.42 C=CC(=O)NC(O)C(=O)O Amb9790819 [0,1,0,0,0,0|2,0,0]=3 1029 B9R0.42 C=CC(=O)NC(O)C(=O)[O-] Amb33512922 [0,1,0,0,0,0|2,0,1]=4 1030 B9R0.42 C=CC(=O)OC(C)C(=O)O Amb27592472 [0,1,0,0,0,0|3,0,0]=4 1031 B9R0.42 CC(=O)C(O)CC(=O)C=O Amb27480852 [0,1,0,0,0,0|1,0,1]=3 1032 B9R0.42 CC(=O)C(O)CC(O)CO Amb28049878 [0,1,0,0,0,0|1,0,2]=4 1033 B9R0.42 CC(=O)N(C)CC(=O)NO Amb28291755 [0,1,0,0,0,0|3,0,0]=4 1034 B9R0.42 CC(CC(=O)CCl)C(=O)O Amb24585160 [0,1,0,0,0,0|2,0,0]=3 1035 B9R0.42 CC(CO)CC(C)C(=O)O Amb27838009 [0,1,0,0,0,0|2,0,1]=4 1036 B9R0.42 CC(CO)CC(N)C(=O)O Amb25147300 [0,1,0,0,0,0|2,0,1]=4 1037 B9R0.42 CC(CO)C[C@@H](N)C(=O)O Amb33036727 [0,1,0,0,0,0|2,0,1]=4 1038 B9R0.42 CC(CO)C[C@H](N)C(=O)O Amb32865934 [0,1,0,0,0,0|2,0,1]=4 1039 B9R0.42 CC(NC(=O)C=O)C(=O)O Amb27830810 [0,1,0,0,0,0|2,0,1]=4 1040 B9R0.42 CC(NC(=O)CCl)C(=O)O Amb3940604 [0,1,0,0,0,0|3,0,0]=4 1041 B9R0.42 CC(NC(=O)CN)C(=O)O Amb533807 [0,1,0,0,0,0|3,0,0]=4 1042 B9R0.42 CC(O)C(O)CC(=O)C=O Amb28201309 [0,1,0,0,0,0|1,0,2]=4 1043 B9R0.42 CC(O)C(O)CC(=O)CO Amb27615146 [0,1,0,0,0,0|1,0,1]=3 1044 B9R0.42 CC(OC(=O)CCl)C(=O)O Amb28042677 [0,1,0,0,0,0|3,0,0]=4 1045 B9R0.42 CC(OC(=O)CO)C(N)=O Amb28126899 [0,1,0,0,0,0|3,0,0]=4 1046 B9R0.42 CCC(=O)CC(N)C(=O)O Amb22546324 [0,1,0,0,0,0|2,0,0]=3 1047 B9R0.42 CCC(=O)CC(N)C(=O)O Amb24479073 [0,1,0,0,0,0|2,0,0]=3 1048 B9R0.42 CCC(=O)CC(N)C(N)=O Amb25129863 [0,1,0,0,0,0|3,0,0]=4 1049 B9R0.42 CCC(=O)CC(O)C(=O)O Amb27655574 [0,1,0,0,0,0|1,0,0]=2 1050 B9R0.42 CCC(=O)C[C@@H](N)C(=O)O Amb26061186 [0,1,0,0,0,0|2,0,0]=3 1051 B9R0.42 CCC(=O)C[C@H](N)C(=O)O Amb24479266 [0,1,0,0,0,0|2,0,0]=3 1052 B9R0.42 CCC(=O)NC(C)C(=O)O Amb1116933 [0,1,0,0,0,0|3,0,0]=4 1053 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O Amb22901053 [0,1,0,0,0,0|3,0,0]=4 1054 B9R0.42 CCC(C)CC(O)C(=O)O Amb25849308 [0,1,0,0,0,0|2,0,1]=4 1055 B9R0.42 CCC(O)CC(C)C(=O)O Amb28348984 [0,1,0,0,0,0|2,0,1]=4 1056 B9R0.42 CCC(O)CC(Cl)C(=O)O Amb28244776 [0,1,0,0,0,0|2,0,1]=4 1057 B9R0.42 CCC(O)CC(N)C(=O)O Amb24117068 [0,1,0,0,0,0|2,0,1]=4 1058 B9R0.42 CCC(O)CC(O)C(=O)O Amb28050169 [0,1,0,0,0,0|1,0,1]=3 1059 B9R0.42 CCC(O)C[C@@H](N)C(=O)O Amb33065603 [0,1,0,0,0,0|2,0,1]=4 1060 B9R0.42 CCC(O)C[C@H](N)C(=O)O Amb24759913 [0,1,0,0,0,0|2,0,1]=4 1061 B9R0.42 CCS(=O)CC(C)C(=O)O Amb19012076 [0,1,0,0,0,0|3,0,0]=4 1062 B9R0.42 CCS(=O)CC(O)C(=O)O Amb28342085 [0,1,0,0,0,0|2,0,0]=3 1063 B9R0.42 CCS(=O)C[C@H](N)C(=O)O Amb28118843 [0,1,0,0,0,0|3,0,0]=4 1064 B9R0.42 CC[C@@H](C)C[C@H](O)C(=O)O Amb27770344 [0,1,0,0,0,0|2,0,1]=4 1065 B9R0.42 CNC(=O)CC(C)C(N)=O Amb17334219 [0,1,0,0,0,0|3,0,0]=4 1066 B9R0.42 CNC(=O)CC(N)C(=O)O Amb27839034 [0,1,0,0,0,0|2,0,0]=3 1067 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O Amb20240891 [0,1,0,0,0,0|2,0,0]=3 1068 B9R0.42 CNC(=O)NC(C)C(=O)O Amb1130316 [0,1,0,0,0,0|3,0,0]=4 1069 B9R0.42 CNC(=O)N[C@@H](C)C(=O)O Amb24478025 [0,1,0,0,0,0|3,0,0]=4 1070 B9R0.42 CNC(=O)N[C@H](C)C(=O)O Amb24558529 [0,1,0,0,0,0|3,0,0]=4 1071 B9R0.42 CNC(=O)OC(C)C(=O)O Amb35655772 [0,1,0,0,0,0|3,0,0]=4 1072 B9R0.42 CNC(=O)O[C@@H](C)C(=O)O Amb35647450 [0,1,0,0,0,0|3,0,0]=4 1073 B9R0.42 CNC(=O)O[C@H](C)C(=O)O Amb29866286 [0,1,0,0,0,0|3,0,0]=4 1074 B9R0.42 COC(=O)CC(=O)C(=O)O Amb22728219 [0,1,0,0,0,0|0,0,2]=3 1075 B9R0.42 COC(=O)CC(=O)C(=O)[O-] Amb34916317 [0,1,0,0,0,0|0,0,3]=4 1076 B9R0.42 COC(=O)CC(=O)C(C)=O Amb25146895 [0,1,0,0,0,0|1,0,2]=4 1077 B9R0.42 COC(=O)CC(Br)C(=O)O Amb18656998 [0,1,0,0,0,0|1,0,0]=2 1078 B9R0.42 COC(=O)CC(Br)C(C)=O Amb17403794 [0,1,0,0,0,0|2,0,0]=3 1079 B9R0.42 COC(=O)CC(Br)C(N)=O Amb27969234 [0,1,0,0,0,0|2,0,0]=3 1080 B9R0.42 COC(=O)CC(C)C(=N)N Amb27971074 [0,1,0,0,0,0|3,0,0]=4 1081 B9R0.42 COC(=O)CC(C)C(=O)Cl Amb27972299 [0,1,0,0,0,0|2,0,0]=3 1082 B9R0.42 COC(=O)CC(C)C(=O)O Amb18644239 [0,1,0,0,0,0|1,0,0]=2 1083 B9R0.42 COC(=O)CC(C)C(=O)[O-] Amb34915052 [0,1,0,0,0,0|1,0,1]=3 1084 B9R0.42 COC(=O)CC(C)[N+](=O)[O-] Amb27444812 [0,1,0,0,0,0|2,0,1]=4 1085 B9R0.42 COC(=O)CC(Cl)C(=O)O Amb32941126 [0,1,0,0,0,0|1,0,0]=2 1086 B9R0.42 COC(=O)CC(Cl)C(C)=O Amb25061154 [0,1,0,0,0,0|2,0,0]=3 1087 B9R0.42 COC(=O)CC(N)C(=O)O Amb22489498 [0,1,0,0,0,0|1,0,0]=2 1088 B9R0.42 COC(=O)CC(N)C(=O)O Amb7172558 [0,1,0,0,0,0|1,0,0]=2 1089 B9R0.42 COC(=O)CC(N)C(=O)O Amb8390391 [0,1,0,0,0,0|1,0,0]=2 1090 B9R0.42 COC(=O)CC(O)C(=O)O Amb25786182 [0,1,0,0,0,0|0,0,0]=1 1091 B9R0.42 COC(=O)CC(O)C(C)C Amb24423234 [0,1,0,0,0,0|2,0,1]=4 1092 B9R0.42 COC(=O)CC(O)C(C)N Amb27429441 [0,1,0,0,0,0|2,0,1]=4 1093 B9R0.42 COC(=O)CC(O)C(C)O Amb27969056 [0,1,0,0,0,0|1,0,1]=3 1094 B9R0.42 COC(=O)CC(O)C(F)F Amb26541815 [0,1,0,0,0,0|2,0,1]=4 1095 B9R0.42 COC(=O)CC(O)C(N)=O Amb27830345 [0,1,0,0,0,0|1,0,0]=2 1096 B9R0.42 COC(=O)CC(O)[C@H](C)O Amb27455910 [0,1,0,0,0,0|1,0,1]=3 1097 B9R0.42 COC(=O)CN(C)C(=O)Cl Amb35749071 [0,1,0,0,0,0|3,0,0]=4 1098 B9R0.42 COC(=O)CN(C)C(C)=O Amb9263349 [0,1,0,0,0,0|3,0,0]=4 1099 B9R0.42 COC(=O)C[C@@H](C)C(=O)O Amb3939892 [0,1,0,0,0,0|1,0,0]=2 1100 B9R0.42 COC(=O)C[C@@H](C)C(C)=O Amb26846867 [0,1,0,0,0,0|2,0,0]=3 1101 B9R0.42 COC(=O)C[C@@H](C)C(N)=O Amb27169355 [0,1,0,0,0,0|2,0,0]=3 1102 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb22745861 [0,1,0,0,0,0|1,0,0]=2 1103 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb8385327 [0,1,0,0,0,0|1,0,0]=2 1104 B9R0.42 COC(=O)C[C@@H](N)[C@@H](C)O Amb28340873 [0,1,0,0,0,0|2,0,1]=4 1105 B9R0.42 COC(=O)C[C@@H](O)C(=O)O Amb23603858 [0,1,0,0,0,0|0,0,0]=1 1106 B9R0.42 COC(=O)C[C@@H](O)C(C)C Amb25847717 [0,1,0,0,0,0|2,0,1]=4 1107 B9R0.42 COC(=O)C[C@@H](O)C(F)F Amb32811475 [0,1,0,0,0,0|2,0,1]=4 1108 B9R0.42 COC(=O)C[C@@H](O)[C@H](C)N Amb27429613 [0,1,0,0,0,0|2,0,1]=4 1109 B9R0.42 COC(=O)C[C@H](Br)C(=O)O Amb26619839 [0,1,0,0,0,0|1,0,0]=2 1110 B9R0.42 COC(=O)C[C@H](C)C(=O)O Amb26967622 [0,1,0,0,0,0|1,0,0]=2 1111 B9R0.42 COC(=O)C[C@H](C)C(C)=O Amb26873807 [0,1,0,0,0,0|2,0,0]=3 1112 B9R0.42 COC(=O)C[C@H](N)C(=O)O Amb8629121 [0,1,0,0,0,0|1,0,0]=2 1113 B9R0.42 COC(=O)C[C@H](O)C(=O)O Amb25367304 [0,1,0,0,0,0|0,0,0]=1 1114 B9R0.42 COC(=O)C[C@H](O)C(C)C Amb26322416 [0,1,0,0,0,0|2,0,1]=4 1115 B9R0.42 COC(=O)C[C@H](O)C(F)F Amb32811477 [0,1,0,0,0,0|2,0,1]=4 1116 B9R0.42 COC(=O)C[C@H](O)C(N)=O Amb28120921 [0,1,0,0,0,0|1,0,0]=2 1117 B9R0.42 COC(=O)C[C@H](O)[C@H](C)O Amb28069717 [0,1,0,0,0,0|1,0,1]=3 1118 B9R0.42 COC(=O)NC(C)C(=O)O Amb6668789 [0,1,0,0,0,0|2,0,0]=3 1119 B9R0.42 COC(=O)N[C@@H](C)C(=O)O Amb24477985 [0,1,0,0,0,0|2,0,0]=3 1120 B9R0.42 COC(=O)N[C@H](C)C(=O)O Amb24381066 [0,1,0,0,0,0|2,0,0]=3 1121 B9R0.42 COC(=O)N[C@H](C)C(N)=O Amb27428453 [0,1,0,0,0,0|3,0,0]=4 1122 B9R0.42 COC(=O)SC(C)C(C)=O Amb27243977 [0,1,0,0,0,0|3,0,0]=4 1123 B9R0.42 COC(=O)\C=C(/C)C(=O)O Amb18644070 [0,1,0,0,0,0|1,0,2]=4 1124 B9R0.42 COC(=S)SC(C)C(=O)O Amb28458571 [0,1,0,0,0,0|2,1,0]=4 1125 B9R0.42 COC(C)CC(N)C(=O)O Amb25147752 [0,1,0,0,0,0|2,0,1]=4 1126 B9R0.42 COC(C)CC(O)C(=O)O Amb33353368 [0,1,0,0,0,0|1,0,1]=3 1127 B9R0.42 COC(C)C[C@@H](N)C(=O)O Amb24412403 [0,1,0,0,0,0|2,0,1]=4 1128 B9R0.42 COC(C)C[C@H](N)C(=O)O Amb27801695 [0,1,0,0,0,0|2,0,1]=4 1129 B9R0.42 C[C@@H](CO)C[C@@H](N)C(=O)O Amb27398331 [0,1,0,0,0,0|2,0,1]=4 1130 B9R0.42 C[C@@H](C[C@@H](O)CN)C(=O)O Amb27768864 [0,1,0,0,0,0|2,0,1]=4 1131 B9R0.42 C[C@@H](NC(=O)CCl)C(=O)O Amb10842258 [0,1,0,0,0,0|3,0,0]=4 1132 B9R0.42 C[C@@H](O)[C@@H](O)C[C@H](O)C=O Amb27617150 [0,1,0,0,0,0|1,0,2]=4 1133 B9R0.42 C[C@H](CO)C[C@H](N)C(=O)O Amb27625117 [0,1,0,0,0,0|2,0,1]=4 1134 B9R0.42 C[C@H](C[C@@H](O)CN)C(=O)O Amb27169198 [0,1,0,0,0,0|2,0,1]=4 1135 B9R0.42 C[C@H](NC(=O)CCl)C(=O)O Amb2781694 [0,1,0,0,0,0|3,0,0]=4 1136 B9R0.42 C[C@H](NC(=O)CN)C(=O)O Amb537542 [0,1,0,0,0,0|3,0,0]=4 1137 B9R0.42 C[C@H](NC(=O)CS)C(=O)O Amb27780474 [0,1,0,0,0,0|2,1,0]=4 1138 B9R0.42 C[C@H](O)[C@H](O)C[C@@H](O)C=O Amb27169403 [0,1,0,0,0,0|1,0,2]=4 1139 B9R0.42 C\C(=C/Cl)CC(N)C(=O)O Amb25934493 [0,1,0,0,0,0|3,0,0]=4 1140 B9R0.42 C\C(=C/Cl)C[C@@H](N)C(=O)O Amb27168937 [0,1,0,0,0,0|3,0,0]=4 1141 B9R0.42 C\C(=C/Cl)C[C@H](N)C(=O)O Amb26888703 [0,1,0,0,0,0|3,0,0]=4 1142 B9R0.42 C\C(=N/C(=O)CO)C(=O)O Amb27426561 [0,1,0,0,0,0|2,0,1]=4 1143 B9R0.42 C\C=C(/C)C[C@H](N)C(=O)O Amb27827659 [0,1,0,0,0,0|3,0,0]=4 1144 B9R0.42 NC(CC(=O)CI)C(=O)O Amb27803464 [0,1,0,0,0,0|2,0,0]=3 1145 B9R0.42 NC(CC(=O)CO)C(=O)O Amb18644310 [0,1,0,0,0,0|1,0,0]=2 1146 B9R0.42 NC(CC(=O)NO)C(=O)O Amb22349932 [0,1,0,0,0,0|1,0,0]=2 1147 B9R0.42 NC(CC(F)CO)C(=O)O Amb27632459 [0,1,0,0,0,0|2,0,1]=4 1148 B9R0.42 NC(CC(O)C=O)C(=O)O Amb28126784 [0,1,0,0,0,0|1,0,1]=3 1149 B9R0.42 NC(CC(O)CF)C(=O)O Amb33065776 [0,1,0,0,0,0|2,0,1]=4 1150 B9R0.42 NC(CC(O)CO)C(=O)O Amb18644388 [0,1,0,0,0,0|1,0,2]=4 1151 B9R0.42 NC(CC(O)CO)C(=O)O Amb24117285 [0,1,0,0,0,0|1,0,2]=4 1152 B9R0.42 NC(C\C(Cl)=C\Cl)C(=O)O Amb27232854 [0,1,0,0,0,0|3,0,0]=4 1153 B9R0.42 NC(\C=C(\P)C=O)C(=O)O Amb25361040 [0,1,0,0,0,0|2,0,1]=4 1154 B9R0.42 NCC(O)CC(N)C(=O)O Amb30988061 [0,1,0,0,0,0|2,0,1]=4 1155 B9R0.42 NCC(O)CC(O)C(=O)O Amb27170737 [0,1,0,0,0,0|1,0,1]=3 1156 B9R0.42 NC[C@H](O)CC(O)C(=O)O Amb27590744 [0,1,0,0,0,0|1,0,1]=3 1157 B9R0.42 NNC(=O)C[C@H](N)C(=O)O Amb24680907 [0,1,0,0,0,0|2,0,0]=3 1158 B9R0.42 N[C@@H](CC(=O)CCl)C(=O)O Amb27168692 [0,1,0,0,0,0|2,0,0]=3 1159 B9R0.42 N[C@@H](CC(=O)CI)C(=O)O Amb27248631 [0,1,0,0,0,0|2,0,0]=3 1160 B9R0.42 N[C@@H](CC(=O)CO)C(=O)O Amb28050099 [0,1,0,0,0,0|1,0,0]=2 1161 B9R0.42 N[C@@H](CC(=O)NO)C(=O)O Amb28320876 [0,1,0,0,0,0|1,0,0]=2 1162 B9R0.42 N[C@@H](CC(O)CCl)C(=O)O Amb27837835 [0,1,0,0,0,0|2,0,1]=4 1163 B9R0.42 N[C@@H](CC(O)CF)C(=O)O Amb33036578 [0,1,0,0,0,0|2,0,1]=4 1164 B9R0.42 N[C@@H](CC(O)CO)C(=O)O Amb25870815 [0,1,0,0,0,0|1,0,2]=4 1165 B9R0.42 N[C@@H](CN(O)N=O)C(=O)O Amb17607759 [0,1,0,0,0,0|2,0,0]=3 1166 B9R0.42 N[C@H](CC(O)CF)C(=O)O Amb32796094 [0,1,0,0,0,0|2,0,1]=4 1167 B9R0.42 N[C@H](CC(O)CO)C(=O)O Amb33036156 [0,1,0,0,0,0|1,0,2]=4 1168 B9R0.42 N[C@H](CN(O)N=O)C(=O)O Amb27976802 [0,1,0,0,0,0|2,0,0]=3 1169 B9R0.42 N\C=C(/N)CC(N)C(=O)O Amb28250396 [0,1,0,0,0,0|3,0,0]=4 1170 B9R0.42 O=C(CBr)C[C@H](O)C(=O)O Amb27876238 [0,1,0,0,0,0|1,0,0]=2 1171 B9R0.42 O=C(CCl)NC(O)C(=O)O Amb27598875 [0,1,0,0,0,0|2,0,0]=3 1172 B9R0.42 O=C(O)C(O)C[C@H](O)CO Amb27984868 [0,1,0,0,0,0|0,0,2]=3 1173 B9R0.57 CC(C)(C)CC(O)C(=O)O Amb18302187 [0,1,0,0,0,0|2,0,1]=4 1174 B9R0.57 CC(C)(F)CC(O)C(=O)O Amb33272231 [0,1,0,0,0,0|2,0,1]=4 1175 B9R0.57 CC(C)(O)CC(N)C(=O)O Amb18644326 [0,1,0,0,0,0|2,0,1]=4 1176 B9R0.57 CC(C)(O)CC(O)C(=O)O Amb27953570 [0,1,0,0,0,0|1,0,1]=3 1177 B9R0.57 CC(C)(O)C[C@@H](N)C(=O)O Amb24479570 [0,1,0,0,0,0|2,0,1]=4 1178 B9R0.57 CC(C)(O)C[C@@H](O)C(=O)O Amb27254266 [0,1,0,0,0,0|1,0,1]=3 1179 B9R0.57 CC(C)(O)C[C@H](N)C(=O)O Amb25992355 [0,1,0,0,0,0|2,0,1]=4 1180 B9R0.57 CC(CP(=O)(O)O)C(=O)O Amb27878703 [0,1,0,0,0,0|2,0,0]=3 1181 B9R0.57 CC(CP(C)(C)=O)C(=O)O Amb28050894 [0,1,0,0,0,0|3,0,0]=4 1182 B9R0.57 CC(CS(C)(=O)=O)C(=O)O Amb18971622 [0,1,0,0,0,0|2,0,1]=4 1183 B9R0.57 CC(CS(N)(=O)=O)C(=O)O Amb18563379 [0,1,0,0,0,0|2,0,1]=4 1184 B9R0.57 CC(F)(F)CC(O)C(=O)O Amb26361859 [0,1,0,0,0,0|2,0,1]=4 1185 B9R0.57 CC(OP(=O)(O)O)C(=O)O Amb28458452 [0,1,0,0,0,0|3,0,0]=4 1186 B9R0.57 CP(=O)(O)CC(N)C(=O)O Amb27770381 [0,1,0,0,0,0|2,0,0]=3 1187 B9R0.57 CS(=O)(=O)CC(Cl)C(=O)O Amb27257814 [0,1,0,0,0,0|2,0,1]=4 1188 B9R0.57 CS(=O)(=O)CC(N)C(=O)O Amb27983621 [0,1,0,0,0,0|2,0,1]=4 1189 B9R0.57 CS(=O)(=O)CC(N)C(=O)O Amb32753509 [0,1,0,0,0,0|2,0,1]=4 1190 B9R0.57 CS(=O)(=O)CC(O)C(=O)O Amb24398186 [0,1,0,0,0,0|1,0,1]=3 1191 B9R0.57 CS(=O)(=O)C[C@@H](N)C(=O)O Amb27831327 [0,1,0,0,0,0|2,0,1]=4 1192 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O Amb27231797 [0,1,0,0,0,0|2,0,1]=4 1193 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O Amb32683294 [0,1,0,0,0,0|2,0,1]=4 1194 B9R0.57 C[C@H](O)[C@@H](O)CP(=O)(O)O Amb28079090 [0,1,0,0,0,0|2,0,1]=4 1195 B9R0.57 C[Si](C)(O)C[C@H](N)C(=O)O Amb27408998 [0,1,0,0,0,0|2,1,0]=4 1196 B9R0.57 NC(CP(=O)(O)O)C(=O)O Amb542762 [0,1,0,0,0,0|2,0,0]=3 1197 B9R0.57 NC(CP(O)(O)=S)C(=O)O Amb27232821 [0,1,0,0,0,0|2,0,1]=4 1198 B9R0.57 NC(CS(=O)(=O)Cl)C(=O)O Amb28367339 [0,1,0,0,0,0|2,0,1]=4 1199 B9R0.57 NC(CS(=O)(=O)O)C(=O)O Amb2698240 [0,1,0,0,0,0|2,0,0]=3 1200 B9R0.57 NC(CS(=O)(=O)S)C(=O)O Amb27982339 [0,1,0,0,0,0|2,0,1]=4 1201 B9R0.57 N[C@@H](CP(=O)(O)O)C(=O)O Amb2719731 [0,1,0,0,0,0|2,0,0]=3 1202 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O Amb17942867 [0,1,0,0,0,0|2,0,0]=3 1203 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O Amb3940873 [0,1,0,0,0,0|2,0,0]=3 1204 B9R0.57 N[C@@H](CS(N)(=O)=O)C(=O)O Amb26342340 [0,1,0,0,0,0|2,0,1]=4 1205 B9R0.57 N[C@H](CP(=O)(O)O)C(=O)O Amb8515685 [0,1,0,0,0,0|2,0,0]=3 1206 B9R0.57 O=C(O)C(=O)CS(=O)(=O)O Amb26352119 [0,1,0,0,0,0|1,0,2]=4 1207 B9R0.57 O=C(O)C(O)CC(F)(F)F Amb24482207 [0,1,0,0,0,0|2,0,1]=4 1208 B9R0.57 O=C(O)C(O)CP(=O)(O)O Amb27166079 [0,1,0,0,0,0|1,0,0]=2 1209 B9R0.57 O=C(O)C(O)CS(=O)(=O)O Amb20247567 [0,1,0,0,0,0|1,0,0]=2 1210 B9R0.79 C=C(C)C(C)C(C)C(=O)O Amb28042819 [0,1,0,0,0,0|3,0,0]=4 1211 B9R0.79 C=C(C)C(N)C(C)C(=O)O Amb33036349 [0,1,0,0,0,0|3,0,0]=4 1212 B9R0.79 C=C(C)C(O)C(C)C(=O)O Amb18644101 [0,1,0,0,0,0|2,0,0]=3 1213 B9R0.79 C=C(C)C(O)C(N)C(=O)O Amb33199606 [0,1,0,0,0,0|2,0,0]=3 1214 B9R0.79 C=C(C)[C@@H](C)[C@@H](C)C(=O)O Amb28050111 [0,1,0,0,0,0|3,0,0]=4 1215 B9R0.79 C=C(C)[C@@H](O)[C@@H](C)C(=O)O Amb28283987 [0,1,0,0,0,0|2,0,0]=3 1216 B9R0.79 CC(=O)C(=O)C(O)C(C)=O Amb25910745 [0,1,0,0,0,0|2,0,1]=4 1217 B9R0.79 CC(=O)C(C)C(C)C(C)=O Amb4016940 [0,1,0,0,0,0|3,0,0]=4 1218 B9R0.79 CC(=O)C(C)C(N)C(=O)O Amb18202116 [0,1,0,0,0,0|2,0,0]=3 1219 B9R0.79 CC(=O)C(C)C(N)C(N)=O Amb27613013 [0,1,0,0,0,0|3,0,0]=4 1220 B9R0.79 CC(=O)C(Cl)C(=O)C(=O)O Amb27600115 [0,1,0,0,0,0|1,0,2]=4 1221 B9R0.79 CC(=O)C(O)C(O)C(=O)O Amb25292189 [0,1,0,0,0,0|1,0,0]=2 1222 B9R0.79 CC(=O)C(O)C(O)C(C)=O Amb17593650 [0,1,0,0,0,0|2,0,0]=3 1223 B9R0.79 CC(=O)N(Cl)[C@@H](C)C(=O)O Amb28458454 [0,1,0,0,0,0|3,0,0]=4 1224 B9R0.79 CC(=O)[C@@H](C)[C@@H](O)C(=O)O Amb27661780 [0,1,0,0,0,0|1,0,0]=2 1225 B9R0.79 CC(=O)[C@@H](C)[C@H](O)C(=O)O Amb28050113 [0,1,0,0,0,0|1,0,0]=2 1226 B9R0.79 CC(=O)[C@H](C)[C@@H](C)C(C)=O Amb28202186 [0,1,0,0,0,0|3,0,0]=4 1227 B9R0.79 CC(=O)[C@H](C)[C@H](N)C(=O)O Amb27424983 [0,1,0,0,0,0|2,0,0]=3 1228 B9R0.79 CC(=S)[C@H](C)[C@H](N)C(=O)O Amb26642807 [0,1,0,0,0,0|2,1,0]=4 1229 B9R0.79 CC(C(=O)Cl)C(C)C(=O)Cl Amb22347385 [0,1,0,0,0,0|3,0,0]=4 1230 B9R0.79 CC(C(=O)O)C(Br)C(=O)O Amb2612973 [0,1,0,0,0,0|1,0,0]=2 1231 B9R0.79 CC(C(=O)O)C(C)C(=O)O Amb8513150 [0,1,0,0,0,0|1,0,0]=2 1232 B9R0.79 CC(C(=O)O)C(N)C(=O)O Amb2099482 [0,1,0,0,0,0|1,0,0]=2 1233 B9R0.79 CC(C(=O)O)C(O)C(=O)O Amb17593680 [0,1,0,0,0,0|0,0,0]=1 1234 B9R0.79 CC(C(N)=O)C(C)C(N)=O Amb28248514 [0,1,0,0,0,0|3,0,0]=4 1235 B9R0.79 CC(C)C(N)C(O)C(=O)O Amb27615047 [0,1,0,0,0,0|2,0,1]=4 1236 B9R0.79 CC(C)C(O)C(C)C(=O)O Amb18990636 [0,1,0,0,0,0|2,0,1]=4 1237 B9R0.79 CC(C)C(O)C(F)C(=O)O Amb33136392 [0,1,0,0,0,0|2,0,1]=4 1238 B9R0.79 CC(C)C(O)C(N)C(=O)O Amb23399656 [0,1,0,0,0,0|2,0,1]=4 1239 B9R0.79 CC(C)C(O)C(O)C(=O)O Amb27655491 [0,1,0,0,0,0|2,0,1]=4 1240 B9R0.79 CC(C)C(O)[C@@H](C)C(=O)O Amb27494047 [0,1,0,0,0,0|2,0,1]=4 1241 B9R0.79 CC(C)C(O)[C@H](N)C(=O)O Amb24509492 [0,1,0,0,0,0|2,0,1]=4 1242 B9R0.79 CC(C)[C@@H](O)[C@@H](Br)C(=O)O Amb27394249 [0,1,0,0,0,0|2,0,1]=4 1243 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(=O)O Amb27874042 [0,1,0,0,0,0|2,0,1]=4 1244 B9R0.79 CC(C)[C@@H](O)[C@H](C)C(=O)O Amb28347218 [0,1,0,0,0,0|2,0,1]=4 1245 B9R0.79 CC(C)[C@H](N)[C@H](O)C(=O)O Amb25147282 [0,1,0,0,0,0|2,0,1]=4 1246 B9R0.79 CC(C)[C@H](O)[C@@H](C)C(=O)O Amb10844253 [0,1,0,0,0,0|2,0,1]=4 1247 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O Amb10807407 [0,1,0,0,0,0|2,0,1]=4 1248 B9R0.79 CC(C)[C@H](O)[C@H](C)C(=O)O Amb28346279 [0,1,0,0,0,0|2,0,1]=4 1249 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O Amb26333625 [0,1,0,0,0,0|2,0,1]=4 1250 B9R0.79 CC(C)[C@H](O)[C@H](O)C(=O)O Amb28050049 [0,1,0,0,0,0|2,0,1]=4 1251 B9R0.79 CC(N)C(O)C(C)C(=O)O Amb25870814 [0,1,0,0,0,0|2,0,1]=4 1252 B9R0.79 CC(O)C(C)C(C)C(=O)O Amb28059349 [0,1,0,0,0,0|2,0,1]=4 1253 B9R0.79 CC(O)C(C)C(N)C(=O)O Amb21953714 [0,1,0,0,0,0|2,0,1]=4 1254 B9R0.79 CC(O)C(C)[C@@H](N)C(=O)O Amb22800202 [0,1,0,0,0,0|2,0,1]=4 1255 B9R0.79 CC(O)C(C)[C@H](N)C(=O)O Amb27390194 [0,1,0,0,0,0|2,0,1]=4 1256 B9R0.79 CC(O)C(O)C(N)C(=O)O Amb27210841 [0,1,0,0,0,0|1,0,1]=3 1257 B9R0.79 CC(O)[C@@H](C)[C@@H](N)C(=O)O Amb33524291 [0,1,0,0,0,0|2,0,1]=4 1258 B9R0.79 C[C@@H](C(=O)O)C(N)C(=O)O Amb27877897 [0,1,0,0,0,0|1,0,0]=2 1259 B9R0.79 C[C@@H](C(=O)O)[C@@H](N)C(=O)O Amb27170727 [0,1,0,0,0,0|1,0,0]=2 1260 B9R0.79 C[C@@H](C(=O)O)[C@H](N)C(=O)O Amb25324829 [0,1,0,0,0,0|1,0,0]=2 1261 B9R0.79 C[C@@H](C(=O)O)[C@H](O)C(=O)O Amb27243908 [0,1,0,0,0,0|0,0,0]=1 1262 B9R0.79 C[C@@H](O)[C@@H](O)[C@H](O)C(N)=O Amb27760015 [0,1,0,0,0,0|2,0,1]=4 1263 B9R0.79 C[C@@H](O)[C@H](C)[C@@H](N)C(=O)O Amb27252085 [0,1,0,0,0,0|2,0,1]=4 1264 B9R0.79 C[C@@H](O)[C@H](C)[C@H](N)C(=O)O Amb17615448 [0,1,0,0,0,0|2,0,1]=4 1265 B9R0.79 C[C@@H]([C@@H](O)C(=O)O)N(C)C Amb28364201 [0,1,0,0,0,0|3,0,0]=4 1266 B9R0.79 C[C@H](C(=O)O)[C@@H](C)C(=O)O Amb22801175 [0,1,0,0,0,0|1,0,0]=2 1267 B9R0.79 C[C@H](C(=O)O)[C@@H](C)C(N)=O Amb27771245 [0,1,0,0,0,0|2,0,0]=3 1268 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O Amb27783086 [0,1,0,0,0,0|1,0,0]=2 1269 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O Amb31031234 [0,1,0,0,0,0|1,0,0]=2 1270 B9R0.79 C[C@H](C(=O)O)[C@H](Br)C(=O)O Amb27463297 [0,1,0,0,0,0|1,0,0]=2 1271 B9R0.79 C[C@H](C(=O)O)[C@H](C)C(=O)O Amb27460990 [0,1,0,0,0,0|1,0,0]=2 1272 B9R0.79 C[C@H](C(=O)O)[C@H](Cl)C(=O)O Amb27955233 [0,1,0,0,0,0|1,0,0]=2 1273 B9R0.79 C[C@H](C(N)=O)[C@H](C)C(N)=O Amb27220901 [0,1,0,0,0,0|3,0,0]=4 1274 B9R0.79 C[C@H](N)[C@@H](O)[C@@H](C)C(=O)O Amb27845316 [0,1,0,0,0,0|2,0,1]=4 1275 B9R0.79 C[C@H](O)[C@@H](C)[C@@H](N)C(=O)O Amb27655509 [0,1,0,0,0,0|2,0,1]=4 1276 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O Amb27595659 [0,1,0,0,0,0|2,0,1]=4 1277 B9R0.79 C[C@H](O)[C@H](O)[C@@H](O)C(=O)O Amb27592166 [0,1,0,0,0,0|1,0,1]=3 1278 B9R0.79 C[C@H](O)[C@H](O)[C@@H](O)C(N)=O Amb27424984 [0,1,0,0,0,0|2,0,1]=4 1279 B9R0.79 C[C@H]([C@@H](C)O)[C@@H](N)C(=O)O Amb25693814 [0,1,0,0,0,0|2,0,1]=4 1280 B9R0.79 C\C(C(=O)O)=C(/Cl)C(=O)O Amb27858839 [0,1,0,0,0,0|1,0,2]=4 1281 B9R0.79 C\C(C(=O)O)=C(\C)C(=O)O Amb24712245 [0,1,0,0,0,0|1,0,2]=4 1282 B9R0.79 C\C(C(=O)O)=C(\O)C(=O)O Amb27867258 [0,1,0,0,0,0|0,0,2]=3 1283 B9R0.79 NC(=O)C(N)C(N)C(=O)O Amb27424997 [0,1,0,0,0,0|2,0,0]=3 1284 B9R0.79 NC(=O)C(O)C(O)C(=O)O Amb24112928 [0,1,0,0,0,0|1,0,0]=2 1285 B9R0.79 NC(=O)C(O)C(O)C(N)=O Amb2842263 [0,1,0,0,0,0|2,0,0]=3 1286 B9R0.79 NC(=O)[C@@H](N)[C@@H](O)C(N)=O Amb27259156 [0,1,0,0,0,0|2,0,0]=3 1287 B9R0.79 NC(=O)[C@@H](N)[C@H](O)C(N)=O Amb28126957 [0,1,0,0,0,0|2,0,0]=3 1288 B9R0.79 NC(=O)[C@@H](O)[C@H](N)C(=O)O Amb24763774 [0,1,0,0,0,0|1,0,0]=2 1289 B9R0.79 NC(=O)[C@H](O)[C@@H](O)C(=O)O Amb28341817 [0,1,0,0,0,0|1,0,0]=2 1290 B9R0.79 NC(=O)[C@H](O)[C@@H](O)C(N)=O Amb24385859 [0,1,0,0,0,0|2,0,0]=3 1291 B9R0.79 NC(C(=O)O)C(F)C(=O)O Amb24061061 [0,1,0,0,0,0|1,0,0]=2 1292 B9R0.79 NC(C(=O)O)C(N)C(=O)O Amb24117894 [0,1,0,0,0,0|1,0,0]=2 1293 B9R0.79 NC(C(=O)O)C(O)C(=O)O Amb9871461 [0,1,0,0,0,0|0,0,0]=1 1294 B9R0.79 NC(C(=O)O)C(O)C(Cl)Cl Amb27837948 [0,1,0,0,0,0|2,0,1]=4 1295 B9R0.79 NC(C(=O)O)C(O)C(F)F Amb19148422 [0,1,0,0,0,0|2,0,1]=4 1296 B9R0.79 N[C@@H](C(=O)O)C(F)C(=O)O Amb27494927 [0,1,0,0,0,0|1,0,0]=2 1297 B9R0.79 N[C@@H](C(=O)O)[C@@H](O)C(=O)O Amb17942870 [0,1,0,0,0,0|0,0,0]=1 1298 B9R0.79 N[C@@H](C(=O)O)[C@@H](O)C(Cl)Cl Amb27792191 [0,1,0,0,0,0|2,0,1]=4 1299 B9R0.79 N[C@@H](C(=O)O)[C@H](O)C(=O)O Amb27470435 [0,1,0,0,0,0|0,0,0]=1 1300 B9R0.79 N[C@@H](C(=O)O)[C@H](O)C(F)F Amb25940794 [0,1,0,0,0,0|2,0,1]=4 1301 B9R0.79 N[C@H](C(=O)O)C(F)C(=O)O Amb27796116 [0,1,0,0,0,0|1,0,0]=2 1302 B9R0.79 N[C@H](C(=O)O)[C@@H](F)C(=O)O Amb27865514 [0,1,0,0,0,0|1,0,0]=2 1303 B9R0.79 N[C@H](C(=O)O)[C@@H](N)C(=O)O Amb10072362 [0,1,0,0,0,0|1,0,0]=2 1304 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(=O)O Amb24087715 [0,1,0,0,0,0|0,0,0]=1 1305 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(=O)O Amb24117974 [0,1,0,0,0,0|0,0,0]=1 1306 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(F)F Amb26336091 [0,1,0,0,0,0|2,0,1]=4 1307 B9R0.79 N[C@H](C(=O)O)[C@H](Cl)C(=O)O Amb27796563 [0,1,0,0,0,0|1,0,0]=2 1308 B9R0.79 N[C@H](C(=O)O)[C@H](F)C(=O)O Amb26945975 [0,1,0,0,0,0|1,0,0]=2 1309 B9R0.79 N[C@H](C(=O)O)[C@H](N)C(=O)O Amb27173533 [0,1,0,0,0,0|1,0,0]=2 1310 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O Amb17615140 [0,1,0,0,0,0|0,0,0]=1 1311 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O Amb33714683 [0,1,0,0,0,0|0,0,0]=1 1312 B9R0.79 O=C(O)C(=O)C(O)=C(O)O Amb26515642 [0,1,0,0,0,0|0,0,3]=4 1313 B9R0.79 O=C(O)C(Br)C(Br)C(=O)O Amb2686761 [0,1,0,0,0,0|1,0,0]=2 1314 B9R0.79 O=C(O)C(Cl)C(Cl)C(=O)O Amb26345874 [0,1,0,0,0,0|1,0,0]=2 1315 B9R0.79 O=C(O)C(F)C(Cl)C(=O)O Amb27875188 [0,1,0,0,0,0|1,0,0]=2 1316 B9R0.79 O=C(O)C(O)C(Cl)C(=O)O Amb17594225 [0,1,0,0,0,0|0,0,0]=1 1317 B9R0.79 O=C(O)C(O)C(F)C(=O)O Amb24479232 [0,1,0,0,0,0|0,0,0]=1 1318 B9R0.79 O=C(O)C(O)C(O)C(=O)O Amb24668916 [0,1,0,0,0,0|0,0,0]=1 1319 B9R0.79 O=C(O)C(O)C(O)C(=O)O Amb6608787 [0,1,0,0,0,0|0,0,0]=1 1320 B9R0.79 O=C(O)C(O)C(O)C(=O)S Amb28050895 [0,1,0,0,0,0|0,1,0]=2 1321 B9R0.79 O=C(O)C(S)C(S)C(=O)O Amb8627761 [0,1,0,0,0,0|0,1,0]=2 1322 B9R0.79 O=C(O)[C@@H](Cl)[C@H](O)C(=O)O Amb27845392 [0,1,0,0,0,0|0,0,0]=1 1323 B9R0.79 O=C(O)[C@@H](O)[C@@H](O)C(=O)O Amb22230832 [0,1,0,0,0,0|0,0,0]=1 1324 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb17616192 [0,1,0,0,0,0|0,0,0]=1 1325 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb19884028 [0,1,0,0,0,0|0,0,0]=1 1326 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb22750609 [0,1,0,0,0,0|0,0,0]=1 1327 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb22756774 [0,1,0,0,0,0|0,0,0]=1 1328 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb34915014 [0,1,0,0,0,0|0,0,0]=1 1329 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb5722339 [0,1,0,0,0,0|0,0,0]=1 1330 B9R0.79 O=C(O)[C@@H](S)[C@H](S)C(=O)O Amb28195042 [0,1,0,0,0,0|0,1,0]=2 1331 B9R0.79 O=C(O)[C@H](Br)[C@H](F)C(=O)O Amb28050029 [0,1,0,0,0,0|1,0,0]=2 1332 B9R0.79 O=C(O)[C@H](F)[C@H](F)C(=O)O Amb28365940 [0,1,0,0,0,0|1,0,0]=2 1333 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb19884026 [0,1,0,0,0,0|0,0,0]=1 1334 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb20240604 [0,1,0,0,0,0|0,0,0]=1 1335 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb20670711 [0,1,0,0,0,0|0,0,0]=1 1336 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb34915016 [0,1,0,0,0,0|0,0,0]=1 1337 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb8628435 [0,1,0,0,0,0|0,0,0]=1 1338 B9R0.79 O=C(O)[C@H](O)[C@H](Br)C(=O)O Amb28252354 [0,1,0,0,0,0|0,0,0]=1 1339 B9R0.79 O=C(O)[C@H](O)[C@H](Cl)C(=O)O Amb27477747 [0,1,0,0,0,0|0,0,0]=1 1340 B9R0.79 O=C(O)[C@H](S)[C@H](S)C(=O)O Amb8393135 [0,1,0,0,0,0|0,1,0]=2 1341 B9R0.79 O=C(O)\C(Br)=C(/Br)C(=O)O Amb27465194 [0,1,0,0,0,0|1,0,2]=4 1342 B9R0.79 O=C(O)\C(Br)=C(\Br)C(=O)O Amb22347940 [0,1,0,0,0,0|1,0,2]=4 1343 B9R0.79 O=C(O)\C(O)=C(/O)C(=O)O Amb18511532 [0,1,0,0,0,0|0,0,2]=3 1344 B9R0.79 O=C(O)\C(O)=C(/O)C(=O)O Amb33802774 [0,1,0,0,0,0|0,0,2]=3 1345 B9R0.79 O=C(O)\C(O)=C(\O)C(=O)O Amb17593679 [0,1,0,0,0,0|0,0,2]=3 1346 B9R0.79 O=C([O-])C(O)C(O)C(=O)O Amb20246422 [0,1,0,0,0,0|0,0,1]=2 1347 B9R0.79 O=C([O-])C(O)C(O)C(=O)O Amb8517447 [0,1,0,0,0,0|0,0,1]=2 1348 B9R0.79 O=C([O-])C(O)C(O)C(=O)[O-] Amb19959974 [0,1,0,0,0,0|0,0,2]=3 1349 B9R0.79 O=C([O-])C(O)C(O)C(=O)[O-] Amb8514450 [0,1,0,0,0,0|0,0,2]=3 1350 B9R0.79 O=C([O-])[C@@H](O)[C@H](O)C(=O)[O-] Amb32414666 [0,1,0,0,0,0|0,0,2]=3 1351 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)O Amb34915846 [0,1,0,0,0,0|0,0,1]=2 1352 B9R1.35 C=C(Br)C1COC(=O)C1 Amb25707934 [0,0,0,1,0,0|3,0,0]=4 1353 B9R1.35 C=C1CCC(C(=O)O)C1 Amb28369274 [0,0,0,1,0,0|3,0,0]=4 1354 B9R1.35 C=C1CN[C@@H](C(=O)O)C1 Amb27795857 [0,0,0,1,0,0|3,0,0]=4 1355 B9R1.35 C=C1CN[C@H](C(=O)O)C1 Amb27400250 [0,0,0,1,0,0|3,0,0]=4 1356 B9R1.35 CC(=O)C1CC(C)=NO1 Amb24457979 [0,0,0,1,0,0|3,0,0]=4 1357 B9R1.35 CC(=O)C1CCC(=O)C1 Amb24423910 [0,0,0,1,0,0|3,0,0]=4 1358 B9R1.35 CC(=O)C1CNC(=O)C1 Amb27488585 [0,0,0,1,0,0|3,0,0]=4 1359 B9R1.35 CC(=O)[C@@H]1CCC(=O)C1 Amb24407171 [0,0,0,1,0,0|3,0,0]=4 1360 B9R1.35 CC(=O)[C@H]1CC(C)=NO1 Amb27212515 [0,0,0,1,0,0|3,0,0]=4 1361 B9R1.35 CC(=O)[C@H]1CCC(=O)C1 Amb26590768 [0,0,0,1,0,0|3,0,0]=4 1362 B9R1.35 CC(=O)[C@H]1COC(=O)C1 Amb18832647 [0,0,0,1,0,0|2,0,0]=3 1363 B9R1.35 CC1=NC(C(=O)O)CO1 Amb20621597 [0,0,0,1,0,0|3,0,0]=4 1364 B9R1.35 CC1=NOC(C(=O)O)C1 Amb7088977 [0,0,0,1,0,0|2,0,0]=3 1365 B9R1.35 CC1=NO[C@H](C(=O)O)C1 Amb25189709 [0,0,0,1,0,0|2,0,0]=3 1366 B9R1.35 CC1CC(C(=O)O)CO1 Amb25922998 [0,0,0,1,0,0|2,0,1]=4 1367 B9R1.35 CC1COC(C(=O)O)C1 Amb32679237 [0,0,0,1,0,0|2,0,1]=4 1368 B9R1.35 C[C@@H]1C[C@H](C(=O)O)CO1 Amb27961253 [0,0,0,1,0,0|2,0,1]=4 1369 B9R1.35 C[C@H](O)[C@H]1COC(=O)C1 Amb27980502 [0,0,0,1,0,0|2,0,1]=4 1370 B9R1.35 N=C1OCC(C(=O)O)S1 Amb27954988 [0,0,0,1,0,0|3,0,0]=4 1371 B9R1.35 NC(=O)C1CC(Br)=NO1 Amb10067861 [0,0,0,1,0,0|3,0,0]=4 1372 B9R1.35 NC(=O)C1CNC(=O)C1 Amb1803351 [0,0,0,1,0,0|3,0,0]=4 1373 B9R1.35 NC(=O)C1CSC(=O)C1 Amb27837681 [0,0,0,1,0,0|2,1,0]=4 1374 B9R1.35 NC1COC(C(=O)O)C1 Amb18642828 [0,0,0,1,0,0|2,0,1]=4 1375 B9R1.35 N[C@@H]1CO[C@@H](C(=O)O)C1 Amb25691536 [0,0,0,1,0,0|2,0,1]=4 1376 B9R1.35 N[C@H]1CO[C@H](C(=O)O)C1 Amb24117069 [0,0,0,1,0,0|2,0,1]=4 1377 B9R1.35 O=C(O)C1CC(Br)=NO1 Amb26852251 [0,0,0,1,0,0|2,0,0]=3 1378 B9R1.35 O=C(O)C1CC(O)CN1 Amb32666298 [0,0,0,1,0,0|2,0,1]=4 1379 B9R1.35 O=C(O)C1CC(O)CN1 Amb33481348 [0,0,0,1,0,0|2,0,1]=4 1380 B9R1.35 O=C(O)C1CC(O)CN1 Amb9702801 [0,0,0,1,0,0|2,0,1]=4 1381 B9R1.35 O=C(O)C1CC(O)CO1 Amb18642869 [0,0,0,1,0,0|1,0,1]=3 1382 B9R1.35 O=C(O)C1CCC(O)C1 Amb21963572 [0,0,0,1,0,0|2,0,1]=4 1383 B9R1.35 O=C(O)C1CSS(=O)C1 Amb27165800 [0,0,0,1,0,0|2,1,0]=4 1384 B9R1.35 O=C(O)C1C[C@H](O)CN1 Amb34913473 [0,0,0,1,0,0|2,0,1]=4 1385 B9R1.35 O=C(O)[C@@H]1CC(O)CN1 Amb25743296 [0,0,0,1,0,0|2,0,1]=4 1386 B9R1.35 O=C(O)[C@@H]1CC[C@@H](O)C1 Amb22746558 [0,0,0,1,0,0|2,0,1]=4 1387 B9R1.35 O=C(O)[C@@H]1CC[C@H](O)C1 Amb27784295 [0,0,0,1,0,0|2,0,1]=4 1388 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)C=N1 Amb27215307 [0,0,0,1,0,0|2,0,1]=4 1389 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CN1 Amb1994991 [0,0,0,1,0,0|2,0,1]=4 1390 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CO1 Amb28287549 [0,0,0,1,0,0|1,0,1]=3 1391 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb22748218 [0,0,0,1,0,0|2,0,1]=4 1392 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8384483 [0,0,0,1,0,0|2,0,1]=4 1393 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8629987 [0,0,0,1,0,0|2,0,1]=4 1394 B9R1.35 O=C(O)[C@H]1CC[C@H](O)C1 Amb26960428 [0,0,0,1,0,0|2,0,1]=4 1395 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5718663 [0,0,0,1,0,0|2,0,1]=4 1396 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5719209 [0,0,0,1,0,0|2,0,1]=4 1397 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb16230723 [0,0,0,1,0,0|2,0,1]=4 1398 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb8628928 [0,0,0,1,0,0|2,0,1]=4 1399 B9R1.35 O=C(O)c1cc(O)co1 Amb27494194 [0,0,0,1,0,0|1,0,2]=4 1400 B9R1.35 O=C(O)c1cc(O)no1 Amb9173684 [0,0,0,1,0,0|1,0,2]=4 1401 B9R1.35 O=C1C=C(C(=O)O)ON1 Amb19889163 [0,0,0,1,0,0|1,0,2]=4 1402 B9R1.35 O=C1C=CC(C(=O)O)C1 Amb26002884 [0,0,0,1,0,0|2,0,0]=3 1403 B9R1.35 O=C1C=CC(C(=O)O)N1 Amb27775192 [0,0,0,1,0,0|3,0,0]=4 1404 B9R1.35 O=C1CC(C(=O)O)=CN1 Amb18832707 [0,0,0,1,0,0|2,0,1]=4 1405 B9R1.35 O=C1CC(C(=O)O)=CO1 Amb3499387 [0,0,0,1,0,0|1,0,1]=3 1406 B9R1.35 O=C1CC(C(=O)O)=NN1 Amb18278720 [0,0,0,1,0,0|2,0,1]=4 1407 B9R1.35 O=C1CC(C(=O)O)CN1 Amb33545000 [0,0,0,1,0,0|2,0,0]=3 1408 B9R1.35 O=C1CC(C(=O)O)CO1 Amb22642307 [0,0,0,1,0,0|1,0,0]=2 1409 B9R1.35 O=C1CC(C(=O)O)CS1 Amb10073724 [0,0,0,1,0,0|1,1,0]=3 1410 B9R1.35 O=C1CC(C(=O)O)NN1 Amb18642739 [0,0,0,1,0,0|2,0,0]=3 1411 B9R1.35 O=C1CCC(C(=O)Cl)C1 Amb25282784 [0,0,0,1,0,0|3,0,0]=4 1412 B9R1.35 O=C1CCC(C(=O)O)C1 Amb2695400 [0,0,0,1,0,0|2,0,0]=3 1413 B9R1.35 O=C1CCC(C(=O)O)N1 Amb9703102 [0,0,0,1,0,0|3,0,0]=4 1414 B9R1.35 O=C1CCC(C(=O)O)O1 Amb20623076 [0,0,0,1,0,0|3,0,0]=4 1415 B9R1.35 O=C1CCC(C(=O)O)S1 Amb23439315 [0,0,0,1,0,0|3,0,0]=4 1416 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 Amb27254141 [0,0,0,1,0,0|2,0,0]=3 1417 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 Amb1995036 [0,0,0,1,0,0|3,0,0]=4 1418 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 Amb24099403 [0,0,0,1,0,0|3,0,0]=4 1419 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 Amb2722887 [0,0,0,1,0,0|3,0,0]=4 1420 B9R1.35 O=C1CC[C@H](C(=O)O)C1 Amb22746923 [0,0,0,1,0,0|2,0,0]=3 1421 B9R1.35 O=C1CC[C@H](C(=O)O)N1 Amb2694994 [0,0,0,1,0,0|3,0,0]=4 1422 B9R1.35 O=C1CC[C@H](C(=O)O)O1 Amb2720513 [0,0,0,1,0,0|3,0,0]=4 1423 B9R1.35 O=C1CNC(C(=O)O)C1 Amb30625211 [0,0,0,1,0,0|2,0,0]=3 1424 B9R1.35 O=C1CNC(C(=O)O)C1 Amb8386094 [0,0,0,1,0,0|2,0,0]=3 1425 B9R1.35 O=C1CN[C@H](C(=O)O)C1 Amb22747440 [0,0,0,1,0,0|2,0,0]=3 1426 B9R1.35 O=C1CN[C@H](C(=O)O)C1 Amb8628977 [0,0,0,1,0,0|2,0,0]=3 1427 B9R1.35 O=C1COC(C(=O)O)C1 Amb32651713 [0,0,0,1,0,0|1,0,0]=2 1428 B9R1.35 O=C1CSC(C(=O)O)C1 Amb24061425 [0,0,0,1,0,0|1,1,0]=3 1429 B9R1.35 O=C1CSC(C(=O)O)O1 Amb25063335 [0,0,0,1,0,0|2,1,0]=4 1430 B9R1.35 O=C1C[C@@H](C(=O)O)CN1 Amb23439643 [0,0,0,1,0,0|2,0,0]=3 1431 B9R1.35 O=C1C[C@@H](C(=O)O)CO1 Amb27253217 [0,0,0,1,0,0|1,0,0]=2 1432 B9R1.35 O=C1C[C@H](C(=O)O)CN1 Amb25946886 [0,0,0,1,0,0|2,0,0]=3 1433 B9R1.35 O=C1NC(C(=O)Cl)CO1 Amb27484689 [0,0,0,1,0,0|3,0,0]=4 1434 B9R1.35 O=C1NC(C(=O)O)CO1 Amb15701690 [0,0,0,1,0,0|2,0,0]=3 1435 B9R1.35 O=C1NC(C(=O)O)CS1 Amb3319393 [0,0,0,1,0,0|2,1,0]=4 1436 B9R1.35 O=C1NCC(C(=O)O)N1 Amb2780032 [0,0,0,1,0,0|3,0,0]=4 1437 B9R1.35 O=C1NCC(C(=O)O)O1 Amb24112958 [0,0,0,1,0,0|3,0,0]=4 1438 B9R1.35 O=C1NCC(C(=O)O)S1 Amb24084914 [0,0,0,1,0,0|3,0,0]=4 1439 B9R1.35 O=C1NC[C@@H](C(=O)O)N1 Amb3997304 [0,0,0,1,0,0|3,0,0]=4 1440 B9R1.35 O=C1NC[C@@H](C(=O)O)O1 Amb25146207 [0,0,0,1,0,0|3,0,0]=4 1441 B9R1.35 O=C1NC[C@H](C(=O)O)N1 Amb24079612 [0,0,0,1,0,0|3,0,0]=4 1442 B9R1.35 O=C1NC[C@H](C(=O)O)O1 Amb27771494 [0,0,0,1,0,0|3,0,0]=4 1443 B9R1.35 O=C1N[C@@H](C(=O)O)CO1 Amb24340149 [0,0,0,1,0,0|2,0,0]=3 1444 B9R1.35 O=C1N[C@@H](C(=O)O)CS1 Amb537246 [0,0,0,1,0,0|2,1,0]=4 1445 B9R1.35 O=C1N[C@H](C(=O)O)CO1 Amb19517080 [0,0,0,1,0,0|2,0,0]=3 1446 B9R1.35 O=C1N[C@H](C(=O)O)CS1 Amb1157856 [0,0,0,1,0,0|2,1,0]=4 1447 B9R1.35 O=C1OCC(C(=O)O)O1 Amb25767974 [0,0,0,1,0,0|2,0,0]=3 1448 B9R1.35 O=C1SCC(C(=O)O)S1 Amb23504458 [0,0,0,1,0,0|2,1,0]=4 1449 B9R1.36 CC1(C)C[C@@H](O)C(=O)O1 Amb27472564 [0,0,0,1,0,0|2,0,1]=4 1450 B9R1.36 CC1(C)C[C@H](O)C(=O)O1 Amb28205922 [0,0,0,1,0,0|2,0,1]=4 1451 B9R1.38 CC1(C)OC(=O)C[C@H]1O Amb27208228 [0,0,0,1,0,0|2,0,1]=4 1452 B9R1.45 C=C1CC1C(N)C(=O)O Amb24117258 [0,0,0,1,0,0|3,0,0]=4 1453 B9R1.45 C=C1CC1C(N)C(=O)O Amb27489118 [0,0,0,1,0,0|3,0,0]=4 1454 B9R1.45 C=C1CC1C(O)C(=O)O Amb27816361 [0,0,0,1,0,0|2,0,0]=3 1455 B9R1.45 C=C1C[C@@H]1C(O)C(=O)O Amb28410295 [0,0,0,1,0,0|2,0,0]=3 1456 B9R1.45 C=C1C[C@@H]1[C@H](N)C(=O)O Amb28349320 [0,0,0,1,0,0|3,0,0]=4 1457 B9R1.45 CC1CC1C(O)C(=O)O Amb33474336 [0,0,0,1,0,0|2,0,1]=4 1458 B9R1.55 C=C1C[C@@H](C(=O)O)[C@H]1N Amb28055563 [0,0,0,1,0,0|3,0,0]=4 1459 B9R1.55 CC(C)[C@@H]1OC(=O)[C@H]1O Amb27196798 [0,0,0,1,0,0|2,0,1]=4 1460 B9R1.55 CC1OC(C(=O)[O-])C1O Amb28069594 [0,0,0,1,0,0|1,0,2]=4 1461 B9R1.55 NC(=O)C1NC(=O)C1N Amb27445718 [0,0,0,1,0,0|3,0,0]=4 1462 B9R1.55 NC1C(=O)NC1C(=O)O Amb25871338 [0,0,0,1,0,0|2,0,0]=3 1463 B9R1.55 N[C@H]1[C@@H](C(=O)O)C[C@H]1O Amb27848566 [0,0,0,1,0,0|2,0,1]=4 1464 B9R1.69 CC1CC(=O)C=CC1=O Amb27750328 [0,0,0,1,0,0|3,0,0]=4 1465 B9R1.69 CC1CC(=O)OCC1O Amb27956456 [0,0,0,1,0,0|2,0,1]=4 1466 B9R1.69 CC1NC(=O)COC1=O Amb20669551 [0,0,0,1,0,0|3,0,0]=4 1467 B9R1.69 CC1OC(=O)COC1=O Amb27421415 [0,0,0,1,0,0|3,0,0]=4 1468 B9R1.69 C[C@@H]1NC(=O)COC1=O Amb28059067 [0,0,0,1,0,0|3,0,0]=4 1469 B9R1.69 C[C@H]1COC(=O)C[C@@H]1O Amb27853905 [0,0,0,1,0,0|2,0,1]=4 1470 B9R1.69 O=C1C=CC(=O)C(O)C1 Amb27191875 [0,0,0,1,0,0|2,0,0]=3 1471 B9R1.69 O=C1C=CC(=O)N(O)C1 Amb27227026 [0,0,0,1,0,0|3,0,0]=4 1472 B9R1.69 O=C1C=CC(O)C(O)C1 Amb27984020 [0,0,0,1,0,0|2,0,1]=4 1473 B9R1.69 O=C1C=CC(O)[C@H](O)C1 Amb27836776 [0,0,0,1,0,0|2,0,1]=4 1474 B9R1.69 O=C1CCC(=O)C(Br)C1 Amb25775016 [0,0,0,1,0,0|3,0,0]=4 1475 B9R1.69 O=C1CCC(=O)C(Cl)C1 Amb24452362 [0,0,0,1,0,0|3,0,0]=4 1476 B9R1.69 O=C1CCC(O)CC1O Amb27494789 [0,0,0,1,0,0|2,0,1]=4 1477 B9R1.69 O=C1CCS(=O)CC1O Amb29847922 [0,0,0,1,0,0|3,0,0]=4 1478 B9R1.69 O=C1CNC(=O)C(O)N1 Amb27204459 [0,0,0,1,0,0|3,0,0]=4 1479 B9R1.69 O=C1C[C@H](O)[C@H](O)CN1 Amb24517387 [0,0,0,1,0,0|2,0,1]=4 1480 B9R1.69 O=C1NCC(O)CC1O Amb28247470 [0,0,0,1,0,0|2,0,1]=4 1481 B9R1.69 O=C1NC[C@H](O)C[C@H]1O Amb27460866 [0,0,0,1,0,0|2,0,1]=4 1482 B9R1.112 N[C@@H](C[C@H]1CO1)C(=O)O Amb28252257 [0,0,0,1,0,0|2,0,1]=4 1483 B9R1.112 O=C(O)C(O)CC1CC1 Amb25082516 [0,0,0,1,0,0|2,0,1]=4 1484 B9R1.112 O=C(O)[C@@H](O)CC1CC1 Amb23401512 [0,0,0,1,0,0|2,0,1]=4 1485 B9R1.112 O=C(O)[C@H](O)CC1CC1 Amb26014645 [0,0,0,1,0,0|2,0,1]=4 1486 B9R1.137 O=C(O)CC(O)C1CC1 Amb17231863 [0,0,0,1,0,0|2,0,1]=4 1487 B9R1.137 O=C(O)C[C@@H](O)C1CC1 Amb25367343 [0,0,0,1,0,0|2,0,1]=4 1488 B9R1.137 O=C(O)C[C@H](O)C1CC1 Amb27468740 [0,0,0,1,0,0|2,0,1]=4 1489 B9R1.139 CC1(C)C(O)C1C(=O)O Amb27642274 [0,0,0,1,0,0|2,0,1]=4 1490 B9R1.152 C=C1CC(C)(C(=O)O)C1 Amb25887446 [0,0,0,1,0,0|3,0,0]=4 1491 B9R1.152 C=C1CC(N)(C(=O)O)C1 Amb34145346 [0,0,0,1,0,0|3,0,0]=4 1492 B9R1.152 C=C1CC(O)(C(=O)O)C1 Amb28201676 [0,0,0,1,0,0|2,0,0]=3 1493 B9R1.152 CC1(C(=O)O)CC(=O)C1 Amb22406208 [0,0,0,1,0,0|2,0,0]=3 1494 B9R1.152 CC1(C(=O)O)CC(O)C1 Amb33361249 [0,0,0,1,0,0|2,0,1]=4 1495 B9R1.152 CN1CC(O)(C(=O)O)C1 Amb28347279 [0,0,0,1,0,0|3,0,0]=4 1496 B9R1.152 NC1(C(=O)O)CC(O)C1 Amb26585144 [0,0,0,1,0,0|2,0,1]=4 1497 B9R1.152 NC1(C(=O)O)CC(O)C1 Amb28992378 [0,0,0,1,0,0|2,0,1]=4 1498 B9R1.152 NC1CC(O)(C(=O)O)C1 Amb27194402 [0,0,0,1,0,0|2,0,1]=4 1499 B9R1.152 N[C@]1(C(=O)O)C[C@H](O)C1 Amb25297893 [0,0,0,1,0,0|2,0,1]=4 1500 B9R1.152 N[C@]1(C(=O)O)C[C@H](O)C1 Amb32679390 [0,0,0,1,0,0|2,0,1]=4 1501 B9R1.152 O=C(O)C1(F)CC(O)C1 Amb34142466 [0,0,0,1,0,0|2,0,1]=4 1502 B9R1.152 O=C(O)[C@]1(F)C[C@@H](O)C1 Amb34912853 [0,0,0,1,0,0|2,0,1]=4 1503 B9R1.152 O=C(O)[C@]1(F)C[C@H](O)C1 Amb34161934 [0,0,0,1,0,0|2,0,1]=4 1504 B9R1.152 O=C(O)[C@]1(O)C[C@@H](O)C1 Amb34147022 [0,0,0,1,0,0|1,0,1]=3 1505 B9R1.152 O=C(O)[C@]1(O)C[C@H](O)C1 Amb34136524 [0,0,0,1,0,0|1,0,1]=3 1506 B9R1.152 O=C1CC(F)(C(=O)O)C1 Amb34136578 [0,0,0,1,0,0|2,0,0]=3 1507 B9R1.161 C=C(C)C1CC1C(=O)O Amb25887453 [0,0,0,1,0,0|3,0,0]=4 1508 B9R1.161 C=C(C)C1OC1C(C)=O Amb24520738 [0,0,0,1,0,0|3,0,0]=4 1509 B9R1.161 C=C(C)[C@@H]1C[C@H]1C(=O)O Amb33199898 [0,0,0,1,0,0|3,0,0]=4 1510 B9R1.161 C=C(C)[C@@H]1O[C@@H]1C(C)=O Amb25163815 [0,0,0,1,0,0|3,0,0]=4 1511 B9R1.161 CC(=O)C1CC1C(C)=O Amb27861276 [0,0,0,1,0,0|3,0,0]=4 1512 B9R1.161 CC(=O)C1OC1C(N)=O Amb28383609 [0,0,0,1,0,0|2,0,0]=3 1513 B9R1.161 CC(=O)[C@@H]1C[C@H]1C(C)=O Amb28246517 [0,0,0,1,0,0|3,0,0]=4 1514 B9R1.161 CC(=O)[C@@H]1O[C@@H]1C(N)=O Amb27194051 [0,0,0,1,0,0|2,0,0]=3 1515 B9R1.161 CC(=O)[C@H]1C[C@H]1C(C)=O Amb28248083 [0,0,0,1,0,0|3,0,0]=4 1516 B9R1.161 CC(C)[C@@H]1O[C@H]1C(=O)O Amb28252782 [0,0,0,1,0,0|2,0,1]=4 1517 B9R1.161 CC(O)C1CC1C(=O)O Amb25888760 [0,0,0,1,0,0|2,0,1]=4 1518 B9R1.161 CC(O)[C@@H]1C[C@@H]1C(=O)O Amb28457538 [0,0,0,1,0,0|2,0,1]=4 1519 B9R1.161 CC(O)[C@@H]1C[C@H]1C(=O)O Amb27489157 [0,0,0,1,0,0|2,0,1]=4 1520 B9R1.161 NC(=O)C1CC1C(=O)O Amb17606123 [0,0,0,1,0,0|2,0,0]=3 1521 B9R1.161 NC(=O)C1CC1C(N)=O Amb27661569 [0,0,0,1,0,0|3,0,0]=4 1522 B9R1.161 NC(=O)C1OC1C(=O)O Amb25695985 [0,0,0,1,0,0|1,0,0]=2 1523 B9R1.161 NC(=O)C1OC1C(N)=O Amb28287239 [0,0,0,1,0,0|2,0,0]=3 1524 B9R1.161 NC(=O)[C@@H]1C[C@@H]1C(=O)O Amb24623178 [0,0,0,1,0,0|2,0,0]=3 1525 B9R1.161 NC(=O)[C@@H]1C[C@H]1C(=O)O Amb27447217 [0,0,0,1,0,0|2,0,0]=3 1526 B9R1.161 NC(=O)[C@H]1C[C@H]1C(=O)O Amb27436130 [0,0,0,1,0,0|2,0,0]=3 1527 B9R1.161 O=C(Cl)C1OC1C(=O)Cl Amb24060960 [0,0,0,1,0,0|2,0,0]=3 1528 B9R1.161 O=C(O)C1CC1B(O)O Amb27599742 [0,0,0,1,0,0|2,0,1]=4 1529 B9R1.161 O=C(O)C1CC1C(=O)Cl Amb26959493 [0,0,0,1,0,0|2,0,0]=3 1530 B9R1.161 O=C(O)C1CC1C(=O)O Amb1350467 [0,0,0,1,0,0|1,0,0]=2 1531 B9R1.161 O=C(O)C1CC1[N+](=O)[O-] Amb9197005 [0,0,0,1,0,0|2,0,1]=4 1532 B9R1.161 O=C(O)C1OC1C(=O)O Amb4001391 [0,0,0,1,0,0|0,0,0]=1 1533 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O Amb22901897 [0,0,0,1,0,0|1,0,0]=2 1534 B9R1.161 O=C(O)[C@@H]1C[C@H]1[N+](=O)[O-] Amb25109456 [0,0,0,1,0,0|2,0,1]=4 1535 B9R1.161 O=C(O)[C@@H]1O[C@H]1C(=O)O Amb22799776 [0,0,0,1,0,0|0,0,0]=1 1536 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O Amb25979295 [0,0,0,1,0,0|1,0,0]=2 1537 B9R1.161 O=C(O)[C@H]1C[C@@H]1[N+](=O)[O-] Amb26439479 [0,0,0,1,0,0|2,0,1]=4 1538 B9R1.161 O=C(O)[C@H]1C[C@H]1C(=O)O Amb3442175 [0,0,0,1,0,0|1,0,0]=2 1539 B9R1.161 O=C(O)[C@H]1O[C@@H]1C(=O)O Amb22262951 [0,0,0,1,0,0|0,0,0]=1 1540 B9R1.161 O=C([O-])[C@@H]1N[C@H]1C(=O)[O-] Amb24120358 [0,0,0,1,0,0|1,0,2]=4 1541 B9R1.164 CC1(O)CC(C(=O)O)C1 Amb33545096 [0,0,0,1,0,0|2,0,1]=4 1542 B9R1.164 C[C@]1(O)C[C@@H](C(=O)O)C1 Amb23440037 [0,0,0,1,0,0|2,0,1]=4 1543 B9R1.164 C[C@]1(O)C[C@H](C(=O)O)C1 Amb23440038 [0,0,0,1,0,0|2,0,1]=4 1544 B9R1.164 O=C(O)C1CC(O)(O)C1 Amb27490909 [0,0,0,1,0,0|1,0,2]=4 1545 B9R1.164 O=C(O)C1CP(=O)(O)C1 Amb4297467 [0,0,0,1,0,0|2,0,0]=3 1546 B9R1.164 O=C(O)C1CS(=O)(=O)C1 Amb8439029 [0,0,0,1,0,0|2,0,1]=4 1547 B7R0.16 C=C(Br)C(N)C(=O)O Amb28193255 [0,0,0,0,1,0|3,0,0]=4 1548 B7R0.16 C=C(C(=O)O)C(=O)Cl Amb28056536 [0,0,0,0,1,0|2,0,1]=4 1549 B7R0.16 C=C(C)C(C)C(=O)O Amb18641781 [0,0,0,0,1,0|3,0,0]=4 1550 B7R0.16 C=C(C)C(N)C(=O)O Amb18641831 [0,0,0,0,1,0|3,0,0]=4 1551 B7R0.16 C=C(C)C(O)C(=O)O Amb27859701 [0,0,0,0,1,0|2,0,0]=3 1552 B7R0.16 C=C(C)C(O)C(N)=O Amb28123135 [0,0,0,0,1,0|3,0,0]=4 1553 B7R0.16 C=C(C)[C@@H](N)C(=O)O Amb26012631 [0,0,0,0,1,0|3,0,0]=4 1554 B7R0.16 C=C(C)[C@@H](O)C(=O)O Amb28071409 [0,0,0,0,1,0|2,0,0]=3 1555 B7R0.16 CC(=O)C(=O)C(=O)O Amb24101563 [0,0,0,0,1,0|1,0,2]=4 1556 B7R0.16 CC(=O)C(Br)C(C)=O Amb22000680 [0,0,0,0,1,0|3,0,0]=4 1557 B7R0.16 CC(=O)C(C)C(=O)Cl Amb27971652 [0,0,0,0,1,0|3,0,0]=4 1558 B7R0.16 CC(=O)C(C)C(C)=O Amb1152249 [0,0,0,0,1,0|3,0,0]=4 1559 B7R0.16 CC(=O)C(Cl)C(C)=O Amb3940505 [0,0,0,0,1,0|3,0,0]=4 1560 B7R0.16 CC(=O)C(N)C(=O)O Amb21962887 [0,0,0,0,1,0|2,0,0]=3 1561 B7R0.16 CC(=O)C(N)C(C)=O Amb18632931 [0,0,0,0,1,0|3,0,0]=4 1562 B7R0.16 CC(=O)C(N)C(C)=O Amb6893881 [0,0,0,0,1,0|3,0,0]=4 1563 B7R0.16 CC(=O)C(O)C(C)=O Amb28048968 [0,0,0,0,1,0|2,0,0]=3 1564 B7R0.16 CC(=O)C(O)C(C)O Amb26597030 [0,0,0,0,1,0|2,0,1]=4 1565 B7R0.16 CC(=O)N(O)C(C)=O Amb22750106 [0,0,0,0,1,0|3,0,0]=4 1566 B7R0.16 CC(=O)[C@@H](O)[C@@H](C)O Amb24481484 [0,0,0,0,1,0|2,0,1]=4 1567 B7R0.16 CC(=O)[C@@H](O)[C@H](C)O Amb28045145 [0,0,0,0,1,0|2,0,1]=4 1568 B7R0.16 CC(=O)[C@H](O)[C@@H](C)O Amb24701454 [0,0,0,0,1,0|2,0,1]=4 1569 B7R0.16 CC(=S)C(S)C(=O)O Amb27791825 [0,0,0,0,1,0|1,2,0]=4 1570 B7R0.16 CC(C(=O)O)C(=O)O Amb6600127 [0,0,0,0,1,0|1,0,0]=2 1571 B7R0.16 CC(C(N)=O)C(=O)O Amb27401562 [0,0,0,0,1,0|2,0,0]=3 1572 B7R0.16 CC(C(N)=O)C(N)=O Amb4034611 [0,0,0,0,1,0|3,0,0]=4 1573 B7R0.16 CC(C)C(O)C(=O)O Amb2582547 [0,0,0,0,1,0|2,0,1]=4 1574 B7R0.16 CC(C)[C@@H](O)C(=O)O Amb10071589 [0,0,0,0,1,0|2,0,1]=4 1575 B7R0.16 CC(C)[C@H](O)C(=O)O Amb2694861 [0,0,0,0,1,0|2,0,1]=4 1576 B7R0.16 CC(N)C(O)C(=O)O Amb18641970 [0,0,0,0,1,0|2,0,1]=4 1577 B7R0.16 CC(N)C(O)C(=O)O Amb33299223 [0,0,0,0,1,0|2,0,1]=4 1578 B7R0.16 CC(O)C(Br)C(=O)O Amb17594710 [0,0,0,0,1,0|2,0,1]=4 1579 B7R0.16 CC(O)C(C)C(=O)O Amb17615515 [0,0,0,0,1,0|2,0,1]=4 1580 B7R0.16 CC(O)C(Cl)C(=O)O Amb17593522 [0,0,0,0,1,0|2,0,1]=4 1581 B7R0.16 CC(O)C(F)C(=O)O Amb33544667 [0,0,0,0,1,0|2,0,1]=4 1582 B7R0.16 CC(O)C(N)C(=O)O Amb32665460 [0,0,0,0,1,0|2,0,1]=4 1583 B7R0.16 CC(O)C(N)C(=O)O Amb9703096 [0,0,0,0,1,0|2,0,1]=4 1584 B7R0.16 CC(O)C(O)C(=O)O Amb18124272 [0,0,0,0,1,0|1,0,1]=3 1585 B7R0.16 CN(C)C(O)C(=O)O Amb28399618 [0,0,0,0,1,0|3,0,0]=4 1586 B7R0.16 C[C@@H](O)C(N)C(=O)O Amb26397429 [0,0,0,0,1,0|2,0,1]=4 1587 B7R0.16 C[C@@H](O)[C@@H](Cl)C(=O)O Amb27489415 [0,0,0,0,1,0|2,0,1]=4 1588 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O Amb8514159 [0,0,0,0,1,0|2,0,1]=4 1589 B7R0.16 C[C@@H](O)[C@@H](O)C(=O)O Amb27812084 [0,0,0,0,1,0|1,0,1]=3 1590 B7R0.16 C[C@@H](O)[C@H](Cl)C(=O)O Amb27188843 [0,0,0,0,1,0|2,0,1]=4 1591 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb22351168 [0,0,0,0,1,0|2,0,1]=4 1592 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb33623705 [0,0,0,0,1,0|2,0,1]=4 1593 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb6599999 [0,0,0,0,1,0|2,0,1]=4 1594 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O Amb10844572 [0,0,0,0,1,0|2,0,1]=4 1595 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O Amb27751951 [0,0,0,0,1,0|2,0,1]=4 1596 B7R0.16 C[C@H](O)[C@@H](Br)C(=O)O Amb27476235 [0,0,0,0,1,0|2,0,1]=4 1597 B7R0.16 C[C@H](O)[C@@H](F)C(=O)O Amb27837922 [0,0,0,0,1,0|2,0,1]=4 1598 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O Amb6297293 [0,0,0,0,1,0|2,0,1]=4 1599 B7R0.16 C[C@H](O)[C@@H](O)C(=O)O Amb25844932 [0,0,0,0,1,0|1,0,1]=3 1600 B7R0.16 C[C@H](O)[C@H](Br)C(=O)O Amb27409077 [0,0,0,0,1,0|2,0,1]=4 1601 B7R0.16 C[C@H](O)[C@H](C)C(=O)O Amb27440373 [0,0,0,0,1,0|2,0,1]=4 1602 B7R0.16 C[C@H](O)[C@H](Cl)C(=O)O Amb27410667 [0,0,0,0,1,0|2,0,1]=4 1603 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb32663639 [0,0,0,0,1,0|2,0,1]=4 1604 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb8514158 [0,0,0,0,1,0|2,0,1]=4 1605 B7R0.16 C[C@H](O)[C@H](O)C(=O)O Amb27831803 [0,0,0,0,1,0|1,0,1]=3 1606 B7R0.16 C[PH](=O)C(O)C(=O)O Amb34916646 [0,0,0,0,1,0|2,0,0]=3 1607 B7R0.16 C\C(O)=C(\N)C(=O)O Amb27191761 [0,0,0,0,1,0|2,0,1]=4 1608 B7R0.16 C\C(O)=C(\O)C(=O)O Amb28282804 [0,0,0,0,1,0|1,0,1]=3 1609 B7R0.16 NC(=O)C(Br)C(N)=O Amb23504430 [0,0,0,0,1,0|3,0,0]=4 1610 B7R0.16 NC(=O)C(F)C(N)=O Amb27948525 [0,0,0,0,1,0|3,0,0]=4 1611 B7R0.16 NC(=O)C(N)C(N)=O Amb518675 [0,0,0,0,1,0|3,0,0]=4 1612 B7R0.16 NC(=O)C(O)C(N)=O Amb27212957 [0,0,0,0,1,0|2,0,0]=3 1613 B7R0.16 NC(=O)C([Na])C(N)=O Amb27838298 [0,0,0,0,1,0|3,0,0]=4 1614 B7R0.16 NC(=O)N(O)C(N)=O Amb35748113 [0,0,0,0,1,0|3,0,0]=4 1615 B7R0.16 NC(=O)N(O)C(N)=O Amb35753209 [0,0,0,0,1,0|3,0,0]=4 1616 B7R0.16 NC(=O)[C@H](N)C(=O)O Amb28397054 [0,0,0,0,1,0|2,0,0]=3 1617 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,0,0,0,1,0|1,0,0]=2 1618 B7R0.16 N[C@@H](C(=O)O)S(=O)O Amb28125643 [0,0,0,0,1,0|2,0,0]=3 1619 B7R0.16 N[C@H](C(=O)O)C(O)O Amb27867398 [0,0,0,0,1,0|1,0,2]=4 1620 B7R0.16 O=C(Cl)C(Cl)C(=O)Cl Amb27781570 [0,0,0,0,1,0|3,0,0]=4 1621 B7R0.16 O=C(Cl)C(F)C(=O)Cl Amb32456101 [0,0,0,0,1,0|3,0,0]=4 1622 B7R0.16 O=C(O)C(=O)C(=O)O Amb18641943 [0,0,0,0,1,0|0,0,2]=3 1623 B7R0.16 O=C(O)C(Br)C(=O)O Amb17594708 [0,0,0,0,1,0|1,0,0]=2 1624 B7R0.16 O=C(O)C(F)C(=O)O Amb24055884 [0,0,0,0,1,0|1,0,0]=2 1625 B7R0.16 O=C(O)C(O)C(=O)O Amb1215315 [0,0,0,0,1,0|0,0,0]=1 1626 B7R0.16 O=C(O)C(O)C(Cl)Cl Amb27212773 [0,0,0,0,1,0|2,0,1]=4 1627 B7R0.16 O=C(O)C(O)C(F)F Amb25074883 [0,0,0,0,1,0|2,0,1]=4 1628 B7R0.16 O=C(O)C(S)C(=O)O Amb28346986 [0,0,0,0,1,0|0,1,0]=2 1629 B9R0.7 C=C(Br)CNC(C)C(=O)O Amb18303282 [0,0,0,0,0,1|3,0,0]=4 1630 B9R0.7 C=C(Br)CN[C@@H](C)C(=O)O Amb27174841 [0,0,0,0,0,1|3,0,0]=4 1631 B9R0.7 C=C(C)C(C)CCC(=O)O Amb27254117 [0,0,0,0,0,1|3,0,0]=4 1632 B9R0.7 C=C(C)C(N)CCC(=O)O Amb33199957 [0,0,0,0,0,1|3,0,0]=4 1633 B9R0.7 C=C(C)C(O)COC(C)=O Amb27170291 [0,0,0,0,0,1|3,0,0]=4 1634 B9R0.7 C=C(C)CCC(C)C(=O)O Amb25809141 [0,0,0,0,0,1|3,0,0]=4 1635 B9R0.7 C=C(C)CCC(N)C(=O)O Amb28121242 [0,0,0,0,0,1|3,0,0]=4 1636 B9R0.7 C=C(C)CCC(O)C(=O)O Amb27436256 [0,0,0,0,0,1|2,0,0]=3 1637 B9R0.7 C=C(C)CC[C@@H](N)C(=O)O Amb25775219 [0,0,0,0,0,1|3,0,0]=4 1638 B9R0.7 C=C(C)CC[C@H](N)C(=O)O Amb25948355 [0,0,0,0,0,1|3,0,0]=4 1639 B9R0.7 C=C(C)CSC(C)C(=O)O Amb6263518 [0,0,0,0,0,1|3,0,0]=4 1640 B9R0.7 C=C(CCC(=O)O)C(=O)O Amb8391367 [0,0,0,0,0,1|1,0,1]=3 1641 B9R0.7 C=C(CCC(=O)O)C(C)=O Amb27814984 [0,0,0,0,0,1|2,0,1]=4 1642 B9R0.7 C=C(Cl)CCC(N)C(=O)O Amb27424777 [0,0,0,0,0,1|3,0,0]=4 1643 B9R0.7 C=C(F)C(N)CCC(=O)O Amb27849938 [0,0,0,0,0,1|3,0,0]=4 1644 B9R0.7 CC(=C=CC(=O)O)C(=O)O Amb17593578 [0,0,0,0,0,1|1,0,2]=4 1645 B9R0.7 CC(=O)C(=O)NCC(=O)O Amb17593639 [0,0,0,0,0,1|1,0,2]=4 1646 B9R0.7 CC(=O)C(=O)OCC(=O)O Amb28126708 [0,0,0,0,0,1|1,0,2]=4 1647 B9R0.7 CC(=O)C(C)CCC(=O)O Amb4020917 [0,0,0,0,0,1|2,0,0]=3 1648 B9R0.7 CC(=O)C(C)CCC(N)=O Amb25843826 [0,0,0,0,0,1|3,0,0]=4 1649 B9R0.7 CC(=O)C(C)SCC(N)=O Amb28206699 [0,0,0,0,0,1|3,0,0]=4 1650 B9R0.7 CC(=O)C(F)CCC(=O)O Amb27620074 [0,0,0,0,0,1|2,0,0]=3 1651 B9R0.7 CC(=O)C(N)CCC(=O)O Amb27875288 [0,0,0,0,0,1|2,0,0]=3 1652 B9R0.7 CC(=O)C(O)CCC(=O)O Amb27826305 [0,0,0,0,0,1|1,0,0]=2 1653 B9R0.7 CC(=O)CCC(Cl)C(C)=O Amb27444965 [0,0,0,0,0,1|3,0,0]=4 1654 B9R0.7 CC(=O)CCC(N)C(=O)O Amb20669473 [0,0,0,0,0,1|2,0,0]=3 1655 B9R0.7 CC(=O)CCC(N)C(=O)O Amb22157242 [0,0,0,0,0,1|2,0,0]=3 1656 B9R0.7 CC(=O)CCC(N)C(N)=O Amb26649117 [0,0,0,0,0,1|3,0,0]=4 1657 B9R0.7 CC(=O)CC[C@@H](N)C(=O)O Amb26516732 [0,0,0,0,0,1|2,0,0]=3 1658 B9R0.7 CC(=O)CC[C@H](N)C(=O)O Amb25147501 [0,0,0,0,0,1|2,0,0]=3 1659 B9R0.7 CC(=O)CNC(=O)C(=O)O Amb24480846 [0,0,0,0,0,1|1,0,2]=4 1660 B9R0.7 CC(=O)CSC(C)C(=O)O Amb17501621 [0,0,0,0,0,1|2,0,0]=3 1661 B9R0.7 CC(=O)CSC(C)C(N)=O Amb27949123 [0,0,0,0,0,1|3,0,0]=4 1662 B9R0.7 CC(=O)N(C)CCC(=O)O Amb2691290 [0,0,0,0,0,1|3,0,0]=4 1663 B9R0.7 CC(=O)N(O)CCC(=O)O Amb28050128 [0,0,0,0,0,1|2,0,0]=3 1664 B9R0.7 CC(=O)NCC(N)C(=O)O Amb26046380 [0,0,0,0,0,1|2,0,0]=3 1665 B9R0.7 CC(=O)NC[C@H](C)C(=O)O Amb27472985 [0,0,0,0,0,1|2,0,0]=3 1666 B9R0.7 CC(=O)OCC(C)C(=O)O Amb28050166 [0,0,0,0,0,1|2,0,0]=3 1667 B9R0.7 CC(=O)OCC(C)C(C)=O Amb27471984 [0,0,0,0,0,1|3,0,0]=4 1668 B9R0.7 CC(=O)OCC(N)C(=O)O Amb17593668 [0,0,0,0,0,1|2,0,0]=3 1669 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O Amb2699176 [0,0,0,0,0,1|2,0,0]=3 1670 B9R0.7 CC(=O)OC[C@@H]([NH3+])C(=O)O Amb3499386 [0,0,0,0,0,1|2,0,0]=3 1671 B9R0.7 CC(=O)OC[C@H](C)C(=O)O Amb28340504 [0,0,0,0,0,1|2,0,0]=3 1672 B9R0.7 CC(=O)OC[C@H](C)C(C)=O Amb28049898 [0,0,0,0,0,1|3,0,0]=4 1673 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb2778750 [0,0,0,0,0,1|2,0,0]=3 1674 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb33757552 [0,0,0,0,0,1|2,0,0]=3 1675 B9R0.7 CC(=O)ONC(C)C(=O)O Amb27765574 [0,0,0,0,0,1|3,0,0]=4 1676 B9R0.7 CC(=O)SCC(C)C(=O)O Amb2732386 [0,0,0,0,0,1|2,0,0]=3 1677 B9R0.7 CC(=O)SCC(C)C(N)=O Amb22586594 [0,0,0,0,0,1|3,0,0]=4 1678 B9R0.7 CC(=O)SCC(Cl)C(=O)Cl Amb28247162 [0,0,0,0,0,1|3,0,0]=4 1679 B9R0.7 CC(=O)SCC(N)C(=O)O Amb22490452 [0,0,0,0,0,1|2,0,0]=3 1680 B9R0.7 CC(=O)SCC(O)C(=O)O Amb31030973 [0,0,0,0,0,1|1,0,0]=2 1681 B9R0.7 CC(=O)SC[C@@H](C)C(=O)Cl Amb26641827 [0,0,0,0,0,1|3,0,0]=4 1682 B9R0.7 CC(=O)SC[C@@H](C)C(=O)O Amb8628177 [0,0,0,0,0,1|2,0,0]=3 1683 B9R0.7 CC(=O)SC[C@H](C)C(=O)Cl Amb25230202 [0,0,0,0,0,1|3,0,0]=4 1684 B9R0.7 CC(=O)[C@H](C)CCC(=O)O Amb24671283 [0,0,0,0,0,1|2,0,0]=3 1685 B9R0.7 CC(C)=CCC(C)C(=O)O Amb18643879 [0,0,0,0,0,1|3,0,0]=4 1686 B9R0.7 CC(C)=CCC(N)C(=O)O Amb6276273 [0,0,0,0,0,1|3,0,0]=4 1687 B9R0.7 CC(C)=CC[C@@H](N)C(=O)O Amb27254062 [0,0,0,0,0,1|3,0,0]=4 1688 B9R0.7 CC(C)=CC[C@H](N)C(=O)O Amb25836895 [0,0,0,0,0,1|3,0,0]=4 1689 B9R0.7 CC(C)C(O)CCC(=O)O Amb25252592 [0,0,0,0,0,1|2,0,1]=4 1690 B9R0.7 CC(C)CCC(O)C(=O)O Amb27788603 [0,0,0,0,0,1|2,0,1]=4 1691 B9R0.7 CC(C)OCC(O)C(=O)O Amb24583914 [0,0,0,0,0,1|2,0,1]=4 1692 B9R0.7 CC(C)[C@@H](O)CCC(=O)O Amb28314215 [0,0,0,0,0,1|2,0,1]=4 1693 B9R0.7 CC(CCC(=O)O)C(=O)O Amb6296609 [0,0,0,0,0,1|1,0,0]=2 1694 B9R0.7 CC(CCS(C)=O)C(=O)O Amb27237254 [0,0,0,0,0,1|3,0,0]=4 1695 B9R0.7 CC(CC[N+](=O)[O-])C(=O)O Amb27425087 [0,0,0,0,0,1|2,0,1]=4 1696 B9R0.7 CC(CNC(=N)N)C(=O)O Amb28050103 [0,0,0,0,0,1|3,0,0]=4 1697 B9R0.7 CC(CNC(N)=O)C(=O)O Amb18298054 [0,0,0,0,0,1|2,0,0]=3 1698 B9R0.7 CC(CSC(=N)N)C(=O)O Amb27392409 [0,0,0,0,0,1|3,0,0]=4 1699 B9R0.7 CC(N)C(O)CCC(=O)O Amb27881667 [0,0,0,0,0,1|2,0,1]=4 1700 B9R0.7 CC(N)CCC(O)C(=O)O Amb28436655 [0,0,0,0,0,1|2,0,1]=4 1701 B9R0.7 CC(NCC(=O)O)C(=O)O Amb26506272 [0,0,0,0,0,1|1,0,0]=2 1702 B9R0.7 CC(NCC(=O)O)C(=O)O Amb3427836 [0,0,0,0,0,1|1,0,0]=2 1703 B9R0.7 CC(NCC(=O)O)C(N)=O Amb9285399 [0,0,0,0,0,1|2,0,0]=3 1704 B9R0.7 CC(NC[C@@H](C)O)C(=O)O Amb27617222 [0,0,0,0,0,1|2,0,1]=4 1705 B9R0.7 CC(NC[C@H](C)O)C(=O)O Amb27248684 [0,0,0,0,0,1|2,0,1]=4 1706 B9R0.7 CC(NNC(N)=O)C(=O)O Amb26391983 [0,0,0,0,0,1|3,0,0]=4 1707 B9R0.7 CC(O)C(C)CCC(=O)O Amb27424805 [0,0,0,0,0,1|2,0,1]=4 1708 B9R0.7 CC(O)C(C)NCC(=O)O Amb27444950 [0,0,0,0,0,1|2,0,1]=4 1709 B9R0.7 CC(O)C(O)CCC(N)=O Amb28146727 [0,0,0,0,0,1|2,0,1]=4 1710 B9R0.7 CC(O)CCC(N)C(=O)O Amb26598749 [0,0,0,0,0,1|2,0,1]=4 1711 B9R0.7 CC(O)CC[C@@H](N)C(=O)O Amb28126862 [0,0,0,0,0,1|2,0,1]=4 1712 B9R0.7 CC(O)CC[C@H](N)C(=O)O Amb26346481 [0,0,0,0,0,1|2,0,1]=4 1713 B9R0.7 CC(O)CNC(C)C(=O)O Amb18523859 [0,0,0,0,0,1|2,0,1]=4 1714 B9R0.7 CC(O)CN[C@H](C)C(=O)O Amb28246243 [0,0,0,0,0,1|2,0,1]=4 1715 B9R0.7 CC(O)CO[C@@H](C)C(=O)O Amb27273395 [0,0,0,0,0,1|2,0,1]=4 1716 B9R0.7 CC(O)NC[C@H](N)C(=O)O Amb24575047 [0,0,0,0,0,1|2,0,1]=4 1717 B9R0.7 CC(O)OC[C@@H](N)C(=O)O Amb28348403 [0,0,0,0,0,1|2,0,1]=4 1718 B9R0.7 CC(SCC(=O)O)C(=O)O Amb2431034 [0,0,0,0,0,1|1,0,0]=2 1719 B9R0.7 CC(SCC(N)=O)C(N)=O Amb27184474 [0,0,0,0,0,1|3,0,0]=4 1720 B9R0.7 CN(C)CCC(O)C(=O)O Amb26847402 [0,0,0,0,0,1|3,0,0]=4 1721 B9R0.7 CN(CCC(=O)O)C(N)=O Amb18984979 [0,0,0,0,0,1|3,0,0]=4 1722 B9R0.7 CN(O)CC[C@H](N)C(=O)O Amb27640254 [0,0,0,0,0,1|3,0,0]=4 1723 B9R0.7 CS(=O)CCC(N)C(=O)O Amb6336322 [0,0,0,0,0,1|3,0,0]=4 1724 B9R0.7 CS(=O)CCC(O)C(=O)O Amb28118981 [0,0,0,0,0,1|2,0,0]=3 1725 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O Amb19133021 [0,0,0,0,0,1|3,0,0]=4 1726 B9R0.7 CS(=O)CC[C@H](N)C(=O)O Amb6600089 [0,0,0,0,0,1|3,0,0]=4 1727 B9R0.7 CS(=O)NCC(N)C(=O)O Amb28122995 [0,0,0,0,0,1|3,0,0]=4 1728 B9R0.7 C[C@@H](CCC(=O)O)C(=O)O Amb22799543 [0,0,0,0,0,1|1,0,0]=2 1729 B9R0.7 C[C@@H](CC[N+](=O)[O-])C(=O)O Amb24330210 [0,0,0,0,0,1|2,0,1]=4 1730 B9R0.7 C[C@@H](CNC(N)=O)C(=O)O Amb10844047 [0,0,0,0,0,1|2,0,0]=3 1731 B9R0.7 C[C@@H](F)[C@H](O)CCC(=O)O Amb28256347 [0,0,0,0,0,1|2,0,1]=4 1732 B9R0.7 C[C@@H](N)CC[C@@H](O)C(=O)O Amb27815031 [0,0,0,0,0,1|2,0,1]=4 1733 B9R0.7 C[C@@H](N)[C@@H](O)CCC(=O)O Amb27655533 [0,0,0,0,0,1|2,0,1]=4 1734 B9R0.7 C[C@@H](NCC(=O)O)C(=O)O Amb22748947 [0,0,0,0,0,1|1,0,0]=2 1735 B9R0.7 C[C@@H](O)[C@@H](O)\C=C\C(=O)O Amb28067737 [0,0,0,0,0,1|1,0,2]=4 1736 B9R0.7 C[C@@H](O)[C@H](O)CCC(=O)O Amb27628876 [0,0,0,0,0,1|1,0,1]=3 1737 B9R0.7 C[C@H](CCC(=O)O)C(=O)O Amb22225175 [0,0,0,0,0,1|1,0,0]=2 1738 B9R0.7 C[C@H](CC[N+](=O)[O-])C(=O)O Amb13883662 [0,0,0,0,0,1|2,0,1]=4 1739 B9R0.7 C[C@H](CNC(N)=O)C(=O)O Amb27235917 [0,0,0,0,0,1|2,0,0]=3 1740 B9R0.7 C[C@H](F)[C@H](O)CCC(=O)O Amb28126864 [0,0,0,0,0,1|2,0,1]=4 1741 B9R0.7 C[C@H](NCC(=O)O)C(=O)O Amb25133540 [0,0,0,0,0,1|1,0,0]=2 1742 B9R0.7 C[C@H](NCC(=O)O)C(=O)O Amb33803333 [0,0,0,0,0,1|1,0,0]=2 1743 B9R0.7 C[C@H](NCC(=O)O)C(N)=O Amb27771293 [0,0,0,0,0,1|2,0,0]=3 1744 B9R0.7 C[C@H](O)[C@H](N)CCC(=O)O Amb27217393 [0,0,0,0,0,1|2,0,1]=4 1745 B9R0.7 C[S+](C)CCC(O)C(=O)O Amb33482959 [0,0,0,0,0,1|3,0,0]=4 1746 B9R0.7 C\C(=C/CC(=O)O)C(=O)O Amb27214024 [0,0,0,0,0,1|1,0,1]=3 1747 B9R0.7 C\C(=C\CC(=O)O)C(=O)O Amb25960751 [0,0,0,0,0,1|1,0,1]=3 1748 B9R0.7 C\C(=N/CC(=O)O)C(=O)O Amb27759453 [0,0,0,0,0,1|1,0,1]=3 1749 B9R0.7 C\C(Cl)=C/CC(Cl)C(=O)O Amb27212547 [0,0,0,0,0,1|3,0,0]=4 1750 B9R0.7 C\C(Cl)=C\CC(Cl)C(=O)O Amb17594711 [0,0,0,0,0,1|3,0,0]=4 1751 B9R0.7 C\C(F)=C/C[C@H](N)C(=O)O Amb27205690 [0,0,0,0,0,1|3,0,0]=4 1752 B9R0.7 N=C(N)CCC(N)C(=O)O Amb28185146 [0,0,0,0,0,1|3,0,0]=4 1753 B9R0.7 N=C(N)NCC(N)C(=O)O Amb22169574 [0,0,0,0,0,1|3,0,0]=4 1754 B9R0.7 N=C(N)NCC(N)C(=O)O Amb9871390 [0,0,0,0,0,1|3,0,0]=4 1755 B9R0.7 N=C(N)NCC(O)C(=O)O Amb27229727 [0,0,0,0,0,1|2,0,0]=3 1756 B9R0.7 N=C(N)NC[C@@H](N)C(=O)O Amb28058768 [0,0,0,0,0,1|3,0,0]=4 1757 B9R0.7 N=C(N)NC[C@@H](N)C(=O)O Amb31292962 [0,0,0,0,0,1|3,0,0]=4 1758 B9R0.7 N=C(N)NC[C@H](N)C(=O)O Amb27230623 [0,0,0,0,0,1|3,0,0]=4 1759 B9R0.7 NC(=O)C(=O)NCC(=O)O Amb28050058 [0,0,0,0,0,1|1,0,2]=4 1760 B9R0.7 NC(=O)C(N)CCC(=O)O Amb18644256 [0,0,0,0,0,1|2,0,0]=3 1761 B9R0.7 NC(=O)CCC(=O)C(=O)O Amb26369364 [0,0,0,0,0,1|1,0,2]=4 1762 B9R0.7 NC(=O)CCC(Br)C(=O)O Amb27828829 [0,0,0,0,0,1|2,0,0]=3 1763 B9R0.7 NC(=O)CCC(N)C(=O)Cl Amb27793490 [0,0,0,0,0,1|3,0,0]=4 1764 B9R0.7 NC(=O)CCC(N)C(=O)O Amb9702792 [0,0,0,0,0,1|2,0,0]=3 1765 B9R0.7 NC(=O)CCC(N)C(N)=O Amb27175153 [0,0,0,0,0,1|3,0,0]=4 1766 B9R0.7 NC(=O)CCC(O)C(N)=O Amb28289307 [0,0,0,0,0,1|2,0,0]=3 1767 B9R0.7 NC(=O)CC[C@@H](Br)C(=O)O Amb28049993 [0,0,0,0,0,1|2,0,0]=3 1768 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O Amb2688618 [0,0,0,0,0,1|2,0,0]=3 1769 B9R0.7 NC(=O)CC[C@@H](N)C(N)=O Amb22748708 [0,0,0,0,0,1|3,0,0]=4 1770 B9R0.7 NC(=O)CC[C@@H](N)C(N)=O Amb25996678 [0,0,0,0,0,1|3,0,0]=4 1771 B9R0.7 NC(=O)CC[C@H](N)C(=O)O Amb6600045 [0,0,0,0,0,1|2,0,0]=3 1772 B9R0.7 NC(=O)CC[C@H](N)C(N)=O Amb24426852 [0,0,0,0,0,1|3,0,0]=4 1773 B9R0.7 NC(=O)CC[C@H](N)C(N)=O Amb33774694 [0,0,0,0,0,1|3,0,0]=4 1774 B9R0.7 NC(=O)CNC(=O)C(=O)O Amb9303805 [0,0,0,0,0,1|1,0,2]=4 1775 B9R0.7 NC(=O)NCC(F)C(=O)O Amb17610485 [0,0,0,0,0,1|2,0,0]=3 1776 B9R0.7 NC(=O)NCC(N)C(=O)O Amb4037018 [0,0,0,0,0,1|2,0,0]=3 1777 B9R0.7 NC(=O)NCC(N)C(N)=O Amb27646620 [0,0,0,0,0,1|3,0,0]=4 1778 B9R0.7 NC(=O)NCC(O)C(=O)O Amb27464106 [0,0,0,0,0,1|1,0,0]=2 1779 B9R0.7 NC(=O)NCC(O)C(N)=O Amb28384014 [0,0,0,0,0,1|2,0,0]=3 1780 B9R0.7 NC(=O)NC[C@@H](N)C(=O)O Amb10068479 [0,0,0,0,0,1|2,0,0]=3 1781 B9R0.7 NC(=O)NC[C@H](N)C(=O)O Amb6298794 [0,0,0,0,0,1|2,0,0]=3 1782 B9R0.7 NC(=O)OCC(N)C(=O)O Amb26968173 [0,0,0,0,0,1|2,0,0]=3 1783 B9R0.7 NC(=O)OC[C@H](N)C(=O)O Amb28126945 [0,0,0,0,0,1|2,0,0]=3 1784 B9R0.7 NC(=O)SCC(N)C(=O)O Amb3993051 [0,0,0,0,0,1|2,0,0]=3 1785 B9R0.7 NC(=O)SC[C@@H](N)C(=O)O Amb10072293 [0,0,0,0,0,1|2,0,0]=3 1786 B9R0.7 NC(=O)SC[C@H](N)C(=O)O Amb22735296 [0,0,0,0,0,1|2,0,0]=3 1787 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O Amb22745051 [0,0,0,0,0,1|2,0,0]=3 1788 B9R0.7 NC(=O)[C@H](N)CCC(=O)O Amb24557281 [0,0,0,0,0,1|2,0,0]=3 1789 B9R0.7 NC(=S)CCC(N)C(=O)O Amb27448533 [0,0,0,0,0,1|2,1,0]=4 1790 B9R0.7 NC(=S)CC[C@H](N)C(=O)O Amb27640783 [0,0,0,0,0,1|2,1,0]=4 1791 B9R0.7 NC(CC=C(Cl)Cl)C(=O)O Amb28239821 [0,0,0,0,0,1|3,0,0]=4 1792 B9R0.7 NC(CCB(O)O)C(=O)O Amb22497480 [0,0,0,0,0,1|2,0,1]=4 1793 B9R0.7 NC(CCC(=O)Cl)C(=O)O Amb27816376 [0,0,0,0,0,1|2,0,0]=3 1794 B9R0.7 NC(CCC(=O)O)B(O)O Amb26983348 [0,0,0,0,0,1|2,0,1]=4 1795 B9R0.7 NC(CCC(=O)O)C(=O)O Amb8395158 [0,0,0,0,0,1|1,0,0]=2 1796 B9R0.7 NC(CCC(=O)O)C(=O)O Amb9703098 [0,0,0,0,0,1|1,0,0]=2 1797 B9R0.7 NC(CCC(=O)O)C(=O)[O-] Amb4014785 [0,0,0,0,0,1|1,0,1]=3 1798 B9R0.7 NC(CC[N+](=O)[O-])C(=O)O Amb27221965 [0,0,0,0,0,1|2,0,1]=4 1799 B9R0.7 NC(CN[N+](=O)[O-])C(=O)O Amb27857570 [0,0,0,0,0,1|2,0,1]=4 1800 B9R0.7 NC(CSC(=O)O)C(=O)O Amb27491502 [0,0,0,0,0,1|1,0,0]=2 1801 B9R0.7 N[C@@H](CC=C(Cl)Cl)C(=O)O Amb29866596 [0,0,0,0,0,1|3,0,0]=4 1802 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb34915082 [0,0,0,0,0,1|1,0,0]=2 1803 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb3940322 [0,0,0,0,0,1|1,0,0]=2 1804 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb8513626 [0,0,0,0,0,1|1,0,0]=2 1805 B9R0.7 N[C@@H](CCC(=O)O)C(=O)[O-] Amb22745619 [0,0,0,0,0,1|1,0,1]=3 1806 B9R0.7 N[C@@H](CCC(O)=S)C(=O)O Amb24480492 [0,0,0,0,0,1|1,1,0]=3 1807 B9R0.7 N[C@@H](CCS(=O)O)C(=O)O Amb25972325 [0,0,0,0,0,1|2,0,0]=3 1808 B9R0.7 N[C@@H](CC[PH](=O)O)C(=O)O Amb22904307 [0,0,0,0,0,1|2,0,0]=3 1809 B9R0.7 N[C@@H](CO[N+](=O)[O-])C(=O)O Amb27793180 [0,0,0,0,0,1|2,0,1]=4 1810 B9R0.7 N[C@@H](CSC(=O)O)C(=O)O Amb27666945 [0,0,0,0,0,1|1,0,0]=2 1811 B9R0.7 N[C@H](CC=C(Cl)Cl)C(=O)O Amb29866643 [0,0,0,0,0,1|3,0,0]=4 1812 B9R0.7 N[C@H](CCC(=O)O)C(=O)O Amb2720565 [0,0,0,0,0,1|1,0,0]=2 1813 B9R0.7 O=C(Cl)SCC(=O)C(=O)O Amb33070040 [0,0,0,0,0,1|1,0,2]=4 1814 B9R0.7 O=C(O)CCC(=O)C(=O)O Amb1154117 [0,0,0,0,0,1|0,0,2]=3 1815 B9R0.7 O=C(O)CCC(=O)C(=O)O Amb16232496 [0,0,0,0,0,1|0,0,2]=3 1816 B9R0.7 O=C(O)CCC(=O)C(=O)O Amb22746233 [0,0,0,0,0,1|0,0,2]=3 1817 B9R0.7 O=C(O)CCC(Br)C(=O)O Amb26568399 [0,0,0,0,0,1|1,0,0]=2 1818 B9R0.7 O=C(O)CCC(Cl)C(=O)O Amb17594149 [0,0,0,0,0,1|1,0,0]=2 1819 B9R0.7 O=C(O)CCC(O)C(=O)O Amb18124864 [0,0,0,0,0,1|0,0,0]=1 1820 B9R0.7 O=C(O)CCC(S)C(=O)O Amb27983646 [0,0,0,0,0,1|0,1,0]=2 1821 B9R0.7 O=C(O)CC[C@@H](O)C(=O)O Amb22799690 [0,0,0,0,0,1|0,0,0]=1 1822 B9R0.7 O=C(O)CC[C@H](Br)C(=O)O Amb26885416 [0,0,0,0,0,1|1,0,0]=2 1823 B9R0.7 O=C(O)CC[C@H](Cl)C(=O)O Amb26590823 [0,0,0,0,0,1|1,0,0]=2 1824 B9R0.7 O=C(O)CC[C@H](O)C(=O)O Amb25948742 [0,0,0,0,0,1|0,0,0]=1 1825 B9R0.7 O=C(O)CNC(=O)C(=O)O Amb2447304 [0,0,0,0,0,1|0,0,2]=3 1826 B9R0.7 O=C(O)COC(=O)C(=O)O Amb28050116 [0,0,0,0,0,1|0,0,2]=3 1827 B9R0.7 O=C(O)C\C=C(/Cl)C(=O)O Amb27863082 [0,0,0,0,0,1|1,0,1]=3 1828 B9R0.7 O=C(O)[C@H](O)CO[PH](=O)O Amb27955235 [0,0,0,0,0,1|1,0,0]=2 1829 B9R0.7 O=C(O)\C=C\C(=O)C(=O)O Amb27214257 [0,0,0,0,0,1|0,0,3]=4 1830 B9R0.7 O=C([O-])CCC(=O)C(=O)O Amb22231405 [0,0,0,0,0,1|0,0,3]=4 1831 B9R0.7 O=C([O-])CC[C@@H](O)C(=O)[O-] Amb17615399 [0,0,0,0,0,1|0,0,2]=3 1832 B9R0.53 C=C(C)CC(N)CC(=O)O Amb32687894 [0,0,0,0,0,1|3,0,0]=4 1833 B9R0.53 CC(=O)CC(C)OC(N)=O Amb27196213 [0,0,0,0,0,1|3,0,0]=4 1834 B9R0.53 CC(=O)CC(O)CC(C)O Amb28202187 [0,0,0,0,0,1|2,0,1]=4 1835 B9R0.53 CC(=O)C[C@@H](C)CC(=O)O Amb27881969 [0,0,0,0,0,1|2,0,0]=3 1836 B9R0.53 CC(=O)C[C@H](C)OC(C)=O Amb25863249 [0,0,0,0,0,1|3,0,0]=4 1837 B9R0.53 CC(=O)C[C@H](O)C[C@@H](C)O Amb27973069 [0,0,0,0,0,1|2,0,1]=4 1838 B9R0.53 CC(=O)NC(=O)CC(=O)O Amb24671240 [0,0,0,0,0,1|1,0,2]=4 1839 B9R0.53 CC(=O)NC(C)CC(=O)O Amb9007551 [0,0,0,0,0,1|2,0,0]=3 1840 B9R0.53 CC(=O)NC(C)CC(N)=O Amb27454423 [0,0,0,0,0,1|3,0,0]=4 1841 B9R0.53 CC(=O)NN(C)CC(=O)O Amb24430379 [0,0,0,0,0,1|3,0,0]=4 1842 B9R0.53 CC(=O)N[C@@H](C)CC(=O)O Amb2372568 [0,0,0,0,0,1|2,0,0]=3 1843 B9R0.53 CC(=O)O[C@@H](C)CC(=O)O Amb28340506 [0,0,0,0,0,1|2,0,0]=3 1844 B9R0.53 CC(=O)SC(C)CC(=O)O Amb4014288 [0,0,0,0,0,1|2,0,0]=3 1845 B9R0.53 CC(=O)\C=C(/O)CC(C)=O Amb27945526 [0,0,0,0,0,1|2,0,1]=4 1846 B9R0.53 CC(C)CC(O)CC(=O)O Amb17232005 [0,0,0,0,0,1|2,0,1]=4 1847 B9R0.53 CC(C)C[C@@H](O)CC(=O)O Amb28050162 [0,0,0,0,0,1|2,0,1]=4 1848 B9R0.53 CC(C)C[C@H](O)CC(=O)O Amb24505145 [0,0,0,0,0,1|2,0,1]=4 1849 B9R0.53 CC(CC(=O)Cl)CC(=O)Cl Amb28076995 [0,0,0,0,0,1|3,0,0]=4 1850 B9R0.53 CC(CC(=O)O)CC(=O)O Amb2782854 [0,0,0,0,0,1|1,0,0]=2 1851 B9R0.53 CC(CC(=O)O)NC(=N)N Amb25696242 [0,0,0,0,0,1|3,0,0]=4 1852 B9R0.53 CC(CC(=O)O)NC(N)=O Amb9018480 [0,0,0,0,0,1|2,0,0]=3 1853 B9R0.53 CC(CC(N)=O)CC(N)=O Amb4020693 [0,0,0,0,0,1|3,0,0]=4 1854 B9R0.53 CN(C)CC(O)CC(=O)O Amb4477325 [0,0,0,0,0,1|3,0,0]=4 1855 B9R0.53 CN(C)C[C@H](O)CC(=O)O Amb10069803 [0,0,0,0,0,1|3,0,0]=4 1856 B9R0.53 CN(CC(=O)O)CC(=O)O Amb1156001 [0,0,0,0,0,1|2,0,0]=3 1857 B9R0.53 CS(=O)C[C@H](N)CC(=O)O Amb27776743 [0,0,0,0,0,1|3,0,0]=4 1858 B9R0.53 C[C@@H](CC(N)=O)CC(=O)O Amb27404517 [0,0,0,0,0,1|2,0,0]=3 1859 B9R0.53 C\C(=C/C(=O)O)CC(=O)O Amb24556420 [0,0,0,0,0,1|1,0,1]=3 1860 B9R0.53 C\C(=C\C(=O)O)CC(=O)O Amb26421861 [0,0,0,0,0,1|1,0,1]=3 1861 B9R0.53 NC(=O)CC(N)CC(=O)O Amb27837998 [0,0,0,0,0,1|2,0,0]=3 1862 B9R0.53 NC(=O)CC(O)CC(N)=O Amb27203532 [0,0,0,0,0,1|2,0,0]=3 1863 B9R0.53 NC(=O)C[C@@H](N)CC(=O)O Amb26023970 [0,0,0,0,0,1|2,0,0]=3 1864 B9R0.53 NC(=O)NC(=O)CC(=O)O Amb25887627 [0,0,0,0,0,1|1,0,2]=4 1865 B9R0.53 NC(CC(=O)O)CC(=O)O Amb16184013 [0,0,0,0,0,1|1,0,0]=2 1866 B9R0.53 NC(CC(=O)O)CC(=O)O Amb6296966 [0,0,0,0,0,1|1,0,0]=2 1867 B9R0.53 NN(CC(=O)O)CC(=O)O Amb534841 [0,0,0,0,0,1|2,0,0]=3 1868 B9R0.53 O=C(Cl)CC(Cl)CC(=O)Cl Amb27390104 [0,0,0,0,0,1|3,0,0]=4 1869 B9R0.53 O=C(O)CC(=O)CC(=O)O Amb6298323 [0,0,0,0,0,1|0,0,2]=3 1870 B9R0.53 O=C(O)CC(Br)CC(=O)O Amb28049987 [0,0,0,0,0,1|1,0,0]=2 1871 B9R0.53 O=C(O)CC(O)CC(=O)O Amb17615401 [0,0,0,0,0,1|0,0,0]=1 1872 B9R0.53 O=C(O)CS(=O)CC(=O)O Amb6364793 [0,0,0,0,0,1|1,0,1]=3 1873 B9R0.53 O=C(O)\C=C(\Cl)CC(=O)O Amb2612119 [0,0,0,0,0,1|1,0,1]=3 1874 B9R0.53 [NH3+]N(CC(=O)O)CC(=O)O Amb23453377 [0,0,0,0,0,1|2,0,0]=3 1875 B6R0.1 C#CCC(O)C=O Amb27838261 [2,0,0,0,0,0|1,0,1]=4 1876 B6R0.1 C=CC(C)CC=O Amb18120863 [2,0,0,0,0,0|2,0,0]=4 1877 B6R0.1 C=CC(O)CC=O Amb27401128 [2,0,0,0,0,0|1,0,0]=3 1878 B6R0.1 C=CC(O)CCO Amb27978087 [2,0,0,0,0,0|1,0,1]=4 1879 B6R0.1 C=CCC(C)C=O Amb4358618 [2,0,0,0,0,0|2,0,0]=4 1880 B6R0.1 C=CCC(O)C=C Amb8513481 [2,0,0,0,0,0|2,0,0]=4 1881 B6R0.1 C=CC[C@@H](O)C=C Amb27636288 [2,0,0,0,0,0|2,0,0]=4 1882 B6R0.1 C=CC[C@@H](O)CO Amb27218592 [2,0,0,0,0,0|1,0,1]=4 1883 B6R0.1 C=CC[C@H](C)C=O Amb28050198 [2,0,0,0,0,0|2,0,0]=4 1884 B6R0.1 C=CC[C@H](I)C=O Amb28042873 [2,0,0,0,0,0|2,0,0]=4 1885 B6R0.1 C=CC[C@H](O)CO Amb27632867 [2,0,0,0,0,0|1,0,1]=4 1886 B6R0.1 C=C[C@@H](O)CCO Amb28318694 [2,0,0,0,0,0|1,0,1]=4 1887 B6R0.1 C=C[C@H](C)CC=O Amb28252390 [2,0,0,0,0,0|2,0,0]=4 1888 B6R0.1 CC(C=O)CCO Amb28208492 [2,0,0,0,0,0|1,0,1]=4 1889 B6R0.1 CCC(O)CC=O Amb27268436 [2,0,0,0,0,0|1,0,1]=4 1890 B6R0.1 CC[C@@H](O)CC=O Amb28287324 [2,0,0,0,0,0|1,0,1]=4 1891 B6R0.1 COC[C@@H](O)C=O Amb28132745 [2,0,0,0,0,0|2,0,0]=4 1892 B6R0.1 COC[C@H](O)C=O Amb27838256 [2,0,0,0,0,0|2,0,0]=4 1893 B6R0.1 CSCC(O)C=O Amb27438538 [2,0,0,0,0,0|2,0,0]=4 1894 B6R0.1 C[C@@H](C=O)CCO Amb27394744 [2,0,0,0,0,0|1,0,1]=4 1895 B6R0.1 C[C@@H](CO)CC=O Amb27227155 [2,0,0,0,0,0|1,0,1]=4 1896 B6R0.1 C[C@H](C=O)CCO Amb27260814 [2,0,0,0,0,0|1,0,1]=4 1897 B6R0.1 N#CCC(O)C=O Amb28370523 [2,0,0,0,0,0|1,0,1]=4 1898 B6R0.1 NC(C=O)CC=O Amb27872844 [2,0,0,0,0,0|1,0,0]=3 1899 B6R0.1 NCCC(O)C=O Amb25682881 [2,0,0,0,0,0|1,0,1]=4 1900 B6R0.1 O=CC(Br)CCO Amb28206552 [2,0,0,0,0,0|1,0,1]=4 1901 B6R0.1 O=CC(O)CCBr Amb27838276 [2,0,0,0,0,0|1,0,1]=4 1902 B6R0.1 O=CC(O)CCO Amb27955546 [2,0,0,0,0,0|0,0,1]=3 1903 B6R0.1 O=CCC(O)C=O Amb28071061 [2,0,0,0,0,0|0,0,0]=2 1904 B6R0.1 O=C[C@H](O)CCBr Amb28399793 [2,0,0,0,0,0|1,0,1]=4 1905 B6R0.1 OCC(O)CSO Amb28455081 [2,0,0,0,0,0|1,0,1]=4 1906 B6R0.1 OCCC(O)CO Amb6608827 [2,0,0,0,0,0|0,0,2]=4 1907 B6R0.1 OCC[C@@H](O)CO Amb10071064 [2,0,0,0,0,0|0,0,2]=4 1908 B6R0.1 OCC[C@H](O)CO Amb8386061 [2,0,0,0,0,0|0,0,2]=4 1909 B6R0.2 C=C(C)CC(=O)O Amb6278832 [2,0,0,0,0,0|1,0,1]=4 1910 B6R0.2 C=C(Cl)CC(=O)O Amb28118668 [2,0,0,0,0,0|1,0,1]=4 1911 B6R0.2 C=C(I)CC(=O)O Amb27598435 [2,0,0,0,0,0|1,0,1]=4 1912 B6R0.2 CC(=O)CC(=O)O Amb377432 [2,0,0,0,0,0|1,0,1]=4 1913 B6R0.2 CC(=O)CC(C)O Amb17593091 [2,0,0,0,0,0|1,0,1]=4 1914 B6R0.2 CC(=O)C[PH](=O)O Amb27975190 [2,0,0,0,0,0|2,0,0]=4 1915 B6R0.2 CC(Br)CC(=O)O Amb8517108 [2,0,0,0,0,0|1,0,1]=4 1916 B6R0.2 CC(C)CC(=O)O Amb3939848 [2,0,0,0,0,0|1,0,1]=4 1917 B6R0.2 CC(Cl)CC(=O)O Amb3940607 [2,0,0,0,0,0|1,0,1]=4 1918 B6R0.2 CC(I)CC(=O)O Amb28398380 [2,0,0,0,0,0|1,0,1]=4 1919 B6R0.2 CC(N)CC(=O)O Amb8379759 [2,0,0,0,0,0|1,0,1]=4 1920 B6R0.2 CC(O)CC(=O)O Amb8513187 [2,0,0,0,0,0|0,0,1]=3 1921 B6R0.2 CC(O)CC(=O)[O-] Amb2725536 [2,0,0,0,0,0|0,0,2]=4 1922 B6R0.2 CC(O)CC(N)=O Amb26394320 [2,0,0,0,0,0|1,0,1]=4 1923 B6R0.2 CC(S)CC(=O)O Amb33538201 [2,0,0,0,0,0|0,1,1]=4 1924 B6R0.2 CN(O)CC(=O)O Amb29838290 [2,0,0,0,0,0|1,0,1]=4 1925 B6R0.2 C[C@@H](Br)CC(=O)O Amb27637683 [2,0,0,0,0,0|1,0,1]=4 1926 B6R0.2 C[C@@H](Cl)CC(=O)O Amb27851223 [2,0,0,0,0,0|1,0,1]=4 1927 B6R0.2 C[C@@H](N)CC(=O)O Amb16184009 [2,0,0,0,0,0|1,0,1]=4 1928 B6R0.2 C[C@@H](N)CC(=O)O Amb8397201 [2,0,0,0,0,0|1,0,1]=4 1929 B6R0.2 C[C@@H](O)CC(=O)O Amb4166322 [2,0,0,0,0,0|0,0,1]=3 1930 B6R0.2 C[C@@H](O)CC(=O)[O-] Amb8470924 [2,0,0,0,0,0|0,0,2]=4 1931 B6R0.2 C[C@H](Br)CC(=O)O Amb24432019 [2,0,0,0,0,0|1,0,1]=4 1932 B6R0.2 C[C@H](N)CC(=O)O Amb16184012 [2,0,0,0,0,0|1,0,1]=4 1933 B6R0.2 C[C@H](N)CC(=O)O Amb8397200 [2,0,0,0,0,0|1,0,1]=4 1934 B6R0.2 C[C@H](O)CC(=O)O Amb22232025 [2,0,0,0,0,0|0,0,1]=3 1935 B6R0.2 NC(=O)CC(=O)O Amb4034884 [2,0,0,0,0,0|1,0,1]=4 1936 B6R0.2 NC(S)CC(=O)O Amb27391244 [2,0,0,0,0,0|1,1,0]=4 1937 B6R0.2 O=C(O)CB(O)O Amb24053058 [2,0,0,0,0,0|1,0,0]=3 1938 B6R0.2 O=C(O)CC(=O)Cl Amb26946943 [2,0,0,0,0,0|1,0,1]=4 1939 B6R0.2 O=C(O)CC(=O)O Amb2689065 [2,0,0,0,0,0|0,0,1]=3 1940 B6R0.2 O=C(O)CC(Cl)Cl Amb27815068 [2,0,0,0,0,0|2,0,0]=4 1941 B6R0.2 O=C(O)CC(F)F Amb22001551 [2,0,0,0,0,0|2,0,0]=4 1942 B6R0.2 O=C(O)CS(=O)O Amb27788997 [2,0,0,0,0,0|1,0,0]=3 1943 B6R0.2 OC(O)CC(O)O Amb27632053 [2,0,0,0,0,0|0,0,2]=4 1944 B6R0.4 C#CCCC(=O)O Amb33532622 [2,0,0,0,0,0|1,0,1]=4 1945 B6R0.4 C=CCCC(=O)Cl Amb3939003 [2,0,0,0,0,0|2,0,0]=4 1946 B6R0.4 C=CCCC(=O)O Amb3940112 [2,0,0,0,0,0|1,0,0]=3 1947 B6R0.4 C=CCCC(C)=O Amb2721704 [2,0,0,0,0,0|2,0,0]=4 1948 B6R0.4 C=CCCC(N)=O Amb28136349 [2,0,0,0,0,0|2,0,0]=4 1949 B6R0.4 C=CNCC(=O)O Amb28346027 [2,0,0,0,0,0|2,0,0]=4 1950 B6R0.4 C=COCC(=O)O Amb27247261 [2,0,0,0,0,0|2,0,0]=4 1951 B6R0.4 CC(=O)CCC=O Amb18639597 [2,0,0,0,0,0|1,0,0]=3 1952 B6R0.4 CC(=O)CCCO Amb3940340 [2,0,0,0,0,0|1,0,1]=4 1953 B6R0.4 CC(=O)NCC=O Amb25757509 [2,0,0,0,0,0|2,0,0]=4 1954 B6R0.4 CC(=O)SCC=O Amb27873378 [2,0,0,0,0,0|2,0,0]=4 1955 B6R0.4 CC(O)CCC=O Amb17593090 [2,0,0,0,0,0|1,0,1]=4 1956 B6R0.4 CCCCC(=O)O Amb3939877 [2,0,0,0,0,0|1,0,1]=4 1957 B6R0.4 CNCCC(=O)O Amb10609760 [2,0,0,0,0,0|2,0,0]=4 1958 B6R0.4 CNCCC(=O)O Amb7766400 [2,0,0,0,0,0|2,0,0]=4 1959 B6R0.4 COCCC(=O)O Amb3938990 [2,0,0,0,0,0|2,0,0]=4 1960 B6R0.4 CSCCC(=O)O Amb3939879 [2,0,0,0,0,0|2,0,0]=4 1961 B6R0.4 C[C@H](O)CCC=O Amb27188424 [2,0,0,0,0,0|1,0,1]=4 1962 B6R0.4 C\C=C\CC(=O)O Amb3941538 [2,0,0,0,0,0|1,0,1]=4 1963 B6R0.4 N#CCCC(=O)O Amb2694975 [2,0,0,0,0,0|1,0,1]=4 1964 B6R0.4 N=CNCC(=O)O Amb24670244 [2,0,0,0,0,0|2,0,0]=4 1965 B6R0.4 NC(=O)CCCO Amb20623438 [2,0,0,0,0,0|1,0,1]=4 1966 B6R0.4 NCCCC(=O)O Amb1935210 [2,0,0,0,0,0|1,0,1]=4 1967 B6R0.4 NNCCC(=O)O Amb33756816 [2,0,0,0,0,0|2,0,0]=4 1968 B6R0.4 NOCCC(=O)O Amb17569891 [2,0,0,0,0,0|2,0,0]=4 1969 B6R0.4 NOCCC(=O)O Amb32693437 [2,0,0,0,0,0|2,0,0]=4 1970 B6R0.4 O=C(O)CCCBr Amb8393276 [2,0,0,0,0,0|1,0,1]=4 1971 B6R0.4 O=C(O)CCCCl Amb3940333 [2,0,0,0,0,0|1,0,1]=4 1972 B6R0.4 O=C(O)CCCF Amb17593104 [2,0,0,0,0,0|1,0,1]=4 1973 B6R0.4 O=C(O)CCCI Amb22295911 [2,0,0,0,0,0|1,0,1]=4 1974 B6R0.4 O=C(O)CCCO Amb18640332 [2,0,0,0,0,0|0,0,1]=3 1975 B6R0.4 O=C(O)CCCS Amb16185429 [2,0,0,0,0,0|0,1,1]=4 1976 B6R0.4 O=C(O)CCNO Amb28067767 [2,0,0,0,0,0|1,0,0]=3 1977 B6R0.4 O=C(O)CCSCl Amb28387511 [2,0,0,0,0,0|2,0,0]=4 1978 B6R0.4 O=C(O)CPCO Amb28340565 [2,0,0,0,0,0|1,0,1]=4 1979 B6R0.4 O=C(O)C\C=C/Br Amb27483815 [2,0,0,0,0,0|1,0,1]=4 1980 B6R0.4 O=C(O)C\C=C\Cl Amb25111871 [2,0,0,0,0,0|1,0,1]=4 1981 B6R0.4 O=C([O-])CCCO Amb3429667 [2,0,0,0,0,0|0,0,2]=4 1982 B6R0.4 O=CCCC(=O)O Amb17673897 [2,0,0,0,0,0|0,0,0]=2 1983 B6R0.4 O=CCCC(O)O Amb27838257 [2,0,0,0,0,0|0,0,2]=4 1984 B6R0.4 O=CCC[N+](=O)[O-] Amb24052990 [2,0,0,0,0,0|1,0,1]=4 1985 B6R0.4 O=CNCC(=O)O Amb1911508 [2,0,0,0,0,0|1,0,0]=3 1986 B6R0.4 O=COCC(=O)O Amb26624011 [2,0,0,0,0,0|1,0,0]=3 1987 B6R0.4 O=C\C=C/C(=O)O Amb26023446 [2,0,0,0,0,0|0,0,2]=4 1988 B6R0.4 O=[PH](O)CCCO Amb28345330 [2,0,0,0,0,0|1,0,1]=4 1989 B6R0.3 C#CC(O)C(=O)O Amb22731622 [2,0,0,0,0,0|0,0,2]=4 1990 B6R0.3 C=C(C)C(O)CO Amb23570510 [2,0,0,0,0,0|2,0,0]=4 1991 B6R0.3 C=C(CO)C(=O)O Amb18121817 [2,0,0,0,0,0|1,0,1]=4 1992 B6R0.3 C=CC(C)C(=O)O Amb21618706 [2,0,0,0,0,0|1,0,1]=4 1993 B6R0.3 C=CC(Cl)C(=O)O Amb27216715 [2,0,0,0,0,0|1,0,1]=4 1994 B6R0.3 C=CC(N)C(=O)O Amb20240543 [2,0,0,0,0,0|1,0,1]=4 1995 B6R0.3 C=CC(O)C(=O)O Amb24061247 [2,0,0,0,0,0|0,0,1]=3 1996 B6R0.3 C=CC(O)C(C)=O Amb27838239 [2,0,0,0,0,0|1,0,1]=4 1997 B6R0.3 C=CC(O)C(N)=O Amb27391902 [2,0,0,0,0,0|1,0,1]=4 1998 B6R0.3 C=CC(S)C(=O)O Amb28069741 [2,0,0,0,0,0|0,1,1]=4 1999 B6R0.3 C=C[C@@H](C)C(=O)O Amb26350417 [2,0,0,0,0,0|1,0,1]=4 2000 B6R0.3 C=C[C@@H](N)C(=O)O Amb22756048 [2,0,0,0,0,0|1,0,1]=4 2001 B6R0.3 C=C[C@H](C)C(=O)O Amb25929549 [2,0,0,0,0,0|1,0,1]=4 2002 B6R0.3 C=C[C@H](N)C(=O)O Amb2699113 [2,0,0,0,0,0|1,0,1]=4 2003 B6R0.3 C=C[C@H](O)C(N)=O Amb28282656 [2,0,0,0,0,0|1,0,1]=4 2004 B6R0.3 CC(=O)C(Br)C=O Amb17232509 [2,0,0,0,0,0|2,0,0]=4 2005 B6R0.3 CC(=O)C(C)C=O Amb18639572 [2,0,0,0,0,0|2,0,0]=4 2006 B6R0.3 CC(=O)C(C)CO Amb10844844 [2,0,0,0,0,0|2,0,0]=4 2007 B6R0.3 CC(=O)C(Cl)C=O Amb28137911 [2,0,0,0,0,0|2,0,0]=4 2008 B6R0.3 CC(=O)C(O)CO Amb26463044 [2,0,0,0,0,0|1,0,0]=3 2009 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [2,0,0,0,0,0|1,0,0]=3 2010 B6R0.3 CC(=O)[C@H](N)CO Amb27451047 [2,0,0,0,0,0|2,0,0]=4 2011 B6R0.3 CC(C=O)C(=O)O Amb27784775 [2,0,0,0,0,0|1,0,0]=3 2012 B6R0.3 CC(C=O)C(=O)[Na] Amb27439065 [2,0,0,0,0,0|2,0,0]=4 2013 B6R0.3 CC(CBr)C(=O)O Amb22002601 [2,0,0,0,0,0|2,0,0]=4 2014 B6R0.3 CC(CCl)C(=O)O Amb18522181 [2,0,0,0,0,0|2,0,0]=4 2015 B6R0.3 CC(CF)C(=O)O Amb24432331 [2,0,0,0,0,0|2,0,0]=4 2016 B6R0.3 CC(CN)C(=O)O Amb2699128 [2,0,0,0,0,0|2,0,0]=4 2017 B6R0.3 CC(CN)C(=O)O Amb6773978 [2,0,0,0,0,0|2,0,0]=4 2018 B6R0.3 CC(CN)C(=O)O Amb8631418 [2,0,0,0,0,0|2,0,0]=4 2019 B6R0.3 CC(CO)C(=O)O Amb8011522 [2,0,0,0,0,0|1,0,0]=3 2020 B6R0.3 CC(O)C(O)CO Amb22227692 [2,0,0,0,0,0|1,0,1]=4 2021 B6R0.3 CCC(Br)C(=O)O Amb5716858 [2,0,0,0,0,0|1,0,1]=4 2022 B6R0.3 CCC(C)C(=O)O Amb9703224 [2,0,0,0,0,0|1,0,1]=4 2023 B6R0.3 CCC(Cl)C(=O)O Amb4017887 [2,0,0,0,0,0|1,0,1]=4 2024 B6R0.3 CCC(F)C(=O)O Amb25716167 [2,0,0,0,0,0|1,0,1]=4 2025 B6R0.3 CCC(N)C(=O)O Amb9729506 [2,0,0,0,0,0|1,0,1]=4 2026 B6R0.3 CCC(O)C(=O)O Amb6609018 [2,0,0,0,0,0|0,0,1]=3 2027 B6R0.3 CCC(O)C(=O)[O-] Amb17943026 [2,0,0,0,0,0|0,0,2]=4 2028 B6R0.3 CCC(O)C(C)=O Amb25336501 [2,0,0,0,0,0|1,0,1]=4 2029 B6R0.3 CCC(O)C(N)=O Amb24116514 [2,0,0,0,0,0|1,0,1]=4 2030 B6R0.3 CCC(S)C(=O)O Amb17501370 [2,0,0,0,0,0|0,1,1]=4 2031 B6R0.3 CC[C@@H](Br)C(=O)O Amb9785161 [2,0,0,0,0,0|1,0,1]=4 2032 B6R0.3 CC[C@@H](C)C(=O)O Amb8384578 [2,0,0,0,0,0|1,0,1]=4 2033 B6R0.3 CC[C@@H](Cl)C(=O)O Amb22800493 [2,0,0,0,0,0|1,0,1]=4 2034 B6R0.3 CC[C@@H](N)C(=O)O Amb16233349 [2,0,0,0,0,0|1,0,1]=4 2035 B6R0.3 CC[C@@H](N)C(=O)O Amb3940761 [2,0,0,0,0,0|1,0,1]=4 2036 B6R0.3 CC[C@@H](O)C(=O)O Amb22369401 [2,0,0,0,0,0|0,0,1]=3 2037 B6R0.3 CC[C@@H](O)C(N)=O Amb27792606 [2,0,0,0,0,0|1,0,1]=4 2038 B6R0.3 CC[C@H](Br)C(=O)O Amb20242441 [2,0,0,0,0,0|1,0,1]=4 2039 B6R0.3 CC[C@H](C)C(=O)O Amb8514667 [2,0,0,0,0,0|1,0,1]=4 2040 B6R0.3 CC[C@H](Cl)C(=O)O Amb25190040 [2,0,0,0,0,0|1,0,1]=4 2041 B6R0.3 CC[C@H](N)C(=O)O Amb2694208 [2,0,0,0,0,0|1,0,1]=4 2042 B6R0.3 CC[C@H](N)C(=O)O Amb8631089 [2,0,0,0,0,0|1,0,1]=4 2043 B6R0.3 CC[C@H](O)C(=O)O Amb4166324 [2,0,0,0,0,0|0,0,1]=3 2044 B6R0.3 CC[C@H](S)C(=O)O Amb9785162 [2,0,0,0,0,0|0,1,1]=4 2045 B6R0.3 CNC(O)C(=O)O Amb27229907 [2,0,0,0,0,0|1,0,1]=4 2046 B6R0.3 C[C@@H](CF)C(=O)O Amb33743265 [2,0,0,0,0,0|2,0,0]=4 2047 B6R0.3 C[C@@H](CI)C(=O)O Amb28322539 [2,0,0,0,0,0|2,0,0]=4 2048 B6R0.3 C[C@@H](CN)C(=O)O Amb22756746 [2,0,0,0,0,0|2,0,0]=4 2049 B6R0.3 C[C@@H](CN)C(=O)O Amb6600138 [2,0,0,0,0,0|2,0,0]=4 2050 B6R0.3 C[C@@H](CO)C(=O)O Amb10844567 [2,0,0,0,0,0|1,0,0]=3 2051 B6R0.3 C[C@@H](CO)C(N)=O Amb27254152 [2,0,0,0,0,0|2,0,0]=4 2052 B6R0.3 C[C@@H](O)[C@@H](O)CO Amb28319973 [2,0,0,0,0,0|1,0,1]=4 2053 B6R0.3 C[C@H](CBr)C(=O)O Amb27975404 [2,0,0,0,0,0|2,0,0]=4 2054 B6R0.3 C[C@H](CF)C(=O)O Amb33727262 [2,0,0,0,0,0|2,0,0]=4 2055 B6R0.3 C[C@H](CN)C(=O)O Amb10844022 [2,0,0,0,0,0|2,0,0]=4 2056 B6R0.3 C[C@H](CN)C(=O)O Amb24117452 [2,0,0,0,0,0|2,0,0]=4 2057 B6R0.3 C[C@H](CO)C(=O)O Amb10844554 [2,0,0,0,0,0|1,0,0]=3 2058 B6R0.3 C[C@H](O)[C@H](O)C=O Amb28434698 [2,0,0,0,0,0|1,0,1]=4 2059 B6R0.3 C\C=C(/O)C(=O)O Amb22727962 [2,0,0,0,0,0|1,0,1]=4 2060 B6R0.3 N#CC(O)C(=O)O Amb27467286 [2,0,0,0,0,0|1,0,1]=4 2061 B6R0.3 NC(=O)C(N)CO Amb17593097 [2,0,0,0,0,0|2,0,0]=4 2062 B6R0.3 NC(=O)C(N)CO Amb2720301 [2,0,0,0,0,0|2,0,0]=4 2063 B6R0.3 NC(=O)C(O)CO Amb27169520 [2,0,0,0,0,0|1,0,0]=3 2064 B6R0.3 NC(=O)[C@@H](N)CO Amb6336612 [2,0,0,0,0,0|2,0,0]=4 2065 B6R0.3 NC(=O)[C@@H](N)CO Amb8387630 [2,0,0,0,0,0|2,0,0]=4 2066 B6R0.3 NC(=O)[C@@H](O)CO Amb27816733 [2,0,0,0,0,0|1,0,0]=3 2067 B6R0.3 NC(=O)[C@H](N)CO Amb22886957 [2,0,0,0,0,0|2,0,0]=4 2068 B6R0.3 NC(=O)[C@H](N)CO Amb26505098 [2,0,0,0,0,0|2,0,0]=4 2069 B6R0.3 NC(CCl)C(=O)O Amb19651457 [2,0,0,0,0,0|2,0,0]=4 2070 B6R0.3 NC(CCl)C(=O)O Amb21961077 [2,0,0,0,0,0|2,0,0]=4 2071 B6R0.3 NC(CF)C(=O)O Amb10839589 [2,0,0,0,0,0|2,0,0]=4 2072 B6R0.3 NC(CO)C(=O)O Amb9702805 [2,0,0,0,0,0|1,0,0]=3 2073 B6R0.3 NC(CP)C(=O)O Amb27234251 [2,0,0,0,0,0|2,0,0]=4 2074 B6R0.3 NC(CS)C(=O)O Amb13961966 [2,0,0,0,0,0|1,1,0]=4 2075 B6R0.3 NC(CS)C(=O)O Amb22489523 [2,0,0,0,0,0|1,1,0]=4 2076 B6R0.3 NC(CS)C(=O)O Amb6537913 [2,0,0,0,0,0|1,1,0]=4 2077 B6R0.3 NC(CS)C(=O)O Amb6537914 [2,0,0,0,0,0|1,1,0]=4 2078 B6R0.3 NC(C[NH3+])C(=O)O Amb4004471 [2,0,0,0,0,0|2,0,0]=4 2079 B6R0.3 NCC(Br)C(=O)O Amb28385732 [2,0,0,0,0,0|2,0,0]=4 2080 B6R0.3 NCC(Cl)C(=O)O Amb17593263 [2,0,0,0,0,0|2,0,0]=4 2081 B6R0.3 NCC(F)C(=O)O Amb22733051 [2,0,0,0,0,0|2,0,0]=4 2082 B6R0.3 NCC(F)C(=O)O Amb2688010 [2,0,0,0,0,0|2,0,0]=4 2083 B6R0.3 NCC(N)C(=O)O Amb22899095 [2,0,0,0,0,0|2,0,0]=4 2084 B6R0.3 NCC(N)C(=O)O Amb2697095 [2,0,0,0,0,0|2,0,0]=4 2085 B6R0.3 NCC(N)C(=O)O Amb8514284 [2,0,0,0,0,0|2,0,0]=4 2086 B6R0.3 NCC(O)C(=O)O Amb8517492 [2,0,0,0,0,0|1,0,0]=3 2087 B6R0.3 NCC(O)C(N)=O Amb27164291 [2,0,0,0,0,0|2,0,0]=4 2088 B6R0.3 NCC(O)C(N)=O Amb28827639 [2,0,0,0,0,0|2,0,0]=4 2089 B6R0.3 NCC(S)C(=O)O Amb17593238 [2,0,0,0,0,0|1,1,0]=4 2090 B6R0.3 NC[C@@H](F)C(=O)O Amb25824168 [2,0,0,0,0,0|2,0,0]=4 2091 B6R0.3 NC[C@@H](F)C(=O)O Amb31291438 [2,0,0,0,0,0|2,0,0]=4 2092 B6R0.3 NC[C@@H](N)C(=O)O Amb22745957 [2,0,0,0,0,0|2,0,0]=4 2093 B6R0.3 NC[C@@H](N)C(=O)O Amb8515776 [2,0,0,0,0,0|2,0,0]=4 2094 B6R0.3 NC[C@@H](O)C(=O)O Amb22169412 [2,0,0,0,0,0|1,0,0]=3 2095 B6R0.3 NC[C@@H](O)C(N)=O Amb28282144 [2,0,0,0,0,0|2,0,0]=4 2096 B6R0.3 NC[C@H](F)C(=O)O Amb27254153 [2,0,0,0,0,0|2,0,0]=4 2097 B6R0.3 NC[C@H](F)C(=O)O Amb31291433 [2,0,0,0,0,0|2,0,0]=4 2098 B6R0.3 NC[C@H](N)C(=O)O Amb16183820 [2,0,0,0,0,0|2,0,0]=4 2099 B6R0.3 NC[C@H](N)C(=O)O Amb33842544 [2,0,0,0,0,0|2,0,0]=4 2100 B6R0.3 NC[C@H](N)C(=O)O Amb8515775 [2,0,0,0,0,0|2,0,0]=4 2101 B6R0.3 NC[C@H](O)C(=O)O Amb4166313 [2,0,0,0,0,0|1,0,0]=3 2102 B6R0.3 NC[C@H](O)C(N)=O Amb32645211 [2,0,0,0,0,0|2,0,0]=4 2103 B6R0.3 N[C@@H](C=S)C(=O)O Amb27838199 [2,0,0,0,0,0|1,1,0]=4 2104 B6R0.3 N[C@@H](CBr)C(=O)O Amb27188433 [2,0,0,0,0,0|2,0,0]=4 2105 B6R0.3 N[C@@H](CCl)C(=O)O Amb22232860 [2,0,0,0,0,0|2,0,0]=4 2106 B6R0.3 N[C@@H](CCl)C(=O)O Amb8515277 [2,0,0,0,0,0|2,0,0]=4 2107 B6R0.3 N[C@@H](CO)C(=O)O Amb22351170 [2,0,0,0,0,0|1,0,0]=3 2108 B6R0.3 N[C@@H](CO)C(=O)O Amb8387621 [2,0,0,0,0,0|1,0,0]=3 2109 B6R0.3 N[C@@H](CS)C(=O)O Amb3940755 [2,0,0,0,0,0|1,1,0]=4 2110 B6R0.3 N[C@@H](CS)C(=O)O Amb8385453 [2,0,0,0,0,0|1,1,0]=4 2111 B6R0.3 N[C@@H](CS)C(=O)O Amb9826090 [2,0,0,0,0,0|1,1,0]=4 2112 B6R0.3 N[C@@H](C[SeH])C(=O)O Amb31031035 [2,0,0,0,0,0|1,1,0]=4 2113 B6R0.3 N[C@H](CCl)C(=O)O Amb2699111 [2,0,0,0,0,0|2,0,0]=4 2114 B6R0.3 N[C@H](CCl)C(=O)O Amb9813688 [2,0,0,0,0,0|2,0,0]=4 2115 B6R0.3 N[C@H](CO)C(=O)Cl Amb28058341 [2,0,0,0,0,0|2,0,0]=4 2116 B6R0.3 N[C@H](CO)C(=O)O Amb2690463 [2,0,0,0,0,0|1,0,0]=3 2117 B6R0.3 N[C@H](CS)C(=O)O Amb17942912 [2,0,0,0,0,0|1,1,0]=4 2118 B6R0.3 N[C@H](CS)C(=O)O Amb8394603 [2,0,0,0,0,0|1,1,0]=4 2119 B6R0.3 N[C@H](CS)C(=O)O Amb8628479 [2,0,0,0,0,0|1,1,0]=4 2120 B6R0.3 O=C(O)C(=O)CO Amb6600025 [2,0,0,0,0,0|0,0,2]=4 2121 B6R0.3 O=C(O)C(Br)CBr Amb8513574 [2,0,0,0,0,0|2,0,0]=4 2122 B6R0.3 O=C(O)C(Br)CF Amb10605519 [2,0,0,0,0,0|2,0,0]=4 2123 B6R0.3 O=C(O)C(Br)CO Amb18126327 [2,0,0,0,0,0|1,0,0]=3 2124 B6R0.3 O=C(O)C(Cl)CCl Amb22228245 [2,0,0,0,0,0|2,0,0]=4 2125 B6R0.3 O=C(O)C(Cl)CO Amb18124304 [2,0,0,0,0,0|1,0,0]=3 2126 B6R0.3 O=C(O)C(Cl)CS Amb18643661 [2,0,0,0,0,0|1,1,0]=4 2127 B6R0.3 O=C(O)C(F)CO Amb17593117 [2,0,0,0,0,0|1,0,0]=3 2128 B6R0.3 O=C(O)C(O)CBr Amb24061932 [2,0,0,0,0,0|1,0,0]=3 2129 B6R0.3 O=C(O)C(O)CCl Amb6371692 [2,0,0,0,0,0|1,0,0]=3 2130 B6R0.3 O=C(O)C(O)CF Amb27476477 [2,0,0,0,0,0|1,0,0]=3 2131 B6R0.3 O=C(O)C(O)CO Amb17593103 [2,0,0,0,0,0|0,0,0]=2 2132 B6R0.3 O=C(O)C(O)CS Amb18642053 [2,0,0,0,0,0|0,1,0]=3 2133 B6R0.3 O=C(O)C(S)CS Amb18643295 [2,0,0,0,0,0|0,2,0]=4 2134 B6R0.3 O=C(O)[C@@H](Br)CO Amb10601700 [2,0,0,0,0,0|1,0,0]=3 2135 B6R0.3 O=C(O)[C@@H](Cl)CO Amb27968485 [2,0,0,0,0,0|1,0,0]=3 2136 B6R0.3 O=C(O)[C@@H](O)CBr Amb27858794 [2,0,0,0,0,0|1,0,0]=3 2137 B6R0.3 O=C(O)[C@@H](O)CCl Amb22225325 [2,0,0,0,0,0|1,0,0]=3 2138 B6R0.3 O=C(O)[C@@H](O)CF Amb24117272 [2,0,0,0,0,0|1,0,0]=3 2139 B6R0.3 O=C(O)[C@@H](O)CO Amb22226732 [2,0,0,0,0,0|0,0,0]=2 2140 B6R0.3 O=C(O)[C@H](Cl)CO Amb27759746 [2,0,0,0,0,0|1,0,0]=3 2141 B6R0.3 O=C(O)[C@H](O)CBr Amb28137021 [2,0,0,0,0,0|1,0,0]=3 2142 B6R0.3 O=C(O)[C@H](O)CF Amb27467272 [2,0,0,0,0,0|1,0,0]=3 2143 B6R0.3 O=C(O)[C@H](O)CO Amb4166319 [2,0,0,0,0,0|0,0,0]=2 2144 B6R0.3 O=C(O)\C(Cl)=C/O Amb24479774 [2,0,0,0,0,0|1,0,1]=4 2145 B6R0.3 O=C(O)\C(O)=C/O Amb27220871 [2,0,0,0,0,0|0,0,1]=3 2146 B6R0.3 O=CC(Br)C(=O)O Amb27793774 [2,0,0,0,0,0|1,0,0]=3 2147 B6R0.3 O=CC(F)C(=O)O Amb22055301 [2,0,0,0,0,0|1,0,0]=3 2148 B6R0.3 O=C[C@@H](O)C(=O)O Amb27629391 [2,0,0,0,0,0|0,0,0]=2 2149 B8R0.2 C=CC(C)C(C)C(=O)O Amb18642611 [1,1,0,0,0,0|2,0,0]=4 2150 B8R0.2 C=CC(C)C(N)C(=O)O Amb18989861 [1,1,0,0,0,0|2,0,0]=4 2151 B8R0.2 C=CC(C)C(O)C(=O)O Amb18642750 [1,1,0,0,0,0|2,0,0]=4 2152 B8R0.2 C=CC(C)[C@@H](N)C(=O)O Amb25889532 [1,1,0,0,0,0|2,0,0]=4 2153 B8R0.2 C=CC(C)[C@H](N)C(=O)O Amb27761345 [1,1,0,0,0,0|2,0,0]=4 2154 B8R0.2 C=CC(N)C(C)C(=O)O Amb33036213 [1,1,0,0,0,0|2,0,0]=4 2155 B8R0.2 C=CC(O)C(C)C(=O)O Amb18642774 [1,1,0,0,0,0|1,0,0]=3 2156 B8R0.2 C=CC(O)C(N)C(=O)O Amb18642830 [1,1,0,0,0,0|1,0,0]=3 2157 B8R0.2 C=CC(O)[C@H](N)C(=O)O Amb28429839 [1,1,0,0,0,0|1,0,0]=3 2158 B8R0.2 C=C[C@@H](C)[C@H](N)C(=O)O Amb28129785 [1,1,0,0,0,0|2,0,0]=4 2159 B8R0.2 C=C[C@@H](C)[C@H](O)C(=O)O Amb27788648 [1,1,0,0,0,0|2,0,0]=4 2160 B8R0.2 C=C[C@H](C)[C@@H](N)C(=O)O Amb28067623 [1,1,0,0,0,0|2,0,0]=4 2161 B8R0.2 C=C[C@H](C)[C@H](Cl)C(=O)O Amb27601824 [1,1,0,0,0,0|2,0,0]=4 2162 B8R0.2 C=C[C@H](C)[C@H](F)C(=O)O Amb28285951 [1,1,0,0,0,0|2,0,0]=4 2163 B8R0.2 C=C[C@H](O)[C@@H](C)C(=O)O Amb28422977 [1,1,0,0,0,0|1,0,0]=3 2164 B8R0.2 C=C[C@H](O)[C@@H](N)C(=O)O Amb27236340 [1,1,0,0,0,0|1,0,0]=3 2165 B8R0.2 C=C[C@H](O)[C@H](C)C(=O)O Amb28285106 [1,1,0,0,0,0|1,0,0]=3 2166 B8R0.2 CC(=O)C(C)C(C)C=O Amb27643957 [1,1,0,0,0,0|2,0,0]=4 2167 B8R0.2 CC(=O)C(O)C(O)CO Amb26636819 [1,1,0,0,0,0|1,0,1]=4 2168 B8R0.2 CC(=O)[C@@H](O)[C@H](O)CO Amb26654815 [1,1,0,0,0,0|1,0,1]=4 2169 B8R0.2 CC(=O)[C@H](O)[C@@H](O)CO Amb28201025 [1,1,0,0,0,0|1,0,1]=4 2170 B8R0.2 CC(=O)[C@H](O)[C@H](O)CO Amb24477828 [1,1,0,0,0,0|1,0,1]=4 2171 B8R0.2 CC(C(=O)O)N(C)C=O Amb18284942 [1,1,0,0,0,0|2,0,0]=4 2172 B8R0.2 CC(CO)C(C)C(=O)O Amb27255789 [1,1,0,0,0,0|1,0,1]=4 2173 B8R0.2 CC(CO)C(N)C(=O)O Amb27629815 [1,1,0,0,0,0|1,0,1]=4 2174 B8R0.2 CC(CO)[C@@H](N)C(=O)O Amb33308939 [1,1,0,0,0,0|1,0,1]=4 2175 B8R0.2 CC(CO)[C@H](N)C(=O)O Amb25918803 [1,1,0,0,0,0|1,0,1]=4 2176 B8R0.2 CC(NO)C(C)C(=O)O Amb27185439 [1,1,0,0,0,0|2,0,0]=4 2177 B8R0.2 CC(O)C(O)C(O)C=O Amb24711583 [1,1,0,0,0,0|1,0,1]=4 2178 B8R0.2 CCC(O)C(C)C(=O)O Amb10844267 [1,1,0,0,0,0|1,0,1]=4 2179 B8R0.2 CCC(O)C(F)C(=O)O Amb33136388 [1,1,0,0,0,0|1,0,1]=4 2180 B8R0.2 CCC(O)C(N)C(=O)O Amb18203168 [1,1,0,0,0,0|1,0,1]=4 2181 B8R0.2 CCC(O)[C@H](N)C(=O)O Amb24364655 [1,1,0,0,0,0|1,0,1]=4 2182 B8R0.2 CC[C@@H](O)[C@@H](C)C(=O)O Amb27879857 [1,1,0,0,0,0|1,0,1]=4 2183 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O Amb26981388 [1,1,0,0,0,0|1,0,1]=4 2184 B8R0.2 CC[C@H](O)[C@H](Br)C(=O)O Amb28285137 [1,1,0,0,0,0|1,0,1]=4 2185 B8R0.2 CC[C@H](O)[C@H](N)C(=O)O Amb26024594 [1,1,0,0,0,0|1,0,1]=4 2186 B8R0.2 C[C@@H](CO)[C@@H](N)C(=O)O Amb24117487 [1,1,0,0,0,0|1,0,1]=4 2187 B8R0.2 C[C@@H](CO)[C@@H](N)C(=O)O Amb27828649 [1,1,0,0,0,0|1,0,1]=4 2188 B8R0.2 C[C@@H](CO)[C@H](N)C(=O)O Amb24117488 [1,1,0,0,0,0|1,0,1]=4 2189 B8R0.2 C[C@@H](O)[C@@H](O)[C@H](O)C=O Amb22229972 [1,1,0,0,0,0|1,0,1]=4 2190 B8R0.2 C[C@H](C(=O)O)[C@@H](O)CN Amb28056248 [1,1,0,0,0,0|1,0,1]=4 2191 B8R0.2 C[C@H](O)[C@@H](O)[C@H](O)C=O Amb28285149 [1,1,0,0,0,0|1,0,1]=4 2192 B8R0.2 C[C@H](O)[C@H](O)[C@@H](O)C=O Amb22229973 [1,1,0,0,0,0|1,0,1]=4 2193 B8R0.2 C[C@H](O)[C@H](O)[C@H](O)C=O Amb26490972 [1,1,0,0,0,0|1,0,1]=4 2194 B8R0.2 NC(=O)[C@@H](F)[C@@H](O)CO Amb27668286 [1,1,0,0,0,0|1,0,1]=4 2195 B8R0.2 NC(=O)[C@H](O)[C@@H](O)CO Amb27814631 [1,1,0,0,0,0|1,0,1]=4 2196 B8R0.2 NC(C(=O)O)C(F)CO Amb27950986 [1,1,0,0,0,0|1,0,1]=4 2197 B8R0.2 NC(C(=O)O)C(O)CCl Amb27846402 [1,1,0,0,0,0|1,0,1]=4 2198 B8R0.2 NC(C(=O)O)C(O)CF Amb27592597 [1,1,0,0,0,0|1,0,1]=4 2199 B8R0.2 NC(C(=O)O)C(S)CO Amb27199680 [1,1,0,0,0,0|0,1,1]=4 2200 B8R0.2 NC(CO)C(N)C(=O)O Amb28208230 [1,1,0,0,0,0|1,0,1]=4 2201 B8R0.2 NCC(O)C(N)C(=O)O Amb27876292 [1,1,0,0,0,0|1,0,1]=4 2202 B8R0.2 NCC(O)C(O)C(=O)O Amb27830532 [1,1,0,0,0,0|1,0,1]=4 2203 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb27945588 [1,1,0,0,0,0|1,0,1]=4 2204 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb33209939 [1,1,0,0,0,0|1,0,1]=4 2205 B8R0.2 NC[C@@H](O)[C@H](N)C(=O)O Amb30884414 [1,1,0,0,0,0|1,0,1]=4 2206 B8R0.2 N[C@@H](C(=O)O)C(O)CBr Amb28245344 [1,1,0,0,0,0|1,0,1]=4 2207 B8R0.2 N[C@@H](C(=O)O)C(S)CO Amb27233478 [1,1,0,0,0,0|0,1,1]=4 2208 B8R0.2 N[C@@H](C(=O)O)[C@H](O)CO Amb24671346 [1,1,0,0,0,0|0,0,1]=3 2209 B8R0.2 N[C@H](C(=O)O)C(O)CCl Amb27212707 [1,1,0,0,0,0|1,0,1]=4 2210 B8R0.2 N[C@H](C(=O)O)C(O)CO Amb28255690 [1,1,0,0,0,0|0,0,1]=3 2211 B8R0.2 N[C@H](C(=O)O)[C@@H](O)CO Amb25678241 [1,1,0,0,0,0|0,0,1]=3 2212 B8R0.2 O=C(O)C(=O)C(O)CO Amb27408895 [1,1,0,0,0,0|0,0,2]=4 2213 B8R0.2 O=C(O)C(O)C(O)CO Amb22495524 [1,1,0,0,0,0|0,0,1]=3 2214 B8R0.2 O=C(O)[C@@H](F)[C@H](O)CO Amb27195151 [1,1,0,0,0,0|0,0,1]=3 2215 B8R0.2 O=C(O)[C@H](O)C(O)CO Amb27229496 [1,1,0,0,0,0|0,0,1]=3 2216 B8R0.2 O=C(O)[C@H](O)[C@@H](O)CO Amb27849401 [1,1,0,0,0,0|0,0,1]=3 2217 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO Amb32644462 [1,1,0,0,0,0|0,0,1]=3 2218 B8R0.2 O=C([O-])C(O)C(O)CO Amb22733096 [1,1,0,0,0,0|0,0,2]=4 2219 B8R0.2 O=C([O-])[C@@H](O)[C@H](O)CO Amb22744783 [1,1,0,0,0,0|0,0,2]=4 2220 B8R0.2 O=C([O-])[C@@H](O)[C@H](O)CO Amb32414707 [1,1,0,0,0,0|0,0,2]=4 2221 B8R0.2 O=CC(O)C(O)C(=O)O Amb18124399 [1,1,0,0,0,0|0,0,0]=2 2222 B8R0.2 O=C[C@H](O)[C@H](O)C(=O)O Amb27266059 [1,1,0,0,0,0|0,0,0]=2 2223 B8R0.5 C=C=CC(C)CC(=O)O Amb27631675 [1,1,0,0,0,0|2,0,0]=4 2224 B8R0.5 C=CCC(C)CC(=O)O Amb18642628 [1,1,0,0,0,0|2,0,0]=4 2225 B8R0.5 C=CCC(N)CC(=O)O Amb22641964 [1,1,0,0,0,0|2,0,0]=4 2226 B8R0.5 C=CCC(N)CC(=O)O Amb31307622 [1,1,0,0,0,0|2,0,0]=4 2227 B8R0.5 C=CCC(O)CC(=O)O Amb18642785 [1,1,0,0,0,0|1,0,0]=3 2228 B8R0.5 C=CC[C@@H](N)CC(=O)O Amb22746166 [1,1,0,0,0,0|2,0,0]=4 2229 B8R0.5 C=CC[C@@H](N)CC(=O)O Amb2699117 [1,1,0,0,0,0|2,0,0]=4 2230 B8R0.5 C=CC[C@@H](O)CC(=O)O Amb28073530 [1,1,0,0,0,0|1,0,0]=3 2231 B8R0.5 C=CC[C@H](N)CC(=O)O Amb2699116 [1,1,0,0,0,0|2,0,0]=4 2232 B8R0.5 C=CC[C@H](N)CC(=O)O Amb33726074 [1,1,0,0,0,0|2,0,0]=4 2233 B8R0.5 C=CC[C@H](O)CC(=O)O Amb28345940 [1,1,0,0,0,0|1,0,0]=3 2234 B8R0.5 CC(=O)CC(C)CC=O Amb28076874 [1,1,0,0,0,0|2,0,0]=4 2235 B8R0.5 CC(=O)CC(C)NC=O Amb24477804 [1,1,0,0,0,0|2,0,0]=4 2236 B8R0.5 CC(=O)C[C@H](C)CC=O Amb27265839 [1,1,0,0,0,0|2,0,0]=4 2237 B8R0.5 CC(CC(=O)O)N=C=O Amb33471303 [1,1,0,0,0,0|1,0,1]=4 2238 B8R0.5 CC(CC(=O)O)NC=O Amb18967805 [1,1,0,0,0,0|1,0,0]=3 2239 B8R0.5 CC(CCO)CC(=O)O Amb18642882 [1,1,0,0,0,0|1,0,1]=4 2240 B8R0.5 CCCC(O)CC(=O)O Amb2699832 [1,1,0,0,0,0|1,0,1]=4 2241 B8R0.5 CCC[C@@H](O)CC(=O)O Amb25188904 [1,1,0,0,0,0|1,0,1]=4 2242 B8R0.5 CCC[C@H](O)CC(=O)O Amb25367955 [1,1,0,0,0,0|1,0,1]=4 2243 B8R0.5 CNCC(O)CC(=O)O Amb28423259 [1,1,0,0,0,0|1,0,1]=4 2244 B8R0.5 CNCC(O)CC(=O)O Amb32661843 [1,1,0,0,0,0|1,0,1]=4 2245 B8R0.5 COCC(C)CC(=O)O Amb19024342 [1,1,0,0,0,0|1,0,1]=4 2246 B8R0.5 COCC(N)CC(=O)O Amb26641146 [1,1,0,0,0,0|1,0,1]=4 2247 B8R0.5 COCC(O)CC(=O)O Amb18832518 [1,1,0,0,0,0|0,0,1]=3 2248 B8R0.5 COC[C@@H](O)CC(=O)O Amb33428853 [1,1,0,0,0,0|0,0,1]=3 2249 B8R0.5 COC[C@H](N)CC(=O)O Amb33038388 [1,1,0,0,0,0|1,0,1]=4 2250 B8R0.5 COC[C@H](N)CC(=O)O Amb33330661 [1,1,0,0,0,0|1,0,1]=4 2251 B8R0.5 COC[C@H](O)CC(=O)O Amb33428852 [1,1,0,0,0,0|0,0,1]=3 2252 B8R0.5 CONC(C)CC(=O)O Amb26844930 [1,1,0,0,0,0|2,0,0]=4 2253 B8R0.5 CO\C=C(\C)CC(=O)O Amb27410916 [1,1,0,0,0,0|1,0,1]=4 2254 B8R0.5 CSCC(O)CC(=O)O Amb24621046 [1,1,0,0,0,0|0,1,1]=4 2255 B8R0.5 CSC[C@@H](O)CC(=O)O Amb33271747 [1,1,0,0,0,0|0,1,1]=4 2256 B8R0.5 CSC[C@H](O)CC(=O)O Amb33271746 [1,1,0,0,0,0|0,1,1]=4 2257 B8R0.5 C[C@H](CC(=O)O)N=C=O Amb33471360 [1,1,0,0,0,0|1,0,1]=4 2258 B8R0.5 C[C@H](CCO)CC(=O)O Amb27461411 [1,1,0,0,0,0|1,0,1]=4 2259 B8R0.5 C\C=C\C(N)CC(=O)O Amb25975538 [1,1,0,0,0,0|2,0,0]=4 2260 B8R0.5 C\C=C\C(O)CC(=O)O Amb8398291 [1,1,0,0,0,0|1,0,0]=3 2261 B8R0.5 C\C=C\[C@H](C)CC(=O)O Amb28047718 [1,1,0,0,0,0|2,0,0]=4 2262 B8R0.5 N#CCC(O)CC(=O)O Amb27249794 [1,1,0,0,0,0|1,0,1]=4 2263 B8R0.5 NCCC(O)CC(=O)O Amb27882021 [1,1,0,0,0,0|1,0,1]=4 2264 B8R0.5 NCCC(O)CC(=O)O Amb31031000 [1,1,0,0,0,0|1,0,1]=4 2265 B8R0.5 N[C@H](CCO)CC(=O)O Amb27169169 [1,1,0,0,0,0|1,0,1]=4 2266 B8R0.5 O=C(O)CC(O)CCF Amb33196428 [1,1,0,0,0,0|1,0,1]=4 2267 B8R0.5 O=C(O)CC(O)CCO Amb31031042 [1,1,0,0,0,0|0,0,1]=3 2268 B8R0.5 O=C(O)CC(O)CNO Amb28044304 [1,1,0,0,0,0|0,0,1]=3 2269 B8R0.5 O=C(O)C[C@@H](O)CCF Amb33196426 [1,1,0,0,0,0|1,0,1]=4 2270 B8R0.5 O=C(O)C[C@H](O)CCF Amb33196427 [1,1,0,0,0,0|1,0,1]=4 2271 B8R0.16 C=CC(C=C)CC(=O)O Amb18642422 [1,1,0,0,0,0|2,0,0]=4 2272 B8R0.16 C=CC(CC(C)=O)OC Amb26556400 [1,1,0,0,0,0|2,0,0]=4 2273 B8R0.16 C=CC(CC)CC(=O)O Amb18642661 [1,1,0,0,0,0|2,0,0]=4 2274 B8R0.16 C=C[C@@H](CC)CC(=O)O Amb27784737 [1,1,0,0,0,0|2,0,0]=4 2275 B8R0.16 CC(=O)CC(C=O)C=O Amb25767018 [1,1,0,0,0,0|1,0,1]=4 2276 B8R0.16 CC(=O)NC(C=O)CO Amb27816982 [1,1,0,0,0,0|2,0,0]=4 2277 B8R0.16 CCC(C=O)CC(C)=O Amb18642641 [1,1,0,0,0,0|2,0,0]=4 2278 B8R0.16 CCC(CC(=O)O)OC Amb19037306 [1,1,0,0,0,0|1,0,1]=4 2279 B8R0.16 CCN(C=O)CC(=O)O Amb18972736 [1,1,0,0,0,0|2,0,0]=4 2280 B8R0.16 CC[C@H](C=O)CC(=O)[O-] Amb28198369 [1,1,0,0,0,0|1,0,1]=4 2281 B8R0.16 COC(C=O)CC(C)O Amb27830119 [1,1,0,0,0,0|1,0,1]=4 2282 B8R0.16 COC(CC(=O)O)OC Amb22231899 [1,1,0,0,0,0|2,0,0]=4 2283 B8R0.16 COC(CN)CC(=O)O Amb27806172 [1,1,0,0,0,0|1,0,1]=4 2284 B8R0.16 COC(CN)CC(=O)O Amb28555397 [1,1,0,0,0,0|1,0,1]=4 2285 B8R0.16 NCC(CO)CC(=O)O Amb22546422 [1,1,0,0,0,0|1,0,1]=4 2286 B8R0.16 O=C(O)CC(CO)CCl Amb27468690 [1,1,0,0,0,0|1,0,1]=4 2287 B8R0.16 O=C(O)CN(CO)CO Amb27412887 [1,1,0,0,0,0|1,0,1]=4 2288 B8R0.19 C#CC(O)CC(=O)OC Amb28078873 [1,1,0,0,0,0|1,0,1]=4 2289 B8R0.19 C=CC(O)CC(=C)CO Amb27208236 [1,1,0,0,0,0|2,0,0]=4 2290 B8R0.19 CCC(O)CC(=O)OC Amb24425172 [1,1,0,0,0,0|1,0,1]=4 2291 B8R0.19 CC[C@@H](O)CC(=O)OC Amb22224793 [1,1,0,0,0,0|1,0,1]=4 2292 B8R0.19 CC[C@H](O)CC(=O)OC Amb20240681 [1,1,0,0,0,0|1,0,1]=4 2293 B8R0.19 CNC(=O)CC(O)CO Amb25960171 [1,1,0,0,0,0|1,0,1]=4 2294 B8R0.19 COC(=O)CC(C)C=O Amb18642765 [1,1,0,0,0,0|1,0,0]=3 2295 B8R0.19 COC(=O)CC(F)C=O Amb27173133 [1,1,0,0,0,0|1,0,0]=3 2296 B8R0.19 COC(=O)CC(O)CCl Amb20241285 [1,1,0,0,0,0|1,0,1]=4 2297 B8R0.19 COC(=O)CC(O)CF Amb26920791 [1,1,0,0,0,0|1,0,1]=4 2298 B8R0.19 COC(=O)CC(O)CN Amb25146166 [1,1,0,0,0,0|1,0,1]=4 2299 B8R0.19 COC(=O)CC(O)CN Amb32668884 [1,1,0,0,0,0|1,0,1]=4 2300 B8R0.19 COC(=O)CC(O)CO Amb6600485 [1,1,0,0,0,0|0,0,1]=3 2301 B8R0.19 COC(=O)CN(C)C=O Amb21856175 [1,1,0,0,0,0|2,0,0]=4 2302 B8R0.19 COC(=O)C[C@@H](C)C=O Amb27863686 [1,1,0,0,0,0|1,0,0]=3 2303 B8R0.19 COC(=O)C[C@@H](C)CO Amb22747755 [1,1,0,0,0,0|1,0,1]=4 2304 B8R0.19 COC(=O)C[C@@H](O)CBr Amb23437907 [1,1,0,0,0,0|1,0,1]=4 2305 B8R0.19 COC(=O)C[C@@H](O)CCl Amb8394990 [1,1,0,0,0,0|1,0,1]=4 2306 B8R0.19 COC(=O)C[C@@H](O)CF Amb33358243 [1,1,0,0,0,0|1,0,1]=4 2307 B8R0.19 COC(=O)C[C@@H](O)CN Amb24113025 [1,1,0,0,0,0|1,0,1]=4 2308 B8R0.19 COC(=O)C[C@@H](O)CN Amb33330793 [1,1,0,0,0,0|1,0,1]=4 2309 B8R0.19 COC(=O)C[C@H](C)C=O Amb28366984 [1,1,0,0,0,0|1,0,0]=3 2310 B8R0.19 COC(=O)C[C@H](C)CO Amb27831499 [1,1,0,0,0,0|1,0,1]=4 2311 B8R0.19 COC(=O)C[C@H](O)CBr Amb8384043 [1,1,0,0,0,0|1,0,1]=4 2312 B8R0.19 COC(=O)C[C@H](O)CCl Amb2695337 [1,1,0,0,0,0|1,0,1]=4 2313 B8R0.19 COC(=O)C[C@H](O)CF Amb33358247 [1,1,0,0,0,0|1,0,1]=4 2314 B8R0.19 COC(=O)C[C@H](O)CN Amb26604358 [1,1,0,0,0,0|1,0,1]=4 2315 B8R0.19 COC(=O)C[C@H](O)CN Amb33331047 [1,1,0,0,0,0|1,0,1]=4 2316 B8R0.19 COC(=O)C[C@H](O)CO Amb13883661 [1,1,0,0,0,0|0,0,1]=3 2317 B8R0.19 O=C(CO)CC(O)CO Amb26067178 [1,1,0,0,0,0|0,0,1]=3 2318 B8R0.19 O=CC(=O)CC(O)CO Amb28202610 [1,1,0,0,0,0|0,0,2]=4 2319 B8R0.19 O=CC(=O)C[C@@H](O)CO Amb27873015 [1,1,0,0,0,0|0,0,2]=4 2320 B8R0.19 O=CC(O)CC(=O)CO Amb28144194 [1,1,0,0,0,0|0,0,0]=2 2321 B8R0.19 O=CC(O)CC(O)CO Amb22731319 [1,1,0,0,0,0|0,0,2]=4 2322 B8R0.19 O=C[C@@H](O)C[C@@H](O)CO Amb27394636 [1,1,0,0,0,0|0,0,2]=4 2323 B8R0.19 O=C[C@@H](O)C[C@H](O)CO Amb28388612 [1,1,0,0,0,0|0,0,2]=4 2324 B8R0.19 O=C[C@H](O)CC(=O)CO Amb28121885 [1,1,0,0,0,0|0,0,0]=2 2325 B8R0.24 O=CC(O)OS(=O)(=O)O Amb27761016 [1,1,0,0,0,0|2,0,0]=4 2326 B8R0.24 O=S(=O)(O)CC(O)CO Amb25802047 [1,1,0,0,0,0|1,0,1]=4 2327 B8R0.34 C=CC(C)(C)CC(=O)O Amb5718701 [1,1,0,0,0,0|2,0,0]=4 2328 B8R0.34 C=CC(C)(N)CC(=O)O Amb22641965 [1,1,0,0,0,0|2,0,0]=4 2329 B8R0.34 C=CC(C)(N)CC(=O)O Amb31307623 [1,1,0,0,0,0|2,0,0]=4 2330 B8R0.34 C=CC(C)(O)CC(=O)O Amb18642755 [1,1,0,0,0,0|1,0,0]=3 2331 B8R0.34 CC(=O)CC(C)(C)C=O Amb18642640 [1,1,0,0,0,0|2,0,0]=4 2332 B8R0.34 CC(C)(C=O)CC(=O)O Amb28401504 [1,1,0,0,0,0|1,0,0]=3 2333 B8R0.34 CC(C)(CC(=O)O)NO Amb27859691 [1,1,0,0,0,0|2,0,0]=4 2334 B8R0.34 CC(C)(CO)CC(=O)O Amb24116870 [1,1,0,0,0,0|1,0,1]=4 2335 B8R0.34 CC(N)(CO)CC(=O)O Amb27162086 [1,1,0,0,0,0|1,0,1]=4 2336 B8R0.34 CC(O)(CCl)CC(=O)O Amb27409236 [1,1,0,0,0,0|1,0,1]=4 2337 B8R0.34 CC(O)(CN)CC(=O)O Amb25188898 [1,1,0,0,0,0|1,0,1]=4 2338 B8R0.34 CC(O)(CN)CC(=O)O Amb28935004 [1,1,0,0,0,0|1,0,1]=4 2339 B8R0.34 CCC(C)(O)CC(=O)O Amb18298122 [1,1,0,0,0,0|1,0,1]=4 2340 B8R0.3 C=CCC(C)C(=O)OC Amb27787724 [1,1,0,0,0,0|2,0,0]=4 2341 B8R0.3 C=CCC(Cl)C(=O)OC Amb25365264 [1,1,0,0,0,0|2,0,0]=4 2342 B8R0.3 C=CCC(N)C(=O)NO Amb28322025 [1,1,0,0,0,0|2,0,0]=4 2343 B8R0.3 C=CCC(N)C(=O)OC Amb18642703 [1,1,0,0,0,0|2,0,0]=4 2344 B8R0.3 C=CCC(N)C(=O)OC Amb22757544 [1,1,0,0,0,0|2,0,0]=4 2345 B8R0.3 C=CCC(O)C(=C)CO Amb28188293 [1,1,0,0,0,0|2,0,0]=4 2346 B8R0.3 C=CCC(O)C(=O)CC Amb27199094 [1,1,0,0,0,0|2,0,0]=4 2347 B8R0.3 C=CCC(O)C(=O)OC Amb28435077 [1,1,0,0,0,0|1,0,0]=3 2348 B8R0.3 C=CC[C@@H](N)C(=O)OC Amb24635550 [1,1,0,0,0,0|2,0,0]=4 2349 B8R0.3 C=CC[C@@H](N)C(=O)OC Amb33868785 [1,1,0,0,0,0|2,0,0]=4 2350 B8R0.3 C=CC[C@H](N)C(=O)OC Amb22750599 [1,1,0,0,0,0|2,0,0]=4 2351 B8R0.3 C=CC[C@H](N)C(=O)OC Amb24120340 [1,1,0,0,0,0|2,0,0]=4 2352 B8R0.3 CCCC(O)C(=O)CO Amb27802691 [1,1,0,0,0,0|1,0,1]=4 2353 B8R0.3 CCCC(O)C(=O)OC Amb23454534 [1,1,0,0,0,0|1,0,1]=4 2354 B8R0.3 CCC[C@@H](O)C(=O)CO Amb27802757 [1,1,0,0,0,0|1,0,1]=4 2355 B8R0.3 CCC[C@@H](O)C(=O)OC Amb28344665 [1,1,0,0,0,0|1,0,1]=4 2356 B8R0.3 CCC[C@H](O)C(=O)CO Amb27838685 [1,1,0,0,0,0|1,0,1]=4 2357 B8R0.3 COC(=O)C(=O)CC=O Amb26620730 [1,1,0,0,0,0|0,0,2]=4 2358 B8R0.3 COC(=O)C(C)CC=O Amb18642746 [1,1,0,0,0,0|1,0,0]=3 2359 B8R0.3 COC(=O)C(N)CCO Amb18305497 [1,1,0,0,0,0|1,0,1]=4 2360 B8R0.3 COC(=O)C(O)CC#N Amb25716720 [1,1,0,0,0,0|1,0,1]=4 2361 B8R0.3 COC(=O)C(O)CCBr Amb28385691 [1,1,0,0,0,0|1,0,1]=4 2362 B8R0.3 COC(=O)C(O)CCF Amb25114455 [1,1,0,0,0,0|1,0,1]=4 2363 B8R0.3 COC(=O)C(O)CCN Amb26960420 [1,1,0,0,0,0|1,0,1]=4 2364 B8R0.3 COC(=O)C(O)CSC Amb26009506 [1,1,0,0,0,0|2,0,0]=4 2365 B8R0.3 COC(=O)N(C)CC=O Amb25216418 [1,1,0,0,0,0|2,0,0]=4 2366 B8R0.3 COC(=O)[C@@H](C)NC=O Amb25716179 [1,1,0,0,0,0|2,0,0]=4 2367 B8R0.3 COC(=O)[C@@H](N)CCO Amb24746756 [1,1,0,0,0,0|1,0,1]=4 2368 B8R0.3 COC(=O)[C@@H](O)CCN Amb25146066 [1,1,0,0,0,0|1,0,1]=4 2369 B8R0.3 COC(=O)[C@@H](O)CCN Amb33457506 [1,1,0,0,0,0|1,0,1]=4 2370 B8R0.3 COC(=O)[C@@H](O)CCO Amb27406740 [1,1,0,0,0,0|0,0,1]=3 2371 B8R0.3 COC(=O)[C@H](C)CC=O Amb28388611 [1,1,0,0,0,0|1,0,0]=3 2372 B8R0.3 COC(=O)[C@H](C)CCO Amb28134520 [1,1,0,0,0,0|1,0,1]=4 2373 B8R0.3 COC(=O)[C@H](C)NC=O Amb24476955 [1,1,0,0,0,0|2,0,0]=4 2374 B8R0.3 COC(=O)[C@H](N)CCO Amb26475851 [1,1,0,0,0,0|1,0,1]=4 2375 B8R0.3 COC(=O)[C@H](O)CCBr Amb27863444 [1,1,0,0,0,0|1,0,1]=4 2376 B8R0.3 COC(=O)[C@H](O)CCO Amb28315513 [1,1,0,0,0,0|0,0,1]=3 2377 B8R0.3 COCC(O)C(=O)OC Amb23596463 [1,1,0,0,0,0|2,0,0]=4 2378 B8R0.3 COC[C@@H](O)C(=O)CO Amb27180388 [1,1,0,0,0,0|2,0,0]=4 2379 B8R0.3 CSCC(O)C(=O)CO Amb28141435 [1,1,0,0,0,0|2,0,0]=4 2380 B8R0.3 O=CCC(O)C(O)CO Amb8513489 [1,1,0,0,0,0|0,0,2]=4 2381 B8R0.3 O=CCC(O)C(O)CS Amb27750353 [1,1,0,0,0,0|0,1,1]=4 2382 B8R0.3 O=CC[C@@H](O)[C@@H](O)CO Amb17943012 [1,1,0,0,0,0|0,0,2]=4 2383 B8R0.3 O=CC[C@H](O)[C@H](O)CO Amb2725665 [1,1,0,0,0,0|0,0,2]=4 2384 B8R0.8 C=C=CCC(N)C(=O)O Amb25843448 [1,1,0,0,0,0|2,0,0]=4 2385 B8R0.8 C=C=CC[C@@H](N)C(=O)O Amb28070890 [1,1,0,0,0,0|2,0,0]=4 2386 B8R0.8 C=CCCC(Br)C(=O)O Amb28047448 [1,1,0,0,0,0|2,0,0]=4 2387 B8R0.8 C=CCCC(C)C(=O)O Amb18642656 [1,1,0,0,0,0|2,0,0]=4 2388 B8R0.8 C=CCCC(N)C(=O)O Amb24383848 [1,1,0,0,0,0|2,0,0]=4 2389 B8R0.8 C=CCCC(N)C(=O)O Amb28934988 [1,1,0,0,0,0|2,0,0]=4 2390 B8R0.8 C=CCC[C@@H](N)C(=O)O Amb23439045 [1,1,0,0,0,0|2,0,0]=4 2391 B8R0.8 C=CCC[C@H](N)C(=O)O Amb28285244 [1,1,0,0,0,0|2,0,0]=4 2392 B8R0.8 C=CCC[C@H](O)C(=O)O Amb28122952 [1,1,0,0,0,0|1,0,0]=3 2393 B8R0.8 C=CCNC(C)C(=O)O Amb9326762 [1,1,0,0,0,0|2,0,0]=4 2394 B8R0.8 C=CCOC(C)C(=O)O Amb9208699 [1,1,0,0,0,0|2,0,0]=4 2395 B8R0.8 C=CCSC(C)C(=O)O Amb6273705 [1,1,0,0,0,0|2,0,0]=4 2396 B8R0.8 C=CSCC(N)C(=O)O Amb28321669 [1,1,0,0,0,0|2,0,0]=4 2397 B8R0.8 CC(=O)C(O)CCC=O Amb25965289 [1,1,0,0,0,0|1,0,0]=3 2398 B8R0.8 CC(CN=C=O)C(=O)O Amb33471309 [1,1,0,0,0,0|1,0,1]=4 2399 B8R0.8 CC(C\C=N\O)C(=O)O Amb27217284 [1,1,0,0,0,0|1,0,0]=3 2400 B8R0.8 CC(OCCO)C(=O)O Amb6680915 [1,1,0,0,0,0|1,0,1]=4 2401 B8R0.8 CCCCC(O)C(=O)O Amb3941634 [1,1,0,0,0,0|1,0,1]=4 2402 B8R0.8 CCCC[C@H](O)C(=O)O Amb27626002 [1,1,0,0,0,0|1,0,1]=4 2403 B8R0.8 CCCSC(O)C(=O)O Amb27592135 [1,1,0,0,0,0|1,0,1]=4 2404 B8R0.8 CCOC[C@@H](O)C(=O)O Amb33347463 [1,1,0,0,0,0|1,0,1]=4 2405 B8R0.8 CCSCC(O)C(=O)O Amb27231753 [1,1,0,0,0,0|1,0,1]=4 2406 B8R0.8 CCSC[C@H](O)C(=O)O Amb27983830 [1,1,0,0,0,0|1,0,1]=4 2407 B8R0.8 CC\C=C\C(O)C(=O)O Amb27781864 [1,1,0,0,0,0|1,0,1]=4 2408 B8R0.8 COCCC(C)C(=O)O Amb18523823 [1,1,0,0,0,0|1,0,1]=4 2409 B8R0.8 COCCC(Cl)C(=O)O Amb27424361 [1,1,0,0,0,0|1,0,1]=4 2410 B8R0.8 COCCC(N)C(=O)O Amb32675454 [1,1,0,0,0,0|1,0,1]=4 2411 B8R0.8 COCCC(N)C(=O)O Amb6281324 [1,1,0,0,0,0|1,0,1]=4 2412 B8R0.8 COCCC(O)C(=O)O Amb27647966 [1,1,0,0,0,0|0,0,1]=3 2413 B8R0.8 COCC[C@@H](N)C(=O)O Amb16183870 [1,1,0,0,0,0|1,0,1]=4 2414 B8R0.8 COCC[C@H](N)C(=O)O Amb16183872 [1,1,0,0,0,0|1,0,1]=4 2415 B8R0.8 COCC[C@H](N)C(=O)O Amb24054991 [1,1,0,0,0,0|1,0,1]=4 2416 B8R0.8 CO\C=C\[C@@H](N)C(=O)O Amb27427471 [1,1,0,0,0,0|1,0,1]=4 2417 B8R0.8 CSCCC(O)C(=O)O Amb18304609 [1,1,0,0,0,0|0,1,1]=4 2418 B8R0.8 CSCC[C@@H](O)C(=O)O Amb25124092 [1,1,0,0,0,0|0,1,1]=4 2419 B8R0.8 CSCC[C@H](O)C(=O)O Amb28285270 [1,1,0,0,0,0|0,1,1]=4 2420 B8R0.8 C[C@@H](NCCO)C(=O)O Amb26885478 [1,1,0,0,0,0|1,0,1]=4 2421 B8R0.8 C[C@@H](OCCO)C(=O)O Amb28318043 [1,1,0,0,0,0|1,0,1]=4 2422 B8R0.8 C[C@H](NCCO)C(=O)O Amb28058421 [1,1,0,0,0,0|1,0,1]=4 2423 B8R0.8 C[C@H](O)[C@@H](O)CCC=O Amb28042891 [1,1,0,0,0,0|1,0,1]=4 2424 B8R0.8 C[C@H](OCCO)C(=O)O Amb27398048 [1,1,0,0,0,0|1,0,1]=4 2425 B8R0.8 C\C=C\CC(C)C(=O)O Amb18642630 [1,1,0,0,0,0|2,0,0]=4 2426 B8R0.8 C\C=C\CC(F)C(=O)O Amb27959670 [1,1,0,0,0,0|2,0,0]=4 2427 B8R0.8 C\C=C\CC(N)C(=O)O Amb6256663 [1,1,0,0,0,0|2,0,0]=4 2428 B8R0.8 C\C=C\CC(O)C(C)=O Amb25707027 [1,1,0,0,0,0|2,0,0]=4 2429 B8R0.8 C\C=C\C[C@@H](N)C(=O)O Amb33065673 [1,1,0,0,0,0|2,0,0]=4 2430 B8R0.8 C\C=C\C[C@H](C)C(=O)O Amb28368854 [1,1,0,0,0,0|2,0,0]=4 2431 B8R0.8 C\C=C\C[C@H](N)C(=O)O Amb27768785 [1,1,0,0,0,0|2,0,0]=4 2432 B8R0.8 N#CCCC(O)C(=O)O Amb28239951 [1,1,0,0,0,0|1,0,1]=4 2433 B8R0.8 N#CCC[C@H](O)C(=O)O Amb28144260 [1,1,0,0,0,0|1,0,1]=4 2434 B8R0.8 N#CNCC(O)C(=O)O Amb35634509 [1,1,0,0,0,0|1,0,1]=4 2435 B8R0.8 N#CNC[C@H](O)C(=O)O Amb35634507 [1,1,0,0,0,0|1,0,1]=4 2436 B8R0.8 NC(=O)C(O)CNC=O Amb27784034 [1,1,0,0,0,0|1,0,0]=3 2437 B8R0.8 NC(CCCO)C(=O)O Amb18642915 [1,1,0,0,0,0|1,0,1]=4 2438 B8R0.8 NC(CCCO)C(=O)O Amb22900028 [1,1,0,0,0,0|1,0,1]=4 2439 B8R0.8 NC(CCNO)C(=O)O Amb28285114 [1,1,0,0,0,0|1,0,1]=4 2440 B8R0.8 NC(C\C=C\Br)C(=O)O Amb27607572 [1,1,0,0,0,0|2,0,0]=4 2441 B8R0.8 NC(C\C=C\Cl)C(=O)O Amb33037023 [1,1,0,0,0,0|2,0,0]=4 2442 B8R0.8 NCCC[C@H](O)C(=O)O Amb27804309 [1,1,0,0,0,0|1,0,1]=4 2443 B8R0.8 NOCCC(N)C(=O)O Amb17593409 [1,1,0,0,0,0|1,0,1]=4 2444 B8R0.8 NOCCC(N)C(=O)O Amb21858490 [1,1,0,0,0,0|1,0,1]=4 2445 B8R0.8 NOCC[C@H](N)C(=O)O Amb26346874 [1,1,0,0,0,0|1,0,1]=4 2446 B8R0.8 NOCC[C@H](N)C(=O)O Amb33038084 [1,1,0,0,0,0|1,0,1]=4 2447 B8R0.8 N[C@@H](CCCO)C(=O)O Amb16183887 [1,1,0,0,0,0|1,0,1]=4 2448 B8R0.8 N[C@@H](CCNO)C(=O)O Amb24117852 [1,1,0,0,0,0|1,0,1]=4 2449 B8R0.8 N[C@@H](CSCO)C(=O)O Amb27470985 [1,1,0,0,0,0|1,0,1]=4 2450 B8R0.8 N[C@@H](CSN=O)C(=O)O Amb28182982 [1,1,0,0,0,0|2,0,0]=4 2451 B8R0.8 N[C@@H](C\C=C\Cl)C(=O)O Amb33065741 [1,1,0,0,0,0|2,0,0]=4 2452 B8R0.8 N[C@H](CCCO)C(=O)O Amb28120579 [1,1,0,0,0,0|1,0,1]=4 2453 B8R0.8 N[C@H](CCCO)C(=O)O Amb34913429 [1,1,0,0,0,0|1,0,1]=4 2454 B8R0.8 N[C@H](CSN=O)C(=O)O Amb27845439 [1,1,0,0,0,0|2,0,0]=4 2455 B8R0.8 N[C@H](C\C=C\Cl)C(=O)O Amb33309034 [1,1,0,0,0,0|2,0,0]=4 2456 B8R0.8 O=C(O)C(Br)CCCO Amb28313364 [1,1,0,0,0,0|1,0,1]=4 2457 B8R0.8 O=C(O)C(O)CC#CBr Amb27634839 [1,1,0,0,0,0|1,0,1]=4 2458 B8R0.8 O=C(O)C(O)CCCF Amb33196454 [1,1,0,0,0,0|1,0,1]=4 2459 B8R0.8 O=C(O)C(O)CCCO Amb18642939 [1,1,0,0,0,0|0,0,1]=3 2460 B8R0.8 O=C([O-])C(O)CCCO Amb28935028 [1,1,0,0,0,0|0,0,2]=4 2461 B8R0.8 O=C=NC[C@@H](F)C(=O)O Amb33037069 [1,1,0,0,0,0|1,0,1]=4 2462 B8R0.8 O=CCCC(=O)C(=O)O Amb27882544 [1,1,0,0,0,0|0,0,2]=4 2463 B8R0.8 O=CCCC(=O)C(=O)O Amb32670694 [1,1,0,0,0,0|0,0,2]=4 2464 B8R0.8 O=CNC[C@@H](O)C(=O)O Amb27637039 [1,1,0,0,0,0|0,0,0]=2 2465 B8R0.8 O=COCC(Cl)C(=O)O Amb27477082 [1,1,0,0,0,0|1,0,0]=3 2466 B8R0.12 C=C(C)C(C)(O)CC=O Amb27754858 [1,1,0,0,0,0|2,0,0]=4 2467 B8R0.12 C=CCC(C)(C)C(=O)O Amb10603495 [1,1,0,0,0,0|2,0,0]=4 2468 B8R0.12 C=CCC(F)(F)C(=O)O Amb10982503 [1,1,0,0,0,0|2,0,0]=4 2469 B8R0.12 C=CC[C@@](C)(N)C(=O)O Amb8389450 [1,1,0,0,0,0|2,0,0]=4 2470 B8R0.12 C=CC[C@@](C)(O)C(=O)O Amb27412350 [1,1,0,0,0,0|1,0,0]=3 2471 B8R0.12 C=CC[C@@](C)(O)C(C)=O Amb28053999 [1,1,0,0,0,0|2,0,0]=4 2472 B8R0.12 C=CC[C@](C)(N)C(=O)O Amb8514992 [1,1,0,0,0,0|2,0,0]=4 2473 B8R0.12 C=CC[C@](C)(O)C(=O)O Amb27958223 [1,1,0,0,0,0|1,0,0]=3 2474 B8R0.12 CC(C)(CC=O)C(N)=O Amb28437049 [1,1,0,0,0,0|2,0,0]=4 2475 B8R0.12 CC(C)(CCO)C(=O)O Amb24763728 [1,1,0,0,0,0|1,0,1]=4 2476 B8R0.12 CC(C)(NC=O)C(=O)O Amb18281022 [1,1,0,0,0,0|2,0,0]=4 2477 B8R0.12 CC(O)(CC#N)C(=O)O Amb27260344 [1,1,0,0,0,0|1,0,1]=4 2478 B8R0.12 CC(O)(CCF)C(=O)O Amb33379277 [1,1,0,0,0,0|1,0,1]=4 2479 B8R0.12 CCCC(C)(O)C(=O)O Amb18288835 [1,1,0,0,0,0|1,0,1]=4 2480 B8R0.12 CNCC(C)(O)C(=O)O Amb27478763 [1,1,0,0,0,0|2,0,0]=4 2481 B8R0.12 COCC(C)(O)C(=O)O Amb18992608 [1,1,0,0,0,0|2,0,0]=4 2482 B8R0.12 C[C@@](N)(CCO)C(=O)O Amb28048736 [1,1,0,0,0,0|1,0,1]=4 2483 B8R0.12 C[C@](O)(NC=O)C(=O)O Amb27628573 [1,1,0,0,0,0|1,0,0]=3 2484 B8R0.12 O=C(O)C(F)(F)CNO Amb33170566 [1,1,0,0,0,0|2,0,0]=4 2485 B8R0.15 C=CCC(C#N)C(=O)O Amb27657209 [1,1,0,0,0,0|2,0,0]=4 2486 B8R0.15 C=CCC(C=O)C(=O)O Amb28313315 [1,1,0,0,0,0|1,0,1]=4 2487 B8R0.15 C=CCC(CC)C(=O)O Amb18642632 [1,1,0,0,0,0|2,0,0]=4 2488 B8R0.15 C=CCC(NO)C(=O)O Amb27768789 [1,1,0,0,0,0|1,0,0]=3 2489 B8R0.15 C=CC[C@@H](C=C)C(=O)O Amb28285259 [1,1,0,0,0,0|2,0,0]=4 2490 B8R0.15 CCC(CCO)C(=O)O Amb18642884 [1,1,0,0,0,0|1,0,1]=4 2491 B8R0.15 CCC(NC=O)C(=O)O Amb4016839 [1,1,0,0,0,0|2,0,0]=4 2492 B8R0.15 CCCC(CO)C(=O)O Amb25881510 [1,1,0,0,0,0|1,0,1]=4 2493 B8R0.15 CCCC(NO)C(=O)O Amb22372057 [1,1,0,0,0,0|1,0,1]=4 2494 B8R0.15 CCCC(OC)C(=O)O Amb8455302 [1,1,0,0,0,0|1,0,1]=4 2495 B8R0.15 CCC[C@@H](CO)C(=O)O Amb24571859 [1,1,0,0,0,0|1,0,1]=4 2496 B8R0.15 CCC[C@H](CO)C(=O)O Amb25063310 [1,1,0,0,0,0|1,0,1]=4 2497 B8R0.15 CNC(CCO)C(=O)O Amb27390592 [1,1,0,0,0,0|1,0,1]=4 2498 B8R0.15 CNCC(CO)C(=O)O Amb26352745 [1,1,0,0,0,0|2,0,0]=4 2499 B8R0.15 CNCC(CO)C(=O)O Amb32661056 [1,1,0,0,0,0|2,0,0]=4 2500 B8R0.15 COC(CC#N)C(=O)O Amb27157791 [1,1,0,0,0,0|1,0,1]=4 2501 B8R0.15 COC(CCF)C(=O)O Amb33379286 [1,1,0,0,0,0|1,0,1]=4 2502 B8R0.15 COC(CCN)C(=O)O Amb26631814 [1,1,0,0,0,0|1,0,1]=4 2503 B8R0.15 COC(CCN)C(=O)O Amb32661022 [1,1,0,0,0,0|1,0,1]=4 2504 B8R0.15 COCC(NO)C(=O)O Amb27247213 [1,1,0,0,0,0|2,0,0]=4 2505 B8R0.15 COCC(OC)C(=O)O Amb26627988 [1,1,0,0,0,0|2,0,0]=4 2506 B8R0.15 COCC(ON)C(=O)O Amb27251693 [1,1,0,0,0,0|2,0,0]=4 2507 B8R0.15 COCC(ON)C(=O)O Amb32670944 [1,1,0,0,0,0|2,0,0]=4 2508 B8R0.15 C\C=N\[C@H](CO)C(=O)O Amb28423512 [1,1,0,0,0,0|2,0,0]=4 2509 B8R0.15 N#CC(CCO)C(=O)O Amb35741464 [1,1,0,0,0,0|1,0,1]=4 2510 B8R0.15 N#CC(NC=O)C(=O)O Amb27444484 [1,1,0,0,0,0|2,0,0]=4 2511 B8R0.15 O=C(O)C(CO)CCF Amb27876842 [1,1,0,0,0,0|1,0,1]=4 2512 B8R0.15 O=CNC(CO)C(=O)O Amb18290435 [1,1,0,0,0,0|1,0,0]=3 2513 B8R0.15 O=CNC(CS)C(=O)O Amb20093366 [1,1,0,0,0,0|1,1,0]=4 2514 B8R0.15 O=CN[C@H](CO)C(=O)O Amb28248397 [1,1,0,0,0,0|1,0,0]=3 2515 B8R0.9 BO\C(O)=C/CC(=O)O Amb27797365 [1,1,0,0,0,0|0,0,2]=4 2516 B8R0.9 C#CC(=C)CCC(=O)O Amb27655639 [1,1,0,0,0,0|2,0,0]=4 2517 B8R0.9 C#CC(=O)NCC(=O)O Amb6270091 [1,1,0,0,0,0|2,0,0]=4 2518 B8R0.9 C=C(C=O)CCC(=O)O Amb27655564 [1,1,0,0,0,0|1,0,0]=3 2519 B8R0.9 C=CC(=C)CCC(=O)O Amb18642412 [1,1,0,0,0,0|2,0,0]=4 2520 B8R0.9 C=CC(=O)NCC(=O)O Amb33532656 [1,1,0,0,0,0|2,0,0]=4 2521 B8R0.9 C=CC(=O)OCC(=O)O Amb27241348 [1,1,0,0,0,0|2,0,0]=4 2522 B8R0.9 C=CC(=O)SCC(=O)O Amb27755823 [1,1,0,0,0,0|2,0,0]=4 2523 B8R0.9 C=CC(O)CCC(=O)O Amb25785193 [1,1,0,0,0,0|1,0,1]=4 2524 B8R0.9 C=C[C@H](O)CCC(=O)O Amb27168215 [1,1,0,0,0,0|1,0,1]=4 2525 B8R0.9 CC(=O)CCC(=O)NN Amb25793418 [1,1,0,0,0,0|2,0,0]=4 2526 B8R0.9 CC(=O)CCC(=O)NO Amb26971070 [1,1,0,0,0,0|1,0,0]=3 2527 B8R0.9 CC(=O)NCC(=O)CO Amb27494067 [1,1,0,0,0,0|2,0,0]=4 2528 B8R0.9 CC(=O)NCC(=O)NO Amb25340085 [1,1,0,0,0,0|2,0,0]=4 2529 B8R0.9 CC(=O)OCC(=O)CO Amb28253910 [1,1,0,0,0,0|2,0,0]=4 2530 B8R0.9 CC(CCC(=O)O)NO Amb27945567 [1,1,0,0,0,0|1,0,1]=4 2531 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [1,1,0,0,0,0|1,0,0]=3 2532 B8R0.9 CCC(=O)CCC(C)=O Amb17593347 [1,1,0,0,0,0|2,0,0]=4 2533 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [1,1,0,0,0,0|2,0,0]=4 2534 B8R0.9 CCC(O)CCC(=O)O Amb27149373 [1,1,0,0,0,0|1,0,1]=4 2535 B8R0.9 CCS(=O)CCC(=O)O Amb9173461 [1,1,0,0,0,0|2,0,0]=4 2536 B8R0.9 CC[C@H](O)CCC(=O)O Amb27170465 [1,1,0,0,0,0|1,0,1]=4 2537 B8R0.9 CN(CCC(=O)O)N=O Amb17618592 [1,1,0,0,0,0|2,0,0]=4 2538 B8R0.9 CNC(=O)CCC(=O)O Amb2720937 [1,1,0,0,0,0|1,0,0]=3 2539 B8R0.9 CNC(=O)CCC(C)=O Amb17334107 [1,1,0,0,0,0|2,0,0]=4 2540 B8R0.9 CNC(=O)CCC(N)=O Amb17334114 [1,1,0,0,0,0|2,0,0]=4 2541 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [1,1,0,0,0,0|2,0,0]=4 2542 B8R0.9 CNC(=O)OCC(=O)O Amb30018932 [1,1,0,0,0,0|2,0,0]=4 2543 B8R0.9 COC(=O)CCB(O)O Amb25705142 [1,1,0,0,0,0|1,0,1]=4 2544 B8R0.9 COC(=O)CCC(=O)Cl Amb3939311 [1,1,0,0,0,0|1,0,0]=3 2545 B8R0.9 COC(=O)CCC(=O)O Amb6538024 [1,1,0,0,0,0|0,0,0]=2 2546 B8R0.9 COC(=O)CCC(C)=O Amb13777321 [1,1,0,0,0,0|1,0,0]=3 2547 B8R0.9 COC(=O)CCC(C)O Amb26459430 [1,1,0,0,0,0|1,0,1]=4 2548 B8R0.9 COC(=O)CCC(N)=O Amb24323351 [1,1,0,0,0,0|1,0,0]=3 2549 B8R0.9 COC(=O)CCC(N)=S Amb18108081 [1,1,0,0,0,0|1,1,0]=4 2550 B8R0.9 COC(=O)CCS(=O)Cl Amb25944850 [1,1,0,0,0,0|2,0,0]=4 2551 B8R0.9 COC(=O)CCS(=O)O Amb25967240 [1,1,0,0,0,0|1,0,0]=3 2552 B8R0.9 COC(=O)CCS(=O)[O-] Amb21520328 [1,1,0,0,0,0|1,0,1]=4 2553 B8R0.9 COC(=O)CCS(N)=O Amb32720304 [1,1,0,0,0,0|2,0,0]=4 2554 B8R0.9 COC(=O)CC[N+](=O)[O-] Amb26494342 [1,1,0,0,0,0|1,0,1]=4 2555 B8R0.9 COC(=O)CNC(C)=O Amb3886556 [1,1,0,0,0,0|2,0,0]=4 2556 B8R0.9 COC(=O)CNC(N)=O Amb1126846 [1,1,0,0,0,0|2,0,0]=4 2557 B8R0.9 COC(=O)COC(C)=O Amb28049254 [1,1,0,0,0,0|2,0,0]=4 2558 B8R0.9 COC(=O)NCC(=O)Cl Amb28388481 [1,1,0,0,0,0|2,0,0]=4 2559 B8R0.9 COC(=O)NCC(=O)O Amb3941451 [1,1,0,0,0,0|1,0,0]=3 2560 B8R0.9 COC(=O)NCC(C)=O Amb28461105 [1,1,0,0,0,0|2,0,0]=4 2561 B8R0.9 COC(=O)NCC(N)=O Amb27640170 [1,1,0,0,0,0|2,0,0]=4 2562 B8R0.9 COC(=O)OCC(=O)Cl Amb8393900 [1,1,0,0,0,0|2,0,0]=4 2563 B8R0.9 COC(=O)OCC(=O)O Amb8393899 [1,1,0,0,0,0|1,0,0]=3 2564 B8R0.9 COC(=O)\C=C/C(=O)O Amb6295872 [1,1,0,0,0,0|0,0,2]=4 2565 B8R0.9 COC(=O)\C=C\C(=O)O Amb33511119 [1,1,0,0,0,0|0,0,2]=4 2566 B8R0.9 COC(=S)SCC(=O)O Amb26653180 [1,1,0,0,0,0|1,1,0]=4 2567 B8R0.9 COC(C)CCC(=O)O Amb24271104 [1,1,0,0,0,0|1,0,1]=4 2568 B8R0.9 CON(C)CCC(=O)O Amb27881744 [1,1,0,0,0,0|2,0,0]=4 2569 B8R0.9 CO[C@@H](C)CCC(=O)O Amb28241276 [1,1,0,0,0,0|1,0,1]=4 2570 B8R0.9 CO\C(C)=C\CC(=O)O Amb27963206 [1,1,0,0,0,0|1,0,1]=4 2571 B8R0.9 CO\P(=O)=C\CC(=O)O Amb27199324 [1,1,0,0,0,0|1,0,1]=4 2572 B8R0.9 C\C(CCC(=O)O)=N/O Amb25138471 [1,1,0,0,0,0|1,0,0]=3 2573 B8R0.9 NC(CO)CCC(=O)O Amb18642916 [1,1,0,0,0,0|1,0,1]=4 2574 B8R0.9 NC(CO)CCC(=O)O Amb32665461 [1,1,0,0,0,0|1,0,1]=4 2575 B8R0.9 NCC(=O)CCC(=O)O Amb2720232 [1,1,0,0,0,0|1,0,0]=3 2576 B8R0.9 NCC(=O)CCC(=O)O Amb5395775 [1,1,0,0,0,0|1,0,0]=3 2577 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [1,1,0,0,0,0|2,0,0]=4 2578 B8R0.9 NCC(=O)NCC(=O)O Amb8382637 [1,1,0,0,0,0|2,0,0]=4 2579 B8R0.9 NCC(O)CCC(=O)O Amb29838305 [1,1,0,0,0,0|1,0,1]=4 2580 B8R0.9 NC[C@@H](O)CCC(=O)O Amb27477096 [1,1,0,0,0,0|1,0,1]=4 2581 B8R0.9 NNC(=O)CCC(N)=O Amb595603 [1,1,0,0,0,0|2,0,0]=4 2582 B8R0.9 NNC(=O)NCC(=O)O Amb27623574 [1,1,0,0,0,0|2,0,0]=4 2583 B8R0.9 N[C@H](CO)CCC(=O)O Amb24685421 [1,1,0,0,0,0|1,0,1]=4 2584 B8R0.9 N[C@H](CO)CCC(=O)O Amb32664911 [1,1,0,0,0,0|1,0,1]=4 2585 B8R0.9 O=C(O)CCC(=O)CCl Amb25736440 [1,1,0,0,0,0|1,0,0]=3 2586 B8R0.9 O=C(O)CCC(O)CCl Amb27799910 [1,1,0,0,0,0|1,0,1]=4 2587 B8R0.9 O=C(O)CC\C(O)=N\O Amb24745795 [1,1,0,0,0,0|0,0,1]=3 2588 B8R0.9 O=C(O)CNC(=O)CCl Amb1144436 [1,1,0,0,0,0|2,0,0]=4 2589 B8R0.9 O=C(O)CNC(=O)CO Amb18124375 [1,1,0,0,0,0|1,0,0]=3 2590 B8R0.9 O=C(O)COC(=O)CCl Amb18644547 [1,1,0,0,0,0|2,0,0]=4 2591 B8R0.9 O=C(O)CSC(=O)CS Amb27213308 [1,1,0,0,0,0|1,1,0]=4 2592 B8R0.9 O=C(O)\C=C\C(=O)NO Amb28060797 [1,1,0,0,0,0|0,0,2]=4 2593 B8R0.9 O=CC(=O)CCC(=O)O Amb18642737 [1,1,0,0,0,0|0,0,1]=3 2594 B8R0.9 O=NN(O)CCC(=O)O Amb27495384 [1,1,0,0,0,0|1,0,0]=3 2595 B8R0.29 CP(=O)(O)CCC(=O)O Amb1792559 [1,1,0,0,0,0|1,0,0]=3 2596 B8R0.29 CP(=O)(O)OCC(=O)O Amb26578720 [1,1,0,0,0,0|2,0,0]=4 2597 B8R0.29 CS(=O)(=O)CCC(=O)O Amb6275720 [1,1,0,0,0,0|1,0,1]=4 2598 B8R0.29 NS(=O)(=O)CCC(=O)O Amb6741826 [1,1,0,0,0,0|1,0,1]=4 2599 B8R0.29 O=C(O)CCP(=O)(O)O Amb2228990 [1,1,0,0,0,0|1,0,0]=3 2600 B8R0.29 O=C(O)CCS(=O)(=O)O Amb17399954 [1,1,0,0,0,0|1,0,0]=3 2601 B8R0.29 O=C(O)CCS(=O)(=O)[O-] Amb28960294 [1,1,0,0,0,0|1,0,1]=4 2602 B8R0.29 O=C(O)COP(=O)(O)O Amb24442945 [1,1,0,0,0,0|2,0,0]=4 2603 B8R0.18 C#CC(C(=O)O)C(=O)O Amb27493331 [0,1,0,0,1,0|1,0,0]=3 2604 B8R0.18 C=C(C)C(OC)C(=O)O Amb27219440 [0,1,0,0,1,0|2,0,0]=4 2605 B8R0.18 C=CC(C(=O)O)C(=O)O Amb27655691 [0,1,0,0,1,0|1,0,0]=3 2606 B8R0.18 CC=C(C(=O)O)C(=O)O Amb27439270 [0,1,0,0,1,0|1,0,1]=4 2607 B8R0.18 CCC(C(=O)O)C(=O)O Amb6297197 [0,1,0,0,1,0|1,0,0]=3 2608 B8R0.18 CCC(C(N)=O)C(=O)O Amb28410332 [0,1,0,0,1,0|2,0,0]=4 2609 B8R0.18 COC(C(=O)O)C(=O)O Amb27396318 [0,1,0,0,1,0|0,0,0]=2 2610 B8R0.18 COC(C(=O)O)C(C)O Amb26003623 [0,1,0,0,1,0|1,0,1]=4 2611 B8R0.18 COC(C(C)=O)C(C)=O Amb25913550 [0,1,0,0,1,0|2,0,0]=4 2612 B8R0.18 CSC(C(=O)O)C(=O)O Amb27407760 [0,1,0,0,1,0|0,1,0]=3 2613 B8R0.18 N#CC(C(N)=O)C(=O)O Amb28121468 [0,1,0,0,1,0|2,0,0]=4 2614 B8R0.18 NC=C(C(=O)O)C(=O)O Amb27236633 [0,1,0,0,1,0|1,0,1]=4 2615 B8R0.18 NCC(C(=O)O)C(=O)O Amb27408219 [0,1,0,0,1,0|1,0,0]=3 2616 B8R0.18 O=C(O)C(=CBr)C(=O)O Amb9825194 [0,1,0,0,1,0|1,0,1]=4 2617 B8R0.18 O=C(O)C(CO)C(=O)O Amb27849072 [0,1,0,0,1,0|0,0,0]=2 2618 B8R0.27 CC(C(=O)O)P(=O)(O)O Amb9814224 [0,1,0,0,1,0|2,0,0]=4 2619 B8R0.27 CC(C(=O)O)S(=O)(=O)O Amb25765487 [0,1,0,0,1,0|2,0,0]=4 2620 B8R0.27 CC(C)(O)C(O)C(=O)O Amb25118477 [0,1,0,0,1,0|1,0,1]=4 2621 B8R0.27 CC(C)(O)[C@@H](O)C(=O)O Amb27974877 [0,1,0,0,1,0|1,0,1]=4 2622 B8R0.27 CC(C)(O)[C@H](O)C(=O)O Amb27469612 [0,1,0,0,1,0|1,0,1]=4 2623 B8R0.27 CP(C)(=O)C(O)C(=O)O Amb22231894 [0,1,0,0,1,0|2,0,0]=4 2624 B8R0.27 C[C@H](C(=O)O)S(=O)(=O)O Amb28385771 [0,1,0,0,1,0|2,0,0]=4 2625 B8R0.27 O=C(O)C(O)P(=O)(O)O Amb24117287 [0,1,0,0,1,0|1,0,0]=3 2626 B8R0.37 CC(=O)C(C)(C)C(=O)O Amb18642784 [0,1,0,0,1,0|2,0,0]=4 2627 B8R0.37 CC(=O)C(C)(O)C(=O)Cl Amb27227227 [0,1,0,0,1,0|2,0,0]=4 2628 B8R0.37 CC(=O)C(C)(O)C(=O)O Amb18642870 [0,1,0,0,1,0|1,0,0]=3 2629 B8R0.37 CC(C)(C(=O)O)C(=O)Cl Amb17593749 [0,1,0,0,1,0|2,0,0]=4 2630 B8R0.37 CC(C)(C(=O)O)C(=O)O Amb2613653 [0,1,0,0,1,0|1,0,0]=3 2631 B8R0.37 CC(C)(C(N)=O)C(=O)O Amb8386802 [0,1,0,0,1,0|2,0,0]=4 2632 B8R0.37 CC(N)(C(=O)O)C(=O)O Amb28347069 [0,1,0,0,1,0|1,0,0]=3 2633 B8R0.37 CC(N)(C(N)=O)C(=O)O Amb27593792 [0,1,0,0,1,0|2,0,0]=4 2634 B8R0.37 CC(O)(C(N)=O)C(N)=O Amb28255865 [0,1,0,0,1,0|2,0,0]=4 2635 B8R0.37 CC(O)C(C)(O)C(=O)O Amb18124401 [0,1,0,0,1,0|1,0,1]=4 2636 B8R0.37 C[C@H](O)[C@](C)(O)C(=O)O Amb27974163 [0,1,0,0,1,0|1,0,1]=4 2637 B8R0.37 NC(=O)C(F)(F)C(=O)O Amb24385040 [0,1,0,0,1,0|2,0,0]=4 2638 B8R0.37 NC(=O)C(F)(F)C(=O)O Amb33496126 [0,1,0,0,1,0|2,0,0]=4 2639 B8R0.37 O=C(O)C(Cl)(Cl)C(=O)O Amb17594338 [0,1,0,0,1,0|1,0,0]=3 2640 B8R0.37 O=C(O)C(F)(F)C(=O)O Amb24088375 [0,1,0,0,1,0|1,0,0]=3 2641 B8R0.37 O=C(O)C(O)(Br)C(=O)O Amb27634888 [0,1,0,0,1,0|0,0,0]=2 2642 B8R0.37 O=C(O)C(O)(O)C(=O)O Amb22002022 [0,1,0,0,1,0|0,0,0]=2 2643 B10R0.12 NC(CCC(=O)O)P(=O)(O)O Amb28388181 [0,1,0,0,0,1|2,0,0]=4 2644 B10R0.13 CC(=O)C(C)C(C)CC(=O)O Amb18645031 [0,1,0,0,0,1|2,0,0]=4 2645 B10R0.13 CC(=O)CC(C)C(C)C(=O)O Amb18126130 [0,1,0,0,0,1|2,0,0]=4 2646 B10R0.13 CC(=O)NC(C)C(C)C(=O)O Amb28137397 [0,1,0,0,0,1|2,0,0]=4 2647 B10R0.13 CC(=O)N[C@@H](C)[C@H](O)C(=O)O Amb27477763 [0,1,0,0,0,1|1,0,0]=3 2648 B10R0.13 CC(=O)OC(C)C(N)C(=O)O Amb25385009 [0,1,0,0,0,1|2,0,0]=4 2649 B10R0.13 CC(=O)OC(C)C(O)C(C)=O Amb27672515 [0,1,0,0,0,1|2,0,0]=4 2650 B10R0.13 CC(=O)O[C@@H](C)[C@@H](N)C(=O)O Amb22747815 [0,1,0,0,0,1|2,0,0]=4 2651 B10R0.13 CC(=O)O[C@H](C)[C@H](N)C(=O)O Amb27272567 [0,1,0,0,0,1|2,0,0]=4 2652 B10R0.13 CC(C(=O)O)S(=O)CC(N)=O Amb18304636 [0,1,0,0,0,1|2,0,0]=4 2653 B10R0.13 CC(C(N)=O)S(=O)CC(=O)O Amb18305129 [0,1,0,0,0,1|2,0,0]=4 2654 B10R0.13 CC(CC(=O)O)C(C)C(=O)O Amb4009129 [0,1,0,0,0,1|1,0,0]=3 2655 B10R0.13 CC(CC(=O)O)C(N)C(=O)O Amb23440872 [0,1,0,0,0,1|1,0,0]=3 2656 B10R0.13 CC(CC(=O)O)C(N)C(N)=O Amb27989322 [0,1,0,0,0,1|2,0,0]=4 2657 B10R0.13 CC(CC(=O)O)[C@H](N)C(=O)O Amb26990553 [0,1,0,0,0,1|1,0,0]=3 2658 B10R0.13 CC(CC(N)=O)C(N)C(=O)O Amb27989323 [0,1,0,0,0,1|2,0,0]=4 2659 B10R0.13 CC(OC(N)=O)C(N)C(=O)O Amb26082810 [0,1,0,0,0,1|2,0,0]=4 2660 B10R0.13 CN(CC(=O)O)C(=O)C(=O)O Amb26660524 [0,1,0,0,0,1|0,0,2]=4 2661 B10R0.13 C[C@@H](CC(=O)O)[C@@H](N)C(=O)O Amb19133152 [0,1,0,0,0,1|1,0,0]=3 2662 B10R0.13 C[C@@H](CC(=O)O)[C@H](N)C(=O)O Amb28388115 [0,1,0,0,0,1|1,0,0]=3 2663 B10R0.13 C[C@H](CC(=O)O)[C@@H](N)C(=O)O Amb28388114 [0,1,0,0,0,1|1,0,0]=3 2664 B10R0.13 C[C@H](O)[C@H](O)[C@@H](O)CC(=O)O Amb27990155 [0,1,0,0,0,1|1,0,1]=4 2665 B10R0.13 C\C(=C/C(=O)O)C(O)C(=O)O Amb28119844 [0,1,0,0,0,1|0,0,1]=3 2666 B10R0.13 C\C(C(=O)O)=C(\Cl)CC(=O)O Amb28077775 [0,1,0,0,0,1|1,0,1]=4 2667 B10R0.13 NC(=O)C[C@@H](O)[C@@H](N)C(=O)O Amb27990186 [0,1,0,0,0,1|2,0,0]=4 2668 B10R0.13 NC(=O)[C@@H](N)[C@H](O)CC(=O)O Amb27990184 [0,1,0,0,0,1|2,0,0]=4 2669 B10R0.13 NC(=O)[C@H](N)[C@H](O)CC(=O)O Amb27990185 [0,1,0,0,0,1|2,0,0]=4 2670 B10R0.13 NC(C(=O)O)C(O)CC(=O)O Amb25383245 [0,1,0,0,0,1|1,0,0]=3 2671 B10R0.13 NC(C(=O)O)\C(Cl)=C\C(=O)O Amb24374819 [0,1,0,0,0,1|1,0,1]=4 2672 B10R0.13 NC(CC(=O)O)C(O)C(=O)O Amb26083654 [0,1,0,0,0,1|0,0,0]=2 2673 B10R0.13 NC(CC(=O)O)[C@H](N)C(=O)O Amb24764806 [0,1,0,0,0,1|1,0,0]=3 2674 B10R0.13 N[C@@H](C(=O)O)[C@@H](O)CC(=O)O Amb27990015 [0,1,0,0,0,1|1,0,0]=3 2675 B10R0.13 N[C@H](C(=O)O)C(F)CC(=O)O Amb26083316 [0,1,0,0,0,1|1,0,0]=3 2676 B10R0.13 O=C(O)CC(Br)C(=O)C(=O)O Amb33756838 [0,1,0,0,0,1|0,0,2]=4 2677 B10R0.43 CC(=O)C(C)(C)CCC(=O)O Amb18126156 [0,1,0,0,0,1|2,0,0]=4 2678 B10R0.43 CC(=O)C(C)(C)SCC(=O)O Amb27990168 [0,1,0,0,0,1|2,0,0]=4 2679 B10R0.43 CC(=O)CCC(C)(C)C(=O)O Amb18645019 [0,1,0,0,0,1|2,0,0]=4 2680 B10R0.43 CC(=O)NCC(C)(C)C(=O)O Amb33548160 [0,1,0,0,0,1|2,0,0]=4 2681 B10R0.43 CC(=O)NCC(C)(O)C(=O)O Amb28044387 [0,1,0,0,0,1|1,0,0]=3 2682 B10R0.43 CC(=O)NCC(F)(F)C(=O)O Amb27840273 [0,1,0,0,0,1|2,0,0]=4 2683 B10R0.43 CC(=O)OCC(C)(C)C(=O)O Amb27269198 [0,1,0,0,0,1|2,0,0]=4 2684 B10R0.43 CC(=O)SCC(C)(C)C(=O)O Amb27818773 [0,1,0,0,0,1|2,0,0]=4 2685 B10R0.43 CC(C)(CCC(=O)O)C(=O)O Amb2721065 [0,1,0,0,0,1|1,0,0]=3 2686 B10R0.43 CC(C)(CNC(N)=O)C(=O)O Amb27401824 [0,1,0,0,0,1|2,0,0]=4 2687 B10R0.43 CC(C)(NCC(=O)O)C(=O)O Amb27000181 [0,1,0,0,0,1|1,0,0]=3 2688 B10R0.43 CC(C)(NCC(=O)O)C(N)=O Amb18306310 [0,1,0,0,0,1|2,0,0]=4 2689 B10R0.43 CC(C)(NCC(N)=O)C(=O)O Amb18306733 [0,1,0,0,0,1|2,0,0]=4 2690 B10R0.43 CC(C)(SCC(=O)O)C(=O)O Amb17501462 [0,1,0,0,0,1|1,0,0]=3 2691 B10R0.43 CC(C)(SCC(N)=O)C(=O)O Amb17501450 [0,1,0,0,0,1|2,0,0]=4 2692 B10R0.43 CC(C)=CCC(C)(O)C(=O)O Amb27864040 [0,1,0,0,0,1|2,0,0]=4 2693 B10R0.43 CC(N)(CCC(=O)O)C(=O)O Amb22801426 [0,1,0,0,0,1|1,0,0]=3 2694 B10R0.43 CC(N)(CCC(=O)O)C(=O)O Amb3940869 [0,1,0,0,0,1|1,0,0]=3 2695 B10R0.43 CC(N)(\C=C\C(=O)O)C(=O)O Amb27401910 [0,1,0,0,0,1|1,0,1]=4 2696 B10R0.43 CS(=O)NCC(C)(O)C(=O)O Amb27272530 [0,1,0,0,0,1|2,0,0]=4 2697 B10R0.43 C[C@@](N)(CCC(=O)O)C(=O)O Amb8629033 [0,1,0,0,0,1|1,0,0]=3 2698 B10R0.43 C[C@](N)(CCC(=O)O)C(=O)O Amb8629032 [0,1,0,0,0,1|1,0,0]=3 2699 B10R0.43 NC(=O)C(N)(O)CCC(=O)O Amb28080506 [0,1,0,0,0,1|1,0,0]=3 2700 B10R0.43 NC(=O)C(O)(Cl)CCC(=O)O Amb27990215 [0,1,0,0,0,1|1,0,0]=3 2701 B10R0.43 NC(=O)CCC(N)(F)C(=O)O Amb10839407 [0,1,0,0,0,1|2,0,0]=4 2702 B10R0.43 NC(N)(CCC(=O)O)C(=O)O Amb26076861 [0,1,0,0,0,1|1,0,0]=3 2703 B10R0.43 O=C(O)CCC(F)(F)C(=O)O Amb22263070 [0,1,0,0,0,1|1,0,0]=3 2704 B10R0.43 O=C(O)CCC(O)(O)C(=O)O Amb27271130 [0,1,0,0,0,1|0,0,0]=2 2705 B10R0.57 CNC(=O)C(C)NCC(=O)O Amb9325887 [0,1,0,0,0,1|2,0,0]=4 2706 B10R0.57 CNC(=O)C(C)SCC(=O)O Amb9203226 [0,1,0,0,0,1|2,0,0]=4 2707 B10R0.57 CNC(=O)C(N)CCC(=O)O Amb27987066 [0,1,0,0,0,1|2,0,0]=4 2708 B10R0.57 CNC(=O)[C@@H](N)CCC(=O)O Amb27671844 [0,1,0,0,0,1|2,0,0]=4 2709 B10R0.57 COC(=O)C(C)CNC(C)=O Amb25385897 [0,1,0,0,0,1|2,0,0]=4 2710 B10R0.57 COC(=O)C(Cl)CSC(C)=O Amb33620490 [0,1,0,0,0,1|2,0,0]=4 2711 B10R0.57 COC(=O)C(N)CCC(C)=O Amb32645698 [0,1,0,0,0,1|2,0,0]=4 2712 B10R0.57 COC(=O)C(N)CCC(N)=O Amb32752608 [0,1,0,0,0,1|2,0,0]=4 2713 B10R0.57 COC(=O)C(N)COC(C)=O Amb33803614 [0,1,0,0,0,1|2,0,0]=4 2714 B10R0.57 COC(=O)C(O)CNC(C)=O Amb27672462 [0,1,0,0,0,1|1,0,0]=3 2715 B10R0.57 COC(=O)[C@@H](N)CCC(=O)O Amb8390399 [0,1,0,0,0,1|1,0,0]=3 2716 B10R0.57 COC(=O)[C@@H](N)CCC(N)=O Amb8629195 [0,1,0,0,0,1|2,0,0]=4 2717 B10R0.57 COC(=O)[C@@H](N)CNC(C)=O Amb27990246 [0,1,0,0,0,1|2,0,0]=4 2718 B10R0.57 COC(=O)[C@@H](N)CNC(N)=O Amb27989967 [0,1,0,0,0,1|2,0,0]=4 2719 B10R0.57 COC(=O)[C@H](Cl)CNC(C)=O Amb27989995 [0,1,0,0,0,1|2,0,0]=4 2720 B10R0.57 COC(=O)[C@H](N)CCC(=O)O Amb33801734 [0,1,0,0,0,1|1,0,0]=3 2721 B10R0.57 COC(=O)[C@H](N)CCC(=O)O Amb33866552 [0,1,0,0,0,1|1,0,0]=3 2722 B10R0.57 COC(=O)[C@H](N)CCC(=O)[O-] Amb34915024 [0,1,0,0,0,1|1,0,1]=4 2723 B10R0.57 COC(=O)[C@H](N)CCC(N)=O Amb8629196 [0,1,0,0,0,1|2,0,0]=4 2724 B10R0.57 NC(CCC(=O)O)C(=O)NO Amb27987067 [0,1,0,0,0,1|1,0,0]=3 2725 B10R0.57 NNC(=O)C(N)CCC(=O)O Amb27987068 [0,1,0,0,0,1|2,0,0]=4 2726 B10R0.57 O=C(O)CNC(=O)C(=O)CO Amb27988470 [0,1,0,0,0,1|0,0,2]=4 2727 B10R0.82 C#CC(=O)NCC(N)C(=O)O Amb27792858 [0,1,0,0,0,1|2,0,0]=4 2728 B10R0.82 C#CC(=O)NC[C@H](N)C(=O)O Amb25210877 [0,1,0,0,0,1|2,0,0]=4 2729 B10R0.82 C#CC(=O)NC[C@H](O)C(=O)O Amb27751159 [0,1,0,0,0,1|1,0,0]=3 2730 B10R0.82 C=C(CCC(=O)OC)C(=O)O Amb30584741 [0,1,0,0,0,1|1,0,1]=4 2731 B10R0.82 C=CC(=O)NC[C@H](N)C(=O)O Amb27674138 [0,1,0,0,0,1|2,0,0]=4 2732 B10R0.82 CC(=O)[C@H](O)C\C=C(\C)C=O Amb27989749 [0,1,0,0,0,1|2,0,0]=4 2733 B10R0.82 CC(N\C=C(/O)C=O)C(=O)O Amb28198008 [0,1,0,0,0,1|1,0,1]=4 2734 B10R0.82 CCC(=O)NC[C@H](O)C(=O)O Amb27670709 [0,1,0,0,0,1|1,0,0]=3 2735 B10R0.82 CNC(=O)CCC(N)C(=O)O Amb18645293 [0,1,0,0,0,1|2,0,0]=4 2736 B10R0.82 CNC(=O)CO[C@@H](C)C(=O)O Amb27986317 [0,1,0,0,0,1|2,0,0]=4 2737 B10R0.82 CNC(=O)CSC(C)C(=O)O Amb6257259 [0,1,0,0,0,1|2,0,0]=4 2738 B10R0.82 CNC(=O)NCC(C)C(=O)O Amb18300018 [0,1,0,0,0,1|2,0,0]=4 2739 B10R0.82 CNC(=O)SC[C@H](N)C(=O)O Amb17617278 [0,1,0,0,0,1|2,0,0]=4 2740 B10R0.82 COC(=O)CCC(Br)C(=O)O Amb18134592 [0,1,0,0,0,1|1,0,0]=3 2741 B10R0.82 COC(=O)CCC(Cl)C(=O)O Amb32941125 [0,1,0,0,0,1|1,0,0]=3 2742 B10R0.82 COC(=O)CCC(N)C(=O)O Amb9825413 [0,1,0,0,0,1|1,0,0]=3 2743 B10R0.82 COC(=O)CCC(N)C(N)=O Amb31291204 [0,1,0,0,0,1|2,0,0]=4 2744 B10R0.82 COC(=O)CCC(O)C(=O)O Amb32941120 [0,1,0,0,0,1|0,0,0]=2 2745 B10R0.82 COC(=O)CC[C@@H](N)C(=O)O Amb16183875 [0,1,0,0,0,1|1,0,0]=3 2746 B10R0.82 COC(=O)CC[C@@H](N)C(=O)O Amb22746068 [0,1,0,0,0,1|1,0,0]=3 2747 B10R0.82 COC(=O)CC[C@H](N)C(=O)O Amb2720571 [0,1,0,0,0,1|1,0,0]=3 2748 B10R0.82 COC(=O)CC[C@H](N)C(=O)[O-] Amb34916015 [0,1,0,0,0,1|1,0,1]=4 2749 B10R0.82 COC(=O)CC[C@H](N)C(N)=O Amb22432474 [0,1,0,0,0,1|2,0,0]=4 2750 B10R0.82 COC(=O)CC[C@H](N)C(N)=O Amb34916457 [0,1,0,0,0,1|2,0,0]=4 2751 B10R0.82 COC(=O)CNC(C)C(N)=O Amb9203719 [0,1,0,0,0,1|2,0,0]=4 2752 B10R0.82 COC(=O)NC[C@H](O)C(=O)O Amb27670721 [0,1,0,0,0,1|0,0,0]=2 2753 B10R0.82 NC(CCC(=O)NO)C(=O)O Amb22350145 [0,1,0,0,0,1|1,0,0]=3 2754 B10R0.82 NC(CNC(=O)C=O)C(=O)O Amb26082139 [0,1,0,0,0,1|1,0,1]=4 2755 B10R0.82 NC(CNC(=O)CCl)C(=O)O Amb27990068 [0,1,0,0,0,1|2,0,0]=4 2756 B10R0.82 NNC(=O)CCC(N)C(=O)O Amb6366546 [0,1,0,0,0,1|2,0,0]=4 2757 B10R0.82 NNC(=O)CC[C@H](N)C(=O)O Amb25379957 [0,1,0,0,0,1|2,0,0]=4 2758 B10R0.82 N[C@@H](CCC(=O)NO)C(=O)O Amb27269199 [0,1,0,0,0,1|1,0,0]=3 2759 B10R0.82 N[C@@H](C\C=C(/Cl)CO)C(=O)O Amb27988484 [0,1,0,0,0,1|2,0,0]=4 2760 B10R0.82 N\C(=N/O)NCC(N)C(=O)O Amb28182515 [0,1,0,0,0,1|2,0,0]=4 2761 B10R0.82 O=C(CCl)NCC(O)C(=O)O Amb27990120 [0,1,0,0,0,1|1,0,0]=3 2762 B10R0.84 CCC(SCC(=O)O)C(=O)O Amb17501325 [0,1,0,0,0,1|1,0,0]=3 2763 B10R0.84 CCC(SCC(N)=O)C(=O)O Amb17501319 [0,1,0,0,0,1|2,0,0]=4 2764 B10R0.84 CN[C@@H](CCC(=O)O)C(=O)O Amb13884885 [0,1,0,0,0,1|1,0,0]=3 2765 B10R0.84 CN[C@@H](CCC(=O)O)C(=O)O Amb24117978 [0,1,0,0,0,1|1,0,0]=3 2766 B10R0.84 COC(CNC(C)=O)C(=O)O Amb27269110 [0,1,0,0,0,1|1,0,0]=3 2767 B10R0.84 COC(CNC(N)=O)C(=O)O Amb27269111 [0,1,0,0,0,1|1,0,0]=3 2768 B10R0.84 N#CC(CCC(=O)O)C(=O)O Amb27990272 [0,1,0,0,0,1|1,0,0]=3 2769 B10R0.84 O=C(O)\C=C\C(=N\O)C(=O)O Amb27484012 [0,1,0,0,0,1|0,0,2]=4 2770 B10R0.92 CC(=O)[C@@H](O)COP(=O)(O)O Amb27001789 [0,1,0,0,0,1|2,0,0]=4 2771 B10R0.92 CP(=O)(O)CCC(N)C(=O)O Amb4424634 [0,1,0,0,0,1|2,0,0]=4 2772 B10R0.92 CP(=O)(O)CCC(O)C(=O)O Amb27000184 [0,1,0,0,0,1|1,0,0]=3 2773 B10R0.92 CP(=O)(O)CC[C@H](N)C(=O)O Amb27001058 [0,1,0,0,0,1|2,0,0]=4 2774 B10R0.92 CP(=O)(O)C\C=C(\O)C(=O)O Amb28458413 [0,1,0,0,0,1|1,0,1]=4 2775 B10R0.92 CS(=O)(=O)CCC(O)C(=O)O Amb18129022 [0,1,0,0,0,1|1,0,1]=4 2776 B10R0.92 CS(=O)(=O)NC[C@H](O)C(=O)O Amb27670718 [0,1,0,0,0,1|1,0,1]=4 2777 B10R0.92 NC(CCP(=O)(O)O)C(=O)O Amb542828 [0,1,0,0,0,1|2,0,0]=4 2778 B10R0.92 NC(CCS(=O)(=O)O)C(=O)O Amb3940449 [0,1,0,0,0,1|2,0,0]=4 2779 B10R0.92 NC(COP(=O)(O)O)C(=O)O Amb6334849 [0,1,0,0,0,1|2,0,0]=4 2780 B10R0.92 NC(CSS(=O)(=O)O)C(=O)O Amb25384388 [0,1,0,0,0,1|2,0,0]=4 2781 B10R0.92 NS(=O)(=O)NCC(O)C(=O)O Amb27987782 [0,1,0,0,0,1|1,0,1]=4 2782 B10R0.92 NS(=O)(=O)NC[C@H](O)C(=O)O Amb27670717 [0,1,0,0,0,1|1,0,1]=4 2783 B10R0.92 N[C@@H](CCP(=O)(O)O)C(=O)O Amb30666599 [0,1,0,0,0,1|2,0,0]=4 2784 B10R0.92 N[C@@H](CCP(=O)(O)O)C(=O)O Amb544255 [0,1,0,0,0,1|2,0,0]=4 2785 B10R0.92 N[C@@H](COP(=O)(O)O)C(=O)O Amb6600024 [0,1,0,0,0,1|2,0,0]=4 2786 B10R0.92 N[C@@H](COS(=O)(=O)O)C(=O)O Amb22800081 [0,1,0,0,0,1|2,0,0]=4 2787 B10R0.92 N[C@@H](CSP(=O)(O)O)C(=O)O Amb25385816 [0,1,0,0,0,1|2,0,0]=4 2788 B10R0.92 N[C@@H](CSS(=O)(=O)O)C(=O)O Amb22348198 [0,1,0,0,0,1|2,0,0]=4 2789 B10R0.92 N[C@H](CCP(=O)(O)O)C(=O)O Amb2719726 [0,1,0,0,0,1|2,0,0]=4 2790 B10R0.92 N[C@H](CCS(=O)(=O)O)C(=O)O Amb27672864 [0,1,0,0,0,1|2,0,0]=4 2791 B10R0.92 N[C@H](COP(=O)(O)O)C(=O)O Amb22231363 [0,1,0,0,0,1|2,0,0]=4 2792 B10R0.92 N[C@H](COS(=O)(=O)O)C(=O)O Amb26660628 [0,1,0,0,0,1|2,0,0]=4 2793 B10R0.92 O=C(O)[C@@H](O)COP(=O)(O)O Amb25386288 [0,1,0,0,0,1|1,0,0]=3 2794 B10R0.92 O=C(O)[C@H](O)COP(=O)(O)O Amb6599982 [0,1,0,0,0,1|1,0,0]=3 2795 B10R0.92 O=C(O)[C@H](O)COP(=O)([O-])[O-] Amb9825525 [0,1,0,0,0,1|1,0,1]=4 2796 B10R0.93 C=C(CC(=C)C(=O)O)C(=O)O Amb27990266 [0,1,0,0,0,1|1,0,1]=4 2797 B10R0.93 C=C(CC(C)C(=O)O)C(=O)O Amb10844068 [0,1,0,0,0,1|1,0,0]=3 2798 B10R0.93 C=C(CC(N)C(=O)O)C(=O)O Amb18126175 [0,1,0,0,0,1|1,0,0]=3 2799 B10R0.93 C=C(CC(N)C(=O)O)C(=O)O Amb33734644 [0,1,0,0,0,1|1,0,0]=3 2800 B10R0.93 C=C(C[C@@H](N)C(=O)O)C(=O)O Amb27990014 [0,1,0,0,0,1|1,0,0]=3 2801 B10R0.93 CC(=O)C(C)CC(C)C(=O)O Amb4014440 [0,1,0,0,0,1|2,0,0]=4 2802 B10R0.93 CC(=O)C(C)SC(C)C(=O)O Amb28352063 [0,1,0,0,0,1|2,0,0]=4 2803 B10R0.93 CC(=O)[C@@H](C)C[C@H](C)C(=O)O Amb27989934 [0,1,0,0,0,1|2,0,0]=4 2804 B10R0.93 CC(CC(=O)C(=O)O)C(=O)O Amb26660388 [0,1,0,0,0,1|1,0,0]=3 2805 B10R0.93 CC(CC(C)C(=O)O)C(=O)O Amb4014252 [0,1,0,0,0,1|1,0,0]=3 2806 B10R0.93 CC(CC(N)C(=O)O)C(=O)O Amb23440871 [0,1,0,0,0,1|1,0,0]=3 2807 B10R0.93 CC(C[C@@H](N)C(=O)O)C(=O)O Amb26999819 [0,1,0,0,0,1|1,0,0]=3 2808 B10R0.93 CC(C[C@H](N)C(=O)O)C(=O)O Amb27000115 [0,1,0,0,0,1|1,0,0]=3 2809 B10R0.93 CC(NC(=O)C(=O)O)C(=O)O Amb25108452 [0,1,0,0,0,1|0,0,2]=4 2810 B10R0.93 CC(NC(C)C(=O)O)C(=O)O Amb18126275 [0,1,0,0,0,1|1,0,0]=3 2811 B10R0.93 CC(N[C@@H](C)C(=O)O)C(=O)O Amb26659333 [0,1,0,0,0,1|1,0,0]=3 2812 B10R0.93 CC(N[C@H](C)C(=O)O)C(=O)O Amb27266632 [0,1,0,0,0,1|1,0,0]=3 2813 B10R0.93 CC(O[C@@H](C)C(=O)O)C(N)=O Amb27986323 [0,1,0,0,0,1|2,0,0]=4 2814 B10R0.93 CC(SC(C)C(=O)O)C(=O)O Amb17501619 [0,1,0,0,0,1|1,0,0]=3 2815 B10R0.93 CC(SC(C)C(=O)O)C(N)=O Amb9202524 [0,1,0,0,0,1|2,0,0]=4 2816 B10R0.93 C[C@@H](C[C@@H](C)C(=O)O)C(=O)O Amb27272288 [0,1,0,0,0,1|1,0,0]=3 2817 B10R0.93 C[C@@H](C[C@@H](N)C(=O)O)C(=O)O Amb19133151 [0,1,0,0,0,1|1,0,0]=3 2818 B10R0.93 C[C@@H](C[C@H](N)C(=O)O)C(N)=O Amb27990165 [0,1,0,0,0,1|2,0,0]=4 2819 B10R0.93 C[C@@H](NC(=O)C(=O)O)C(=O)O Amb19893389 [0,1,0,0,0,1|0,0,2]=4 2820 B10R0.93 C[C@@H](N[C@H](C)C(=O)O)C(=O)O Amb25384906 [0,1,0,0,0,1|1,0,0]=3 2821 B10R0.93 C[C@@H](O[C@H](C)C(=O)O)C(=O)O Amb25386293 [0,1,0,0,0,1|1,0,0]=3 2822 B10R0.93 C[C@@H](S[C@H](C)C(=O)O)C(=O)O Amb27990009 [0,1,0,0,0,1|1,0,0]=3 2823 B10R0.93 C[C@H](C[C@H](N)C(=O)O)C(=O)O Amb10807462 [0,1,0,0,0,1|1,0,0]=3 2824 B10R0.93 C[C@H](N[C@@H](C)C(=O)O)C(=O)O Amb27001396 [0,1,0,0,0,1|1,0,0]=3 2825 B10R0.93 C\C(=C\C(C)C(=O)O)C(=O)O Amb23591115 [0,1,0,0,0,1|1,0,1]=4 2826 B10R0.93 NC(=O)C(F)CC(N)C(=O)O Amb25386442 [0,1,0,0,0,1|2,0,0]=4 2827 B10R0.93 NC(=O)C(F)C[C@H](N)C(=O)O Amb25383170 [0,1,0,0,0,1|2,0,0]=4 2828 B10R0.93 NC(=O)C(O)C[C@H](N)C(=O)O Amb27990187 [0,1,0,0,0,1|1,0,0]=3 2829 B10R0.93 NC(=O)[C@@H](F)C[C@@H](N)C(=O)O Amb10839752 [0,1,0,0,0,1|2,0,0]=4 2830 B10R0.93 NC(=O)[C@@H](F)C[C@H](N)C(=O)O Amb10839753 [0,1,0,0,0,1|2,0,0]=4 2831 B10R0.93 NC(=O)[C@@H](N)C[C@H](F)C(=O)O Amb10838207 [0,1,0,0,0,1|2,0,0]=4 2832 B10R0.93 NC(=O)[C@H](F)C[C@@H](N)C(=O)O Amb25384972 [0,1,0,0,0,1|2,0,0]=4 2833 B10R0.93 NC(=O)[C@H](F)C[C@H](N)C(=O)O Amb26083606 [0,1,0,0,0,1|2,0,0]=4 2834 B10R0.93 NC(=O)[C@H](F)C[C@H](N)C(=O)O Amb33804028 [0,1,0,0,0,1|2,0,0]=4 2835 B10R0.93 NC(CC(=O)C(=O)O)C(=O)O Amb27671651 [0,1,0,0,0,1|1,0,0]=3 2836 B10R0.93 NC(CC(F)C(=O)O)C(=O)O Amb2688100 [0,1,0,0,0,1|1,0,0]=3 2837 B10R0.93 NC(CC(N)C(=O)O)C(=O)O Amb24117887 [0,1,0,0,0,1|1,0,0]=3 2838 B10R0.93 NC(CC(N)C(=O)O)C(=O)O Amb3994432 [0,1,0,0,0,1|1,0,0]=3 2839 B10R0.93 N[C@@H](CC(F)C(=O)O)C(=O)O Amb22800491 [0,1,0,0,0,1|1,0,0]=3 2840 B10R0.93 N[C@@H](CC(O)C(=O)O)C(=O)O Amb27492043 [0,1,0,0,0,1|0,0,0]=2 2841 B10R0.93 N[C@@H](C[C@@H](F)C(=O)O)C(=O)O Amb24055860 [0,1,0,0,0,1|1,0,0]=3 2842 B10R0.93 N[C@@H](C[C@@H](N)C(=O)O)C(=O)O Amb22746048 [0,1,0,0,0,1|1,0,0]=3 2843 B10R0.93 N[C@@H](C[C@@H](O)C(=O)O)C(=O)O Amb6600059 [0,1,0,0,0,1|0,0,0]=2 2844 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O Amb22388564 [0,1,0,0,0,1|1,0,0]=3 2845 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O Amb22745417 [0,1,0,0,0,1|1,0,0]=3 2846 B10R0.93 N[C@@H](C[C@H](O)C(=O)O)C(=O)O Amb22800665 [0,1,0,0,0,1|0,0,0]=2 2847 B10R0.93 N[C@@H](C[C@H](O)C(=O)O)C(=O)O Amb24117514 [0,1,0,0,0,1|0,0,0]=2 2848 B10R0.93 N[C@H](C[C@@H](F)C(=O)O)C(=O)O Amb26083605 [0,1,0,0,0,1|1,0,0]=3 2849 B10R0.93 N[C@H](C[C@@H](N)C(=O)O)C(=O)O Amb22388558 [0,1,0,0,0,1|1,0,0]=3 2850 B10R0.93 N[C@H](C[C@H](F)C(=O)O)C(=O)O Amb10839750 [0,1,0,0,0,1|1,0,0]=3 2851 B10R0.93 O=C(O)C(=O)CC(O)C(=O)O Amb17615458 [0,1,0,0,0,1|0,0,0]=2 2852 B10R0.93 O=C(O)C(Br)CC(Br)C(=O)O Amb17621581 [0,1,0,0,0,1|1,0,0]=3 2853 B10R0.93 O=C(O)C(O)SC(O)C(=O)O Amb17772308 [0,1,0,0,0,1|0,0,0]=2 2854 B10R0.93 O=C(O)[C@@H](S)C[C@@H](S)C(=O)O Amb27990019 [0,1,0,0,0,1|0,1,0]=3 2855 B10R0.93 [NH3+]C(CC(O)C(=O)O)C(=O)[O-] Amb25385683 [0,1,0,0,0,1|0,0,1]=3 2856 B10R0.31 CS(=O)(=O)CC(O)CC(=O)O Amb33056364 [0,1,0,0,0,1|1,0,1]=4 2857 B10R0.31 CS(=O)(=O)C[C@@H](O)CC(=O)O Amb33481788 [0,1,0,0,0,1|1,0,1]=4 2858 B10R0.31 CS(=O)(=O)C[C@H](O)CC(=O)O Amb33055950 [0,1,0,0,0,1|1,0,1]=4 2859 B10R0.31 NC(CC(=O)O)CP(=O)(O)O Amb27990151 [0,1,0,0,0,1|2,0,0]=4 2860 B10R0.44 CNC(=O)NC(C)CC(=O)O Amb18290552 [0,1,0,0,0,1|2,0,0]=4 2861 B10R0.44 COC(=O)CC(C)CC(=O)O Amb2689808 [0,1,0,0,0,1|1,0,0]=3 2862 B10R0.44 COC(=O)CC(C)CC(C)=O Amb32668276 [0,1,0,0,0,1|2,0,0]=4 2863 B10R0.44 COC(=O)CC(C)NC(N)=O Amb27266623 [0,1,0,0,0,1|2,0,0]=4 2864 B10R0.44 COC(=O)C[C@@H](N)CC(=O)O Amb33621255 [0,1,0,0,0,1|1,0,0]=3 2865 B10R0.44 COC(=O)C[C@@H](N)CC(=O)O Amb33747103 [0,1,0,0,0,1|1,0,0]=3 2866 B10R0.44 COC(=O)C\C(O)=C\C(C)=O Amb27673810 [0,1,0,0,0,1|1,0,1]=4 2867 B10R0.44 COC(=O)NC(C)CC(C)=O Amb27271970 [0,1,0,0,0,1|2,0,0]=4 2868 B10R0.70 CCC(CC(=O)O)CC(=O)O Amb33172175 [0,1,0,0,0,1|1,0,0]=3 2869 B10R0.70 CCC(CC(=O)O)NC(C)=O Amb25384609 [0,1,0,0,0,1|2,0,0]=4 2870 B10R0.70 CC[C@H](CC(=O)O)NC(C)=O Amb27272274 [0,1,0,0,0,1|2,0,0]=4 2871 B10R0.70 CC\C(=C/C(=O)O)CC(=O)O Amb27990198 [0,1,0,0,0,1|1,0,1]=4 2872 B10R0.70 CC\C(=C\C(=O)O)CC(=O)O Amb27990169 [0,1,0,0,0,1|1,0,1]=4 2873 B10R0.70 CNN(CC(=O)O)CC(=O)O Amb24101394 [0,1,0,0,0,1|2,0,0]=4 2874 B10R0.70 CO\C(=C/C(=O)O)CC(=O)O Amb27990199 [0,1,0,0,0,1|0,0,1]=3 2875 B10R0.70 CO\C(=C\C(=O)O)CC(=O)O Amb27990171 [0,1,0,0,0,1|0,0,1]=3 2876 B10R0.70 O=C(O)CC(CF)CC(=O)O Amb33379251 [0,1,0,0,0,1|1,0,0]=3 2877 B10R0.165 CC(=O)CC(C)(C)CC(=O)O Amb9782556 [0,1,0,0,0,1|2,0,0]=4 2878 B10R0.165 CC(=O)NC(C)(C)CC(=O)O Amb22360340 [0,1,0,0,0,1|2,0,0]=4 2879 B10R0.165 CC(C)(CC(=O)O)CC(=O)O Amb6608976 [0,1,0,0,0,1|1,0,0]=3 2880 B10R0.165 CC(C)(CC(=O)O)NC(N)=O Amb27260802 [0,1,0,0,0,1|2,0,0]=4 2881 B10R0.165 CC(O)(CC(=O)O)CC(=O)O Amb5719671 [0,1,0,0,0,1|0,0,0]=2 2882 B10R0.165 O=C(O)CC(Cl)(Cl)CC(=O)O Amb4014518 [0,1,0,0,0,1|1,0,0]=3 2883 B10R0.165 O=C(O)CC(F)(F)CC(=O)O Amb1149070 [0,1,0,0,0,1|1,0,0]=3 2884 B10R0.165 O=C(O)CS(=O)(=O)CC(=O)O Amb6364794 [0,1,0,0,0,1|1,0,1]=4 2885 B10R0.52 COC(=O)CC(N)P(=O)(O)O Amb27988500 [0,2,0,0,0,0|2,0,0]=4 2886 B10R0.52 COC(=O)CC(O)C(C)(C)O Amb27673879 [0,2,0,0,0,0|1,0,1]=4 2887 B10R0.63 CC(C)(CO)C(O)CC(=O)O Amb33200304 [0,2,0,0,0,0|1,0,1]=4 2888 B10R0.63 CC(C)(CO)[C@@H](O)CC(=O)O Amb33200303 [0,2,0,0,0,0|1,0,1]=4 2889 B10R0.63 CC(C)(CO)[C@H](O)CC(=O)O Amb33200302 [0,2,0,0,0,0|1,0,1]=4 2890 B10R0.154 CC(C(N)C(=O)O)P(=O)(O)O Amb28341378 [0,2,0,0,0,0|2,0,0]=4 2891 B10R0.47 CC(C)(CC(=O)CN)C(=O)O Amb27990161 [0,2,0,0,0,0|2,0,0]=4 2892 B10R0.47 CNC(=O)CC(C)(C)C(=O)O Amb24707522 [0,2,0,0,0,0|2,0,0]=4 2893 B10R0.47 COC(=O)CC(C)(C)C(=O)O Amb16232093 [0,2,0,0,0,0|1,0,0]=3 2894 B10R0.47 COC(=O)CC(C)(C)C(C)=O Amb27672540 [0,2,0,0,0,0|2,0,0]=4 2895 B10R0.47 COC(=O)CC(C)(O)C(C)=O Amb27673775 [0,2,0,0,0,0|1,0,0]=3 2896 B10R0.47 COC(=O)NC(C)(C)C(=O)O Amb18974085 [0,2,0,0,0,0|2,0,0]=4 2897 B10R0.47 C\C(CC(C)(C)C(=O)O)=N/O Amb27493468 [0,2,0,0,0,0|2,0,0]=4 2898 B10R0.117 C=C(C)C(C)(C)C(O)C(=O)O Amb33199890 [0,2,0,0,0,0|2,0,0]=4 2899 B10R0.117 C=C(C)C(O)C(C)(C)C(=O)O Amb18645021 [0,2,0,0,0,0|2,0,0]=4 2900 B10R0.117 CC(C(=O)O)C(C)(Cl)C(=O)O Amb27456129 [0,2,0,0,0,0|1,0,0]=3 2901 B10R0.117 CC(C(=O)O)C(C)(N)C(=O)O Amb27791829 [0,2,0,0,0,0|1,0,0]=3 2902 B10R0.117 CC(C(=O)O)C(C)(S)C(=O)O Amb27429072 [0,2,0,0,0,0|0,1,0]=3 2903 B10R0.117 CC(C)(C(=O)O)C(Br)C(=O)O Amb25089525 [0,2,0,0,0,0|1,0,0]=3 2904 B10R0.117 CC(C)(C(=O)O)C(N)C(=O)O Amb27232768 [0,2,0,0,0,0|1,0,0]=3 2905 B10R0.117 CC(C)(C(=O)O)C(O)C(=O)O Amb18126316 [0,2,0,0,0,0|0,0,0]=2 2906 B10R0.117 CC(C)(C(N)C(=O)O)S(=O)O Amb24487834 [0,2,0,0,0,0|2,0,0]=4 2907 B10R0.117 CC(Cl)(C(N)=O)C(O)C(=O)O Amb27845428 [0,2,0,0,0,0|1,0,0]=3 2908 B10R0.117 CC(O)(C(N)=O)C(O)C(N)=O Amb27975478 [0,2,0,0,0,0|2,0,0]=4 2909 B10R0.117 C[C@@H](C(=O)O)[C@](C)(N)C(=O)O Amb28141183 [0,2,0,0,0,0|1,0,0]=3 2910 B10R0.117 C[C@@H](C(=O)O)[C@](C)(O)C(=O)O Amb27876050 [0,2,0,0,0,0|0,0,0]=2 2911 B10R0.117 C[C@@](O)(C(=O)O)[C@H](O)C(=O)O Amb28385578 [0,2,0,0,0,0|0,0,0]=2 2912 B10R0.117 C[C@@](O)(C(N)=O)[C@@H](O)C(N)=O Amb28141953 [0,2,0,0,0,0|2,0,0]=4 2913 B10R0.117 C[C@H](C(=O)O)[C@@](C)(Cl)C(=O)O Amb28070747 [0,2,0,0,0,0|1,0,0]=3 2914 B10R0.117 C[C@H](C(=O)O)[C@](C)(O)C(=O)O Amb27483589 [0,2,0,0,0,0|0,0,0]=2 2915 B10R0.117 NC(C(=O)O)C(F)(F)C(=O)O Amb24558165 [0,2,0,0,0,0|1,0,0]=3 2916 B10R0.117 N[C@@H](C(=O)O)C(F)(F)C(=O)O Amb26566062 [0,2,0,0,0,0|1,0,0]=3 2917 B10R0.117 O=C(O)C(O)C(F)(F)C(=O)O Amb27650600 [0,2,0,0,0,0|0,0,0]=2 2918 B10R0.119 C=CC(N)(CC(=O)O)C(=O)O Amb26659495 [0,2,0,0,0,0|1,0,0]=3 2919 B10R0.119 CC(=O)N[C@](C)(CO)C(=O)O Amb27758605 [0,2,0,0,0,0|2,0,0]=4 2920 B10R0.119 CC(CN)(CC(=O)O)C(=O)O Amb22546424 [0,2,0,0,0,0|1,0,0]=3 2921 B10R0.119 CC(CN)(CC(=O)O)C(=O)O Amb26999762 [0,2,0,0,0,0|1,0,0]=3 2922 B10R0.119 CC(CO)(NC(N)=O)C(=O)O Amb28385975 [0,2,0,0,0,0|2,0,0]=4 2923 B10R0.119 CCC(C)(CC(=O)O)C(=O)O Amb17776967 [0,2,0,0,0,0|1,0,0]=3 2924 B10R0.119 CCC(N)(CC(=O)O)C(=O)O Amb27673263 [0,2,0,0,0,0|1,0,0]=3 2925 B10R0.119 N[C@@](CO)(CC(=O)O)C(=O)O Amb27001406 [0,2,0,0,0,0|0,0,0]=2 2926 B10R0.119 N[C@](CO)(CC(=O)O)C(=O)O Amb26659195 [0,2,0,0,0,0|0,0,0]=2 2927 B10R0.119 O=C(O)CC(Cl)(CO)C(=O)O Amb27271127 [0,2,0,0,0,0|0,0,0]=2 2928 B10R0.141 C=C(C)C[C@](C)(O)C(=O)CO Amb27673710 [0,2,0,0,0,0|2,0,0]=4 2929 B10R0.141 C=C(Cl)C[C@](C)(O)C(=O)CO Amb27673711 [0,2,0,0,0,0|2,0,0]=4 2930 B10R0.141 CC(O)(CC(=O)O)C(O)CO Amb27673650 [0,2,0,0,0,0|0,0,2]=4 2931 B10R0.141 CCC(=O)[C@@](C)(O)CC(C)=O Amb27672471 [0,2,0,0,0,0|2,0,0]=4 2932 B10R0.141 CNC(=O)C(C)(C)CC(=O)O Amb25032544 [0,2,0,0,0,0|2,0,0]=4 2933 B10R0.141 COC(=O)C(C)(C)CC(=O)O Amb16232092 [0,2,0,0,0,0|1,0,0]=3 2934 B10R0.141 COC(=O)C(C)(O)CN(C)O Amb28079718 [0,2,0,0,0,0|2,0,0]=4 2935 B10R0.141 COC(=O)C(C)(O)NC(C)=O Amb25311212 [0,2,0,0,0,0|2,0,0]=4 2936 B10R0.141 COC(=O)C(C)(S)CC(C)=O Amb28080276 [0,2,0,0,0,0|1,1,0]=4 2937 B10R0.141 COC(=O)C(F)(F)CC(=O)O Amb25385023 [0,2,0,0,0,0|1,0,0]=3 2938 B10R0.141 COC(=O)[C@@](C)(N)CC(N)=O Amb27671927 [0,2,0,0,0,0|2,0,0]=4 2939 B10R0.141 COC(=O)[C@@](C)(O)CC(C)=O Amb27672349 [0,2,0,0,0,0|1,0,0]=3 2940 B10R0.141 COC(=O)[C@](C)(O)CC(C)=O Amb27672533 [0,2,0,0,0,0|1,0,0]=3 2941 B10R0.163 CC(C)(CS(=O)(=O)O)C(=O)O Amb28343120 [0,2,0,0,0,0|2,0,0]=4 2942 B10R0.163 CC(N)(CP(=O)(O)O)C(=O)O Amb27614362 [0,2,0,0,0,0|2,0,0]=4 2943 B10R0.163 CC(N)(CP(C)(=O)O)C(=O)O Amb27835231 [0,2,0,0,0,0|2,0,0]=4 2944 B10R0.32 C=C(CC(=O)O)C(=O)OCC Amb24086592 [0,2,0,0,0,0|1,0,1]=4 2945 B10R0.32 CCNC(=O)C(N)CC(=O)O Amb18224398 [0,2,0,0,0,0|2,0,0]=4 2946 B10R0.32 CCOC(=O)C(N)CC(C)=O Amb32653477 [0,2,0,0,0,0|2,0,0]=4 2947 B10R0.32 CCOC(=O)C(N)CC(C)=O Amb32653478 [0,2,0,0,0,0|2,0,0]=4 2948 B10R0.32 CCOC(=O)N(C)CC(=O)O Amb6251129 [0,2,0,0,0,0|2,0,0]=4 2949 B10R0.32 CCOC(=O)[C@@H](N)CC(=O)O Amb22745898 [0,2,0,0,0,0|1,0,0]=3 2950 B10R0.32 CCOC(C)C(O)CC(=O)O Amb33425384 [0,2,0,0,0,0|1,0,1]=4 2951 B10R0.32 CCOC(C)[C@@H](O)CC(=O)O Amb33425383 [0,2,0,0,0,0|1,0,1]=4 2952 B10R0.32 CCOC(C)[C@H](O)CC(=O)O Amb33425381 [0,2,0,0,0,0|1,0,1]=4 2953 B10R0.32 COCC(=O)N(C)CC(=O)O Amb1120074 [0,2,0,0,0,0|2,0,0]=4 2954 B10R0.32 CONC(=O)C(N)CC(=O)O Amb27670779 [0,2,0,0,0,0|1,0,0]=3 2955 B10R0.32 CONC(=O)C(N)CC(N)=O Amb27987617 [0,2,0,0,0,0|2,0,0]=4 2956 B10R0.32 N#CNC(=O)C(N)CC(=O)O Amb27209412 [0,2,0,0,0,0|2,0,0]=4 2957 B10R0.37 COC(=O)C(N)CP(=O)(O)O Amb27671655 [0,2,0,0,0,0|2,0,0]=4 2958 B10R0.37 COC(=O)C(O)CS(=O)(=O)Cl Amb27270954 [0,2,0,0,0,0|1,0,1]=4 2959 B10R0.37 COC(=O)C(O)CS(C)(=O)=O Amb27270947 [0,2,0,0,0,0|1,0,1]=4 2960 B10R0.37 COC(=O)C(O)CS(N)(=O)=O Amb27270950 [0,2,0,0,0,0|1,0,1]=4 2961 B10R0.46 C=C(CC(=O)OC)C(=O)OC Amb533251 [0,2,0,0,0,0|1,0,1]=4 2962 B10R0.46 CCC(=O)CC(N)C(=O)OC Amb32789392 [0,2,0,0,0,0|2,0,0]=4 2963 B10R0.46 CNC(=O)C(N)CC(=O)OC Amb27671619 [0,2,0,0,0,0|2,0,0]=4 2964 B10R0.46 CNC(=O)CC(N)C(=O)OC Amb27671628 [0,2,0,0,0,0|2,0,0]=4 2965 B10R0.46 CNC(=O)C[C@@H](O)C(=O)NC Amb27653304 [0,2,0,0,0,0|2,0,0]=4 2966 B10R0.46 COC(=O)C(C)CC(=O)NO Amb27987382 [0,2,0,0,0,0|1,0,0]=3 2967 B10R0.46 COC(=O)CC(=O)C(=O)OC Amb22490417 [0,2,0,0,0,0|0,0,2]=4 2968 B10R0.46 COC(=O)CC(C)C(=O)OC Amb21964553 [0,2,0,0,0,0|1,0,0]=3 2969 B10R0.46 COC(=O)CC(N)C(=O)OC Amb18126274 [0,2,0,0,0,0|1,0,0]=3 2970 B10R0.46 COC(=O)CC(N)C(=O)OC Amb6366547 [0,2,0,0,0,0|1,0,0]=3 2971 B10R0.46 COC(=O)CC(O)C(=O)OC Amb3939692 [0,2,0,0,0,0|0,0,0]=2 2972 B10R0.46 COC(=O)C[C@@H](Br)C(=O)OC Amb22747395 [0,2,0,0,0,0|1,0,0]=3 2973 B10R0.46 COC(=O)C[C@@H](C)C(=O)OC Amb15692786 [0,2,0,0,0,0|1,0,0]=3 2974 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC Amb16183880 [0,2,0,0,0,0|1,0,0]=3 2975 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC Amb19372612 [0,2,0,0,0,0|1,0,0]=3 2976 B10R0.46 COC(=O)C[C@@H](O)C(=O)OC Amb3939675 [0,2,0,0,0,0|0,0,0]=2 2977 B10R0.46 COC(=O)C[C@H](C)C(=O)OC Amb22226743 [0,2,0,0,0,0|1,0,0]=3 2978 B10R0.46 COC(=O)C[C@H](N)C(=O)OC Amb6211510 [0,2,0,0,0,0|1,0,0]=3 2979 B10R0.46 COC(=O)C[C@H](O)C(=O)OC Amb3939687 [0,2,0,0,0,0|0,0,0]=2 2980 B10R0.46 COC(=O)N(C)CC(=O)NO Amb27272208 [0,2,0,0,0,0|2,0,0]=4 2981 B10R0.46 COC(=O)N[C@@H](C)C(=O)OC Amb25385806 [0,2,0,0,0,0|2,0,0]=4 2982 B10R0.46 C\C=C(/C)C[C@@H](O)C(=O)OC Amb27989491 [0,2,0,0,0,0|2,0,0]=4 2983 B10R0.46 NNC(=O)CC(O)C(=O)NN Amb26482844 [0,2,0,0,0,0|2,0,0]=4 2984 B10R0.54 CNC(=O)C(CC(=O)O)OC Amb23536084 [0,2,0,0,0,0|1,0,0]=3 2985 B10R0.54 COC(=O)C(C#N)CC(C)=O Amb18125822 [0,2,0,0,0,0|2,0,0]=4 2986 B10R0.54 COC(=O)C(CO)NC(C)=O Amb9263032 [0,2,0,0,0,0|2,0,0]=4 2987 B10R0.54 COC(=O)[C@H](CO)NC(N)=O Amb27266620 [0,2,0,0,0,0|2,0,0]=4 2988 B10R0.54 COC(=O)\C(=C/Cl)CC(=O)O Amb27990076 [0,2,0,0,0,0|1,0,1]=4 2989 B10R0.54 COC(=O)\C(=C/O)CC(C)=O Amb27672601 [0,2,0,0,0,0|1,0,1]=4 2990 B10R0.54 [C-]#[N+]C(CC(C)=O)C(=O)OC Amb19928639 [0,2,0,0,0,0|2,0,0]=4 2991 B10R0.56 C=C(C)C(O)C(C)C(=O)OC Amb25380221 [0,2,0,0,0,0|2,0,0]=4 2992 B10R0.56 C=C(C)[C@@H](C)[C@@H](O)C(=O)OC Amb27989929 [0,2,0,0,0,0|2,0,0]=4 2993 B10R0.56 C=C(C)[C@@H](O)[C@@H](C)C(=O)OC Amb27989611 [0,2,0,0,0,0|2,0,0]=4 2994 B10R0.56 C=C(C)[C@H](C)[C@@H](O)C(=O)OC Amb27989589 [0,2,0,0,0,0|2,0,0]=4 2995 B10R0.56 C=C(C)[C@H](O)[C@@H](C)C(=O)OC Amb27989576 [0,2,0,0,0,0|2,0,0]=4 2996 B10R0.56 C=C(C)[C@H](O)[C@H](C)C(=O)OC Amb27989613 [0,2,0,0,0,0|2,0,0]=4 2997 B10R0.56 CC(=O)[C@@H](O)[C@@H](O)C(=O)CO Amb27672418 [0,2,0,0,0,0|1,0,0]=3 2998 B10R0.56 CC(C(=O)O)N(O)C(=O)CN Amb27990216 [0,2,0,0,0,0|2,0,0]=4 2999 B10R0.56 CC(O)C(O)C(O)C(=O)CO Amb25384023 [0,2,0,0,0,0|1,0,1]=4 3000 B10R0.56 CC(O)C(O)C(O)C(=O)NO Amb27405176 [0,2,0,0,0,0|1,0,1]=4 3001 B10R0.56 CCC(=O)[C@@H](C)[C@H](N)C(=O)O Amb27990250 [0,2,0,0,0,0|2,0,0]=4 3002 B10R0.56 CCC(=O)[C@H](C)[C@H](N)C(=O)O Amb27990251 [0,2,0,0,0,0|2,0,0]=4 3003 B10R0.56 CNC(=O)C(O)C(O)C(=O)O Amb27176596 [0,2,0,0,0,0|1,0,0]=3 3004 B10R0.56 CNC(=O)[C@H](O)[C@@H](O)C(=O)O Amb27617308 [0,2,0,0,0,0|1,0,0]=3 3005 B10R0.56 COC(=O)C(C)C(C)C(C)=O Amb27672526 [0,2,0,0,0,0|2,0,0]=4 3006 B10R0.56 COC(=O)C(F)C(N)C(=O)O Amb27671674 [0,2,0,0,0,0|1,0,0]=3 3007 B10R0.56 COC(=O)C(F)[C@H](N)C(=O)O Amb26083722 [0,2,0,0,0,0|1,0,0]=3 3008 B10R0.56 COC(=O)C(N)C(C)C(=O)O Amb27673475 [0,2,0,0,0,0|1,0,0]=3 3009 B10R0.56 COC(=O)C(O)C(C)C(C)=O Amb27673836 [0,2,0,0,0,0|1,0,0]=3 3010 B10R0.56 COC(=O)C(O)C(N)C(=O)O Amb18645752 [0,2,0,0,0,0|0,0,0]=2 3011 B10R0.56 COC(=O)C(O)C(O)C(=O)O Amb25384902 [0,2,0,0,0,0|0,0,0]=2 3012 B10R0.56 COC(=O)N(C)C(C)C(=O)O Amb18299738 [0,2,0,0,0,0|2,0,0]=4 3013 B10R0.56 COC(=O)N(C)[C@@H](C)C(=O)O Amb26659556 [0,2,0,0,0,0|2,0,0]=4 3014 B10R0.56 COC(=O)N(C)[C@H](C)C(=O)O Amb33726089 [0,2,0,0,0,0|2,0,0]=4 3015 B10R0.56 COC(=O)[C@@H](C)[C@@H](C)C(C)=O Amb27672272 [0,2,0,0,0,0|2,0,0]=4 3016 B10R0.56 COC(=O)[C@@H](C)[C@H](C)C(=O)O Amb27990012 [0,2,0,0,0,0|1,0,0]=3 3017 B10R0.56 COC(=O)[C@@H](O)[C@H](N)C(=O)O Amb27271132 [0,2,0,0,0,0|0,0,0]=2 3018 B10R0.56 COC(=O)[C@@H](O)[C@H](O)C(=O)O Amb24764738 [0,2,0,0,0,0|0,0,0]=2 3019 B10R0.56 COC(=O)[C@H](O)[C@@H](C)C(C)=O Amb27672220 [0,2,0,0,0,0|1,0,0]=3 3020 B10R0.56 COC(=O)[C@H](O)[C@@H](O)C(=O)O Amb24763072 [0,2,0,0,0,0|0,0,0]=2 3021 B10R0.56 COC(C)C(O)C(C)C(=O)O Amb25385684 [0,2,0,0,0,0|1,0,1]=4 3022 B10R0.56 C[C@@H](O)[C@@H](O)[C@@H](O)C(=O)CO Amb27269954 [0,2,0,0,0,0|1,0,1]=4 3023 B10R0.56 C[C@@H](O)[C@@H](O)[C@H](O)C(=O)CO Amb27672523 [0,2,0,0,0,0|1,0,1]=4 3024 B10R0.56 C[C@@H](O)[C@H](O)[C@@H](O)C(=O)CO Amb27672351 [0,2,0,0,0,0|1,0,1]=4 3025 B10R0.56 C[C@@H](O)[C@H](O)[C@H](O)C(=O)CO Amb27672576 [0,2,0,0,0,0|1,0,1]=4 3026 B10R0.56 C[C@H](C(=O)O)[C@H](O)[C@@H](C)C=O Amb27990231 [0,2,0,0,0,0|1,0,1]=4 3027 B10R0.56 C[C@H](O)[C@@H](O)[C@@H](O)C(=O)CO Amb27672265 [0,2,0,0,0,0|1,0,1]=4 3028 B10R0.56 C[C@H](O)[C@@H](O)[C@H](O)C(=O)CO Amb27672407 [0,2,0,0,0,0|1,0,1]=4 3029 B10R0.56 C[C@H](O)[C@H](O)[C@@H](O)C(=O)CO Amb27673859 [0,2,0,0,0,0|1,0,1]=4 3030 B10R0.56 C[C@H](O)[C@H](O)[C@H](O)C(=O)CO Amb27672575 [0,2,0,0,0,0|1,0,1]=4 3031 B10R0.56 C\C=C(/C)[C@@H](O)[C@@H](C)C(=O)O Amb27478010 [0,2,0,0,0,0|2,0,0]=4 3032 B10R0.56 C\C=C(/C)[C@@H](O)[C@H](C)C(=O)O Amb27478009 [0,2,0,0,0,0|2,0,0]=4 3033 B10R0.56 C\C=C(\C)C(O)C(C)C(=O)O Amb27828161 [0,2,0,0,0,0|2,0,0]=4 3034 B10R0.56 NC(C(=O)O)C(O)C(O)CBr Amb28080388 [0,2,0,0,0,0|1,0,1]=4 3035 B10R0.56 NC(C(O)CO)C(O)C(=O)O Amb28079622 [0,2,0,0,0,0|0,0,2]=4 3036 B10R0.56 NC(CO)C(O)C(O)C(=O)O Amb27671618 [0,2,0,0,0,0|1,0,1]=4 3037 B10R0.56 NNC(=O)C(O)C(O)C(N)=O Amb28208291 [0,2,0,0,0,0|2,0,0]=4 3038 B10R0.56 N[C@@H](C(=O)O)[C@H](O)C(=O)NO Amb27823329 [0,2,0,0,0,0|0,0,0]=2 3039 B10R0.56 N[C@H](CO)[C@H](O)[C@@H](O)C(=O)O Amb27671661 [0,2,0,0,0,0|1,0,1]=4 3040 B10R0.56 O=C(O)C(O)C(Cl)C(O)CCl Amb27672102 [0,2,0,0,0,0|1,0,1]=4 3041 B10R0.56 O=C(O)C(O)C(O)C(O)CO Amb17939854 [0,2,0,0,0,0|0,0,2]=4 3042 B10R0.56 O=C(O)[C@@H](O)[C@@H](O)C(O)CO Amb27988493 [0,2,0,0,0,0|0,0,2]=4 3043 B10R0.56 O=C(O)[C@@H](O)[C@@H](O)[C@@H](O)CO Amb26659477 [0,2,0,0,0,0|0,0,2]=4 3044 B10R0.56 O=C(O)[C@@H](O)[C@H](O)C(=O)CO Amb27988486 [0,2,0,0,0,0|0,0,0]=2 3045 B10R0.56 O=C(O)[C@@H](O)[C@H](O)C(O)CO Amb27988491 [0,2,0,0,0,0|0,0,2]=4 3046 B10R0.56 O=C(O)[C@@H](O)[C@H](O)[C@H](O)CO Amb22233142 [0,2,0,0,0,0|0,0,2]=4 3047 B10R0.56 O=C(O)[C@H](O)[C@@H](O)C(O)CO Amb27988494 [0,2,0,0,0,0|0,0,2]=4 3048 B10R0.56 O=C(O)[C@H](O)[C@@H](O)[C@@H](O)CO Amb24764799 [0,2,0,0,0,0|0,0,2]=4 3049 B10R0.56 O=C(O)[C@H](O)[C@H](O)C(O)CO Amb27988492 [0,2,0,0,0,0|0,0,2]=4 3050 B10R0.56 O=C(O)[C@H](O)[C@H](O)[C@H](O)CO Amb25379509 [0,2,0,0,0,0|0,0,2]=4 3051 B10R0.56 O=C[C@H](O)[C@@H](O)[C@H](O)C(=O)O Amb27990018 [0,2,0,0,0,0|0,0,1]=3 3052 B10R0.144 CCC(OC)C(O)CC(=O)O Amb33326023 [0,2,0,0,0,0|1,0,1]=4 3053 B10R0.144 CCC(OC)[C@@H](O)CC(=O)O Amb33326022 [0,2,0,0,0,0|1,0,1]=4 3054 B10R0.144 CCC(OC)[C@H](O)CC(=O)O Amb33326021 [0,2,0,0,0,0|1,0,1]=4 3055 B10R0.144 COC(OC)C(O)CC(=O)O Amb33342067 [0,2,0,0,0,0|0,0,2]=4 3056 B10R0.144 COC(OC)[C@@H](O)CC(=O)O Amb33225611 [0,2,0,0,0,0|0,0,2]=4 3057 B10R0.144 COC(OC)[C@H](O)CC(=O)O Amb33342068 [0,2,0,0,0,0|0,0,2]=4 3058 B10R0.23 C=C(C)C(CC(=O)O)OCC Amb20667844 [0,2,0,0,0,0|2,0,0]=4 3059 B10R0.23 C=NNC(CC(=O)O)C(=O)O Amb24070182 [0,2,0,0,0,0|1,0,0]=3 3060 B10R0.23 CC(=O)CC(NC=O)C(=O)O Amb26998851 [0,2,0,0,0,0|1,0,1]=4 3061 B10R0.23 CC(=O)NC(CCO)C(=O)O Amb8631250 [0,2,0,0,0,0|2,0,0]=4 3062 B10R0.23 CCCC(CC(=O)O)C(=O)O Amb18645267 [0,2,0,0,0,0|1,0,0]=3 3063 B10R0.23 CCCC(CC(C)=O)C(=O)O Amb533160 [0,2,0,0,0,0|2,0,0]=4 3064 B10R0.23 CCNC(CC(=O)O)C(C)=O Amb18608416 [0,2,0,0,0,0|2,0,0]=4 3065 B10R0.23 COCC(CC(=O)O)C(=O)O Amb4007524 [0,2,0,0,0,0|0,0,0]=2 3066 B10R0.23 COCC(NC(=O)Cl)C(=O)O Amb27673662 [0,2,0,0,0,0|2,0,0]=4 3067 B10R0.23 COCC(NC(C)=O)C(=O)O Amb8385373 [0,2,0,0,0,0|2,0,0]=4 3068 B10R0.23 COC[C@@H](NC(C)=O)C(=O)O Amb27990008 [0,2,0,0,0,0|2,0,0]=4 3069 B10R0.23 COC[C@H](NC(C)=O)C(=O)O Amb26999845 [0,2,0,0,0,0|2,0,0]=4 3070 B10R0.23 CSCC(CC(=O)O)C(=O)O Amb32953699 [0,2,0,0,0,0|0,1,0]=3 3071 B10R0.23 N=CN[C@@H](CC(=O)O)C(=O)O Amb27272462 [0,2,0,0,0,0|1,0,0]=3 3072 B10R0.23 NC(=O)N[C@@H](CCO)C(=O)O Amb26993170 [0,2,0,0,0,0|2,0,0]=4 3073 B10R0.23 NCCC(NC(=O)O)C(=O)O Amb24091186 [0,2,0,0,0,0|2,0,0]=4 3074 B10R0.23 O=C(O)CC(CCF)C(=O)O Amb33196068 [0,2,0,0,0,0|1,0,0]=3 3075 B10R0.23 O=CNC(CC(=O)O)C(=O)O Amb9813710 [0,2,0,0,0,0|0,0,1]=3 3076 B10R0.23 O=CN[C@@H](CC(=O)O)C(=O)O Amb16232029 [0,2,0,0,0,0|0,0,1]=3 3077 B10R0.23 O=CN[C@H](CC(=O)O)C(=O)O Amb22746431 [0,2,0,0,0,0|0,0,1]=3 3078 B10R0.53 CCC(NC(=O)OC)C(=O)O Amb9329787 [0,2,0,0,0,0|2,0,0]=4 3079 B10R0.53 CC[C@@H](NC(=O)OC)C(=O)O Amb25386298 [0,2,0,0,0,0|2,0,0]=4 3080 B10R0.53 CNC(=O)NC(CO)C(=O)O Amb18290471 [0,2,0,0,0,0|2,0,0]=4 3081 B10R0.53 COC(=O)NC(OC)C(N)=O Amb24764691 [0,2,0,0,0,0|2,0,0]=4 3082 B10R0.53 COC(=O)N[C@@H](CO)C(N)=O Amb27271972 [0,2,0,0,0,0|2,0,0]=4 3083 B10R0.53 NC(=O)[C@H](CO)NC(=O)CO Amb27271882 [0,2,0,0,0,0|2,0,0]=4 3084 B10R0.53 NCC(=O)NC(CO)C(=O)O Amb557297 [0,2,0,0,0,0|2,0,0]=4 3085 B10R0.53 NCC(=O)N[C@@H](CO)C(=O)O Amb18180042 [0,2,0,0,0,0|2,0,0]=4 3086 B10R0.53 NCC(=O)N[C@H](CO)C(=O)O Amb22230741 [0,2,0,0,0,0|2,0,0]=4 3087 B10R0.53 O=C(CCl)NC(CO)C(=O)O Amb3940605 [0,2,0,0,0,0|2,0,0]=4 3088 B10R0.53 O=C(CCl)N[C@@H](CO)C(=O)O Amb27990067 [0,2,0,0,0,0|2,0,0]=4 3089 B10R0.76 CC(=O)N(C)C(CO)C(=O)O Amb28386887 [0,2,0,0,0,0|2,0,0]=4 3090 B10R0.76 CC(=O)N(C)[C@@H](CO)C(=O)O Amb26083314 [0,2,0,0,0,0|2,0,0]=4 3091 B10R0.76 CC(C(=O)O)C(NO)C(=O)O Amb27673476 [0,2,0,0,0,0|0,0,0]=2 3092 B10R0.76 CCC(C(=O)O)C(O)C(=O)O Amb25386294 [0,2,0,0,0,0|0,0,0]=2 3093 B10R0.76 CC[C@@H](C(=O)O)[C@@H](O)C(=O)O Amb27990177 [0,2,0,0,0,0|0,0,0]=2 3094 B10R0.76 CC[C@H](C(=O)O)[C@@H](C)C(=O)O Amb27269197 [0,2,0,0,0,0|1,0,0]=3 3095 B10R0.76 CC[C@H](C(=O)O)[C@H](C)C(=O)O Amb27990007 [0,2,0,0,0,0|1,0,0]=3 3096 B10R0.76 CC\C(C(=O)O)=C(\O)C(=O)O Amb27231786 [0,2,0,0,0,0|0,0,2]=4 3097 B10R0.76 CO[C@H](C(=O)O)[C@@H](O)C(=O)O Amb27990020 [0,2,0,0,0,0|0,0,0]=2 3098 B10R0.76 C[C@H](C(=O)O)[C@H](NN)C(=O)O Amb27272552 [0,2,0,0,0,0|1,0,0]=3 3099 B10R0.76 N#CC(C(=O)O)C(N)C(=O)O Amb27974151 [0,2,0,0,0,0|1,0,0]=3 3100 B10R0.76 NC(C(=O)O)C(CO)C(=O)O Amb27988471 [0,2,0,0,0,0|0,0,0]=2 3101 B10R0.76 NCC(C(=O)O)[C@H](N)C(=O)O Amb25384089 [0,2,0,0,0,0|1,0,0]=3 3102 B10R0.76 NN[C@H](C(=O)O)[C@H](Cl)C(=O)O Amb27272395 [0,2,0,0,0,0|1,0,0]=3 3103 B10R0.76 N[C@H](C(=O)O)C(CO)C(=O)O Amb25384088 [0,2,0,0,0,0|0,0,0]=2 3104 B10R0.95 CNC(CS(=O)(=O)O)C(=O)O Amb27990226 [0,2,0,0,0,0|2,0,0]=4 3105 B10R0.95 NCC(CS(=O)(=O)O)C(=O)O Amb27990268 [0,2,0,0,0,0|2,0,0]=4 3106 B10R0.95 O=C(O)C(CO)NS(=O)(=O)O Amb17594775 [0,2,0,0,0,0|2,0,0]=4 3107 B10R0.95 O=C(O)C(CO)OP(=O)(O)O Amb27000108 [0,2,0,0,0,0|2,0,0]=4 3108 B10R0.95 O=C(O)[C@H](CO)NP(=O)(O)O Amb22233132 [0,2,0,0,0,0|2,0,0]=4 3109 B10R0.162 C=C(C)C(CC(=O)O)C(=O)O Amb18644989 [0,2,0,0,0,0|1,0,0]=3 3110 B10R0.162 CC(=O)C(CC(=O)O)C(C)C Amb27990011 [0,2,0,0,0,0|2,0,0]=4 3111 B10R0.162 CC(=O)NC(C(=O)O)C(=O)O Amb27471757 [0,2,0,0,0,0|2,0,0]=4 3112 B10R0.162 CC(=O)NC(C(=O)O)C(C)O Amb1119285 [0,2,0,0,0,0|2,0,0]=4 3113 B10R0.162 CC(=O)N[C@@H](C(=O)O)[C@H](C)O Amb24388953 [0,2,0,0,0,0|2,0,0]=4 3114 B10R0.162 CC(=O)N[C@H](C(=O)O)[C@@H](C)O Amb4606017 [0,2,0,0,0,0|2,0,0]=4 3115 B10R0.162 CC(=O)N[C@H](C(=O)O)[C@H](C)O Amb27165719 [0,2,0,0,0,0|2,0,0]=4 3116 B10R0.162 CC(=O)[C@@H](CC(=O)O)C(C)C Amb27990157 [0,2,0,0,0,0|2,0,0]=4 3117 B10R0.162 CC(=O)\C(CC(=O)O)=C(/C)O Amb28351515 [0,2,0,0,0,0|1,0,1]=4 3118 B10R0.162 CC(C)C(CC(=O)O)C(=O)O Amb18645268 [0,2,0,0,0,0|1,0,0]=3 3119 B10R0.162 CC(O)C(NC(N)=O)C(=O)O Amb9706401 [0,2,0,0,0,0|2,0,0]=4 3120 B10R0.162 C[C@@H](O)[C@H](NC(N)=O)C(=O)O Amb24651146 [0,2,0,0,0,0|2,0,0]=4 3121 B10R0.162 O=C(O)CC(C(=O)O)C(=O)O Amb4035259 [0,2,0,0,0,0|0,0,0]=2 3122 B10R0.162 O=C(O)CC(C(=O)O)C(F)F Amb32811600 [0,2,0,0,0,0|1,0,0]=3 3123 B10R0.162 O=C(O)CC(C(=O)O)[N+](=O)[O-] Amb26083808 [0,2,0,0,0,0|0,0,1]=3 3124 B10R0.162 O=C(O)CC(C(=O)O)[SH](=O)=O Amb27990267 [0,2,0,0,0,0|0,0,1]=3 3125 B10R0.162 O=C(O)C[C@@H](C(=O)O)[N+](=O)[O-] Amb24762931 [0,2,0,0,0,0|0,0,1]=3 3126 B10R0.162 O=C(O)C\C(C(=O)O)=P(=O)\O Amb27974262 [0,2,0,0,0,0|0,0,1]=3 3127 B10R0.26 C=C(C)C(O)CC(=O)OCC Amb33038273 [0,2,0,0,0,0|2,0,0]=4 3128 B10R0.26 C=COC(=O)N[C@@H](C)C(=O)O Amb25386315 [0,2,0,0,0,0|2,0,0]=4 3129 B10R0.26 CCCC(=O)CC(N)C(=O)O Amb33065496 [0,2,0,0,0,0|2,0,0]=4 3130 B10R0.26 CCCC(=O)C[C@@H](N)C(=O)O Amb33036798 [0,2,0,0,0,0|2,0,0]=4 3131 B10R0.26 CCCC(=O)C[C@H](N)C(=O)O Amb33065790 [0,2,0,0,0,0|2,0,0]=4 3132 B10R0.26 CCNC(=O)CC(N)C(=O)O Amb27990016 [0,2,0,0,0,0|2,0,0]=4 3133 B10R0.26 CCNC(=O)CC(O)C(N)=O Amb27272122 [0,2,0,0,0,0|2,0,0]=4 3134 B10R0.26 CCOC(=O)CC(Br)C(=O)O Amb18659113 [0,2,0,0,0,0|1,0,0]=3 3135 B10R0.26 CCOC(=O)CC(Br)C(C)=O Amb17406255 [0,2,0,0,0,0|2,0,0]=4 3136 B10R0.26 CCOC(=O)CC(N)C(=O)O Amb4017449 [0,2,0,0,0,0|1,0,0]=3 3137 B10R0.26 CCOC(=O)CC(N)C(=O)O Amb4019239 [0,2,0,0,0,0|1,0,0]=3 3138 B10R0.26 CCOC(=O)CC(O)C(=O)O Amb33362320 [0,2,0,0,0,0|0,0,0]=2 3139 B10R0.26 CCOC(=O)C[C@H](Br)C(=O)O Amb32653240 [0,2,0,0,0,0|1,0,0]=3 3140 B10R0.26 CCOC(=O)NC(C)C(=O)O Amb6248353 [0,2,0,0,0,0|2,0,0]=4 3141 B10R0.26 CCOC(=O)N[C@H](C)C(=O)O Amb24761982 [0,2,0,0,0,0|2,0,0]=4 3142 B10R0.26 CCOC(C)CC(O)C(=O)O Amb33079786 [0,2,0,0,0,0|1,0,1]=4 3143 B10R0.26 COCC(=O)CC(N)C(=O)O Amb32789418 [0,2,0,0,0,0|1,0,0]=3 3144 B10R0.26 COCC(=O)CC(N)C(N)=O Amb33065478 [0,2,0,0,0,0|2,0,0]=4 3145 B10R0.26 COCC(=O)C[C@@H](N)C(=O)O Amb33308520 [0,2,0,0,0,0|1,0,0]=3 3146 B10R0.26 COCC(=O)C[C@H](N)C(=O)O Amb33036839 [0,2,0,0,0,0|1,0,0]=3 3147 B10R0.26 COCC(=O)NC(C)C(=O)O Amb9705107 [0,2,0,0,0,0|2,0,0]=4 3148 B10R0.26 COCC(=O)N[C@@H](C)C(=O)O Amb18179995 [0,2,0,0,0,0|2,0,0]=4 3149 B10R0.26 COCC(C)CC(O)C(=O)O Amb33353382 [0,2,0,0,0,0|1,0,1]=4 3150 B10R0.26 C\C(=C/CO)C[C@H](N)C(=O)O Amb27990183 [0,2,0,0,0,0|2,0,0]=4 3151 B10R0.67 CC(C)(CO)CC(O)C(=O)O Amb33200342 [0,2,0,0,0,0|1,0,1]=4 3152 B10R0.67 CCP(=O)(O)CC(C)C(=O)O Amb27990021 [0,2,0,0,0,0|2,0,0]=4 3153 B10R0.67 CCS(=O)(=O)CC(O)C(=O)O Amb27270946 [0,2,0,0,0,0|1,0,1]=4 3154 B10R0.67 COC(C)(C)CC(O)C(=O)O Amb26997370 [0,2,0,0,0,0|1,0,1]=4 3155 B10R0.72 CCC(CC(O)C(=O)O)OC Amb33353281 [0,2,0,0,0,0|1,0,1]=4 3156 B10R0.72 COC(CC(O)C(=O)O)OC Amb33342032 [0,2,0,0,0,0|0,0,2]=4 3157 B8R1.1 C=CC1COC(=O)C1 Amb22232189 [1,0,0,1,0,0|2,0,0]=4 3158 B8R1.1 C=C[C@@H]1COC(=O)C1 Amb22232075 [1,0,0,1,0,0|2,0,0]=4 3159 B8R1.1 C=C[C@H]1COC(=O)C1 Amb22232080 [1,0,0,1,0,0|2,0,0]=4 3160 B8R1.1 CC1=NOC(C=O)C1 Amb8010570 [1,0,0,1,0,0|2,0,0]=4 3161 B8R1.1 O=C1CC(CO)CO1 Amb22886806 [1,0,0,1,0,0|1,0,1]=4 3162 B8R1.1 O=C1COC(CO)C1 Amb24117838 [1,0,0,1,0,0|1,0,1]=4 3163 B8R1.1 O=CC1=NOC(=O)C1 Amb27209562 [1,0,0,1,0,0|1,0,1]=4 3164 B8R1.1 O=CC1CCC(=O)C1 Amb18124240 [1,0,0,1,0,0|2,0,0]=4 3165 B8R1.1 O=CC1CNC(=O)C1 Amb24435979 [1,0,0,1,0,0|2,0,0]=4 3166 B8R1.1 O=CC1COC(=O)C1 Amb26428572 [1,0,0,1,0,0|1,0,0]=3 3167 B8R1.1 O=CC1COC(=O)O1 Amb27446683 [1,0,0,1,0,0|2,0,0]=4 3168 B8R1.18 C=C1CC(=O)OC1=O Amb3940408 [1,0,0,1,0,0|1,0,1]=4 3169 B8R1.18 CC1CC(=O)NC1=O Amb10609734 [1,0,0,1,0,0|2,0,0]=4 3170 B8R1.18 CC1CC(=O)OC1=O Amb3940407 [1,0,0,1,0,0|1,0,0]=3 3171 B8R1.18 CC1CC(=O)OC1O Amb26536810 [1,0,0,1,0,0|1,0,1]=4 3172 B8R1.18 CC1CC(O)C(=O)O1 Amb27451083 [1,0,0,1,0,0|1,0,1]=4 3173 B8R1.18 CC1NC(=O)OC1=O Amb22236022 [1,0,0,1,0,0|2,0,0]=4 3174 B8R1.18 CC1OC(=O)OC1=O Amb28315579 [1,0,0,1,0,0|2,0,0]=4 3175 B8R1.18 CN1CC(=O)OC1=O Amb22734007 [1,0,0,1,0,0|2,0,0]=4 3176 B8R1.18 C[C@@H]1CC(=O)OC1=O Amb25791861 [1,0,0,1,0,0|1,0,0]=3 3177 B8R1.18 C[C@@H]1NC(=O)OC1=O Amb2689575 [1,0,0,1,0,0|2,0,0]=4 3178 B8R1.18 C[C@H]1CC(=O)NC1=O Amb28119095 [1,0,0,1,0,0|2,0,0]=4 3179 B8R1.18 C[C@H]1CC(=O)OC1=O Amb2609932 [1,0,0,1,0,0|1,0,0]=3 3180 B8R1.18 C[C@H]1C[C@H](O)C(=O)O1 Amb27852763 [1,0,0,1,0,0|1,0,1]=4 3181 B8R1.18 C[C@H]1NC(=O)OC1=O Amb2689574 [1,0,0,1,0,0|2,0,0]=4 3182 B8R1.18 C[C@H]1OC(=O)C[C@H]1O Amb27775518 [1,0,0,1,0,0|1,0,1]=4 3183 B8R1.18 NC1CC(=O)NC1=O Amb30585083 [1,0,0,1,0,0|2,0,0]=4 3184 B8R1.18 NC1CC(=O)NC1=O Amb9502460 [1,0,0,1,0,0|2,0,0]=4 3185 B8R1.18 NC1CC(=O)OC1=O Amb27216215 [1,0,0,1,0,0|1,0,0]=3 3186 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb25992097 [1,0,0,1,0,0|1,0,0]=3 3187 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb8631355 [1,0,0,1,0,0|1,0,0]=3 3188 B8R1.18 N[C@H]1CC(=O)NC1=O Amb17134612 [1,0,0,1,0,0|2,0,0]=4 3189 B8R1.18 N[C@H]1CC(=O)OC1=O Amb24745675 [1,0,0,1,0,0|1,0,0]=3 3190 B8R1.18 N[C@H]1CC(=O)O[C@H]1O Amb28196677 [1,0,0,1,0,0|1,0,1]=4 3191 B8R1.18 O=C1CC(=O)C(O)C1 Amb24330382 [1,0,0,1,0,0|1,0,0]=3 3192 B8R1.18 O=C1CC(Cl)C(=O)O1 Amb24677749 [1,0,0,1,0,0|1,0,0]=3 3193 B8R1.18 O=C1CC(O)C(=O)O1 Amb27399619 [1,0,0,1,0,0|0,0,0]=2 3194 B8R1.18 O=C1C[C@@H](F)C(=O)O1 Amb28286140 [1,0,0,1,0,0|1,0,0]=3 3195 B8R1.18 O=C1C[C@@H](O)[C@H](O)C1 Amb27841798 [1,0,0,1,0,0|1,0,1]=4 3196 B8R1.18 O=C1C[C@H](F)C(=O)O1 Amb27406936 [1,0,0,1,0,0|1,0,0]=3 3197 B8R1.18 O=C1NC(=O)C(O)N1 Amb17615425 [1,0,0,1,0,0|2,0,0]=4 3198 B8R1.18 O=C1OC(O)CC1O Amb27761542 [1,0,0,1,0,0|0,0,2]=4 3199 B8R1.20 C=C1CC1CC(=O)O Amb25870954 [1,0,0,1,0,0|2,0,0]=4 3200 B8R1.20 O=C(O)CC1CC1O Amb27981662 [1,0,0,1,0,0|1,0,1]=4 3201 B8R1.31 NC1COC1C(=O)O Amb28428430 [1,0,0,1,0,0|1,0,1]=4 3202 B8R1.31 N[C@@H]1CO[C@H]1C(=O)O Amb24681491 [1,0,0,1,0,0|1,0,1]=4 3203 B8R1.31 N[C@H]1CO[C@@H]1C(=O)O Amb25324265 [1,0,0,1,0,0|1,0,1]=4 3204 B8R1.31 N[C@H]1CO[C@H]1C(=O)O Amb25929776 [1,0,0,1,0,0|1,0,1]=4 3205 B8R1.31 O=C(O)C1C=CC1Br Amb27220099 [1,0,0,1,0,0|2,0,0]=4 3206 B8R1.31 O=C(O)C1C=CC1O Amb27475863 [1,0,0,1,0,0|1,0,0]=3 3207 B8R1.31 O=C(O)C1CCC1O Amb24481384 [1,0,0,1,0,0|1,0,1]=4 3208 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O Amb27619188 [1,0,0,1,0,0|1,0,1]=4 3209 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O Amb34913090 [1,0,0,1,0,0|1,0,1]=4 3210 B8R1.34 O=C(O)CC1CCO1 Amb28136625 [1,0,0,1,0,0|1,0,1]=4 3211 B8R1.34 O=C(O)CC1COC1 Amb18199145 [1,0,0,1,0,0|1,0,1]=4 3212 B8R1.34 O=C(O)C[C@@H]1CCO1 Amb33715997 [1,0,0,1,0,0|1,0,1]=4 3213 B8R1.34 O=C(O)C[C@H]1CCO1 Amb26570015 [1,0,0,1,0,0|1,0,1]=4 3214 B8R1.42 O=C(O)CC1(O)CC1 Amb24117238 [1,0,0,1,0,0|1,0,1]=4 3215 B8R1.43 C=CC1OC1C(C)=O Amb28133068 [1,0,0,1,0,0|2,0,0]=4 3216 B8R1.43 C=C[C@@H]1C[C@H]1C(=O)O Amb28347448 [1,0,0,1,0,0|2,0,0]=4 3217 B8R1.43 CC(=O)C1CC1C=O Amb27809942 [1,0,0,1,0,0|2,0,0]=4 3218 B8R1.43 CC(=O)C1OC1C=O Amb27429116 [1,0,0,1,0,0|1,0,0]=3 3219 B8R1.43 CC(=O)[C@H]1C[C@H]1C=O Amb27186674 [1,0,0,1,0,0|2,0,0]=4 3220 B8R1.43 CC[C@@H]1O[C@@H]1C(=O)O Amb27855470 [1,0,0,1,0,0|1,0,1]=4 3221 B8R1.43 CC[C@H]1O[C@@H]1C(=O)O Amb27811556 [1,0,0,1,0,0|1,0,1]=4 3222 B8R1.43 CC[C@H]1O[C@H]1C(=O)O Amb27222314 [1,0,0,1,0,0|1,0,1]=4 3223 B8R1.43 O=C(O)C1CC1CO Amb25173469 [1,0,0,1,0,0|1,0,1]=4 3224 B8R1.43 O=C(O)[C@@H]1C[C@@H]1CO Amb28198703 [1,0,0,1,0,0|1,0,1]=4 3225 B8R1.43 O=C(O)[C@@H]1C[C@H]1CO Amb25231147 [1,0,0,1,0,0|1,0,1]=4 3226 B8R1.43 O=C(O)[C@H]1C[C@H]1CO Amb26916980 [1,0,0,1,0,0|1,0,1]=4 3227 B8R1.43 O=C[C@H]1C[C@H]1C(=O)O Amb25911990 [1,0,0,1,0,0|1,0,0]=3 3228 B8R1.67 C=C1C(C)C1C(=O)O Amb27985954 [1,0,0,1,0,0|2,0,0]=4 3229 B8R1.5 O=C1OCC=CC1O Amb27795928 [1,0,0,1,0,0|1,0,1]=4 3230 B8R1.5 O=C1OCCCC1O Amb19959000 [1,0,0,1,0,0|1,0,1]=4 3231 B8R1.7 CC(=O)C1CC=NO1 Amb27481847 [1,0,0,1,0,0|2,0,0]=4 3232 B8R1.7 O=C(O)C1C=CCO1 Amb18641762 [1,0,0,1,0,0|1,0,1]=4 3233 B8R1.7 O=C(O)C1CC=CC1 Amb2694750 [1,0,0,1,0,0|2,0,0]=4 3234 B8R1.7 O=C(O)C1CC=NN1 Amb18641765 [1,0,0,1,0,0|2,0,0]=4 3235 B8R1.7 O=C(O)C1CC=NO1 Amb27216537 [1,0,0,1,0,0|1,0,0]=3 3236 B8R1.7 O=C(O)C1CCCO1 Amb9702828 [1,0,0,1,0,0|1,0,1]=4 3237 B8R1.7 O=C(O)C1CCNO1 Amb28205451 [1,0,0,1,0,0|1,0,1]=4 3238 B8R1.7 O=C(O)C1CCNO1 Amb33329025 [1,0,0,1,0,0|1,0,1]=4 3239 B8R1.7 O=C(O)C1CCOC1 Amb33542759 [1,0,0,1,0,0|1,0,1]=4 3240 B8R1.7 O=C(O)C1COC=N1 Amb28291372 [1,0,0,1,0,0|2,0,0]=4 3241 B8R1.7 O=C(O)C1COCO1 Amb27810510 [1,0,0,1,0,0|2,0,0]=4 3242 B8R1.7 O=C(O)C1OC=CS1 Amb27489874 [1,0,0,1,0,0|2,0,0]=4 3243 B8R1.7 O=C(O)[C@@H]1CCCO1 Amb3940908 [1,0,0,1,0,0|1,0,1]=4 3244 B8R1.7 O=C(O)[C@@H]1CCOC1 Amb10603235 [1,0,0,1,0,0|1,0,1]=4 3245 B8R1.7 O=C(O)[C@@H]1CCON1 Amb26919409 [1,0,0,1,0,0|1,0,1]=4 3246 B8R1.7 O=C(O)[C@H]1CCCO1 Amb3941554 [1,0,0,1,0,0|1,0,1]=4 3247 B8R1.7 O=C(O)[C@H]1CCOC1 Amb22226787 [1,0,0,1,0,0|1,0,1]=4 3248 B8R1.23 C=C1CC(C(=O)O)C1 Amb613197 [1,0,0,1,0,0|2,0,0]=4 3249 B8R1.23 NC(=O)C1CC(=O)N1 Amb27214249 [1,0,0,1,0,0|2,0,0]=4 3250 B8R1.23 O=C(O)C1CC(O)C1 Amb8011535 [1,0,0,1,0,0|1,0,1]=4 3251 B8R1.23 O=C(O)C1CS(=O)C1 Amb26056015 [1,0,0,1,0,0|2,0,0]=4 3252 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 Amb19516179 [1,0,0,1,0,0|1,0,1]=4 3253 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 Amb19516178 [1,0,0,1,0,0|1,0,1]=4 3254 B8R1.23 O=C1CC(C(=O)Cl)C1 Amb16230813 [1,0,0,1,0,0|2,0,0]=4 3255 B8R1.23 O=C1CC(C(=O)O)C1 Amb33544325 [1,0,0,1,0,0|1,0,0]=3 3256 B8R1.23 O=C1CC(C(=O)O)N1 Amb16232079 [1,0,0,1,0,0|1,0,0]=3 3257 B8R1.23 O=C1CC(C(=O)O)O1 Amb26887454 [1,0,0,1,0,0|0,0,0]=2 3258 B8R1.23 O=C1CC(S(=O)O)N1 Amb27595618 [1,0,0,1,0,0|2,0,0]=4 3259 B8R1.23 O=C1C[C@@H](C(=O)O)N1 Amb22367070 [1,0,0,1,0,0|1,0,0]=3 3260 B8R1.23 O=C1C[C@H](C(=O)O)N1 Amb26975061 [1,0,0,1,0,0|1,0,0]=3 3261 B8R1.30 C=C1CC1(N)C(=O)O Amb22274582 [1,0,0,1,0,0|2,0,0]=4 3262 B8R1.30 C[C@@H]1C[C@@]1(O)C(=O)O Amb28133921 [1,0,0,1,0,0|1,0,1]=4 3263 B8R1.30 C[C@H]1C[C@]1(O)C(=O)O Amb27881113 [1,0,0,1,0,0|1,0,1]=4 3264 B8R1.46 C=C[C@@H]1NC(=O)[C@@H]1O Amb27421682 [1,0,0,1,0,0|2,0,0]=4 3265 B8R1.46 O=C1O[C@H](CO)[C@H]1O Amb27659903 [1,0,0,1,0,0|0,0,1]=3 3266 B8R1.54 O=C(O)C(O)C1CC1 Amb18282441 [1,0,0,1,0,0|1,0,1]=4 3267 B8R1.78 CC1(C(=O)O)CCO1 Amb22001906 [1,0,0,1,0,0|1,0,1]=4 3268 B8R1.78 O=C(O)C1(O)CCC1 Amb495557 [1,0,0,1,0,0|1,0,1]=4 3269 B8R1.78 O=C(O)C1(O)CNC1 Amb24122891 [1,0,0,1,0,0|2,0,0]=4 3270 B8R1.78 O=C(O)C1(O)CNC1 Amb28934838 [1,0,0,1,0,0|2,0,0]=4 3271 B8R1.78 O=C(O)C1(O)COC1 Amb25714262 [1,0,0,1,0,0|2,0,0]=4 3272 B8R1.3 O=C1CCC(=O)CC1 Amb6471902 [1,0,0,1,0,0|2,0,0]=4 3273 B8R1.3 O=C1CCC(=O)NC1 Amb15692796 [1,0,0,1,0,0|2,0,0]=4 3274 B8R1.3 O=C1CCC(=O)NN1 Amb22365926 [1,0,0,1,0,0|2,0,0]=4 3275 B8R1.3 O=C1CCC(=O)OC1 Amb26404271 [1,0,0,1,0,0|1,0,0]=3 3276 B8R1.3 O=C1CCC(O)CO1 Amb26345105 [1,0,0,1,0,0|1,0,1]=4 3277 B8R1.3 O=C1COC(=O)CN1 Amb2612815 [1,0,0,1,0,0|2,0,0]=4 3278 B8R1.3 O=C1COC(=O)CO1 Amb2725557 [1,0,0,1,0,0|2,0,0]=4 3279 B8R1.35 O=C(O)CCC1=CC1 Amb28364765 [1,0,0,1,0,0|2,0,0]=4 3280 B8R1.35 O=C(O)CCC1CO1 Amb27667995 [1,0,0,1,0,0|1,0,1]=4 3281 B8R1.50 CC1C(=O)COC1=O Amb4035239 [0,0,0,1,1,0|2,0,0]=4 3282 B8R1.50 O=C1CCC(=O)C1O Amb24443990 [0,0,0,1,1,0|2,0,0]=4 3283 B8R1.50 O=C1COC(=O)C1Br Amb17594578 [0,0,0,1,1,0|2,0,0]=4 3284 B8R1.50 O=C1COC(=O)C1Cl Amb534802 [0,0,0,1,1,0|2,0,0]=4 3285 B8R1.50 O=C1OC=C(O)C1Cl Amb28396605 [0,0,0,1,1,0|2,0,0]=4 3286 B8R1.50 O=C1OCC(O)=C1O Amb23505710 [0,0,0,1,1,0|1,0,1]=4 3287 B8R1.50 O=C1OCC(O)C1O Amb22730078 [0,0,0,1,1,0|1,0,1]=4 3288 B8R1.50 O=C1OC[C@@H](O)[C@@H]1O Amb24609731 [0,0,0,1,1,0|1,0,1]=4 3289 B8R1.50 O=C1OC[C@@H](O)[C@H]1O Amb8515014 [0,0,0,1,1,0|1,0,1]=4 3290 B8R1.50 O=C1OC[C@H](O)[C@@H]1O Amb27440225 [0,0,0,1,1,0|1,0,1]=4 3291 B8R1.50 O=C1OC[C@H](O)[C@H]1O Amb15692412 [0,0,0,1,1,0|1,0,1]=4 3292 B8R1.50 O=C1ON=C(O)C1F Amb27193869 [0,0,0,1,1,0|2,0,0]=4 3293 B8R1.50 OC1=CC=C(O)C1O Amb27651887 [0,0,0,1,1,0|2,0,0]=4 3294 B10R1.13 O=C(O)C1CCC(O)CO1 Amb23596937 [0,0,0,1,0,1|1,0,1]=4 3295 B10R1.13 O=C(O)[C@@H]1CC[C@@H](O)CO1 Amb27758209 [0,0,0,1,0,1|1,0,1]=4 3296 B10R1.13 O=C1CCC(C(=O)O)CC1 Amb5719059 [0,0,0,1,0,1|2,0,0]=4 3297 B10R1.13 O=C1CCC(C(=O)O)CN1 Amb8503400 [0,0,0,1,0,1|2,0,0]=4 3298 B10R1.13 O=C1CCC(C(=O)O)CN1 Amb9721708 [0,0,0,1,0,1|2,0,0]=4 3299 B10R1.13 O=C1CCC(C(=O)O)NC1 Amb21960863 [0,0,0,1,0,1|2,0,0]=4 3300 B10R1.13 O=C1CCC(C(=O)O)NC1 Amb5719827 [0,0,0,1,0,1|2,0,0]=4 3301 B10R1.13 O=C1CCC(C(=O)O)NN1 Amb23441127 [0,0,0,1,0,1|2,0,0]=4 3302 B10R1.13 O=C1CCC(C(=O)O)SC1 Amb23596925 [0,0,0,1,0,1|1,1,0]=4 3303 B10R1.13 O=C1CC[C@@H](C(=O)O)CN1 Amb26878933 [0,0,0,1,0,1|2,0,0]=4 3304 B10R1.13 O=C1CC[C@@H](C(=O)O)NC1 Amb24655763 [0,0,0,1,0,1|2,0,0]=4 3305 B10R1.13 O=C1CC[C@@H](C(=O)O)NC1 Amb31291189 [0,0,0,1,0,1|2,0,0]=4 3306 B10R1.13 O=C1CC[C@H](C(=O)O)CN1 Amb26515676 [0,0,0,1,0,1|2,0,0]=4 3307 B10R1.13 O=C1CC[C@H](C(=O)O)NC1 Amb27648107 [0,0,0,1,0,1|2,0,0]=4 3308 B10R1.13 O=C1CC[C@H](C(=O)O)NC1 Amb31291190 [0,0,0,1,0,1|2,0,0]=4 3309 B10R1.13 O=C1CNC(C(=O)O)CN1 Amb22235954 [0,0,0,1,0,1|2,0,0]=4 3310 B10R1.13 O=C1CNC(C(=O)O)CN1 Amb22641428 [0,0,0,1,0,1|2,0,0]=4 3311 B10R1.13 O=C1CN[C@@H](C(=O)O)CN1 Amb24423079 [0,0,0,1,0,1|2,0,0]=4 3312 B10R1.13 O=C1CN[C@H](C(=O)O)CN1 Amb22756547 [0,0,0,1,0,1|2,0,0]=4 3313 B10R1.13 O=C1COC(C(=O)O)CN1 Amb27872662 [0,0,0,1,0,1|1,0,0]=3 3314 B10R1.13 O=C1NCC(C(=O)O)CN1 Amb27469166 [0,0,0,1,0,1|2,0,0]=4 3315 B10R1.58 C=C1CC(C(=O)O)OC1=O Amb27838007 [0,0,0,1,0,1|1,0,1]=4 3316 B10R1.58 C=C1C[C@@H](C(=O)O)OC1=O Amb27253954 [0,0,0,1,0,1|1,0,1]=4 3317 B10R1.58 C=C1C[C@H](C(=O)O)OC1=O Amb28340915 [0,0,0,1,0,1|1,0,1]=4 3318 B10R1.58 CC1CC(C(=O)O)CC1=O Amb27413499 [0,0,0,1,0,1|2,0,0]=4 3319 B10R1.58 CC1CC(C(=O)O)OC1=O Amb27836333 [0,0,0,1,0,1|1,0,0]=3 3320 B10R1.58 CC1C[C@@H](C(=O)O)OC1=O Amb27615055 [0,0,0,1,0,1|1,0,0]=3 3321 B10R1.58 CC1OC(C(=O)O)OC1=O Amb27250530 [0,0,0,1,0,1|1,0,0]=3 3322 B10R1.58 CC1O[C@@H](C(=O)O)C[C@H]1O Amb27216683 [0,0,0,1,0,1|1,0,1]=4 3323 B10R1.58 CN1CC(C(=O)O)OC1=O Amb27864010 [0,0,0,1,0,1|2,0,0]=4 3324 B10R1.58 CN1C[C@@H](C(=O)O)OC1=O Amb25696396 [0,0,0,1,0,1|2,0,0]=4 3325 B10R1.58 C[C@@H](O)[C@H]1C[C@@H](O)C(=O)O1 Amb27427653 [0,0,0,1,0,1|1,0,1]=4 3326 B10R1.58 C[C@H](O)[C@H]1C[C@H](O)C(=O)O1 Amb27219090 [0,0,0,1,0,1|1,0,1]=4 3327 B10R1.58 C[C@H]1C[C@@H](C(=O)Cl)OC1=O Amb27255383 [0,0,0,1,0,1|2,0,0]=4 3328 B10R1.58 C[C@H]1O[C@H](C(=O)O)C[C@@H]1O Amb27194347 [0,0,0,1,0,1|1,0,1]=4 3329 B10R1.58 NC1CC(C(=O)O)OC1=O Amb25147458 [0,0,0,1,0,1|1,0,0]=3 3330 B10R1.58 N[C@H]1C[C@@H](C(=O)O)OC1=O Amb27782562 [0,0,0,1,0,1|1,0,0]=3 3331 B10R1.58 N[C@H]1C[C@@H](C(=O)O)SC1=O Amb27486281 [0,0,0,1,0,1|1,1,0]=4 3332 B10R1.58 O=C(O)C1CC(=O)N(O)C1 Amb27779851 [0,0,0,1,0,1|2,0,0]=4 3333 B10R1.58 O=C(O)C1CC(O)C(O)C1 Amb26034622 [0,0,0,1,0,1|1,0,1]=4 3334 B10R1.58 O=C(O)C1C[C@H](O)[C@H](O)C1 Amb28126711 [0,0,0,1,0,1|1,0,1]=4 3335 B10R1.58 O=C(O)C1OC(O)C(O)O1 Amb27838116 [0,0,0,1,0,1|0,0,2]=4 3336 B10R1.58 O=C(O)C1O[C@H](O)[C@@H](O)O1 Amb27204841 [0,0,0,1,0,1|0,0,2]=4 3337 B10R1.58 O=C(O)[C@@H]1C[C@@H](Br)C(=O)O1 Amb28436779 [0,0,0,1,0,1|1,0,0]=3 3338 B10R1.58 O=C(O)[C@@H]1C[C@@H](F)C(=O)N1 Amb10839466 [0,0,0,1,0,1|2,0,0]=4 3339 B10R1.58 O=C1NC(C(=O)O)CC1F Amb24696741 [0,0,0,1,0,1|2,0,0]=4 3340 B10R1.58 O=C1N[C@@H](C(=O)O)C[C@@H]1F Amb27421959 [0,0,0,1,0,1|2,0,0]=4 3341 B10R1.58 O=C1N[C@H](C(=O)O)CC1F Amb25360897 [0,0,0,1,0,1|2,0,0]=4 3342 B10R1.58 O=C1N[C@H](C(=O)O)CC1O Amb28208546 [0,0,0,1,0,1|1,0,0]=3 3343 B10R1.58 O=C1N[C@H](C(=O)O)C[C@@H]1F Amb10838332 [0,0,0,1,0,1|2,0,0]=4 3344 B10R1.58 O=C1O[C@H](C(=O)O)C[C@@H]1O Amb25230626 [0,0,0,1,0,1|0,0,0]=2 3345 B10R1.190 N[C@@H](CC1CC1=O)C(=O)O Amb28315789 [0,0,0,1,0,1|2,0,0]=4 3346 B10R1.332 O=C1CCC(=O)C(O)CN1 Amb27184436 [0,0,0,1,0,1|2,0,0]=4 3347 B10R1.349 C=C(O)C1CC(C(=O)O)N1 Amb27397366 [0,0,0,1,0,1|2,0,0]=4 3348 B10R1.349 CC(=O)C1CC(C(=O)O)C1 Amb25113879 [0,0,0,1,0,1|2,0,0]=4 3349 B10R1.349 CC(=O)N1CC(C(=O)O)C1 Amb33545591 [0,0,0,1,0,1|2,0,0]=4 3350 B10R1.349 NC(=O)C1CC(C(=O)O)N1 Amb27872340 [0,0,0,1,0,1|2,0,0]=4 3351 B10R1.349 NC(=O)N1CC(C(=O)O)C1 Amb25990817 [0,0,0,1,0,1|2,0,0]=4 3352 B10R1.349 NC(=O)[C@@H]1C[C@H](C(=O)O)N1 Amb27186909 [0,0,0,1,0,1|2,0,0]=4 3353 B10R1.349 NC(=O)[C@H]1C[C@@H](C(=O)O)N1 Amb27961402 [0,0,0,1,0,1|2,0,0]=4 3354 B10R1.349 O=C(O)C1CC(C(=O)O)C1 Amb19958786 [0,0,0,1,0,1|1,0,0]=3 3355 B10R1.349 O=C(O)C1CC(C(=O)O)N1 Amb28318335 [0,0,0,1,0,1|1,0,0]=3 3356 B10R1.349 O=C(O)[C@@H]1C[C@@H](C(=O)O)N1 Amb8515688 [0,0,0,1,0,1|1,0,0]=3 3357 B10R1.349 O=C(O)[C@@H]1C[C@H](C(=O)O)N1 Amb8515686 [0,0,0,1,0,1|1,0,0]=3 3358 B10R1.349 O=C(O)[C@H]1C[C@@H](C(=O)O)C1 Amb7970125 [0,0,0,1,0,1|1,0,0]=3 3359 B10R1.349 O=C(O)[C@H]1C[C@H](C(=O)O)C1 Amb19514892 [0,0,0,1,0,1|1,0,0]=3 3360 B10R1.349 O=C(O)[C@H]1C[C@H](C(=O)O)N1 Amb8515687 [0,0,0,1,0,1|1,0,0]=3 3361 B10R1.359 O=C(O)C1CCP(=O)(O)C1 Amb27450568 [0,0,0,1,0,1|2,0,0]=4 3362 B10R1.360 CC(=O)C1(Br)CC1C(=O)O Amb28204025 [0,0,0,1,0,1|2,0,0]=4 3363 B10R1.360 CC1(C(=O)O)CC1C(=O)O Amb612291 [0,0,0,1,0,1|1,0,0]=3 3364 B10R1.360 C[C@@]1(C(=O)O)C[C@@H]1C(=O)O Amb24598825 [0,0,0,1,0,1|1,0,0]=3 3365 B10R1.360 C[C@@]1(C(=O)O)O[C@@H]1C(=O)O Amb25340526 [0,0,0,1,0,1|1,0,0]=3 3366 B10R1.360 C[C@]1(C(=O)O)C[C@@H]1C(=O)O Amb27420123 [0,0,0,1,0,1|1,0,0]=3 3367 B10R1.360 C[C@]1(C(=O)O)C[C@H]1C(=O)O Amb27969184 [0,0,0,1,0,1|1,0,0]=3 3368 B10R1.360 NC1(C(=O)O)CC1C(=O)O Amb25124900 [0,0,0,1,0,1|1,0,0]=3 3369 B10R1.360 N[C@@]1(C(=O)O)C[C@H]1C(=O)O Amb24515142 [0,0,0,1,0,1|1,0,0]=3 3370 B10R1.360 N[C@]1(C(=O)O)C[C@H]1C(=O)O Amb23452828 [0,0,0,1,0,1|1,0,0]=3 3371 B10R1.360 O=C(O)C1CC1(Br)C(=O)O Amb27770448 [0,0,0,1,0,1|1,0,0]=3 3372 B10R1.360 O=C(O)C1CC1(Cl)C(=O)O Amb27838075 [0,0,0,1,0,1|1,0,0]=3 3373 B10R1.360 O=C(O)C1CC1(O)C(=O)O Amb27975726 [0,0,0,1,0,1|0,0,0]=2 3374 B10R1.360 O=C(O)[C@@H]1C[C@@]1(Br)C(=O)O Amb27213790 [0,0,0,1,0,1|1,0,0]=3 3375 B10R1.360 O=C(O)[C@H]1C[C@@]1(Br)C(=O)O Amb27969089 [0,0,0,1,0,1|1,0,0]=3 3376 B10R1.360 O=C(O)[C@H]1C[C@@]1(Cl)C(=O)O Amb27984863 [0,0,0,1,0,1|1,0,0]=3 3377 B10R1.368 CC(=O)NC1CC1C(=O)O Amb18831601 [0,0,0,1,0,1|2,0,0]=4 3378 B10R1.368 O=C(O)CC1OC1C(=O)O Amb28146420 [0,0,0,1,0,1|0,0,0]=2 3379 B10R1.368 O=C(O)C[C@@H]1O[C@@H]1C(=O)O Amb27254162 [0,0,0,1,0,1|0,0,0]=2 3380 B10R1.368 O=C(O)\C=C1\CC1C(=O)O Amb27216810 [0,0,0,1,0,1|1,0,1]=4 3381 B10R1.470 C=C1CCC(O)(C(=O)O)C1 Amb27620508 [0,0,0,1,0,1|2,0,0]=4 3382 B10R1.470 CC(=O)C1(O)CCC(=O)O1 Amb26927588 [0,0,0,1,0,1|1,0,0]=3 3383 B10R1.470 CC1(C(=O)Cl)CCC(=O)O1 Amb27817345 [0,0,0,1,0,1|2,0,0]=4 3384 B10R1.470 CC1(C(=O)O)CCC(=O)C1 Amb23454199 [0,0,0,1,0,1|2,0,0]=4 3385 B10R1.470 CC1(C(=O)O)CCC(=O)N1 Amb33545084 [0,0,0,1,0,1|2,0,0]=4 3386 B10R1.470 CC1(C(=O)O)CCC(=O)O1 Amb9783335 [0,0,0,1,0,1|1,0,0]=3 3387 B10R1.470 CC1(C(=O)O)CNC(=O)C1 Amb22546311 [0,0,0,1,0,1|2,0,0]=4 3388 B10R1.470 CC1(C(=O)O)CNC(=O)N1 Amb33745555 [0,0,0,1,0,1|2,0,0]=4 3389 B10R1.470 CC1(C(=O)O)CNC(=O)O1 Amb33736385 [0,0,0,1,0,1|1,0,0]=3 3390 B10R1.470 CC1(C(=O)O)COC(=O)N1 Amb27838110 [0,0,0,1,0,1|2,0,0]=4 3391 B10R1.470 CC1(C(=O)O)COC(=O)O1 Amb28422351 [0,0,0,1,0,1|1,0,0]=3 3392 B10R1.470 CC1=CCC(O)(C(=O)O)C1 Amb28067642 [0,0,0,1,0,1|2,0,0]=4 3393 B10R1.470 C[C@@]1(C(=O)O)CCC(=O)N1 Amb28126701 [0,0,0,1,0,1|2,0,0]=4 3394 B10R1.470 C[C@@]1(C(=O)O)CCC(=O)O1 Amb28067769 [0,0,0,1,0,1|1,0,0]=3 3395 B10R1.470 C[C@@]1(C(=O)O)COC(=O)O1 Amb27467542 [0,0,0,1,0,1|1,0,0]=3 3396 B10R1.470 C[C@]1(C(=O)O)CCC(=O)O1 Amb27881875 [0,0,0,1,0,1|1,0,0]=3 3397 B10R1.470 O=C(O)C1(O)CC(O)CO1 Amb27220131 [0,0,0,1,0,1|1,0,1]=4 3398 B10R1.470 O=C1CCC(O)(C(=O)O)O1 Amb28050065 [0,0,0,1,0,1|0,0,0]=2 3399 B10R1.470 O=C1C[C@@](O)(C(=O)O)CO1 Amb25084490 [0,0,0,1,0,1|1,0,0]=3 3400 B10R1.54 CC(=O)OC1COC(=O)C1 Amb22730362 [0,0,0,1,0,1|2,0,0]=4 3401 B10R1.54 CC(=O)O[C@@H]1COC(=O)C1 Amb8516055 [0,0,0,1,0,1|2,0,0]=4 3402 B10R1.54 CC(=O)O[C@H]1COC(=O)C1 Amb22225179 [0,0,0,1,0,1|2,0,0]=4 3403 B10R1.54 CC1=NOC(CC(=O)O)C1 Amb5721477 [0,0,0,1,0,1|2,0,0]=4 3404 B10R1.54 O=C(O)CC1=CC(=O)NO1 Amb18831605 [0,0,0,1,0,1|1,0,1]=4 3405 B10R1.54 O=C(O)CC1=CC(=O)OC1 Amb27615054 [0,0,0,1,0,1|1,0,1]=4 3406 B10R1.54 O=C(O)CC1=CC(=O)ON1 Amb28348890 [0,0,0,1,0,1|1,0,1]=4 3407 B10R1.54 O=C(O)CC1=NOC(=O)C1 Amb18202495 [0,0,0,1,0,1|1,0,1]=4 3408 B10R1.54 O=C(O)CC1CC(=O)CN1 Amb27860610 [0,0,0,1,0,1|2,0,0]=4 3409 B10R1.54 O=C(O)CC1CCC(=O)C1 Amb18643816 [0,0,0,1,0,1|2,0,0]=4 3410 B10R1.54 O=C(O)CC1CCC(=O)N1 Amb2372619 [0,0,0,1,0,1|2,0,0]=4 3411 B10R1.54 O=C(O)CC1CCC(=O)O1 Amb6316138 [0,0,0,1,0,1|2,0,0]=4 3412 B10R1.54 O=C(O)CC1CNC(=O)C1 Amb18831602 [0,0,0,1,0,1|2,0,0]=4 3413 B10R1.54 O=C(O)CC1COC(=O)C1 Amb20669416 [0,0,0,1,0,1|1,0,0]=3 3414 B10R1.54 O=C(O)CC1COC(=O)N1 Amb27838109 [0,0,0,1,0,1|1,0,0]=3 3415 B10R1.54 O=C(O)C[C@@H]1C=CC(=O)O1 Amb28314258 [0,0,0,1,0,1|2,0,0]=4 3416 B10R1.54 O=C(O)C[C@@H]1CCC(=O)C1 Amb24480441 [0,0,0,1,0,1|2,0,0]=4 3417 B10R1.54 O=C(O)C[C@@H]1CCC(=O)N1 Amb22587587 [0,0,0,1,0,1|2,0,0]=4 3418 B10R1.54 O=C(O)C[C@@H]1CNC(=O)C1 Amb24410373 [0,0,0,1,0,1|2,0,0]=4 3419 B10R1.54 O=C(O)C[C@H]1CCC(=O)C1 Amb22898751 [0,0,0,1,0,1|2,0,0]=4 3420 B10R1.54 O=C(O)C[C@H]1CCC(=O)N1 Amb22587585 [0,0,0,1,0,1|2,0,0]=4 3421 B10R1.54 O=C(O)C[C@H]1CCC(=O)O1 Amb26025159 [0,0,0,1,0,1|2,0,0]=4 3422 B10R1.54 O=C(O)C[C@H]1CNC(=O)C1 Amb26611732 [0,0,0,1,0,1|2,0,0]=4 3423 B10R1.54 O=C(O)C[C@H]1COC(=O)N1 Amb25744486 [0,0,0,1,0,1|1,0,0]=3 3424 B10R1.59 CC(=O)[C@@H]1OC(=O)C[C@@H]1C Amb25319949 [0,0,0,1,0,1|2,0,0]=4 3425 B10R1.59 CC1CC(=O)NC1C(=O)O Amb25063723 [0,0,0,1,0,1|2,0,0]=4 3426 B10R1.59 CC1NC(=O)OC1C(=O)O Amb25046075 [0,0,0,1,0,1|1,0,0]=3 3427 B10R1.59 CC1NC(=O)OC1C(N)=O Amb27962612 [0,0,0,1,0,1|2,0,0]=4 3428 B10R1.59 CC1OC(=O)NC1C(=O)O Amb18644184 [0,0,0,1,0,1|2,0,0]=4 3429 B10R1.59 CC1SC(=O)NC1C(=O)O Amb28208417 [0,0,0,1,0,1|2,0,0]=4 3430 B10R1.59 CC1SC(=O)SC1C(=O)O Amb23504453 [0,0,0,1,0,1|1,1,0]=4 3431 B10R1.59 C[C@@H]1CC(=O)C[C@H]1C(=O)O Amb26891990 [0,0,0,1,0,1|2,0,0]=4 3432 B10R1.59 C[C@@H]1CC(=O)N[C@@H]1C(=O)O Amb27188183 [0,0,0,1,0,1|2,0,0]=4 3433 B10R1.59 C[C@@H]1CC(=O)O[C@@H]1C(=O)O Amb28428901 [0,0,0,1,0,1|1,0,0]=3 3434 B10R1.59 C[C@@H]1NC(=O)C[C@H]1C(=O)O Amb18202489 [0,0,0,1,0,1|2,0,0]=4 3435 B10R1.59 C[C@@H]1NC(=O)O[C@@H]1C(=O)O Amb28057719 [0,0,0,1,0,1|1,0,0]=3 3436 B10R1.59 C[C@@H]1NC(=O)O[C@H]1C(=O)O Amb27630658 [0,0,0,1,0,1|1,0,0]=3 3437 B10R1.59 C[C@@H]1OC(=O)C[C@@H]1C(=O)O Amb27810863 [0,0,0,1,0,1|2,0,0]=4 3438 B10R1.59 C[C@@H]1OC(=O)N[C@H]1C(=O)O Amb25243703 [0,0,0,1,0,1|2,0,0]=4 3439 B10R1.59 C[C@@H]1SC(=O)S[C@H]1C(=O)O Amb28384455 [0,0,0,1,0,1|1,1,0]=4 3440 B10R1.59 C[C@H](O)C1OC(=O)C[C@@H]1O Amb28345319 [0,0,0,1,0,1|1,0,1]=4 3441 B10R1.59 C[C@H](O)[C@@H]1OC(=O)C[C@H]1O Amb28350193 [0,0,0,1,0,1|1,0,1]=4 3442 B10R1.59 C[C@H]1CC(=O)N[C@@H]1C(=O)O Amb28429784 [0,0,0,1,0,1|2,0,0]=4 3443 B10R1.59 C[C@H]1CC(=O)O[C@@H]1C(=O)O Amb27230560 [0,0,0,1,0,1|1,0,0]=3 3444 B10R1.59 C[C@H]1NC(=O)O[C@@H]1C(=O)O Amb28346276 [0,0,0,1,0,1|1,0,0]=3 3445 B10R1.59 C[C@H]1OC(=O)O[C@@H]1C(=O)O Amb27446650 [0,0,0,1,0,1|1,0,0]=3 3446 B10R1.59 NC1CC(=O)CC1C(=O)O Amb24523031 [0,0,0,1,0,1|2,0,0]=4 3447 B10R1.59 N[C@H]1CC(=O)C[C@H]1C(=O)O Amb27658876 [0,0,0,1,0,1|2,0,0]=4 3448 B10R1.59 O=C(O)[C@H]1O[C@@H](O)C[C@@H]1O Amb27961459 [0,0,0,1,0,1|0,0,2]=4 3449 B10R1.59 O=C(O)[C@H]1O[C@H](O)C[C@@H]1O Amb27422050 [0,0,0,1,0,1|0,0,2]=4 3450 B10R1.59 O=C1CC(O)C(C(=O)O)N1 Amb27175349 [0,0,0,1,0,1|1,0,0]=3 3451 B10R1.59 O=C1CC(O)C(C(=O)O)O1 Amb27815003 [0,0,0,1,0,1|0,0,0]=2 3452 B10R1.59 O=C1C[C@@H](O)[C@H](C(=O)O)O1 Amb27254163 [0,0,0,1,0,1|0,0,0]=2 3453 B10R1.59 O=C1C[C@H](O)[C@@H](C(=O)O)N1 Amb27803055 [0,0,0,1,0,1|1,0,0]=3 3454 B10R1.59 O=C1OC(=O)C(C(=O)O)O1 Amb25335302 [0,0,0,1,0,1|0,0,2]=4 3455 B10R1.282 C=C1C(C(=O)O)C1C(=O)O Amb9703293 [0,0,0,1,0,1|1,0,1]=4 3456 B10R1.282 C=C1C(C(=O)O)[C@@H]1C(=O)O Amb27830032 [0,0,0,1,0,1|1,0,1]=4 3457 B10R1.282 C=C1[C@@H](C(=O)O)[C@@H]1C(=O)O Amb533202 [0,0,0,1,0,1|1,0,1]=4 3458 B10R1.282 C=C1[C@@H](C(=O)O)[C@H]1C(=O)O Amb10069605 [0,0,0,1,0,1|1,0,1]=4 3459 B10R1.282 C=C1[C@H](C(=O)O)[C@H]1C(=O)O Amb2721000 [0,0,0,1,0,1|1,0,1]=4 3460 B10R1.282 CC(=O)C1C(C)C1C(=O)O Amb27794780 [0,0,0,1,0,1|2,0,0]=4 3461 B10R1.282 CC(=O)[C@@H]1[C@@H](C)[C@H]1C(=O)O Amb27489158 [0,0,0,1,0,1|2,0,0]=4 3462 B10R1.282 CC1C(C(=O)O)C1C(=O)O Amb25113473 [0,0,0,1,0,1|1,0,0]=3 3463 B10R1.282 CC1C(C(N)=O)C1C(=O)O Amb27816551 [0,0,0,1,0,1|2,0,0]=4 3464 B10R1.282 CC1[C@@H](C(=O)O)[C@@H]1C(=O)O Amb27422045 [0,0,0,1,0,1|1,0,0]=3 3465 B10R1.282 CC1[C@H](C(=O)O)[C@H]1C(=O)O Amb25956733 [0,0,0,1,0,1|1,0,0]=3 3466 B10R1.282 N[C@@H]1[C@@H](C(=O)O)[C@H]1C(=O)O Amb27472114 [0,0,0,1,0,1|1,0,0]=3 3467 B10R1.309 CC(=O)CC1(C)CC(=O)O1 Amb27217382 [0,0,0,1,0,1|2,0,0]=4 3468 B10R1.309 C[C@]1(CC(=O)O)CC(=O)O1 Amb27827327 [0,0,0,1,0,1|1,0,0]=3 3469 B10R1.442 CC(=O)CC1(C(=O)O)CC1 Amb35789256 [0,1,0,1,0,0|2,0,0]=4 3470 B10R1.442 NC(=O)C1(CC(=O)O)CO1 Amb27617834 [0,1,0,1,0,0|1,0,0]=3 3471 B10R1.442 O=C(O)CC1(C(=O)O)CC1 Amb27410590 [0,1,0,1,0,0|1,0,0]=3 3472 B10R1.14 COC(=O)C1=NOC(=O)C1 Amb22498282 [0,1,0,1,0,0|1,0,1]=4 3473 B10R1.14 COC(=O)C1CC(=O)CN1 Amb27874114 [0,1,0,1,0,0|2,0,0]=4 3474 B10R1.14 COC(=O)C1CC(=O)CO1 Amb22755134 [0,1,0,1,0,0|1,0,0]=3 3475 B10R1.14 COC(=O)C1CC(=O)CS1 Amb18199422 [0,1,0,1,0,0|1,1,0]=4 3476 B10R1.14 COC(=O)C1CC(=O)NN1 Amb32993767 [0,1,0,1,0,0|2,0,0]=4 3477 B10R1.14 COC(=O)C1CC(Br)=NO1 Amb23449508 [0,1,0,1,0,0|2,0,0]=4 3478 B10R1.14 COC(=O)C1CC(C)=NO1 Amb22411580 [0,1,0,1,0,0|2,0,0]=4 3479 B10R1.14 COC(=O)C1CC(O)CO1 Amb24648233 [0,1,0,1,0,0|1,0,1]=4 3480 B10R1.14 COC(=O)C1CCC(=O)C1 Amb10067354 [0,1,0,1,0,0|2,0,0]=4 3481 B10R1.14 COC(=O)C1CNC(=O)C1 Amb9175027 [0,1,0,1,0,0|2,0,0]=4 3482 B10R1.14 COC(=O)C1COC(=O)C1 Amb27985654 [0,1,0,1,0,0|1,0,0]=3 3483 B10R1.14 COC(=O)C1COC(=O)N1 Amb22432172 [0,1,0,1,0,0|2,0,0]=4 3484 B10R1.14 COC(=O)C1CSC(=O)C1 Amb27478518 [0,1,0,1,0,0|1,1,0]=4 3485 B10R1.14 COC(=O)[C@@H]1CC(=O)CN1 Amb27213178 [0,1,0,1,0,0|2,0,0]=4 3486 B10R1.14 COC(=O)[C@@H]1CC(=O)CN1 Amb33743709 [0,1,0,1,0,0|2,0,0]=4 3487 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 Amb27459673 [0,1,0,1,0,0|2,0,0]=4 3488 B10R1.14 COC(=O)[C@@H]1CNC(=O)C1 Amb24479010 [0,1,0,1,0,0|2,0,0]=4 3489 B10R1.14 COC(=O)[C@@H]1COC(=O)N1 Amb22746545 [0,1,0,1,0,0|2,0,0]=4 3490 B10R1.14 COC(=O)[C@@H]1C[C@@H](O)CO1 Amb27970939 [0,1,0,1,0,0|1,0,1]=4 3491 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 Amb23440273 [0,1,0,1,0,0|2,0,0]=4 3492 B10R1.14 COC(=O)[C@H]1CNC(=O)C1 Amb27834292 [0,1,0,1,0,0|2,0,0]=4 3493 B10R1.14 COC(=O)[C@H]1COC(=O)C1 Amb25945015 [0,1,0,1,0,0|1,0,0]=3 3494 B10R1.14 COC(=O)[C@H]1COC(=O)N1 Amb19929331 [0,1,0,1,0,0|2,0,0]=4 3495 B10R1.14 O=C1CC(C(=O)CCl)CO1 Amb24738564 [0,1,0,1,0,0|2,0,0]=4 3496 B10R1.22 CC1OC(=O)CC(O)C1O Amb27164229 [0,1,0,1,0,0|1,0,1]=4 3497 B10R1.22 C[C@@H]1OC(=O)C[C@H](O)C1=O Amb27629583 [0,1,0,1,0,0|1,0,0]=3 3498 B10R1.22 C[C@@H]1OC(=O)C[C@H](O)[C@@H]1O Amb27220279 [0,1,0,1,0,0|1,0,1]=4 3499 B10R1.22 C[C@H]1OC(=O)C[C@@H](O)[C@H]1O Amb27980472 [0,1,0,1,0,0|1,0,1]=4 3500 B10R1.25 N=C1CC(O)C(C=O)=CO1 Amb26450992 [0,1,0,1,0,0|2,0,0]=4 3501 B10R1.64 C=C1COCC1CC(=O)O Amb27778654 [0,1,0,1,0,0|2,0,0]=4 3502 B10R1.64 O=C(O)CC1CCCC1=O Amb18643831 [0,1,0,1,0,0|2,0,0]=4 3503 B10R1.64 O=C(O)CC1CCNC1=O Amb18831604 [0,1,0,1,0,0|2,0,0]=4 3504 B10R1.64 O=C(O)CC1CCOC1=O Amb18644064 [0,1,0,1,0,0|1,0,0]=3 3505 B10R1.64 O=C(O)CC1CNCC1=O Amb27797524 [0,1,0,1,0,0|2,0,0]=4 3506 B10R1.64 O=C(O)CC1OCOC1=O Amb27595868 [0,1,0,1,0,0|0,0,0]=2 3507 B10R1.64 O=C(O)CN1CCOC1=O Amb3941353 [0,1,0,1,0,0|2,0,0]=4 3508 B10R1.64 O=C(O)CN1COCC1=O Amb2692931 [0,1,0,1,0,0|2,0,0]=4 3509 B10R1.64 O=C(O)CN1N=COC1=O Amb28193793 [0,1,0,1,0,0|2,0,0]=4 3510 B10R1.64 O=C(O)C[C@@H]1COC[C@H]1O Amb32904239 [0,1,0,1,0,0|1,0,1]=4 3511 B10R1.64 O=C(O)C[C@H]1OCOC1=O Amb27882671 [0,1,0,1,0,0|0,0,0]=2 3512 B10R1.64 O=C(O)Cc1nonc1O Amb10552405 [0,1,0,1,0,0|1,0,1]=4 3513 B10R1.163 O=C(O)C1NC(CO)C1O Amb28143118 [0,1,0,1,0,0|1,0,1]=4 3514 B10R1.163 O=C(O)C1OC(CO)C1O Amb27168739 [0,1,0,1,0,0|0,0,2]=4 3515 B10R1.194 C=C(C)[C@H]1COC(=O)[C@H]1O Amb28255717 [0,1,0,1,0,0|2,0,0]=4 3516 B10R1.194 CC(=O)C1COC(=O)C1C Amb27863667 [0,1,0,1,0,0|2,0,0]=4 3517 B10R1.194 CC(=O)[C@@H]1COC(=O)[C@@H]1C Amb18202639 [0,1,0,1,0,0|2,0,0]=4 3518 B10R1.194 CC1C(=O)C=CC1C(=O)O Amb27408528 [0,1,0,1,0,0|2,0,0]=4 3519 B10R1.194 CC1C(=O)NCC1C(=O)O Amb27660444 [0,1,0,1,0,0|2,0,0]=4 3520 B10R1.194 CC1C(=O)OCC1C(=O)O Amb4022599 [0,1,0,1,0,0|1,0,0]=3 3521 B10R1.194 CC1C(O)COC1C(=O)O Amb25738059 [0,1,0,1,0,0|1,0,1]=4 3522 B10R1.194 CN1C(=O)OCC1C(=O)O Amb25800781 [0,1,0,1,0,0|2,0,0]=4 3523 B10R1.194 CN1C(=O)OC[C@@H]1C(=O)O Amb32673921 [0,1,0,1,0,0|2,0,0]=4 3524 B10R1.194 C[C@@H]1C(=O)OC[C@H]1C(=O)O Amb28429847 [0,1,0,1,0,0|1,0,0]=3 3525 B10R1.194 C[C@H]1C(=O)CC[C@H]1C(=O)O Amb27778459 [0,1,0,1,0,0|2,0,0]=4 3526 B10R1.194 C[C@H]1C(=O)CN[C@@H]1C(=O)O Amb18831599 [0,1,0,1,0,0|2,0,0]=4 3527 B10R1.194 C[C@H]1C(=O)NC[C@@H]1C(=O)O Amb27858486 [0,1,0,1,0,0|2,0,0]=4 3528 B10R1.194 NC1C(=O)NCC1C(=O)O Amb25683449 [0,1,0,1,0,0|2,0,0]=4 3529 B10R1.194 NC1C(=O)NCC1C(=O)O Amb32721524 [0,1,0,1,0,0|2,0,0]=4 3530 B10R1.194 N[C@H]1C(=O)NC[C@@H]1C(=O)O Amb25230623 [0,1,0,1,0,0|2,0,0]=4 3531 B10R1.194 N[C@H]1C(=O)NC[C@@H]1C(=O)O Amb32992773 [0,1,0,1,0,0|2,0,0]=4 3532 B10R1.194 O=C(O)C1CCC(=O)N1O Amb27807058 [0,1,0,1,0,0|2,0,0]=4 3533 B10R1.194 O=C(O)C1CCC(O)C1O Amb24480401 [0,1,0,1,0,0|1,0,1]=4 3534 B10R1.194 O=C(O)C1NCC(O)C1O Amb24120646 [0,1,0,1,0,0|1,0,1]=4 3535 B10R1.194 O=C(O)[C@@H]1CCC(=O)N1O Amb26357551 [0,1,0,1,0,0|2,0,0]=4 3536 B10R1.194 O=C(O)[C@@H]1CC[C@@H](O)[C@@H]1O Amb28248507 [0,1,0,1,0,0|1,0,1]=4 3537 B10R1.194 O=C(O)[C@@H]1CC[C@@H](O)[C@H]1O Amb27482063 [0,1,0,1,0,0|1,0,1]=4 3538 B10R1.194 O=C(O)[C@@H]1CC[C@H](O)[C@@H]1O Amb27438244 [0,1,0,1,0,0|1,0,1]=4 3539 B10R1.194 O=C(O)[C@@H]1NC[C@@H](O)[C@@H]1O Amb27258648 [0,1,0,1,0,0|1,0,1]=4 3540 B10R1.194 O=C(O)[C@@H]1NC[C@@H](O)[C@H]1O Amb24546981 [0,1,0,1,0,0|1,0,1]=4 3541 B10R1.194 O=C(O)[C@@H]1NC[C@H](O)[C@@H]1O Amb24605220 [0,1,0,1,0,0|1,0,1]=4 3542 B10R1.194 O=C(O)[C@@H]1NC[C@H](O)[C@H]1O Amb25259269 [0,1,0,1,0,0|1,0,1]=4 3543 B10R1.194 O=C(O)[C@H]1NCC(O)C1O Amb27647851 [0,1,0,1,0,0|1,0,1]=4 3544 B10R1.194 O=C(O)[C@H]1NCC(O)[C@@H]1O Amb28203927 [0,1,0,1,0,0|1,0,1]=4 3545 B10R1.194 O=C(O)[C@H]1NC[C@@H](O)[C@@H]1O Amb27252019 [0,1,0,1,0,0|1,0,1]=4 3546 B10R1.194 O=C(O)[C@H]1NC[C@@H](O)[C@H]1O Amb27246425 [0,1,0,1,0,0|1,0,1]=4 3547 B10R1.194 O=C(O)[C@H]1NC[C@H](O)[C@@H]1O Amb24120647 [0,1,0,1,0,0|1,0,1]=4 3548 B10R1.194 O=C1OCC(C(=O)O)C1O Amb26405203 [0,1,0,1,0,0|0,0,0]=2 3549 B10R1.408 CNC(=O)C1CC1C(=O)O Amb17606124 [0,1,0,1,0,0|2,0,0]=4 3550 B10R1.408 CNC(=O)[C@@H]1C[C@H]1C(=O)O Amb24055632 [0,1,0,1,0,0|2,0,0]=4 3551 B10R1.408 COC(=O)C1CC1C(=O)Cl Amb25104983 [0,1,0,1,0,0|2,0,0]=4 3552 B10R1.408 COC(=O)C1CC1C(=O)O Amb19314991 [0,1,0,1,0,0|1,0,0]=3 3553 B10R1.408 COC(=O)C1CC1C(=O)[O-] Amb34916021 [0,1,0,1,0,0|1,0,1]=4 3554 B10R1.408 COC(=O)C1CC1C(C)=O Amb26641869 [0,1,0,1,0,0|2,0,0]=4 3555 B10R1.408 COC(=O)C1CC1C(N)=O Amb26964635 [0,1,0,1,0,0|2,0,0]=4 3556 B10R1.408 COC(=O)C1OC1C(=O)O Amb25072766 [0,1,0,1,0,0|0,0,0]=2 3557 B10R1.408 COC(=O)C1OC1C(C)=O Amb26444891 [0,1,0,1,0,0|1,0,0]=3 3558 B10R1.408 COC(=O)[C@@H]1C[C@@H]1C(=O)Cl Amb25306534 [0,1,0,1,0,0|2,0,0]=4 3559 B10R1.408 COC(=O)[C@@H]1C[C@@H]1C(=O)O Amb25949202 [0,1,0,1,0,0|1,0,0]=3 3560 B10R1.408 COC(=O)[C@@H]1C[C@@H]1C(C)=O Amb28052590 [0,1,0,1,0,0|2,0,0]=4 3561 B10R1.408 COC(=O)[C@@H]1C[C@H]1C(=O)O Amb24183508 [0,1,0,1,0,0|1,0,0]=3 3562 B10R1.408 COC(=O)[C@@H]1C[C@H]1C(C)=O Amb25179679 [0,1,0,1,0,0|2,0,0]=4 3563 B10R1.408 COC(=O)[C@@H]1O[C@H]1C(=O)O Amb25174796 [0,1,0,1,0,0|0,0,0]=2 3564 B10R1.408 COC(=O)[C@@H]1O[C@H]1C(C)=O Amb27455466 [0,1,0,1,0,0|1,0,0]=3 3565 B10R1.408 COC(=O)[C@H]1C[C@@H]1C(=O)O Amb27254210 [0,1,0,1,0,0|1,0,0]=3 3566 B10R1.408 COC(=O)[C@H]1C[C@H]1C(=O)O Amb26397116 [0,1,0,1,0,0|1,0,0]=3 3567 B10R1.408 COC(=O)[C@H]1C[C@H]1C(C)=O Amb25377828 [0,1,0,1,0,0|2,0,0]=4 3568 B10R1.408 COC(=O)[C@H]1O[C@@H]1C(=O)O Amb24745530 [0,1,0,1,0,0|0,0,0]=2 3569 B10R1.408 COC(=O)[C@H]1O[C@H]1C(=O)O Amb24601831 [0,1,0,1,0,0|0,0,0]=2 3570 B10R1.408 COC(=O)[C@H]1O[C@H]1[C@H](C)O Amb27218648 [0,1,0,1,0,0|1,0,1]=4 3571 B10R1.408 O=C(O)C1CC1C(=O)CBr Amb27626250 [0,1,0,1,0,0|2,0,0]=4 3572 B10R1.424 COC(=O)C1(C)CC(=O)C1 Amb22406222 [0,1,0,1,0,0|2,0,0]=4 3573 B10R1.424 COC(=O)C1(C)CC(=O)O1 Amb27615111 [0,1,0,1,0,0|1,0,0]=3 3574 B10R1.424 COC(=O)C1(F)CC(=O)C1 Amb34136231 [0,1,0,1,0,0|2,0,0]=4 3575 B10R1.424 COC(=O)[C@]1(C)CC(=O)O1 Amb27949184 [0,1,0,1,0,0|1,0,0]=3 3576 B10R1.461 COC(=O)[C@@H](O)[C@H]1O[C@@H]1C Amb27876378 [0,1,0,1,0,0|1,0,1]=4 3577 B10R1.30 O=C1COC(=O)[C@H](CO)N1 Amb24648743 [0,1,0,1,0,0|2,0,0]=4 3578 B10R1.52 CO[C@@H]1C(=O)N[C@@H]1C(C)=O Amb26568739 [0,1,0,1,0,0|2,0,0]=4 3579 B10R1.113 C[C@@H]1C[C@H](C(=O)O)OCO1 Amb28428440 [0,1,0,1,0,0|1,0,1]=4 3580 B10R1.113 O=C(O)C1CC(O)CCO1 Amb28246597 [0,1,0,1,0,0|1,0,1]=4 3581 B10R1.113 O=C(O)C1COCC(O)C1 Amb27810785 [0,1,0,1,0,0|1,0,1]=4 3582 B10R1.113 O=C1C=CCC(C(=O)O)C1 Amb18643491 [0,1,0,1,0,0|2,0,0]=4 3583 B10R1.113 O=C1CC(C(=O)O)CCN1 Amb33531218 [0,1,0,1,0,0|2,0,0]=4 3584 B10R1.113 O=C1CC(C(=O)O)CNN1 Amb22546429 [0,1,0,1,0,0|2,0,0]=4 3585 B10R1.113 O=C1CC(C(=O)O)CNN1 Amb28144294 [0,1,0,1,0,0|2,0,0]=4 3586 B10R1.113 O=C1CC(C(=O)O)N=CN1 Amb24099645 [0,1,0,1,0,0|2,0,0]=4 3587 B10R1.113 O=C1CCCC(C(=O)O)C1 Amb6305244 [0,1,0,1,0,0|2,0,0]=4 3588 B10R1.113 O=C1CCC[C@@H](C(=O)O)C1 Amb28050152 [0,1,0,1,0,0|2,0,0]=4 3589 B10R1.113 O=C1CCNC(C(=O)O)C1 Amb13889088 [0,1,0,1,0,0|2,0,0]=4 3590 B10R1.113 O=C1CCNC(C(=O)O)C1 Amb13889089 [0,1,0,1,0,0|2,0,0]=4 3591 B10R1.113 O=C1CCN[C@@H](C(=O)O)C1 Amb27977165 [0,1,0,1,0,0|2,0,0]=4 3592 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 Amb13889084 [0,1,0,1,0,0|2,0,0]=4 3593 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 Amb2699956 [0,1,0,1,0,0|2,0,0]=4 3594 B10R1.113 O=C1CCOC(C(=O)O)C1 Amb22496784 [0,1,0,1,0,0|1,0,0]=3 3595 B10R1.113 O=C1CNCC(C(=O)O)C1 Amb27244770 [0,1,0,1,0,0|2,0,0]=4 3596 B10R1.113 O=C1COCC(C(=O)O)N1 Amb18862478 [0,1,0,1,0,0|2,0,0]=4 3597 B10R1.113 O=C1COCC(C(=O)O)O1 Amb27209316 [0,1,0,1,0,0|2,0,0]=4 3598 B10R1.113 O=C1COC[C@@H](C(=O)O)N1 Amb27164013 [0,1,0,1,0,0|2,0,0]=4 3599 B10R1.113 O=C1NC(C(=O)O)CCO1 Amb28121893 [0,1,0,1,0,0|2,0,0]=4 3600 B10R1.234 CCC1(C(=O)O)CC(=O)C1 Amb33204270 [0,1,0,1,0,0|2,0,0]=4 3601 B10R1.234 CSC1(C(=O)O)CC(=O)C1 Amb27754200 [0,1,0,1,0,0|1,1,0]=4 3602 B10R1.234 N#CC1(C(=O)O)CC(=O)C1 Amb27838979 [0,1,0,1,0,0|2,0,0]=4 3603 B10R1.234 NCC1(C(=O)O)CC(=O)C1 Amb26392240 [0,1,0,1,0,0|2,0,0]=4 3604 B10R1.234 O=C1CC(CCl)(C(=O)O)O1 Amb27185492 [0,1,0,1,0,0|1,0,0]=3 3605 B10R1.234 O=C1CC(CF)(C(=O)O)C1 Amb33378697 [0,1,0,1,0,0|2,0,0]=4 3606 B10R1.361 CC(=O)[C@H]1CC[C@@H]1C(=O)O Amb28252580 [0,1,0,1,0,0|2,0,0]=4 3607 B10R1.361 NC(=O)C1CCC1C(=O)O Amb26027341 [0,1,0,1,0,0|2,0,0]=4 3608 B10R1.361 NC(=O)[C@@H]1CC[C@@H]1C(=O)O Amb27216173 [0,1,0,1,0,0|2,0,0]=4 3609 B10R1.361 NC(=O)[C@@H]1CC[C@H]1C(=O)O Amb24366239 [0,1,0,1,0,0|2,0,0]=4 3610 B10R1.361 O=C(O)C1CCC1C(=O)Cl Amb24753887 [0,1,0,1,0,0|2,0,0]=4 3611 B10R1.361 O=C(O)C1CCC1C(=O)O Amb19373431 [0,1,0,1,0,0|1,0,0]=3 3612 B10R1.361 O=C(O)[C@@H]1C=C[C@H]1C(=O)O Amb27469606 [0,1,0,1,0,0|1,0,0]=3 3613 B10R1.361 O=C(O)[C@@H]1CC[C@H]1C(=O)O Amb2609028 [0,1,0,1,0,0|1,0,0]=3 3614 B10R1.361 O=C(O)[C@@H]1CN[C@H]1C(=O)O Amb25956288 [0,1,0,1,0,0|1,0,0]=3 3615 B10R1.361 O=C(O)[C@H]1C=C[C@H]1C(=O)O Amb27831905 [0,1,0,1,0,0|1,0,0]=3 3616 B10R1.361 O=C(O)[C@H]1CC[C@@H]1C(=O)O Amb25267014 [0,1,0,1,0,0|1,0,0]=3 3617 B10R1.361 O=C(O)[C@H]1CC[C@H]1C(=O)O Amb16230761 [0,1,0,1,0,0|1,0,0]=3 3618 B10R1.361 O=C(O)[C@H]1CN[C@@H]1C(=O)O Amb25225066 [0,1,0,1,0,0|1,0,0]=3 3619 B10R1.361 O=C(O)[C@H]1NC[C@H]1C(=O)O Amb26967619 [0,1,0,1,0,0|1,0,0]=3 3620 B10R1.31 CCC1=NOC(C(=O)O)C1 Amb9902100 [0,1,0,1,0,0|2,0,0]=4 3621 B10R1.31 O=C(O)C1CC(CCl)=NO1 Amb35750953 [0,1,0,1,0,0|2,0,0]=4 3622 B10R1.31 O=C(O)C1CC\C(=N/O)C1 Amb23453115 [0,1,0,1,0,0|2,0,0]=4 3623 B10R1.31 O=C(O)[C@H]1CC\C(=N/O)C1 Amb25888967 [0,1,0,1,0,0|2,0,0]=4 3624 B10R1.116 O=C(O)C(O)C1CCC1=O Amb28349882 [0,1,0,1,0,0|1,0,0]=3 3625 B10R1.118 CC1OC(O)C(=O)CC1O Amb27750673 [0,1,0,1,0,0|1,0,1]=4 3626 B10R1.244 COP1(=O)CC(C)C(=O)O1 Amb24349767 [0,1,0,1,0,0|2,0,0]=4 3627 B10R1.412 COC(=O)C1NC(=O)C1C Amb27841623 [0,1,0,1,0,0|2,0,0]=4 3628 B10R1.412 COC(=O)C1NC(=O)C1N Amb28386017 [0,1,0,1,0,0|2,0,0]=4 3629 B10R1.412 COC(=O)[C@H]1NC(=O)[C@H]1C Amb27630717 [0,1,0,1,0,0|2,0,0]=4 3630 B10R1.119 N[C@@H]1C(=O)OC[C@@H](O)[C@H]1O Amb27640709 [0,1,0,1,0,0|1,0,1]=4 3631 B10R1.119 N[C@H]1C(=O)OC[C@@H](O)[C@@H]1O Amb27460862 [0,1,0,1,0,0|1,0,1]=4 3632 B10R1.119 O=C1NNC(=O)C(O)C1O Amb27805422 [0,1,0,1,0,0|2,0,0]=4 3633 B10R1.119 O=C1OC[C@@H](O)[C@@H](O)[C@@H]1O Amb28053537 [0,1,0,1,0,0|1,0,1]=4 3634 B10R1.119 O=C1OC[C@@H](O)[C@@H](O)[C@H]1O Amb26911960 [0,1,0,1,0,0|1,0,1]=4 3635 B10R1.119 O=C1OC[C@@H](O)[C@H](O)[C@H]1O Amb27431367 [0,1,0,1,0,0|1,0,1]=4 3636 B10R2.64 O=C1C[C@@H]2C(=O)O[C@@H]2C1 Amb26034562 [0,0,0,2,0,0|2,0,0]=4 3637 B10R2.64 O=C1C[C@@H]2OC(=O)[C@@H]2C1 Amb27793026 [0,0,0,2,0,0|2,0,0]=4 3638 B10R2.73 O=C1C=CC(=O)C2OC12 Amb24363955 [0,0,0,2,0,0|2,0,0]=4 3639 B10R2.73 O=C1OC[C@@H](O)[C@H]2O[C@@H]12 Amb27970530 [0,0,0,2,0,0|1,0,1]=4 3640 B8R0.28 C=C(C)CCCC(=O)O Amb2699907 [1,0,0,0,0,1|2,0,0]=4 3641 B8R0.28 C=C(C)CSCC(=O)O Amb6280447 [1,0,0,0,0,1|2,0,0]=4 3642 B8R0.28 C=C(F)CCCC(=O)O Amb22641515 [1,0,0,0,0,1|2,0,0]=4 3643 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [1,0,0,0,0,1|1,0,0]=3 3644 B8R0.28 CC(=O)CCCC(C)=O Amb24093532 [1,0,0,0,0,1|2,0,0]=4 3645 B8R0.28 CC(=O)CCCC(N)=O Amb25259665 [1,0,0,0,0,1|2,0,0]=4 3646 B8R0.28 CC(=O)CCNC(C)=O Amb17102868 [1,0,0,0,0,1|2,0,0]=4 3647 B8R0.28 CC(=O)CCOC(C)=O Amb4605918 [1,0,0,0,0,1|2,0,0]=4 3648 B8R0.28 CC(=O)CSCC(=O)O Amb26415891 [1,0,0,0,0,1|1,0,0]=3 3649 B8R0.28 CC(=O)CSCC(=O)[O-] Amb20622616 [1,0,0,0,0,1|1,0,1]=4 3650 B8R0.28 CC(=O)CSCC(N)=O Amb27411260 [1,0,0,0,0,1|2,0,0]=4 3651 B8R0.28 CC(=O)NCCC(=O)O Amb1104704 [1,0,0,0,0,1|1,0,0]=3 3652 B8R0.28 CC(=O)NCCC(N)=O Amb8997734 [1,0,0,0,0,1|2,0,0]=4 3653 B8R0.28 CC(=O)NCCS(=O)O Amb27638053 [1,0,0,0,0,1|2,0,0]=4 3654 B8R0.28 CC(=O)NOCC(=O)O Amb25921073 [1,0,0,0,0,1|2,0,0]=4 3655 B8R0.28 CC(=O)OCCC(=O)O Amb18642866 [1,0,0,0,0,1|1,0,0]=3 3656 B8R0.28 CC(=O)OCCC(N)=O Amb25921090 [1,0,0,0,0,1|2,0,0]=4 3657 B8R0.28 CC(=O)SCCC(=O)Cl Amb26637117 [1,0,0,0,0,1|2,0,0]=4 3658 B8R0.28 CC(=O)SCCC(=O)O Amb17607685 [1,0,0,0,0,1|1,0,0]=3 3659 B8R0.28 CC(=O)\C=C\CC(=O)O Amb26900226 [1,0,0,0,0,1|1,0,1]=4 3660 B8R0.28 CC(C)=CCCC(=O)O Amb10601609 [1,0,0,0,0,1|2,0,0]=4 3661 B8R0.28 CC(O)CCCC(=O)O Amb2371277 [1,0,0,0,0,1|1,0,1]=4 3662 B8R0.28 CC(O)CNCC(=O)O Amb9359979 [1,0,0,0,0,1|1,0,1]=4 3663 B8R0.28 CC(O)COCC(=O)O Amb27968624 [1,0,0,0,0,1|1,0,1]=4 3664 B8R0.28 CC(O)CSCC(=O)O Amb19005278 [1,0,0,0,0,1|1,0,1]=4 3665 B8R0.28 N=C(N)CSCC(=O)O Amb28040821 [1,0,0,0,0,1|2,0,0]=4 3666 B8R0.28 N=C(N)NCCC(=O)O Amb3940732 [1,0,0,0,0,1|2,0,0]=4 3667 B8R0.28 N=C(N)SCCC(=O)O Amb1043190 [1,0,0,0,0,1|2,0,0]=4 3668 B8R0.28 NC(=O)CCCC(=O)O Amb5718388 [1,0,0,0,0,1|1,0,0]=3 3669 B8R0.28 NC(=O)CCSC(N)=O Amb28045967 [1,0,0,0,0,1|2,0,0]=4 3670 B8R0.28 NC(=O)CNCC(N)=O Amb6714597 [1,0,0,0,0,1|2,0,0]=4 3671 B8R0.28 NC(=O)COCC(=O)O Amb3429648 [1,0,0,0,0,1|1,0,0]=3 3672 B8R0.28 NC(=O)COCC(N)=O Amb4442013 [1,0,0,0,0,1|2,0,0]=4 3673 B8R0.28 NC(=O)CSCC(=O)O Amb1128074 [1,0,0,0,0,1|1,0,0]=3 3674 B8R0.28 NC(=O)CSCC(N)=O Amb6374270 [1,0,0,0,0,1|2,0,0]=4 3675 B8R0.28 NC(=O)NCCC(=O)O Amb6567400 [1,0,0,0,0,1|1,0,0]=3 3676 B8R0.28 NC(=O)NOCC(=O)O Amb28285979 [1,0,0,0,0,1|2,0,0]=4 3677 B8R0.28 NC(=O)SCCC(=O)O Amb28340935 [1,0,0,0,0,1|1,0,0]=3 3678 B8R0.28 NC(=S)CCCC(=O)O Amb27956588 [1,0,0,0,0,1|1,1,0]=4 3679 B8R0.28 NC(=S)NCCC(=O)O Amb27815302 [1,0,0,0,0,1|1,1,0]=4 3680 B8R0.28 NC(=S)SCCC(=O)O Amb4007391 [1,0,0,0,0,1|1,1,0]=4 3681 B8R0.28 O=C(Cl)CCCC(=O)Cl Amb3940242 [1,0,0,0,0,1|2,0,0]=4 3682 B8R0.28 O=C(Cl)COCC(=O)Cl Amb22228240 [1,0,0,0,0,1|2,0,0]=4 3683 B8R0.28 O=C(O)C=C=CC(=O)O Amb17593335 [1,0,0,0,0,1|0,0,2]=4 3684 B8R0.28 O=C(O)CCCC(=O)O Amb4037276 [1,0,0,0,0,1|0,0,0]=2 3685 B8R0.28 O=C(O)CCC[N+](=O)[O-] Amb24711043 [1,0,0,0,0,1|1,0,1]=4 3686 B8R0.28 O=C(O)CCO[N+](=O)[O-] Amb21953424 [1,0,0,0,0,1|1,0,1]=4 3687 B8R0.28 O=C(O)CNCC(=O)O Amb3940364 [1,0,0,0,0,1|0,0,0]=2 3688 B8R0.28 O=C(O)COCC(=O)O Amb4433967 [1,0,0,0,0,1|0,0,0]=2 3689 B8R0.28 O=C(O)CSCC(=O)O Amb6608738 [1,0,0,0,0,1|0,0,0]=2 3690 B8R0.28 O=C(O)\C=C/CC(=O)O Amb27882014 [1,0,0,0,0,1|0,0,1]=3 3691 B8R0.28 O=C(O)\C=C\CC(=O)O Amb1154189 [1,0,0,0,0,1|0,0,1]=3 3692 B8R0.28 O=C([O-])COCC(=O)O Amb9787328 [1,0,0,0,0,1|0,0,1]=3 3693 B10R0.96 CC(=O)CC(C)CCC(=O)O Amb32667485 [0,0,0,0,0,2|2,0,0]=4 3694 B10R0.96 CC(=O)CCC(C)CC(=O)O Amb32668383 [0,0,0,0,0,2|2,0,0]=4 3695 B10R0.96 CC(=O)NC(C)CCC(=O)O Amb27492061 [0,0,0,0,0,2|2,0,0]=4 3696 B10R0.96 CC(=O)NCC(O)CC(=O)O Amb28079665 [0,0,0,0,0,2|1,0,0]=3 3697 B10R0.96 CC(CCC(=O)O)CC(=O)O Amb6608722 [0,0,0,0,0,2|1,0,0]=3 3698 B10R0.96 CC(CCC(=O)O)NC(N)=O Amb27492066 [0,0,0,0,0,2|2,0,0]=4 3699 B10R0.96 NC(=O)CC[C@@H](N)CC(=O)O Amb22746285 [0,0,0,0,0,2|2,0,0]=4 3700 B10R0.96 NC(=O)CC[C@H](N)CC(=O)O Amb22348459 [0,0,0,0,0,2|2,0,0]=4 3701 B10R0.96 NC(=O)NCC(O)CC(=O)O Amb28079675 [0,0,0,0,0,2|1,0,0]=3 3702 B10R0.96 NC(CCC(=O)O)CC(=O)O Amb8631356 [0,0,0,0,0,2|1,0,0]=3 3703 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O Amb16232070 [0,0,0,0,0,2|1,0,0]=3 3704 B10R0.96 N[C@H](CCC(=O)O)CC(=O)O Amb22750585 [0,0,0,0,0,2|1,0,0]=3 3705 B10R0.96 O=C(O)CCC(O)CC(=O)O Amb22727761 [0,0,0,0,0,2|0,0,0]=2 3706 B10R0.96 O=C(O)CNC(=O)CC(=O)O Amb18800491 [0,0,0,0,0,2|0,0,2]=4 3707 B10R0.98 CC(=O)CCCC(N)C(=O)O Amb33036722 [0,0,0,0,0,2|2,0,0]=4 3708 B10R0.98 CC(=O)CCC[C@@H](N)C(=O)O Amb32937025 [0,0,0,0,0,2|2,0,0]=4 3709 B10R0.98 CC(=O)CCC[C@H](N)C(=O)O Amb32865922 [0,0,0,0,0,2|2,0,0]=4 3710 B10R0.98 CC(=O)CCNC(C)C(=O)O Amb32675829 [0,0,0,0,0,2|2,0,0]=4 3711 B10R0.98 CC(=O)NCCC(C)C(=O)O Amb27270987 [0,0,0,0,0,2|2,0,0]=4 3712 B10R0.98 CC(=O)NCC[C@H](N)C(=O)O Amb26659493 [0,0,0,0,0,2|2,0,0]=4 3713 B10R0.98 CC(=O)NCC[C@H](O)C(=O)O Amb27670710 [0,0,0,0,0,2|1,0,0]=3 3714 B10R0.98 CC(C)=NOCC(O)C(=O)O Amb27270949 [0,0,0,0,0,2|2,0,0]=4 3715 B10R0.98 CC(CCNC(N)=O)C(=O)O Amb27270986 [0,0,0,0,0,2|2,0,0]=4 3716 B10R0.98 CC(NCCC(=O)O)C(=O)O Amb18098310 [0,0,0,0,0,2|1,0,0]=3 3717 B10R0.98 CC(SCCC(=O)O)C(=O)O Amb17501234 [0,0,0,0,0,2|1,0,0]=3 3718 B10R0.98 CC(SCCC(=O)O)C(N)=O Amb9202514 [0,0,0,0,0,2|2,0,0]=4 3719 B10R0.98 CC(S\C=C\C(=O)O)C(=O)O Amb18647961 [0,0,0,0,0,2|1,0,1]=4 3720 B10R0.98 NC(=O)NCCC(O)C(=O)O Amb27670719 [0,0,0,0,0,2|1,0,0]=3 3721 B10R0.98 NC(=O)NCC[C@H](O)C(=O)O Amb27670720 [0,0,0,0,0,2|1,0,0]=3 3722 B10R0.98 NC(=O)N\N=C\C(O)C(=O)O Amb27617440 [0,0,0,0,0,2|1,0,1]=4 3723 B10R0.98 NC(CCCC(=O)O)C(=O)O Amb22740152 [0,0,0,0,0,2|1,0,0]=3 3724 B10R0.98 NC(CCCC(=O)O)C(=O)O Amb6334822 [0,0,0,0,0,2|1,0,0]=3 3725 B10R0.98 NC(CSCC(=O)O)C(=O)O Amb6740297 [0,0,0,0,0,2|1,0,0]=3 3726 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O Amb6600090 [0,0,0,0,0,2|1,0,0]=3 3727 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O Amb16232500 [0,0,0,0,0,2|1,0,0]=3 3728 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O Amb6336477 [0,0,0,0,0,2|1,0,0]=3 3729 B10R0.98 N[C@H](CCCC(=O)O)C(=O)O Amb8629031 [0,0,0,0,0,2|1,0,0]=3 3730 B10R0.98 N[C@H](C\C=C\C(=O)O)C(=O)O Amb25383155 [0,0,0,0,0,2|1,0,0]=3 3731 B10R0.98 O=C(O)CCCC(O)C(=O)O Amb21963897 [0,0,0,0,0,2|0,0,0]=2 3732 B10R0.98 O=C(O)CONC(=O)C(=O)O Amb16185780 [0,0,0,0,0,2|0,0,2]=4 3733 B10R0.98 O=C(O)CSCC(=O)C(=O)O Amb33069681 [0,0,0,0,0,2|0,0,2]=4 3734 B10R0.98 O=C(O)C\C=C/C(=O)C(=O)O Amb27269966 [0,0,0,0,0,2|0,0,2]=4 3735 B10R0.98 O=C(O)\C=C\C=C(/O)C(=O)O Amb28325659 [0,0,0,0,0,2|0,0,2]=4 3736 B10R0.98 O=C([O-])CCCC(O)C(=O)[O-] Amb22284811 [0,0,0,0,0,2|0,0,2]=4