0 B10R0.162 CC(=C(CC(=O)O)C(=O)O)C MCULE-6667375823 [1,0,0,0,0,0|0,0,2]=3 1 B10R0.162 CC(=O)NC(C(=O)N)C(C)C MCULE-4954417296 [1,0,0,0,0,0|3,0,0]=4 2 B10R0.162 CC(=O)NC(C(=O)O)C(C)C MCULE-5114275353 [1,0,0,0,0,0|2,0,0]=3 3 B10R0.162 CC(=O)NC(C(=O)O)C(C)C MCULE-7625507425 [1,0,0,0,0,0|2,0,0]=3 4 B10R0.162 CC(=O)N[C@@H](C(=O)O)C(C)C MCULE-7724348414 [1,0,0,0,0,0|2,0,0]=3 5 B10R0.162 CC(=O)N[C@H](C(=O)N)C(C)C MCULE-5832011663 [1,0,0,0,0,0|3,0,0]=4 6 B10R0.162 CC(=O)N[C@H](C(=O)N)C(C)C MCULE-6203599101 [1,0,0,0,0,0|3,0,0]=4 7 B10R0.162 CC(=O)N[C@H](C(=O)O)C(C)C MCULE-4757813230 [1,0,0,0,0,0|2,0,0]=3 8 B10R0.162 CC(=O)N[C@H](C(=O)O)C(C)C MCULE-6959371366 [1,0,0,0,0,0|2,0,0]=3 9 B10R0.162 CC(=O)N[C@H](C(=O)O)[C@@H](C)O MCULE-1503882427 [1,0,0,0,0,0|3,0,0]=4 10 B10R0.162 CC(=O)N[C@H](C(=O)O)[C@@H](C)O MCULE-5611708903 [1,0,0,0,0,0|3,0,0]=4 11 B10R0.162 CC(=O)OC(C(=O)O)C(C)C MCULE-6800981090 [1,0,0,0,0,0|2,0,0]=3 12 B10R0.162 CC(=O)O[C@@H](C(=O)O)C(C)C MCULE-2609525866 [1,0,0,0,0,0|2,0,0]=3 13 B10R0.162 CC(C)C(CC(=O)O)C(=O)O MCULE-8647740549 [1,0,0,0,0,0|0,0,0]=1 14 B10R0.162 CC(C)C(NC(=O)N)C(=O)O MCULE-8905457274 [1,0,0,0,0,0|2,0,0]=3 15 B10R0.162 CC(C)CC(C(=O)O)C(C)C MCULE-4248316159 [1,0,0,0,0,0|2,0,1]=4 16 B10R0.162 CC(C)[C@@H](NC(=O)N)C(=O)O MCULE-8034373559 [1,0,0,0,0,0|2,0,0]=3 17 B10R0.162 CC(O)C(NC(=O)N)C(=O)O MCULE-3166365598 [1,0,0,0,0,0|3,0,0]=4 18 B10R0.162 CN(C)[C@@H](CC(=O)O)C(=O)O MCULE-5975487097 [1,0,0,0,0,0|1,0,0]=2 19 B10R0.162 CN(C)[C@H](CC(=O)N)C(=O)O MCULE-9653422208 [1,0,0,0,0,0|2,0,0]=3 20 B10R0.162 CN(C)[C@H](CC(=O)O)C(=O)O MCULE-7438928757 [1,0,0,0,0,0|1,0,0]=2 21 B10R0.162 [C@@H](NC(=O)N)(C(=O)O)C(C)C MCULE-1578246756 [1,0,0,0,0,0|2,0,0]=3 22 B10R0.162 [C@H](NC(=O)C)(C(=O)O)C(C)C MCULE-3375530717 [1,0,0,0,0,0|2,0,0]=3 23 B12R0.945 CC(C)C(C(=O)O)[C@](C)(Cl)C(=O)N MCULE-1013243719 [0,1,0,0,0,0|2,0,0]=3 24 B12R1.498 CC(C)N1C(=O)CCC1C(=O)O MCULE-1139097560 [0,0,0,1,0,0|3,0,0]=4 25 B12R1.498 CC(C)N1C(=O)CC[C@H]1C(=O)O MCULE-7670203479 [0,0,0,1,0,0|3,0,0]=4 26 B12R0.43 O=C(O)CC(C(=O)O)C(O)C(=O)O MCULE-1207186330 [0,0,0,0,0,1|2,0,1]=4 27 B12R0.43 O=C(O)C[C@@H](C(=O)[O-])[C@@H](O)C(=O)O MCULE-6280875375 [0,0,0,0,0,1|2,0,1]=4 28 B12R0.43 O=C(O)C[C@@H](C(=O)[O-])[C@@H](O)C(=O)O MCULE-9197214556 [0,0,0,0,0,1|2,0,1]=4 29 B12R0.693 CC(C)CC(O)C(C(=O)O)C(C)C MCULE-1864252195 [0,0,0,0,0,1|2,0,1]=4 30 B9R0.39 CC=C(CC(=O)O)C(=O)O MCULE-9255608800 [2,0,0,0,0,0|0,0,2]=4 31 B9R0.39 CCC(CC(=O)Cl)C(=O)Cl MCULE-4134104716 [2,0,0,0,0,0|2,0,0]=4 32 B9R0.39 CCC(CC(=O)O)C(=O)O MCULE-6275256194 [2,0,0,0,0,0|0,0,0]=2 33 B9R0.39 CCC(CC(=O)O)C(C)C MCULE-3121416106 [2,0,0,0,0,0|1,0,1]=4 34 B9R0.39 CCC(NC(=O)C)C(=O)O MCULE-1309294109 [2,0,0,0,0,0|2,0,0]=4 35 B9R0.39 CCC(NC(=O)C)C(=O)O MCULE-9698129539 [2,0,0,0,0,0|2,0,0]=4 36 B9R0.39 CCC(NC(=O)N)C(=O)O MCULE-1973871135 [2,0,0,0,0,0|2,0,0]=4 37 B9R0.39 CC[C@@H](NC(=O)C)C(=O)O MCULE-4606830483 [2,0,0,0,0,0|2,0,0]=4 38 B9R0.39 CC[C@@H](NC(=O)C)C(=O)O MCULE-7396715663 [2,0,0,0,0,0|2,0,0]=4 39 B9R0.39 CC[C@H](CC(=O)O)C(C)C MCULE-7554516678 [2,0,0,0,0,0|1,0,1]=4 40 B9R0.39 CNC(CC(=O)O)C(=O)O MCULE-5049531079 [2,0,0,0,0,0|1,0,0]=3 41 B9R0.39 CN[C@@H](CC(=O)N)C(=O)O MCULE-2449462396 [2,0,0,0,0,0|2,0,0]=4 42 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-4725692041 [2,0,0,0,0,0|1,0,0]=3 43 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-6356483886 [2,0,0,0,0,0|1,0,0]=3 44 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-9428412153 [2,0,0,0,0,0|1,0,0]=3 45 B9R0.39 CN[C@H](CC(=O)N)C(=O)O MCULE-2092394249 [2,0,0,0,0,0|2,0,0]=4 46 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-1405442072 [2,0,0,0,0,0|1,0,0]=3 47 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-8611804669 [2,0,0,0,0,0|1,0,0]=3 48 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-9080466863 [2,0,0,0,0,0|1,0,0]=3 49 B9R0.39 COC(CC(=O)O)C(=O)O MCULE-3778948045 [2,0,0,0,0,0|1,0,0]=3 50 B9R0.39 NCC(CC(=O)O)C(=O)O MCULE-1683659350 [2,0,0,0,0,0|1,0,0]=3 51 B9R0.39 NCC(CC(=O)O)C(=O)O MCULE-8428141166 [2,0,0,0,0,0|1,0,0]=3 52 B9R0.39 NCN(CC(=O)O)C(=O)O MCULE-9677383798 [2,0,0,0,0,0|2,0,0]=4 53 B9R0.39 O=C(O)CC(CS)C(=O)O MCULE-7352825049 [2,0,0,0,0,0|1,0,0]=3 54 B9R0.79 CC(C(=O)O)C(C)C(=O)O MCULE-6112773421 [2,0,0,0,0,0|1,0,0]=3 55 B9R0.79 CC(C(=O)O)C(N)C(=O)O MCULE-7699599383 [2,0,0,0,0,0|1,0,0]=3 56 B9R0.79 CC(C(=O)O)C(O)C(=O)O MCULE-1644748819 [2,0,0,0,0,0|0,0,0]=2 57 B9R0.79 CC(C(=O)O)[C@H](N)C(=O)O MCULE-1516476673 [2,0,0,0,0,0|1,0,0]=3 58 B9R0.79 CC(C)C(O)C(N)C(=O)O MCULE-8766263714 [2,0,0,0,0,0|1,0,0]=3 59 B9R0.79 CC(C)C(O)[C@H](N)C(=O)O MCULE-5332720895 [2,0,0,0,0,0|1,0,0]=3 60 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(=O)O MCULE-5667397461 [2,0,0,0,0,0|1,0,0]=3 61 B9R0.79 CC(C)[C@@H](O)[C@@H](N)C(=O)O MCULE-2425417830 [2,0,0,0,0,0|1,0,0]=3 62 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-5438285037 [2,0,0,0,0,0|1,0,0]=3 63 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-6278820254 [2,0,0,0,0,0|1,0,0]=3 64 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-7542741263 [2,0,0,0,0,0|1,0,0]=3 65 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-8101644962 [2,0,0,0,0,0|1,0,0]=3 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[2,0,0,0,0,0|1,0,0]=3 79 B9R0.79 O=C(O)C(Br)C(Br)C(=O)O MCULE-5784765255 [2,0,0,0,0,0|2,0,0]=4 80 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-1129308393 [2,0,0,0,0,0|1,0,0]=3 81 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-2045308981 [2,0,0,0,0,0|1,0,0]=3 82 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-2628563960 [2,0,0,0,0,0|1,0,0]=3 83 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-3711883524 [2,0,0,0,0,0|1,0,0]=3 84 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-3867000095 [2,0,0,0,0,0|1,0,0]=3 85 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-4358223174 [2,0,0,0,0,0|1,0,0]=3 86 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-4807487882 [2,0,0,0,0,0|1,0,0]=3 87 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-5140635020 [2,0,0,0,0,0|1,0,0]=3 88 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-6522296758 [2,0,0,0,0,0|1,0,0]=3 89 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-6821495270 [2,0,0,0,0,0|1,0,0]=3 90 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-7561074998 [2,0,0,0,0,0|1,0,0]=3 91 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-8089597216 [2,0,0,0,0,0|1,0,0]=3 92 B9R0.79 O=C(O)C(O)[C@@H](O)C(=O)O MCULE-5751523258 [2,0,0,0,0,0|1,0,0]=3 93 B9R0.79 O=C(O)C(O)[C@@H](O)C(=O)O MCULE-9550173577 [2,0,0,0,0,0|1,0,0]=3 94 B9R0.79 O=C(O)C(O)[C@H](O)C(=O)O MCULE-7402521361 [2,0,0,0,0,0|1,0,0]=3 95 B9R0.79 O=C(O)C(S)C(S)C(=O)O MCULE-6206640169 [2,0,0,0,0,0|1,1,0]=4 96 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-2640391251 [2,0,0,0,0,0|1,0,0]=3 97 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-3329629643 [2,0,0,0,0,0|1,0,0]=3 98 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-3643444072 [2,0,0,0,0,0|1,0,0]=3 99 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-4107297969 [2,0,0,0,0,0|1,0,0]=3 100 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-6410123526 [2,0,0,0,0,0|1,0,0]=3 101 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-6491788082 [2,0,0,0,0,0|1,0,0]=3 102 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-8917357121 [2,0,0,0,0,0|1,0,0]=3 103 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-9727943205 [2,0,0,0,0,0|1,0,0]=3 104 B9R0.79 O=C(O)[C@H](Br)[C@H](Br)C(=O)O MCULE-4542712392 [2,0,0,0,0,0|2,0,0]=4 105 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-1568229930 [2,0,0,0,0,0|1,0,0]=3 106 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-2241188013 [2,0,0,0,0,0|1,0,0]=3 107 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-2831813022 [2,0,0,0,0,0|1,0,0]=3 108 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-3942804599 [2,0,0,0,0,0|1,0,0]=3 109 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-5431486019 [2,0,0,0,0,0|1,0,0]=3 110 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-5579731165 [2,0,0,0,0,0|1,0,0]=3 111 B9R0.79 O=C(O)[C@H](S)[C@H](S)C(=O)O MCULE-4953802229 [2,0,0,0,0,0|1,1,0]=4 112 B9R0.79 O=C([O-])C(O)C(O)C(=O)O MCULE-7425540478 [2,0,0,0,0,0|1,0,1]=4 113 B9R0.79 O=C([O-])C(O)C(O)C(=O)O MCULE-8338522673 [2,0,0,0,0,0|1,0,1]=4 114 B9R0.79 O=C([O-])[C@@H](O)[C@H](O)C(=O)O MCULE-2803273406 [2,0,0,0,0,0|1,0,1]=4 115 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)O MCULE-3429484887 [2,0,0,0,0,0|1,0,1]=4 116 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)O MCULE-5385898917 [2,0,0,0,0,0|1,0,1]=4 117 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)O MCULE-9680288022 [2,0,0,0,0,0|1,0,1]=4 118 B9R0.79 [C@@H](O)(C(=O)O)[C@H](O)C(=O)O MCULE-5798988872 [2,0,0,0,0,0|1,0,0]=3 119 B9R0.79 [C@H](O)(C(=O)O)[C@@H](O)C(=O)O MCULE-9974976226 [2,0,0,0,0,0|1,0,0]=3 120 B9R0.79 [C@H](O)(C(=O)[O-])[C@@H](O)C(=O)O MCULE-7449957572 [2,0,0,0,0,0|1,0,1]=4 121 B9R0.33 C=CCC(C(=O)N)C(C)C MCULE-4190504102 [2,0,0,0,0,0|2,0,0]=4 122 B9R0.33 C=CCC(C(=O)O)C(C)C MCULE-6557819980 [2,0,0,0,0,0|1,0,0]=3 123 B9R0.33 C=CCC(C(=O)O)N(C)C MCULE-4850155708 [2,0,0,0,0,0|2,0,0]=4 124 B9R0.33 CC(C)C(CCN)C(=O)O MCULE-5177043751 [2,0,0,0,0,0|1,0,1]=4 125 B9R0.33 CC(C)C(CCN)C(=O)O MCULE-7075545898 [2,0,0,0,0,0|1,0,1]=4 126 B9R0.33 CC(C)[C@H](NC=O)C(=O)O MCULE-7474560828 [2,0,0,0,0,0|1,0,0]=3 127 B9R0.33 CC(C)[C@H](NC=O)C(=O)O MCULE-9296824406 [2,0,0,0,0,0|1,0,0]=3 128 B9R0.33 CCCC(C(=O)O)C(C)C MCULE-9298455866 [2,0,0,0,0,0|1,0,1]=4 129 B9R0.33 CN(C)[C@@H](CCO)C(=O)O MCULE-5311348966 [2,0,0,0,0,0|1,0,1]=4 130 B9R0.54 CC(C)C(C(=O)O)C(=O)O MCULE-5431269503 [2,0,0,0,0,0|0,0,1]=3 131 B9R0.54 CC(C)C(C(=O)O)C(C)C MCULE-9620894384 [2,0,0,0,0,0|1,0,1]=4 132 B9R0.54 CC(C)C(C(=O)O)C(C)N MCULE-1631604472 [2,0,0,0,0,0|1,0,1]=4 133 B9R0.54 CC(C)C(C(=O)O)C(C)N MCULE-2481029284 [2,0,0,0,0,0|1,0,1]=4 134 B11R0.296 CCC(C(=O)O)C(CC)C(=O)O MCULE-7362604126 [1,1,0,0,0,0|1,0,0]=3 135 B11R0.108 CC(C)C(NC(=O)CCl)C(=O)O MCULE-1203892200 [1,1,0,0,0,0|2,0,0]=4 136 B11R0.108 CC(C)C(NC(=O)CN)C(=O)O MCULE-4472224636 [1,1,0,0,0,0|2,0,0]=4 137 B11R0.108 CC(C)C(NC(=O)CN)C(=O)O MCULE-6309803593 [1,1,0,0,0,0|2,0,0]=4 138 B11R0.108 CC(C)[C@@H](NC(=O)CN)C(=O)O MCULE-5092294978 [1,1,0,0,0,0|2,0,0]=4 139 B11R0.108 CC(C)[C@@H](NC(=O)CN)C(=O)O MCULE-9121632356 [1,1,0,0,0,0|2,0,0]=4 140 B11R0.108 CC(C)[C@H](NC(=O)CCl)C(=O)O MCULE-2586080519 [1,1,0,0,0,0|2,0,0]=4 141 B11R0.108 CC(C)[C@H](NC(=O)CCl)C(=O)O MCULE-6553558540 [1,1,0,0,0,0|2,0,0]=4 142 B11R0.108 CC(C)[C@H](NC(=O)CN)C(=O)O MCULE-3588102951 [1,1,0,0,0,0|2,0,0]=4 143 B11R0.108 CC(C)[C@H](NC(=O)CN)C(=O)O MCULE-6230197891 [1,1,0,0,0,0|2,0,0]=4 144 B11R0.108 CCC(=O)N[C@H](C(=O)O)C(C)C MCULE-2868833515 [1,1,0,0,0,0|2,0,0]=4 145 B11R0.108 CCC(=O)N[C@H](C(=O)O)C(C)C MCULE-7972254981 [1,1,0,0,0,0|2,0,0]=4 146 B11R0.108 COC(=O)NC(C(=O)O)C(C)C MCULE-3178281275 [1,1,0,0,0,0|1,0,0]=3 147 B11R0.108 COC(=O)NC(C(=O)O)C(C)C MCULE-5609688099 [1,1,0,0,0,0|1,0,0]=3 148 B11R0.108 COC(=O)N[C@@H](C(=O)O)C(C)C MCULE-2004220305 [1,1,0,0,0,0|1,0,0]=3 149 B11R0.108 COC(=O)N[C@H](C(=O)O)C(C)C MCULE-4761998877 [1,1,0,0,0,0|1,0,0]=3 150 B11R0.108 COC(=O)N[C@H](C(=O)O)C(C)C MCULE-5593997568 [1,1,0,0,0,0|1,0,0]=3 151 B11R0.108 [C@H](NC(=O)OC)(C(=O)O)C(C)C MCULE-6608047361 [1,1,0,0,0,0|1,0,0]=3 152 B11R0.115 CCC(C)C(NC(=O)C)C(=O)O MCULE-4181667774 [1,1,0,0,0,0|2,0,0]=4 153 B11R0.115 CC[C@H](C)[C@@H](NC(=O)C)C(=O)O MCULE-5204918668 [1,1,0,0,0,0|2,0,0]=4 154 B11R0.115 CC[C@H](C)[C@H](NC(=O)C)C(=O)O MCULE-1874701839 [1,1,0,0,0,0|2,0,0]=4 155 B11R0.115 CC[C@H](C)[C@H](NC(=O)C)C(=O)O MCULE-2741794137 [1,1,0,0,0,0|2,0,0]=4 156 B11R0.115 CC[C@H](C)[C@H](NC(=O)C)C(=O)O MCULE-6557323131 [1,1,0,0,0,0|2,0,0]=4 157 B11R0.115 COC(=O)C(NC(=O)C)C(C)C MCULE-2098636411 [1,1,0,0,0,0|2,0,0]=4 158 B11R0.115 COC(=O)[C@@H](CC(=O)O)C(C)C MCULE-6012271415 [1,1,0,0,0,0|0,0,0]=2 159 B11R0.115 COC(=O)[C@@H](NC(=O)C)C(C)C MCULE-2606738774 [1,1,0,0,0,0|2,0,0]=4 160 B11R0.115 COC(=O)[C@@H](NC(=O)C)C(C)C MCULE-6470945106 [1,1,0,0,0,0|2,0,0]=4 161 B11R0.115 [C@@H](C)(CC)[C@@H](NC(=O)C)C(=O)O MCULE-5237529088 [1,1,0,0,0,0|2,0,0]=4 162 B11R0.115 [C@@H](NC(=O)C)(C(=O)O)C(C)CC MCULE-8702697039 [1,1,0,0,0,0|2,0,0]=4 163 B11R0.115 [C@@H](NC(=O)N)(C(=O)O)C(C)CC MCULE-3282905656 [1,1,0,0,0,0|2,0,0]=4 164 B11R0.115 [C@H](C)(CC)[C@@H](NC(=O)C)C(=O)O MCULE-2360572915 [1,1,0,0,0,0|2,0,0]=4 165 B11R0.234 CC(=O)NC(C(=O)O)C(C)(C)C MCULE-8664701798 [1,1,0,0,0,0|2,0,0]=4 166 B11R0.234 CC(=O)NC(C(=O)O)C(C)(C)S MCULE-4274464810 [1,1,0,0,0,0|2,0,0]=4 167 B11R0.234 CC(=O)N[C@@H](C(=O)O)C(C)(C)C MCULE-1949334332 [1,1,0,0,0,0|2,0,0]=4 168 B11R0.234 CC(=O)N[C@@H](C(=O)O)C(C)(C)S MCULE-3114286376 [1,1,0,0,0,0|2,0,0]=4 169 B11R0.234 CC(=O)N[C@@H](C(=O)O)C(C)(C)S MCULE-6911816639 [1,1,0,0,0,0|2,0,0]=4 170 B11R0.234 CC(=O)N[C@H](C(=O)O)C(C)(C)C MCULE-2109188969 [1,1,0,0,0,0|2,0,0]=4 171 B11R0.234 CC(=O)N[C@H](C(=O)O)C(C)(C)C MCULE-4518125072 [1,1,0,0,0,0|2,0,0]=4 172 B11R0.234 CC(C)(C)C(NC(=O)N)C(=O)O MCULE-8574533977 [1,1,0,0,0,0|2,0,0]=4 173 B11R0.427 CC(=O)NC(C)(C(=O)O)C(C)C MCULE-6185233720 [1,1,0,0,0,0|2,0,0]=4 174 B11R0.427 CC(C)C(O)(CC(=O)O)C(=O)O MCULE-3688505128 [1,1,0,0,0,0|0,0,0]=2 175 B11R1.178 O=C(O)C1CCCC1C(=O)O MCULE-1370613174 [1,0,0,1,0,0|1,0,0]=3 176 B11R1.178 O=C(O)C1CCNC1C(=O)O MCULE-2316581520 [1,0,0,1,0,0|1,0,0]=3 177 B11R1.178 O=C(O)C1CCNC1C(=O)O MCULE-9331741117 [1,0,0,1,0,0|1,0,0]=3 178 B11R1.178 O=C(O)C1COCC1C(=O)O MCULE-4469020347 [1,0,0,1,0,0|2,0,0]=4 179 B11R1.178 O=C(O)[C@@H]1CCCN1C(=O)O MCULE-1970767326 [1,0,0,1,0,0|2,0,0]=4 180 B11R1.178 O=C(O)[C@@H]1CCC[C@H]1C(=O)O MCULE-5772739452 [1,0,0,1,0,0|1,0,0]=3 181 B11R1.178 O=C(O)[C@@H]1CCC[C@H]1C(=O)O MCULE-6923663809 [1,0,0,1,0,0|1,0,0]=3 182 B11R1.178 O=C(O)[C@@H]1CNC[C@@H]1C(=O)O MCULE-7094844570 [1,0,0,1,0,0|2,0,0]=4 183 B11R1.178 O=C(O)[C@@H]1COC[C@@H]1C(=O)O MCULE-2959853524 [1,0,0,1,0,0|2,0,0]=4 184 B11R1.178 O=C(O)[C@@H]1COC[C@H]1C(=O)O MCULE-9190757159 [1,0,0,1,0,0|2,0,0]=4 185 B11R1.178 O=C(O)[C@H]1CCC[C@H]1C(=O)O MCULE-2898188373 [1,0,0,1,0,0|1,0,0]=3 186 B11R1.178 O=C(O)[C@H]1COC[C@@H]1C(=O)O MCULE-4154653911 [1,0,0,1,0,0|2,0,0]=4 187 B11R1.178 O=C(O)[C@H]1COC[C@@H]1C(=O)O MCULE-5321587208 [1,0,0,1,0,0|2,0,0]=4 188 B11R1.489 CC1(CC(=O)NC1C(=O)O)C MCULE-5250835582 [1,0,0,1,0,0|2,0,0]=4 189 B11R1.489 CC1(NC(=O)CC1C(=O)O)C MCULE-1222232931 [1,0,0,1,0,0|1,0,0]=3 190 B11R1.489 CC1(OC(=O)CC1C(=O)O)C MCULE-8227422771 [1,0,0,1,0,0|0,0,0]=2 191 B11R1.732 CC1(C(C1C(=O)O)C(=O)N)C MCULE-5059635043 [1,0,0,1,0,0|1,0,0]=3 192 B11R1.732 CC1(C(C1C(=O)O)C(=O)O)C MCULE-7677624380 [1,0,0,1,0,0|0,0,0]=2 193 B11R1.732 CC1(C(C1C(=O)[O-])C(=O)[O-])C MCULE-4804490730 [1,0,0,1,0,0|0,0,2]=4 194 B11R1.732 O=C(O)[C@@H]1[C@@H](C1(Cl)Cl)C(=O)O MCULE-3895743291 [1,0,0,1,0,0|2,0,0]=4 195 B13R1.1046 C1(OC(OC1C(=O)N)(C)C)C(=O)N MCULE-7649823437 [0,0,0,1,0,1|2,0,0]=4 196 B13R1.1046 CC1(O[C@H]([C@@H](O1)C(=O)O)C(=O)O)C MCULE-9745372297 [0,0,0,1,0,1|0,0,0]=2 197 B13R1.1046 [C@H]1(OC(O[C@H]1C(=O)N)(C)C)C(=O)N MCULE-9184148552 [0,0,0,1,0,1|2,0,0]=4 198 B13R1.3475 O=C1C[C@@]([C@H](O1)C(=O)O)(O)C(=O)O MCULE-6114315628 [0,0,0,1,0,1|1,0,1]=4 199 B13R1.3475 O=C1C[C@@]([C@H](O1)C(=O)O)(O)C(=O)O MCULE-7321149696 [0,0,0,1,0,1|1,0,1]=4 200 B13R1.1053 C1(N[C@H](C(S1)(C)C)C(=O)O)C(=O)O MCULE-4119817067 [0,0,0,1,0,1|0,1,0]=3 201 B13R1.295 CC1C=CCC(C1C(=O)O)C(=O)O MCULE-1243088880 [0,1,0,1,0,0|1,0,1]=4 202 B13R1.295 CC1C=CC[C@H]([C@H]1C(=O)O)C(=O)O MCULE-2377796737 [0,1,0,1,0,0|1,0,1]=4 203 B13R1.295 CC1C=CC[C@H]([C@H]1C(=O)O)C(=O)O MCULE-8829137091 [0,1,0,1,0,0|1,0,1]=4 204 B13R1.295 C[C@H]1C=CC[C@H]([C@H]1C(=O)O)C(=O)O MCULE-9407268901 [0,1,0,1,0,0|1,0,1]=4 205 B11R0.275 CCC(C[C@H](N)C(=O)O)C(=O)O MCULE-1744478562 [1,0,0,0,0,1|1,0,0]=3 206 B11R0.28 CC(=O)CCC(C(=O)O)C(C)C MCULE-5205208596 [1,0,0,0,0,1|1,0,0]=3 207 B11R0.28 CC(N)C(CCC(=O)O)C(=O)O MCULE-4285872078 [1,0,0,0,0,1|1,0,0]=3 208 B11R0.28 CC(N)C(CCC(=O)O)C(=O)O MCULE-7706960153 [1,0,0,0,0,1|1,0,0]=3 209 B11R0.28 CN(C)[C@@H](CCC(=O)O)C(=O)O MCULE-2784771552 [1,0,0,0,0,1|1,0,0]=3 210 B11R0.28 CN(C)[C@H](CCC(=O)N)C(=O)O MCULE-2650965426 [1,0,0,0,0,1|2,0,0]=4 211 B11R0.28 CN(C)[C@H](CCC(=O)O)C(=O)O MCULE-7024104536 [1,0,0,0,0,1|1,0,0]=3 212 B11R0.32 CC(=O)NC(CC(=O)O)C(=O)O MCULE-8912395007 [1,0,0,0,0,1|1,0,1]=4 213 B11R0.32 CC(=O)NC(CC(C)C)C(=O)O MCULE-7375828849 [1,0,0,0,0,1|2,0,0]=4 214 B11R0.32 CC(=O)NC(CC(C)C)C(=O)O MCULE-8541961335 [1,0,0,0,0,1|2,0,0]=4 215 B11R0.32 CC(=O)N[C@@H](CC(=O)O)C(=O)O MCULE-2346017798 [1,0,0,0,0,1|1,0,1]=4 216 B11R0.32 CC(=O)N[C@@H](CC(=O)O)C(=O)O MCULE-5208660790 [1,0,0,0,0,1|1,0,1]=4 217 B11R0.32 CC(=O)N[C@@H](CC(C)C)C(=O)O MCULE-3541053611 [1,0,0,0,0,1|2,0,0]=4 218 B11R0.32 CC(=O)N[C@@H](CC(C)C)C(=O)O MCULE-9082534218 [1,0,0,0,0,1|2,0,0]=4 219 B11R0.32 CC(=O)N[C@H](CC(C)C)C(=O)O MCULE-8998784853 [1,0,0,0,0,1|2,0,0]=4 220 B11R0.32 CC(=O)S[C@@H](CC(C)C)C(=O)O MCULE-8202562834 [1,0,0,0,0,1|2,0,0]=4 221 B11R0.32 CC(C)C(CC(=O)O)CC(=O)O MCULE-6857247229 [1,0,0,0,0,1|0,0,0]=2 222 B11R0.32 CC(C)CC(CC(=O)O)C(=O)O MCULE-4610463681 [1,0,0,0,0,1|0,0,0]=2 223 B11R0.32 CC(C)CC(NC(=O)N)C(=O)O MCULE-3278114292 [1,0,0,0,0,1|2,0,0]=4 224 B11R0.32 CC(C)C[C@H](NC(=O)N)C(=O)O MCULE-3333503554 [1,0,0,0,0,1|2,0,0]=4 225 B11R0.32 [C@H](CC(C)C)(NC(=O)C)C(=O)O MCULE-9509726558 [1,0,0,0,0,1|2,0,0]=4