0 B8R0.23 C(=C(Br)C(=O)O)C(=O)O MCULE-1343964958 [0,0,0,0,0,0|1,0,2]=3 1 B8R0.23 C(N)(CC(C)C)C(=O)O MCULE-7664540924 [0,0,0,0,0,0|2,0,1]=3 2 B8R0.23 C(N)(CS(=O)C)C(=O)O MCULE-3320985154 [0,0,0,0,0,0|2,0,0]=2 3 B8R0.23 C/C(=C/C(=O)O)/C(=O)O MCULE-9648210920 [0,0,0,0,0,0|1,0,2]=3 4 B8R0.23 C/C(=C\C(=O)O)/C(=O)O MCULE-1060050416 [0,0,0,0,0,0|1,0,2]=3 5 B8R0.23 C=C(Br)CC(N)C(=O)O MCULE-2311003313 [0,0,0,0,0,0|2,0,0]=2 6 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O MCULE-2061865879 [0,0,0,0,0,0|2,0,0]=2 7 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O MCULE-6617690939 [0,0,0,0,0,0|2,0,0]=2 8 B8R0.23 C=C(Br)C[C@H](N)C(=O)O MCULE-2602336550 [0,0,0,0,0,0|2,0,0]=2 9 B8R0.23 C=C(Br)C[C@H](N)C(=O)O MCULE-9274484893 [0,0,0,0,0,0|2,0,0]=2 10 B8R0.23 C=C(C)C(N)CC(=O)O MCULE-5527747045 [0,0,0,0,0,0|2,0,0]=2 11 B8R0.23 C=C(C)CC(C)C(=O)O MCULE-7268483710 [0,0,0,0,0,0|3,0,0]=3 12 B8R0.23 C=C(C)CC(N)C(=O)O MCULE-5915882776 [0,0,0,0,0,0|2,0,0]=2 13 B8R0.23 C=C(C)C[C@@H](N)C(=O)O MCULE-2841714882 [0,0,0,0,0,0|2,0,0]=2 14 B8R0.23 C=C(C)C[C@H](C)C(=O)O MCULE-9053114079 [0,0,0,0,0,0|3,0,0]=3 15 B8R0.23 C=C(C)C[C@H](N)C(=O)O MCULE-1029058491 [0,0,0,0,0,0|2,0,0]=2 16 B8R0.23 C=C(C)C[C@H](N)C(=O)O MCULE-6974720260 [0,0,0,0,0,0|2,0,0]=2 17 B8R0.23 C=C(C)[C@@H](O)CC(=O)O MCULE-9399932923 [0,0,0,0,0,0|3,0,0]=3 18 B8R0.23 C=C(CC(=O)Cl)C(=O)Cl MCULE-5964382878 [0,0,0,0,0,0|3,0,1]=4 19 B8R0.23 C=C(CC(=O)O)C(=O)O MCULE-5221256796 [0,0,0,0,0,0|1,0,1]=2 20 B8R0.23 C=C(Cl)CC(N)C(=O)O MCULE-3498417929 [0,0,0,0,0,0|2,0,0]=2 21 B8R0.23 C=C(Cl)CC(N)C(=O)O MCULE-7451890779 [0,0,0,0,0,0|2,0,0]=2 22 B8R0.23 C=C(NC(=O)C)C(=O)O MCULE-6963284423 [0,0,0,0,0,0|3,0,1]=4 23 B8R0.23 CC(=CC(=O)O)C(=O)O MCULE-9291663033 [0,0,0,0,0,0|1,0,2]=3 24 B8R0.23 CC(=NC(=O)N)C(=O)O MCULE-5921330982 [0,0,0,0,0,0|3,0,1]=4 25 B8R0.23 CC(=O)C(C)CC(=O)O MCULE-9095166615 [0,0,0,0,0,0|2,0,0]=2 26 B8R0.23 CC(=O)C(N)CC(=O)O MCULE-7043175556 [0,0,0,0,0,0|1,0,0]=1 27 B8R0.23 CC(=O)C(N)CC(C)C MCULE-2548441556 [0,0,0,0,0,0|3,0,1]=4 28 B8R0.23 CC(=O)CC(C)C(=O)O MCULE-4640477792 [0,0,0,0,0,0|2,0,0]=2 29 B8R0.23 CC(=O)CC(N)C(=O)O MCULE-6275652695 [0,0,0,0,0,0|1,0,0]=1 30 B8R0.23 CC(=O)CC(N)C(=O)O MCULE-6690241894 [0,0,0,0,0,0|1,0,0]=1 31 B8R0.23 CC(=O)CC(O)C(=O)C MCULE-3447949844 [0,0,0,0,0,0|3,0,0]=3 32 B8R0.23 CC(=O)CC(O)C(=O)O MCULE-4728629069 [0,0,0,0,0,0|2,0,0]=2 33 B8R0.23 CC(=O)N(C)CC(=O)O MCULE-1037482941 [0,0,0,0,0,0|3,0,0]=3 34 B8R0.23 CC(=O)NC(C)C(=O)C MCULE-4672583112 [0,0,0,0,0,0|4,0,0]=4 35 B8R0.23 CC(=O)NC(C)C(=O)O MCULE-1209958700 [0,0,0,0,0,0|3,0,0]=3 36 B8R0.23 CC(=O)NC(C)C(=O)O MCULE-6844686208 [0,0,0,0,0,0|3,0,0]=3 37 B8R0.23 CC(=O)N[C@@H](C)C(=O)Cl MCULE-1899336261 [0,0,0,0,0,0|4,0,0]=4 38 B8R0.23 CC(=O)N[C@@H](C)C(=O)Cl MCULE-2242849037 [0,0,0,0,0,0|4,0,0]=4 39 B8R0.23 CC(=O)N[C@@H](C)C(=O)N MCULE-9322824133 [0,0,0,0,0,0|4,0,0]=4 40 B8R0.23 CC(=O)N[C@@H](C)C(=O)N MCULE-9348799148 [0,0,0,0,0,0|4,0,0]=4 41 B8R0.23 CC(=O)N[C@@H](C)C(=O)O MCULE-7453059048 [0,0,0,0,0,0|3,0,0]=3 42 B8R0.23 CC(=O)N[C@@H](C)C(=O)O MCULE-9637570463 [0,0,0,0,0,0|3,0,0]=3 43 B8R0.23 CC(=O)N[C@H](C)C(=O)O MCULE-1908712348 [0,0,0,0,0,0|3,0,0]=3 44 B8R0.23 CC(=O)N[C@H](C)C(=O)O MCULE-3023888296 [0,0,0,0,0,0|3,0,0]=3 45 B8R0.23 CC(=O)OC(C)C(=O)C MCULE-7403314261 [0,0,0,0,0,0|4,0,0]=4 46 B8R0.23 CC(=O)OC(C)C(=O)Cl MCULE-9987734584 [0,0,0,0,0,0|4,0,0]=4 47 B8R0.23 CC(=O)OC(C)C(=O)O MCULE-6745958064 [0,0,0,0,0,0|3,0,0]=3 48 B8R0.23 CC(=O)OC(C)C(=O)O MCULE-8940501529 [0,0,0,0,0,0|3,0,0]=3 49 B8R0.23 CC(=O)O[C@@H](C)C(=O)Cl MCULE-6842776649 [0,0,0,0,0,0|4,0,0]=4 50 B8R0.23 CC(=O)O[C@@H](C)C(=O)Cl MCULE-9564324053 [0,0,0,0,0,0|4,0,0]=4 51 B8R0.23 CC(=O)O[C@@H](C)C(=O)O MCULE-7850132202 [0,0,0,0,0,0|3,0,0]=3 52 B8R0.23 CC(=O)O[C@@H](C)C(=O)O MCULE-9087871033 [0,0,0,0,0,0|3,0,0]=3 53 B8R0.23 CC(=O)O[C@H](C)C(=O)Cl MCULE-4690787544 [0,0,0,0,0,0|4,0,0]=4 54 B8R0.23 CC(=O)O[C@H](C)C(=O)Cl MCULE-6415823129 [0,0,0,0,0,0|4,0,0]=4 55 B8R0.23 CC(=O)O[C@H](C)C(=O)O MCULE-3788243723 [0,0,0,0,0,0|3,0,0]=3 56 B8R0.23 CC(=O)O[C@H](C)C(=O)O MCULE-8696299139 [0,0,0,0,0,0|3,0,0]=3 57 B8R0.23 CC(C)C(C)CC(=O)O MCULE-8256978568 [0,0,0,0,0,0|3,0,1]=4 58 B8R0.23 CC(C)C(N)CC(=O)O MCULE-1591106639 [0,0,0,0,0,0|2,0,1]=3 59 B8R0.23 CC(C)C(N)CC(=O)O MCULE-2785677086 [0,0,0,0,0,0|2,0,1]=3 60 B8R0.23 CC(C)C(N)CC(=O)O MCULE-7741390676 [0,0,0,0,0,0|2,0,1]=3 61 B8R0.23 CC(C)C(N)CC(=O)O MCULE-7820976140 [0,0,0,0,0,0|2,0,1]=3 62 B8R0.23 CC(C)C(O)CC(=O)O MCULE-2577623422 [0,0,0,0,0,0|3,0,1]=4 63 B8R0.23 CC(C)CC(Br)C(=O)O MCULE-2778142655 [0,0,0,0,0,0|3,0,1]=4 64 B8R0.23 CC(C)CC(Br)C(=O)O MCULE-7689846956 [0,0,0,0,0,0|3,0,1]=4 65 B8R0.23 CC(C)CC(C)C(=O)O MCULE-7217536279 [0,0,0,0,0,0|3,0,1]=4 66 B8R0.23 CC(C)CC(Cl)C(=O)O MCULE-6347367806 [0,0,0,0,0,0|3,0,1]=4 67 B8R0.23 CC(C)CC(F)C(=O)O MCULE-6908911956 [0,0,0,0,0,0|3,0,1]=4 68 B8R0.23 CC(C)CC(N)C(=O)N MCULE-8974870406 [0,0,0,0,0,0|3,0,1]=4 69 B8R0.23 CC(C)CC(N)C(=O)N MCULE-9193295179 [0,0,0,0,0,0|3,0,1]=4 70 B8R0.23 CC(C)CC(N)C(=O)O MCULE-2550986320 [0,0,0,0,0,0|2,0,1]=3 71 B8R0.23 CC(C)CC(N)C(=O)O MCULE-7657212416 [0,0,0,0,0,0|2,0,1]=3 72 B8R0.23 CC(C)CC(O)C(=O)O MCULE-3638762911 [0,0,0,0,0,0|3,0,1]=4 73 B8R0.23 CC(C)CC(O)C(=O)O MCULE-4315013875 [0,0,0,0,0,0|3,0,1]=4 74 B8R0.23 CC(C)C[C@@H](Br)C(=O)O MCULE-2325122781 [0,0,0,0,0,0|3,0,1]=4 75 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O MCULE-6797937420 [0,0,0,0,0,0|3,0,1]=4 76 B8R0.23 CC(C)C[C@@H](N)C(=O)N MCULE-6195005494 [0,0,0,0,0,0|3,0,1]=4 77 B8R0.23 CC(C)C[C@@H](N)C(=O)O MCULE-3041792060 [0,0,0,0,0,0|2,0,1]=3 78 B8R0.23 CC(C)C[C@@H](N)C(=O)O MCULE-8280206722 [0,0,0,0,0,0|2,0,1]=3 79 B8R0.23 CC(C)C[C@@H](O)C(=O)O MCULE-4108530385 [0,0,0,0,0,0|3,0,1]=4 80 B8R0.23 CC(C)C[C@@H](O)C(=O)O MCULE-5253943571 [0,0,0,0,0,0|3,0,1]=4 81 B8R0.23 CC(C)C[C@H](Br)C(=O)O MCULE-4423121396 [0,0,0,0,0,0|3,0,1]=4 82 B8R0.23 CC(C)C[C@H](Br)C(=O)O MCULE-7601821889 [0,0,0,0,0,0|3,0,1]=4 83 B8R0.23 CC(C)C[C@H](Cl)C(=O)O MCULE-1038344796 [0,0,0,0,0,0|3,0,1]=4 84 B8R0.23 CC(C)C[C@H](Cl)C(=O)O MCULE-9007168250 [0,0,0,0,0,0|3,0,1]=4 85 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-3907393760 [0,0,0,0,0,0|3,0,1]=4 86 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-5393472198 [0,0,0,0,0,0|3,0,1]=4 87 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-7425207205 [0,0,0,0,0,0|3,0,1]=4 88 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-8093463847 [0,0,0,0,0,0|3,0,1]=4 89 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-4718215038 [0,0,0,0,0,0|2,0,1]=3 90 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-4930237913 [0,0,0,0,0,0|2,0,1]=3 91 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-8722899457 [0,0,0,0,0,0|2,0,1]=3 92 B8R0.23 CC(C)C[C@H](O)C(=O)O MCULE-1740362996 [0,0,0,0,0,0|3,0,1]=4 93 B8R0.23 CC(C)C[C@H](O)C(=O)O MCULE-4466965907 [0,0,0,0,0,0|3,0,1]=4 94 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-4128027229 [0,0,0,0,0,0|2,0,1]=3 95 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-5111030586 [0,0,0,0,0,0|2,0,1]=3 96 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-7447469347 [0,0,0,0,0,0|2,0,1]=3 97 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-8228659608 [0,0,0,0,0,0|2,0,1]=3 98 B8R0.23 CC(C)[C@@H](O)CC(=O)O MCULE-6946774834 [0,0,0,0,0,0|3,0,1]=4 99 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-2362404476 [0,0,0,0,0,0|2,0,1]=3 100 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-4006103633 [0,0,0,0,0,0|2,0,1]=3 101 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-8085621397 [0,0,0,0,0,0|2,0,1]=3 102 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-8783742568 [0,0,0,0,0,0|2,0,1]=3 103 B8R0.23 CC(CC(=O)Cl)C(=O)Cl MCULE-1409735811 [0,0,0,0,0,0|3,0,0]=3 104 B8R0.23 CC(CC(=O)N)C(=O)O MCULE-8238400356 [0,0,0,0,0,0|2,0,0]=2 105 B8R0.23 CC(CC(=O)O)C(=O)O MCULE-4824634360 [0,0,0,0,0,0|1,0,0]=1 106 B8R0.23 CC(CC(=O)O)C(=O)O MCULE-8116748590 [0,0,0,0,0,0|1,0,0]=1 107 B8R0.23 CC(CC(=O)O)C(F)F MCULE-1349015136 [0,0,0,0,0,0|3,0,1]=4 108 B8R0.23 CC(CC(=O)O)N(C)C MCULE-5382425068 [0,0,0,0,0,0|4,0,0]=4 109 B8R0.23 CC(CC(=O)O)N(C)C MCULE-9798996642 [0,0,0,0,0,0|4,0,0]=4 110 B8R0.23 CC(CC(F)F)C(=O)O MCULE-2211206695 [0,0,0,0,0,0|3,0,1]=4 111 B8R0.23 CC(CN(C)C)C(=O)O MCULE-7139783268 [0,0,0,0,0,0|4,0,0]=4 112 B8R0.23 CC(CN(C)C)C(=O)O MCULE-7716649676 [0,0,0,0,0,0|4,0,0]=4 113 B8R0.23 CC(CS(=O)C)C(=O)O MCULE-4855592077 [0,0,0,0,0,0|3,0,0]=3 114 B8R0.23 CC(NC(=N)N)C(=O)O MCULE-1509115617 [0,0,0,0,0,0|4,0,0]=4 115 B8R0.23 CC(NC(=O)N)C(=O)O MCULE-9370944250 [0,0,0,0,0,0|3,0,0]=3 116 B8R0.23 CC(O)C(N)CC(=O)O MCULE-5161755443 [0,0,0,0,0,0|1,0,1]=2 117 B8R0.23 CC(O)C(N)CC(=O)O MCULE-6370326858 [0,0,0,0,0,0|1,0,1]=2 118 B8R0.23 CN(C)CC(N)C(=O)O MCULE-4589211472 [0,0,0,0,0,0|3,0,0]=3 119 B8R0.23 CN(C)CC(N)C(=O)O MCULE-4873136690 [0,0,0,0,0,0|3,0,0]=3 120 B8R0.23 CN(C)CC(O)C(=O)O MCULE-2461037518 [0,0,0,0,0,0|4,0,0]=4 121 B8R0.23 CN(C)C[C@@H](N)C(=O)O MCULE-7056570231 [0,0,0,0,0,0|3,0,0]=3 122 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-1155351106 [0,0,0,0,0,0|3,0,0]=3 123 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-2217543416 [0,0,0,0,0,0|3,0,0]=3 124 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-6989814495 [0,0,0,0,0,0|3,0,0]=3 125 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-7529109312 [0,0,0,0,0,0|3,0,0]=3 126 B8R0.23 CN(C)C[C@H](O)C(=O)O MCULE-7629489364 [0,0,0,0,0,0|4,0,0]=4 127 B8R0.23 CN(CC(=O)O)C(=N)N MCULE-3625061513 [0,0,0,0,0,0|4,0,0]=4 128 B8R0.23 CN(CC(=O)O)C(=N)N MCULE-4950835709 [0,0,0,0,0,0|4,0,0]=4 129 B8R0.23 CN(CC(=O)O)C(=N)N MCULE-5131797215 [0,0,0,0,0,0|4,0,0]=4 130 B8R0.23 CN(CC(=O)O)C(=O)N MCULE-6739535875 [0,0,0,0,0,0|3,0,0]=3 131 B8R0.23 CN(CC(=O)O)C(=S)S MCULE-1910105668 [0,0,0,0,0,0|2,2,0]=4 132 B8R0.23 CS(=O)CC(N)C(=O)O MCULE-5699602621 [0,0,0,0,0,0|2,0,0]=2 133 B8R0.23 CS(=O)C[C@@H](N)C(=O)O MCULE-8253087333 [0,0,0,0,0,0|2,0,0]=2 134 B8R0.23 CS(=O)C[C@H](N)C(=O)O MCULE-5080098254 [0,0,0,0,0,0|2,0,0]=2 135 B8R0.23 C[C@@H](CC(=O)O)C(=O)O MCULE-1711994689 [0,0,0,0,0,0|1,0,0]=1 136 B8R0.23 C[C@@H](CC(=O)O)C(=O)O MCULE-6107805812 [0,0,0,0,0,0|1,0,0]=1 137 B8R0.23 C[C@@H](CC(=O)O)N(C)C MCULE-7203350382 [0,0,0,0,0,0|4,0,0]=4 138 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-1416044737 [0,0,0,0,0,0|1,0,1]=2 139 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-2990511228 [0,0,0,0,0,0|1,0,1]=2 140 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-3178455647 [0,0,0,0,0,0|1,0,1]=2 141 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-4413833682 [0,0,0,0,0,0|1,0,1]=2 142 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-7332826518 [0,0,0,0,0,0|1,0,1]=2 143 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-7552978009 [0,0,0,0,0,0|1,0,1]=2 144 B8R0.23 C[C@H](CC(=O)O)C(=O)O MCULE-2738295504 [0,0,0,0,0,0|1,0,0]=1 145 B8R0.23 C[C@H](CC(=O)O)C(=O)O MCULE-4544789339 [0,0,0,0,0,0|1,0,0]=1 146 B8R0.23 C[C@H](CC(=O)O)N(C)C MCULE-8459726256 [0,0,0,0,0,0|4,0,0]=4 147 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O MCULE-5195061270 [0,0,0,0,0,0|2,0,1]=3 148 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O MCULE-5975065356 [0,0,0,0,0,0|2,0,1]=3 149 B8R0.23 C[C@H](NC(=O)N)C(=O)O MCULE-7947685696 [0,0,0,0,0,0|3,0,0]=3 150 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O MCULE-8673070329 [0,0,0,0,0,0|1,0,1]=2 151 B8R0.23 C[S@](=O)C[C@@H](N)C(=O)O MCULE-4004385080 [0,0,0,0,0,0|2,0,0]=2 152 B8R0.23 NC(=O)C(N)CC(=O)O MCULE-2277575843 [0,0,0,0,0,0|1,0,0]=1 153 B8R0.23 NC(=O)C=C(N)C(=O)N MCULE-1435081726 [0,0,0,0,0,0|2,0,2]=4 154 B8R0.23 NC(=O)CC(Br)C(=O)O MCULE-2823539046 [0,0,0,0,0,0|2,0,0]=2 155 B8R0.23 NC(=O)CC(N)C(=O)O MCULE-1395307434 [0,0,0,0,0,0|1,0,0]=1 156 B8R0.23 NC(=O)C[C@@H](N)C(=O)N MCULE-7126009795 [0,0,0,0,0,0|2,0,0]=2 157 B8R0.23 NC(=O)C[C@@H](N)C(=O)O MCULE-5685974579 [0,0,0,0,0,0|1,0,0]=1 158 B8R0.23 NC(=O)C[C@@H](N)C(=O)O MCULE-6923060287 [0,0,0,0,0,0|1,0,0]=1 159 B8R0.23 NC(=O)C[C@H](N)C(=O)N MCULE-3049784970 [0,0,0,0,0,0|2,0,0]=2 160 B8R0.23 NC(=O)C[C@H](N)C(=O)N MCULE-6209092318 [0,0,0,0,0,0|2,0,0]=2 161 B8R0.23 NC(=O)C[C@H](N)C(=O)N MCULE-7482170747 [0,0,0,0,0,0|2,0,0]=2 162 B8R0.23 NC(=O)C[C@H](N)C(=O)N MCULE-8939291995 [0,0,0,0,0,0|2,0,0]=2 163 B8R0.23 NC(=O)C[C@H](N)C(=O)O MCULE-1868046141 [0,0,0,0,0,0|1,0,0]=1 164 B8R0.23 NC(=O)C[C@H](N)C(=O)O MCULE-8248953574 [0,0,0,0,0,0|1,0,0]=1 165 B8R0.23 NC(=O)N(N)CC(=O)O MCULE-2553509411 [0,0,0,0,0,0|2,0,0]=2 166 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-1924512659 [0,0,0,0,0,0|1,0,0]=1 167 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-5836180326 [0,0,0,0,0,0|1,0,0]=1 168 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-8799617587 [0,0,0,0,0,0|1,0,0]=1 169 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-9477928215 [0,0,0,0,0,0|1,0,0]=1 170 B8R0.23 NC(=O)[C@H](N)CC(=O)O MCULE-5316198498 [0,0,0,0,0,0|1,0,0]=1 171 B8R0.23 NC(=O)[C@H](N)CC(=O)O MCULE-9833023193 [0,0,0,0,0,0|1,0,0]=1 172 B8R0.23 NC(CC(=O)O)C(=O)O MCULE-1247865301 [0,0,0,0,0,0|0,0,0]=0 173 B8R0.23 NC(CC(=O)O)C(=O)O MCULE-9328817309 [0,0,0,0,0,0|0,0,0]=0 174 B8R0.23 NC(CC(=O)O)C(=O)[O-] MCULE-5149469296 [0,0,0,0,0,0|0,0,1]=1 175 B8R0.23 NC(CC(=O)O)C(=O)[O-] MCULE-6655576025 [0,0,0,0,0,0|0,0,1]=1 176 B8R0.23 NC(CC(=O)[O-])C(=O)O MCULE-9221777365 [0,0,0,0,0,0|0,0,1]=1 177 B8R0.23 NC(CC(=O)[O-])C(=O)[O-] MCULE-5331717218 [0,0,0,0,0,0|0,0,2]=2 178 B8R0.23 NC(CC(=O)[O-])C(=O)[O-] MCULE-5921707862 [0,0,0,0,0,0|0,0,2]=2 179 B8R0.23 NC(CC(F)F)C(=O)O MCULE-1880803967 [0,0,0,0,0,0|2,0,1]=3 180 B8R0.23 NC(CC(F)F)C(=O)O MCULE-7276277891 [0,0,0,0,0,0|2,0,1]=3 181 B8R0.23 N[C@@H](CC(=O)O)C(=O)O MCULE-3710241722 [0,0,0,0,0,0|0,0,0]=0 182 B8R0.23 N[C@@H](CC(=O)O)C(=O)O MCULE-6700641640 [0,0,0,0,0,0|0,0,0]=0 183 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] MCULE-6196524297 [0,0,0,0,0,0|0,0,1]=1 184 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O MCULE-5793000569 [0,0,0,0,0,0|0,0,1]=1 185 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] MCULE-4019077430 [0,0,0,0,0,0|0,0,2]=2 186 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] MCULE-5586538224 [0,0,0,0,0,0|0,0,2]=2 187 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] MCULE-7845714288 [0,0,0,0,0,0|0,0,2]=2 188 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] MCULE-8320700728 [0,0,0,0,0,0|0,0,2]=2 189 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] MCULE-8905060145 [0,0,0,0,0,0|0,0,2]=2 190 B8R0.23 N[C@@H](CC(Cl)Cl)C(=O)O MCULE-9426370618 [0,0,0,0,0,0|2,0,1]=3 191 B8R0.23 N[C@@H](CC(F)F)C(=O)O MCULE-3232895455 [0,0,0,0,0,0|2,0,1]=3 192 B8R0.23 N[C@@H](CC(F)F)C(=O)O MCULE-3771092799 [0,0,0,0,0,0|2,0,1]=3 193 B8R0.23 N[C@@H](CC(F)F)C(=O)O MCULE-5990452255 [0,0,0,0,0,0|2,0,1]=3 194 B8R0.23 N[C@@H](CS(=O)O)C(=O)O MCULE-6647925908 [0,0,0,0,0,0|1,0,0]=1 195 B8R0.23 N[C@@H](CS(=O)O)C(=O)O MCULE-7596867929 [0,0,0,0,0,0|1,0,0]=1 196 B8R0.23 N[C@H](CC(=O)O)C(=O)O MCULE-8102700760 [0,0,0,0,0,0|0,0,0]=0 197 B8R0.23 N[C@H](CC(F)F)C(=O)O MCULE-2615133633 [0,0,0,0,0,0|2,0,1]=3 198 B8R0.23 N[C@H](CC(F)F)C(=O)O MCULE-4923641891 [0,0,0,0,0,0|2,0,1]=3 199 B8R0.23 O=C(O)/C=C(\F)/C(=O)O MCULE-5646698704 [0,0,0,0,0,0|1,0,2]=3 200 B8R0.23 O=C(O)C=C(F)C(=O)O MCULE-9862154394 [0,0,0,0,0,0|1,0,2]=3 201 B8R0.23 O=C(O)C=C(I)C(=O)O MCULE-3104454041 [0,0,0,0,0,0|1,0,2]=3 202 B8R0.23 O=C(O)CC(=C(Cl)Cl)Cl MCULE-1048319494 [0,0,0,0,0,0|3,0,1]=4 203 B8R0.23 O=C(O)CC(=O)C(=O)O MCULE-6059222019 [0,0,0,0,0,0|1,0,1]=2 204 B8R0.23 O=C(O)CC(Br)C(=O)O MCULE-8178780603 [0,0,0,0,0,0|1,0,0]=1 205 B8R0.23 O=C(O)CC(Cl)C(=O)O MCULE-6357456691 [0,0,0,0,0,0|1,0,0]=1 206 B8R0.23 O=C(O)CC(F)C(=O)O MCULE-8433198001 [0,0,0,0,0,0|1,0,0]=1 207 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-5852208511 [0,0,0,0,0,0|1,0,0]=1 208 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-9713558868 [0,0,0,0,0,0|1,0,0]=1 209 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-9924961830 [0,0,0,0,0,0|1,0,0]=1 210 B8R0.23 O=C(O)CC(S)C(=O)O MCULE-7005300961 [0,0,0,0,0,0|1,0,0]=1 211 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O MCULE-4598056907 [0,0,0,0,0,0|1,0,0]=1 212 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O MCULE-7861798045 [0,0,0,0,0,0|1,0,0]=1 213 B8R0.23 O=C(O)C[C@@H](O)C(=O)O MCULE-2239273084 [0,0,0,0,0,0|1,0,0]=1 214 B8R0.23 O=C(O)C[C@@H](O)C(=O)O MCULE-4984266891 [0,0,0,0,0,0|1,0,0]=1 215 B8R0.23 O=C(O)C[C@H](Br)C(=O)O MCULE-6763472515 [0,0,0,0,0,0|1,0,0]=1 216 B8R0.23 O=C(O)C[C@H](Br)C(=O)O MCULE-7524683930 [0,0,0,0,0,0|1,0,0]=1 217 B8R0.23 O=C(O)C[C@H](F)C(=O)O MCULE-9607625100 [0,0,0,0,0,0|1,0,0]=1 218 B8R0.23 O=C(O)C[C@H](O)C(=O)O MCULE-8339271078 [0,0,0,0,0,0|1,0,0]=1 219 B8R0.23 O=C(O)C[C@H](O)C(=O)O MCULE-8865188741 [0,0,0,0,0,0|1,0,0]=1 220 B8R0.23 O=C(O)C[C@H](O)C(=O)[O-] MCULE-1033530810 [0,0,0,0,0,0|1,0,1]=2 221 B8R0.23 O=C(O)C[C@H](S)C(=O)O MCULE-6393371024 [0,0,0,0,0,0|1,0,0]=1 222 B8R0.23 OC(=O)CN(C(=O)N)N MCULE-5081763144 [0,0,0,0,0,0|2,0,0]=2 223 B8R0.23 [C@@H](N)(CC(=O)O)C(=O)O MCULE-7899824165 [0,0,0,0,0,0|0,0,0]=0 224 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-4796212792 [0,0,0,0,0,0|3,0,1]=4 225 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-7620299780 [0,0,0,0,0,0|3,0,1]=4 226 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-8990653324 [0,0,0,0,0,0|3,0,1]=4 227 B8R0.23 [C@H](N)(CS(=O)C)C(=O)O MCULE-5084638505 [0,0,0,0,0,0|2,0,0]=2 228 B8R0.23 [NH3+]C(CS(=O)[O-])C(=O)O MCULE-5293441756 [0,0,0,0,0,0|1,0,2]=3 229 B8R0.23 [NH3+][C@@H](CC(=O)[O-])C(=O)[O-] MCULE-1215535631 [0,0,0,0,0,0|0,0,3]=3 230 B7R0.2 C#CC(C)CC(=O)O MCULE-8780802803 [1,0,0,0,0,0|2,0,1]=4 231 B7R0.2 C(O)(CN)CC(=O)O MCULE-8378388788 [1,0,0,0,0,0|2,0,1]=4 232 B7R0.2 C=C(C)CC(N)CO MCULE-9114906744 [1,0,0,0,0,0|2,0,1]=4 233 B7R0.2 C=CC(C)CC(=O)O MCULE-4817084034 [1,0,0,0,0,0|2,0,0]=3 234 B7R0.2 C=CC(N)CC(=O)O MCULE-1733618438 [1,0,0,0,0,0|1,0,0]=2 235 B7R0.2 C=CC(N)CC(=O)O MCULE-9636299966 [1,0,0,0,0,0|1,0,0]=2 236 B7R0.2 C=CC(O)CC(=O)O MCULE-2383393271 [1,0,0,0,0,0|2,0,0]=3 237 B7R0.2 CC(=CC(=O)O)C=O MCULE-7652207149 [1,0,0,0,0,0|1,0,2]=4 238 B7R0.2 CC(C)C[C@H](N)C=O MCULE-3713415627 [1,0,0,0,0,0|2,0,1]=4 239 B7R0.2 CC(CC(=O)O)NN MCULE-2614719429 [1,0,0,0,0,0|3,0,0]=4 240 B7R0.2 CC(CC(=O)O)NN MCULE-2739806820 [1,0,0,0,0,0|3,0,0]=4 241 B7R0.2 CC(CN)CC(=O)O MCULE-1594242184 [1,0,0,0,0,0|2,0,1]=4 242 B7R0.2 CC(CN)CC(=O)O MCULE-8074816359 [1,0,0,0,0,0|2,0,1]=4 243 B7R0.2 CCC(C)CC(=O)O MCULE-3409782202 [1,0,0,0,0,0|2,0,1]=4 244 B7R0.2 CCC(C)CC(=O)O MCULE-6537278030 [1,0,0,0,0,0|2,0,1]=4 245 B7R0.2 CCC(N)CC(=O)O MCULE-1744910444 [1,0,0,0,0,0|1,0,1]=3 246 B7R0.2 CCC(N)CC(=O)O MCULE-5610499925 [1,0,0,0,0,0|1,0,1]=3 247 B7R0.2 CCC(O)CC(=O)O MCULE-4663578527 [1,0,0,0,0,0|2,0,1]=4 248 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-5550070887 [1,0,0,0,0,0|2,0,1]=4 249 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-9572363620 [1,0,0,0,0,0|2,0,1]=4 250 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-1158271004 [1,0,0,0,0,0|1,0,1]=3 251 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-2354820947 [1,0,0,0,0,0|1,0,1]=3 252 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-4284161835 [1,0,0,0,0,0|1,0,1]=3 253 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-9523089766 [1,0,0,0,0,0|1,0,1]=3 254 B7R0.2 CC[C@H](C)CC(=O)O MCULE-4177365854 [1,0,0,0,0,0|2,0,1]=4 255 B7R0.2 CC[C@H](C)CC(=O)O MCULE-5173108207 [1,0,0,0,0,0|2,0,1]=4 256 B7R0.2 CC[C@H](N)CC(=O)O MCULE-1463536674 [1,0,0,0,0,0|1,0,1]=3 257 B7R0.2 CC[C@H](N)CC(=O)O MCULE-2865599647 [1,0,0,0,0,0|1,0,1]=3 258 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4506847599 [1,0,0,0,0,0|1,0,1]=3 259 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4819674539 [1,0,0,0,0,0|1,0,1]=3 260 B7R0.2 CN(C=O)CC(=O)O MCULE-2679649056 [1,0,0,0,0,0|2,0,0]=3 261 B7R0.2 CN(CC(=O)O)N=O MCULE-5473244336 [1,0,0,0,0,0|3,0,0]=4 262 B7R0.2 CNC(C)CC(=O)O MCULE-6592893730 [1,0,0,0,0,0|3,0,0]=4 263 B7R0.2 CNC(C)CC(=O)O MCULE-7655437452 [1,0,0,0,0,0|3,0,0]=4 264 B7R0.2 COC(C)CC(=O)O MCULE-7063015720 [1,0,0,0,0,0|3,0,0]=4 265 B7R0.2 CSC(C)CC(=O)O MCULE-7827833531 [1,0,0,0,0,0|3,0,0]=4 266 B7R0.2 C[C@H](CN)CC(=O)O MCULE-4808630217 [1,0,0,0,0,0|2,0,1]=4 267 B7R0.2 C[C@H](CN)CC(=O)O MCULE-5474405940 [1,0,0,0,0,0|2,0,1]=4 268 B7R0.2 N#CC(N)CC(=O)N MCULE-6918234601 [1,0,0,0,0,0|2,0,1]=4 269 B7R0.2 N/C(=N/O)/CC(=O)O MCULE-5236282846 [1,0,0,0,0,0|1,0,1]=3 270 B7R0.2 NC(=O)C/C(=N\O)/N MCULE-7090967368 [1,0,0,0,0,0|2,0,1]=4 271 B7R0.2 NC(CO)CC(=O)O MCULE-4749383822 [1,0,0,0,0,0|0,0,1]=2 272 B7R0.2 NC(CO)CC(=O)O MCULE-7973334774 [1,0,0,0,0,0|0,0,1]=2 273 B7R0.2 NC(CO)CC(=O)O MCULE-8406665261 [1,0,0,0,0,0|0,0,1]=2 274 B7R0.2 NCC(N)CC(=O)O MCULE-5523883615 [1,0,0,0,0,0|1,0,1]=3 275 B7R0.2 NCC(N)CC(=O)O MCULE-7594259237 [1,0,0,0,0,0|1,0,1]=3 276 B7R0.2 NCC(O)CC(=O)O MCULE-9221352157 [1,0,0,0,0,0|2,0,1]=4 277 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-6348974465 [1,0,0,0,0,0|1,0,1]=3 278 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-9397628218 [1,0,0,0,0,0|1,0,1]=3 279 B7R0.2 NC[C@@H](O)CC(=O)O MCULE-2174350055 [1,0,0,0,0,0|2,0,1]=4 280 B7R0.2 NC[C@@H](O)CC(=O)O MCULE-8177708130 [1,0,0,0,0,0|2,0,1]=4 281 B7R0.2 NC[C@H](N)CC(=O)O MCULE-6133569516 [1,0,0,0,0,0|1,0,1]=3 282 B7R0.2 NC[C@H](N)CC(=O)O MCULE-7098533469 [1,0,0,0,0,0|1,0,1]=3 283 B7R0.2 NC[C@H](O)CC(=O)O MCULE-6634973995 [1,0,0,0,0,0|2,0,1]=4 284 B7R0.2 NC[C@H](O)CC(=O)O MCULE-8055679819 [1,0,0,0,0,0|2,0,1]=4 285 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-1773927420 [1,0,0,0,0,0|0,0,1]=2 286 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-2797951743 [1,0,0,0,0,0|0,0,1]=2 287 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-3839766977 [1,0,0,0,0,0|0,0,1]=2 288 B7R0.2 N[C@H](CO)CC(=O)O MCULE-4130106630 [1,0,0,0,0,0|0,0,1]=2 289 B7R0.2 O=C(O)CC(=O)CO MCULE-2224143705 [1,0,0,0,0,0|1,0,2]=4 290 B7R0.2 O=C(O)CC(O)CO MCULE-2851149196 [1,0,0,0,0,0|1,0,1]=3 291 B7R0.2 O=C(O)C[C@H](O)CO MCULE-5671818548 [1,0,0,0,0,0|1,0,1]=3 292 B7R0.2 O=C([O-])CC(O)CO MCULE-5202762172 [1,0,0,0,0,0|1,0,2]=4 293 B7R0.2 O=C([O-])CC(O)CO MCULE-6219855770 [1,0,0,0,0,0|1,0,2]=4 294 B7R0.2 O=CN(O)CC(=O)O MCULE-7408790227 [1,0,0,0,0,0|2,0,0]=3 295 B7R0.2 [NH3+][C@H](CO)CC(=O)[O-] MCULE-5131942851 [1,0,0,0,0,0|0,0,3]=4 296 B7R0.5 C#CCC(C)C(=O)O MCULE-4819055703 [1,0,0,0,0,0|2,0,1]=4 297 B7R0.5 C#CCC(F)C(=O)O MCULE-1070671235 [1,0,0,0,0,0|2,0,1]=4 298 B7R0.5 C#CCC(N)C(=O)O MCULE-2022398365 [1,0,0,0,0,0|1,0,1]=3 299 B7R0.5 C#CCC(N)C(=O)O MCULE-2451098139 [1,0,0,0,0,0|1,0,1]=3 300 B7R0.5 C#CCC(N)C(=O)O MCULE-4330300997 [1,0,0,0,0,0|1,0,1]=3 301 B7R0.5 C#CCC(N)C(=O)O MCULE-5100293043 [1,0,0,0,0,0|1,0,1]=3 302 B7R0.5 C#CCC(O)C(=O)O MCULE-4988425198 [1,0,0,0,0,0|2,0,1]=4 303 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-1266511504 [1,0,0,0,0,0|1,0,1]=3 304 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-2589808316 [1,0,0,0,0,0|1,0,1]=3 305 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-4703021434 [1,0,0,0,0,0|1,0,1]=3 306 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-5616417783 [1,0,0,0,0,0|1,0,1]=3 307 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-1593368546 [1,0,0,0,0,0|1,0,1]=3 308 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-5683421535 [1,0,0,0,0,0|1,0,1]=3 309 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-7302855511 [1,0,0,0,0,0|1,0,1]=3 310 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-9256626051 [1,0,0,0,0,0|1,0,1]=3 311 B7R0.5 C=C(CCO)C(=O)O MCULE-3336434079 [1,0,0,0,0,0|1,0,2]=4 312 B7R0.5 C=CCC(C)C(=O)C MCULE-4395269639 [1,0,0,0,0,0|3,0,0]=4 313 B7R0.5 C=CCC(C)C(=O)O MCULE-2912410432 [1,0,0,0,0,0|2,0,0]=3 314 B7R0.5 C=CCC(N)C(=O)O MCULE-1550468430 [1,0,0,0,0,0|1,0,0]=2 315 B7R0.5 C=CCC(N)C(=O)O MCULE-1783682768 [1,0,0,0,0,0|1,0,0]=2 316 B7R0.5 C=CCC(N)C(=O)O MCULE-8721864064 [1,0,0,0,0,0|1,0,0]=2 317 B7R0.5 C=CCC(N)C(=O)O MCULE-9091562338 [1,0,0,0,0,0|1,0,0]=2 318 B7R0.5 C=CCC(O)C(=O)O MCULE-6418899544 [1,0,0,0,0,0|2,0,0]=3 319 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-3817126030 [1,0,0,0,0,0|1,0,0]=2 320 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-5479618260 [1,0,0,0,0,0|1,0,0]=2 321 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-6719393730 [1,0,0,0,0,0|1,0,0]=2 322 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-7577627870 [1,0,0,0,0,0|1,0,0]=2 323 B7R0.5 C=CC[C@@H](O)C(=O)O MCULE-4103471826 [1,0,0,0,0,0|2,0,0]=3 324 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-2073484196 [1,0,0,0,0,0|1,0,0]=2 325 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-3267648941 [1,0,0,0,0,0|1,0,0]=2 326 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-4183531139 [1,0,0,0,0,0|1,0,0]=2 327 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-8225762047 [1,0,0,0,0,0|1,0,0]=2 328 B7R0.5 C=CC[C@H](O)C(=O)O MCULE-8230827617 [1,0,0,0,0,0|2,0,0]=3 329 B7R0.5 CC(=O)C(C)CCO MCULE-3907160101 [1,0,0,0,0,0|2,0,1]=4 330 B7R0.5 CC(=O)C(Cl)CCO MCULE-1606704903 [1,0,0,0,0,0|2,0,1]=4 331 B7R0.5 CC(CCN)C(=O)O MCULE-8098419324 [1,0,0,0,0,0|2,0,1]=4 332 B7R0.5 CC(CCN)C(=O)O MCULE-8509861009 [1,0,0,0,0,0|2,0,1]=4 333 B7R0.5 CC(CCO)C(=O)N MCULE-3037868887 [1,0,0,0,0,0|2,0,1]=4 334 B7R0.5 CC(CCO)C(=O)O MCULE-9724304469 [1,0,0,0,0,0|1,0,1]=3 335 B7R0.5 CC(CCO)C(=O)[O-] MCULE-2278638513 [1,0,0,0,0,0|1,0,2]=4 336 B7R0.5 CC(NC=O)C(=O)O MCULE-7277951464 [1,0,0,0,0,0|2,0,0]=3 337 B7R0.5 CC=CC(C)C(=O)O MCULE-5584906296 [1,0,0,0,0,0|2,0,1]=4 338 B7R0.5 CC=CC(O)C(=O)O MCULE-5249095255 [1,0,0,0,0,0|2,0,1]=4 339 B7R0.5 CCCC(Br)C(=O)O MCULE-4304229911 [1,0,0,0,0,0|2,0,1]=4 340 B7R0.5 CCCC(C)C(=O)O MCULE-7779384365 [1,0,0,0,0,0|2,0,1]=4 341 B7R0.5 CCCC(Cl)C(=O)O MCULE-1265367924 [1,0,0,0,0,0|2,0,1]=4 342 B7R0.5 CCCC(F)C(=O)O MCULE-5551678948 [1,0,0,0,0,0|2,0,1]=4 343 B7R0.5 CCCC(N)C(=O)N MCULE-5159221123 [1,0,0,0,0,0|2,0,1]=4 344 B7R0.5 CCCC(N)C(=O)N MCULE-5742773956 [1,0,0,0,0,0|2,0,1]=4 345 B7R0.5 CCCC(N)C(=O)O MCULE-1684743992 [1,0,0,0,0,0|1,0,1]=3 346 B7R0.5 CCCC(N)C(=O)O MCULE-5263067403 [1,0,0,0,0,0|1,0,1]=3 347 B7R0.5 CCCC(N)C(=O)O MCULE-7151907627 [1,0,0,0,0,0|1,0,1]=3 348 B7R0.5 CCCC(O)C(=O)O MCULE-8533446195 [1,0,0,0,0,0|2,0,1]=4 349 B7R0.5 CCCC(O)C(=O)O MCULE-9586449213 [1,0,0,0,0,0|2,0,1]=4 350 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-1302378905 [1,0,0,0,0,0|1,0,1]=3 351 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-5246507817 [1,0,0,0,0,0|1,0,1]=3 352 B7R0.5 CCC[C@@H](O)C(=O)O MCULE-2742119346 [1,0,0,0,0,0|2,0,1]=4 353 B7R0.5 CCC[C@H](Br)C(=O)O MCULE-3070253588 [1,0,0,0,0,0|2,0,1]=4 354 B7R0.5 CCC[C@H](N)C(=O)N MCULE-2163059771 [1,0,0,0,0,0|2,0,1]=4 355 B7R0.5 CCC[C@H](N)C(=O)N MCULE-4687172013 [1,0,0,0,0,0|2,0,1]=4 356 B7R0.5 CCC[C@H](N)C(=O)N MCULE-7482592029 [1,0,0,0,0,0|2,0,1]=4 357 B7R0.5 CCC[C@H](N)C(=O)N MCULE-9639796243 [1,0,0,0,0,0|2,0,1]=4 358 B7R0.5 CCC[C@H](N)C(=O)O MCULE-2890516597 [1,0,0,0,0,0|1,0,1]=3 359 B7R0.5 CCC[C@H](N)C(=O)O MCULE-4690406880 [1,0,0,0,0,0|1,0,1]=3 360 B7R0.5 CCC[C@H](N)C(=O)O MCULE-9323049450 [1,0,0,0,0,0|1,0,1]=3 361 B7R0.5 CCC[C@H](O)C(=O)O MCULE-6533548138 [1,0,0,0,0,0|2,0,1]=4 362 B7R0.5 CCC[C@H](O)C(=O)O MCULE-8321722254 [1,0,0,0,0,0|2,0,1]=4 363 B7R0.5 CNCC(C)C(=O)O MCULE-4255373615 [1,0,0,0,0,0|3,0,0]=4 364 B7R0.5 CNCC(C)C(=O)O MCULE-8076489545 [1,0,0,0,0,0|3,0,0]=4 365 B7R0.5 CNCC(N)C(=O)O MCULE-4360775406 [1,0,0,0,0,0|2,0,0]=3 366 B7R0.5 CNCC(N)C(=O)O MCULE-4913403405 [1,0,0,0,0,0|2,0,0]=3 367 B7R0.5 CNC[C@H](N)C(=O)O MCULE-3465445123 [1,0,0,0,0,0|2,0,0]=3 368 B7R0.5 CNC[C@H](N)C(=O)O MCULE-7309489523 [1,0,0,0,0,0|2,0,0]=3 369 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8418254346 [1,0,0,0,0,0|2,0,0]=3 370 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8752314299 [1,0,0,0,0,0|2,0,0]=3 371 B7R0.5 COCC(Br)C(=O)O MCULE-2977381282 [1,0,0,0,0,0|3,0,0]=4 372 B7R0.5 COCC(C)C(=O)O MCULE-9776415948 [1,0,0,0,0,0|3,0,0]=4 373 B7R0.5 COCC(Cl)C(=O)O MCULE-1439107016 [1,0,0,0,0,0|3,0,0]=4 374 B7R0.5 COCC(N)C(=O)N MCULE-2465830538 [1,0,0,0,0,0|3,0,0]=4 375 B7R0.5 COCC(N)C(=O)N MCULE-6194410780 [1,0,0,0,0,0|3,0,0]=4 376 B7R0.5 COCC(N)C(=O)O MCULE-4336440568 [1,0,0,0,0,0|2,0,0]=3 377 B7R0.5 COCC(N)C(=O)O MCULE-4899043582 [1,0,0,0,0,0|2,0,0]=3 378 B7R0.5 COCC(N)C(=O)O MCULE-6964823693 [1,0,0,0,0,0|2,0,0]=3 379 B7R0.5 COCC(N)C(=O)O MCULE-7037870255 [1,0,0,0,0,0|2,0,0]=3 380 B7R0.5 COCC(O)C(=O)O MCULE-3185498869 [1,0,0,0,0,0|3,0,0]=4 381 B7R0.5 COC[C@@H](N)C(=O)O MCULE-1827086666 [1,0,0,0,0,0|2,0,0]=3 382 B7R0.5 COC[C@@H](N)C(=O)O MCULE-4868456769 [1,0,0,0,0,0|2,0,0]=3 383 B7R0.5 COC[C@@H](N)C(=O)O MCULE-5275247485 [1,0,0,0,0,0|2,0,0]=3 384 B7R0.5 COC[C@@H](N)C(=O)O MCULE-7339751251 [1,0,0,0,0,0|2,0,0]=3 385 B7R0.5 COC[C@H](N)C(=O)O MCULE-3719679803 [1,0,0,0,0,0|2,0,0]=3 386 B7R0.5 COC[C@H](N)C(=O)O MCULE-4874807874 [1,0,0,0,0,0|2,0,0]=3 387 B7R0.5 COC[C@H](N)C(=O)O MCULE-5303156917 [1,0,0,0,0,0|2,0,0]=3 388 B7R0.5 COC[C@H](N)C(=O)O MCULE-8138564560 [1,0,0,0,0,0|2,0,0]=3 389 B7R0.5 CSCC(C)C(=O)O MCULE-7112130175 [1,0,0,0,0,0|3,0,0]=4 390 B7R0.5 CSCC(N)C(=O)O MCULE-7668628251 [1,0,0,0,0,0|2,0,0]=3 391 B7R0.5 CSC[C@H](N)C(=O)O MCULE-1178337776 [1,0,0,0,0,0|2,0,0]=3 392 B7R0.5 CSC[C@H](N)C(=O)O MCULE-2769761337 [1,0,0,0,0,0|2,0,0]=3 393 B7R0.5 C[C@@H](CCS)C(=O)O MCULE-2918304262 [1,0,0,0,0,0|1,1,1]=4 394 B7R0.5 C[C@H](NC=O)C(=O)O MCULE-3824082361 [1,0,0,0,0,0|2,0,0]=3 395 B7R0.5 C[C@H](NC=O)C(=O)O MCULE-5248110352 [1,0,0,0,0,0|2,0,0]=3 396 B7R0.5 C[Se]CC(N)C(=O)O MCULE-3357465269 [1,0,0,0,0,0|2,0,0]=3 397 B7R0.5 C[Se]CC(N)C(=O)O MCULE-7671606756 [1,0,0,0,0,0|2,0,0]=3 398 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-5208306365 [1,0,0,0,0,0|2,0,0]=3 399 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6734478742 [1,0,0,0,0,0|2,0,0]=3 400 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6760615750 [1,0,0,0,0,0|2,0,0]=3 401 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-7512025617 [1,0,0,0,0,0|2,0,0]=3 402 B7R0.5 N#CCC(N)C(=O)O MCULE-4929926467 [1,0,0,0,0,0|1,0,1]=3 403 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6294926701 [1,0,0,0,0,0|1,0,1]=3 404 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6432920316 [1,0,0,0,0,0|1,0,1]=3 405 B7R0.5 NC(CCBr)C(=O)O MCULE-1900559475 [1,0,0,0,0,0|1,0,1]=3 406 B7R0.5 NC(CCBr)C(=O)O MCULE-7293320576 [1,0,0,0,0,0|1,0,1]=3 407 B7R0.5 NC(CCF)C(=O)O MCULE-5519595590 [1,0,0,0,0,0|1,0,1]=3 408 B7R0.5 NC(CCF)C(=O)O MCULE-7293194855 [1,0,0,0,0,0|1,0,1]=3 409 B7R0.5 NC(CCO)C(=O)O MCULE-1744838687 [1,0,0,0,0,0|0,0,1]=2 410 B7R0.5 NC(CCO)C(=O)O MCULE-9642233758 [1,0,0,0,0,0|0,0,1]=2 411 B7R0.5 NC(CCS)C(=O)O MCULE-8057550187 [1,0,0,0,0,0|0,1,1]=3 412 B7R0.5 NC(CCS)C(=O)O MCULE-8117596001 [1,0,0,0,0,0|0,1,1]=3 413 B7R0.5 NC(CNO)C(=O)O MCULE-2332662988 [1,0,0,0,0,0|1,0,0]=2 414 B7R0.5 NCCC(F)C(=O)O MCULE-5068755002 [1,0,0,0,0,0|2,0,1]=4 415 B7R0.5 NCCC(F)C(=O)O MCULE-9196695600 [1,0,0,0,0,0|2,0,1]=4 416 B7R0.5 NCCC(N)C(=O)O MCULE-1239764966 [1,0,0,0,0,0|1,0,1]=3 417 B7R0.5 NCCC(N)C(=O)O MCULE-2441123923 [1,0,0,0,0,0|1,0,1]=3 418 B7R0.5 NCCC(N)C(=O)O MCULE-3966593369 [1,0,0,0,0,0|1,0,1]=3 419 B7R0.5 NCCC(N)C(=O)O MCULE-4212078130 [1,0,0,0,0,0|1,0,1]=3 420 B7R0.5 NCCC(N)C(=O)O MCULE-7713366571 [1,0,0,0,0,0|1,0,1]=3 421 B7R0.5 NCCC(N)C(=O)O MCULE-8402131049 [1,0,0,0,0,0|1,0,1]=3 422 B7R0.5 NCCC(N)C(=O)O MCULE-9198187552 [1,0,0,0,0,0|1,0,1]=3 423 B7R0.5 NCCC(O)C(=O)O MCULE-3670080484 [1,0,0,0,0,0|2,0,1]=4 424 B7R0.5 NCCC(O)C(=O)O MCULE-6540935279 [1,0,0,0,0,0|2,0,1]=4 425 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-4000770618 [1,0,0,0,0,0|1,0,1]=3 426 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-5775312784 [1,0,0,0,0,0|1,0,1]=3 427 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-6259961704 [1,0,0,0,0,0|1,0,1]=3 428 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-9871958374 [1,0,0,0,0,0|1,0,1]=3 429 B7R0.5 NCC[C@@H](O)C(=O)O MCULE-9726912888 [1,0,0,0,0,0|2,0,1]=4 430 B7R0.5 NCC[C@H](N)C(=O)O MCULE-1745978456 [1,0,0,0,0,0|1,0,1]=3 431 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3856066353 [1,0,0,0,0,0|1,0,1]=3 432 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3919721317 [1,0,0,0,0,0|1,0,1]=3 433 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5434373726 [1,0,0,0,0,0|1,0,1]=3 434 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5992578597 [1,0,0,0,0,0|1,0,1]=3 435 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6536533546 [1,0,0,0,0,0|1,0,1]=3 436 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6978035806 [1,0,0,0,0,0|1,0,1]=3 437 B7R0.5 NCC[C@H](N)C(=O)O MCULE-8762011291 [1,0,0,0,0,0|1,0,1]=3 438 B7R0.5 NCC[C@H](N)C(=O)O MCULE-9645608127 [1,0,0,0,0,0|1,0,1]=3 439 B7R0.5 NCC[C@H](O)C(=O)O MCULE-3296998083 [1,0,0,0,0,0|2,0,1]=4 440 B7R0.5 NCC[C@H](O)C(=O)O MCULE-7901866019 [1,0,0,0,0,0|2,0,1]=4 441 B7R0.5 NOC[C@H](N)C(=O)O MCULE-1050292176 [1,0,0,0,0,0|2,0,0]=3 442 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2388269464 [1,0,0,0,0,0|1,0,1]=3 443 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2456796412 [1,0,0,0,0,0|1,0,1]=3 444 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-6229782603 [1,0,0,0,0,0|1,0,1]=3 445 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-8123446168 [1,0,0,0,0,0|1,0,1]=3 446 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-2370353784 [1,0,0,0,0,0|0,0,1]=2 447 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-4861747928 [1,0,0,0,0,0|0,0,1]=2 448 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-4021115723 [1,0,0,0,0,0|0,1,1]=3 449 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-7661321953 [1,0,0,0,0,0|0,1,1]=3 450 B7R0.5 N[C@@H](CSS)C(=O)O MCULE-3029500977 [1,0,0,0,0,0|1,1,0]=3 451 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-1975650690 [1,0,0,0,0,0|1,0,1]=3 452 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-7245104465 [1,0,0,0,0,0|1,0,1]=3 453 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8005652100 [1,0,0,0,0,0|0,0,1]=2 454 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8613625039 [1,0,0,0,0,0|0,0,1]=2 455 B7R0.5 N[C@H](CCS)C(=O)O MCULE-1110046008 [1,0,0,0,0,0|0,1,1]=3 456 B7R0.5 N[C@H](CCS)C(=O)O MCULE-7556963357 [1,0,0,0,0,0|0,1,1]=3 457 B7R0.5 O=C(O)C(Br)CCBr MCULE-3091819269 [1,0,0,0,0,0|2,0,1]=4 458 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [1,0,0,0,0,0|1,0,1]=3 459 B7R0.5 [C@H](N)(CC#C)C(=O)O MCULE-7308061694 [1,0,0,0,0,0|1,0,1]=3 460 B7R0.6 C=C(Br)CCC(=O)O MCULE-5257916083 [1,0,0,0,0,0|2,0,0]=3 461 B7R0.6 C=C(C)CCC(=O)C MCULE-4201277876 [1,0,0,0,0,0|3,0,0]=4 462 B7R0.6 C=C(C)CCC(=O)N MCULE-7602727888 [1,0,0,0,0,0|3,0,0]=4 463 B7R0.6 C=C(C)CCC(=O)O MCULE-8738532812 [1,0,0,0,0,0|2,0,0]=3 464 B7R0.6 C=C(C)NCC(=O)O MCULE-6347105994 [1,0,0,0,0,0|3,0,0]=4 465 B7R0.6 C=C(Cl)CCC(=O)O MCULE-8617886776 [1,0,0,0,0,0|2,0,0]=3 466 B7R0.6 CC(=CCC(=O)O)C MCULE-2552993418 [1,0,0,0,0,0|2,0,1]=4 467 B7R0.6 CC(=O)/C=C/C(=O)O MCULE-8768861026 [1,0,0,0,0,0|1,0,2]=4 468 B7R0.6 CC(=O)C=CC(=O)O MCULE-6867353277 [1,0,0,0,0,0|1,0,2]=4 469 B7R0.6 CC(=O)CCC(=O)C MCULE-3166810473 [1,0,0,0,0,0|2,0,0]=3 470 B7R0.6 CC(=O)CCC(=O)N MCULE-8943258659 [1,0,0,0,0,0|2,0,0]=3 471 B7R0.6 CC(=O)CCC(=O)O MCULE-1392778065 [1,0,0,0,0,0|1,0,0]=2 472 B7R0.6 CC(=O)CCC(=O)[O-] MCULE-4975344808 [1,0,0,0,0,0|1,0,1]=3 473 B7R0.6 CC(=O)CCN(=O)=O MCULE-4726243654 [1,0,0,0,0,0|2,0,1]=4 474 B7R0.6 CC(=O)CNC(=O)C MCULE-7941086302 [1,0,0,0,0,0|3,0,0]=4 475 B7R0.6 CC(=O)CNC(=O)Cl MCULE-2043888982 [1,0,0,0,0,0|3,0,0]=4 476 B7R0.6 CC(=O)COC(=O)C MCULE-2994552521 [1,0,0,0,0,0|3,0,0]=4 477 B7R0.6 CC(=O)NCC(=O)Cl MCULE-3900899057 [1,0,0,0,0,0|3,0,0]=4 478 B7R0.6 CC(=O)NCC(=O)N MCULE-7934502236 [1,0,0,0,0,0|3,0,0]=4 479 B7R0.6 CC(=O)NCC(=O)O MCULE-5811325186 [1,0,0,0,0,0|2,0,0]=3 480 B7R0.6 CC(=O)OCC(=O)Cl MCULE-3086938222 [1,0,0,0,0,0|3,0,0]=4 481 B7R0.6 CC(=O)OCC(=O)O MCULE-6837320824 [1,0,0,0,0,0|2,0,0]=3 482 B7R0.6 CC(=O)SCC(=O)O MCULE-1974657694 [1,0,0,0,0,0|2,0,0]=3 483 B7R0.6 CC(=S)NCC(=O)O MCULE-9052571833 [1,0,0,0,0,0|2,1,0]=4 484 B7R0.6 CC(C)CCC(=O)O MCULE-7691755837 [1,0,0,0,0,0|2,0,1]=4 485 B7R0.6 CC(N)CCC(=O)O MCULE-3711689460 [1,0,0,0,0,0|2,0,1]=4 486 B7R0.6 CC(N)CCC(=O)O MCULE-5008572656 [1,0,0,0,0,0|2,0,1]=4 487 B7R0.6 CC(O)CCC(=O)O MCULE-6352217997 [1,0,0,0,0,0|1,0,1]=3 488 B7R0.6 CC(O)CCC(=O)[O-] MCULE-5872581098 [1,0,0,0,0,0|1,0,2]=4 489 B7R0.6 CC(S)CCC(=O)O MCULE-9612173883 [1,0,0,0,0,0|1,1,1]=4 490 B7R0.6 CN(C)CCC(=O)O MCULE-5553815845 [1,0,0,0,0,0|3,0,0]=4 491 B7R0.6 CN(C)CCC(=O)O MCULE-7454823322 [1,0,0,0,0,0|3,0,0]=4 492 B7R0.6 CS(=O)CCC(=O)O MCULE-8243349779 [1,0,0,0,0,0|2,0,0]=3 493 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-3295260637 [1,0,0,0,0,0|2,0,1]=4 494 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-5409083898 [1,0,0,0,0,0|2,0,1]=4 495 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-6530230723 [1,0,0,0,0,0|2,0,1]=4 496 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-7530095699 [1,0,0,0,0,0|2,0,1]=4 497 B7R0.6 C[C@@H](O)COC(=O)O MCULE-3794886346 [1,0,0,0,0,0|2,0,1]=4 498 B7R0.6 C[C@H](N)CCC(=O)O MCULE-3621527632 [1,0,0,0,0,0|2,0,1]=4 499 B7R0.6 C[C@H](N)CCC(=O)O MCULE-7670557122 [1,0,0,0,0,0|2,0,1]=4 500 B7R0.6 C[S+](C)CCC(=O)O MCULE-8115187503 [1,0,0,0,0,0|3,0,0]=4 501 B7R0.6 C[S+](C)CCC(=O)O MCULE-9668037011 [1,0,0,0,0,0|3,0,0]=4 502 B7R0.6 N=C(N)NCC(=O)O MCULE-8180759180 [1,0,0,0,0,0|3,0,0]=4 503 B7R0.6 N=C(N)NCC(=O)O MCULE-8327589872 [1,0,0,0,0,0|3,0,0]=4 504 B7R0.6 N=C(N)SCC(=O)O MCULE-2089510220 [1,0,0,0,0,0|3,0,0]=4 505 B7R0.6 N=C(N)SCC(=O)O MCULE-3427937751 [1,0,0,0,0,0|3,0,0]=4 506 B7R0.6 NC(=O)/C=C/C(=O)O MCULE-4042951919 [1,0,0,0,0,0|1,0,2]=4 507 B7R0.6 NC(=O)/C=C\C(=O)O MCULE-9066996879 [1,0,0,0,0,0|1,0,2]=4 508 B7R0.6 NC(=O)C=CC(=O)O MCULE-2401877342 [1,0,0,0,0,0|1,0,2]=4 509 B7R0.6 NC(=O)CCC(=O)N MCULE-2107382817 [1,0,0,0,0,0|2,0,0]=3 510 B7R0.6 NC(=O)CCC(=O)O MCULE-5813999826 [1,0,0,0,0,0|1,0,0]=2 511 B7R0.6 NC(=O)NCC(=O)O MCULE-7640310218 [1,0,0,0,0,0|2,0,0]=3 512 B7R0.6 NC(=O)SCC(=O)O MCULE-2409074226 [1,0,0,0,0,0|2,0,0]=3 513 B7R0.6 NC(=S)NCC(=O)O MCULE-7421473219 [1,0,0,0,0,0|2,1,0]=4 514 B7R0.6 O=C(Cl)CCC(=O)Cl MCULE-6220065982 [1,0,0,0,0,0|2,0,0]=3 515 B7R0.6 O=C(O)/C=C/C(=O)O MCULE-3549142744 [1,0,0,0,0,0|0,0,2]=3 516 B7R0.6 O=C(O)/C=C/C(=O)O MCULE-5263906793 [1,0,0,0,0,0|0,0,2]=3 517 B7R0.6 O=C(O)/C=C\C(=O)O MCULE-1113222985 [1,0,0,0,0,0|0,0,2]=3 518 B7R0.6 O=C(O)C#CC(=O)O MCULE-3952041688 [1,0,0,0,0,0|0,0,2]=3 519 B7R0.6 O=C(O)C=CC(=O)O MCULE-5329407890 [1,0,0,0,0,0|0,0,2]=3 520 B7R0.6 O=C(O)C=CC(=O)O MCULE-7492596773 [1,0,0,0,0,0|0,0,2]=3 521 B7R0.6 O=C(O)C=CC(=O)O MCULE-8076793268 [1,0,0,0,0,0|0,0,2]=3 522 B7R0.6 O=C(O)C=CC(=O)O MCULE-9488315563 [1,0,0,0,0,0|0,0,2]=3 523 B7R0.6 O=C(O)C=CC(=O)O MCULE-9920754312 [1,0,0,0,0,0|0,0,2]=3 524 B7R0.6 O=C(O)CCB(O)O MCULE-9351023222 [1,0,0,0,0,0|1,0,1]=3 525 B7R0.6 O=C(O)CCC(=O)O MCULE-1233211613 [1,0,0,0,0,0|0,0,0]=1 526 B7R0.6 O=C(O)CCC(=O)O MCULE-5889111640 [1,0,0,0,0,0|0,0,0]=1 527 B7R0.6 O=C(O)CCC(F)F MCULE-6002651269 [1,0,0,0,0,0|2,0,1]=4 528 B7R0.6 O=C(O)CCN(=O)=O MCULE-1879231817 [1,0,0,0,0,0|1,0,1]=3 529 B7R0.6 O=C(O)N=NC(=O)O MCULE-6858626658 [1,0,0,0,0,0|2,0,0]=3 530 B7R0.6 O=C([O-])C#CC(=O)O MCULE-8275918466 [1,0,0,0,0,0|0,0,3]=4 531 B7R0.6 O=C([O-])CCC(=O)O MCULE-9149947862 [1,0,0,0,0,0|0,0,1]=2 532 B7R0.6 O=C([O-])CCC(=O)[O-] MCULE-6304944077 [1,0,0,0,0,0|0,0,2]=3 533 B9R0.10 CC(C)(C)C(N)CC(=O)O MCULE-6654125396 [0,1,0,0,0,0|2,0,1]=4 534 B9R0.10 CC(C)(C)C(N)CC(=O)O MCULE-6842051841 [0,1,0,0,0,0|2,0,1]=4 535 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O MCULE-5408253054 [0,1,0,0,0,0|2,0,1]=4 536 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O MCULE-6704022659 [0,1,0,0,0,0|2,0,1]=4 537 B9R0.10 CC(C)(C)[C@H](N)CC(=O)O MCULE-4579899518 [0,1,0,0,0,0|2,0,1]=4 538 B9R0.10 CC(C)(C)[C@H](N)CC(=O)O MCULE-4645205176 [0,1,0,0,0,0|2,0,1]=4 539 B9R0.10 CC(CC(=O)O)C(C)(C)O MCULE-5216715591 [0,1,0,0,0,0|2,0,1]=4 540 B9R0.10 NC(CC(=O)O)C(F)(F)F MCULE-1895408699 [0,1,0,0,0,0|2,0,1]=4 541 B9R0.10 NC(CC(=O)O)C(F)(F)F MCULE-8626766835 [0,1,0,0,0,0|2,0,1]=4 542 B9R0.10 NC(CC(=O)O)C(F)(F)F MCULE-9145718434 [0,1,0,0,0,0|2,0,1]=4 543 B9R0.10 N[C@@H](CC(=O)O)C(F)(F)F MCULE-7887087837 [0,1,0,0,0,0|2,0,1]=4 544 B9R0.10 N[C@@H](CC(=O)O)C(F)(F)F MCULE-8616386693 [0,1,0,0,0,0|2,0,1]=4 545 B9R0.10 N[C@H](CC(=O)O)C(F)(F)F MCULE-3328223896 [0,1,0,0,0,0|2,0,1]=4 546 B9R0.10 N[C@H](CC(=O)O)C(F)(F)F MCULE-8617897331 [0,1,0,0,0,0|2,0,1]=4 547 B9R0.10 [C@@H](N)(CC(=O)O)C(C)(C)C MCULE-5327849230 [0,1,0,0,0,0|2,0,1]=4 548 B9R0.11 C=C(C)C(C)(N)CC(=O)O MCULE-2432744381 [0,1,0,0,0,0|2,0,0]=3 549 B9R0.11 C=C(C)C(C)(N)CC(=O)O MCULE-7800105371 [0,1,0,0,0,0|2,0,0]=3 550 B9R0.11 C=C(C)CC(C)(C)C(=O)O MCULE-2137357994 [0,1,0,0,0,0|3,0,0]=4 551 B9R0.11 CC(=O)C(C)(C)CC(=O)O MCULE-3797968347 [0,1,0,0,0,0|2,0,0]=3 552 B9R0.11 CC(=O)CC(C)(C)C(=O)O MCULE-3548808704 [0,1,0,0,0,0|2,0,0]=3 553 B9R0.11 CC(=O)NC(C)(C)C(=O)O MCULE-7910205661 [0,1,0,0,0,0|3,0,0]=4 554 B9R0.11 CC(=O)OC(C)(C)C(=O)O MCULE-7786541244 [0,1,0,0,0,0|3,0,0]=4 555 B9R0.11 CC(C)(CC(=O)O)C(=O)O MCULE-7005043054 [0,1,0,0,0,0|1,0,0]=2 556 B9R0.11 CC(C)(NC(=O)N)C(=O)O MCULE-3780805662 [0,1,0,0,0,0|3,0,0]=4 557 B9R0.11 CC(C)CC(C)(N)C(=O)O MCULE-4257632982 [0,1,0,0,0,0|2,0,1]=4 558 B9R0.11 CC(C)CC(C)(N)C(=O)O MCULE-6991659149 [0,1,0,0,0,0|2,0,1]=4 559 B9R0.11 CC(C)C[C@@](C)(N)C(=O)O MCULE-4712290479 [0,1,0,0,0,0|2,0,1]=4 560 B9R0.11 CC(C)C[C@@](C)(N)C(=O)O MCULE-9085844136 [0,1,0,0,0,0|2,0,1]=4 561 B9R0.11 CC(C)C[C@](C)(N)C(=O)O MCULE-6073129801 [0,1,0,0,0,0|2,0,1]=4 562 B9R0.11 CC(C)C[C@](C)(N)C(=O)O MCULE-7162987343 [0,1,0,0,0,0|2,0,1]=4 563 B9R0.11 CC(F)(NC(=O)N)C(=O)O MCULE-5893224532 [0,1,0,0,0,0|3,0,0]=4 564 B9R0.11 CC(N)(CC(=O)O)C(=O)O MCULE-3390093551 [0,1,0,0,0,0|0,0,0]=1 565 B9R0.11 CC(N)(CC(=O)O)C(=O)O MCULE-4137717341 [0,1,0,0,0,0|0,0,0]=1 566 B9R0.11 CC(O)(CC(=O)O)C(=O)O MCULE-8670926890 [0,1,0,0,0,0|1,0,0]=2 567 B9R0.11 CN(C)CC(C)(N)C(=O)O MCULE-4857565953 [0,1,0,0,0,0|3,0,0]=4 568 B9R0.11 C[C@@](N)(CC(=O)O)C(=O)O MCULE-5803003392 [0,1,0,0,0,0|0,0,0]=1 569 B9R0.11 C[C@@](N)(CC(=O)O)C(=O)O MCULE-7987571569 [0,1,0,0,0,0|0,0,0]=1 570 B9R0.11 C[C@](N)(CC(=O)N)C(=O)O MCULE-5803295303 [0,1,0,0,0,0|1,0,0]=2 571 B9R0.11 C[C@](N)(CC(=O)N)C(=O)O MCULE-9662132548 [0,1,0,0,0,0|1,0,0]=2 572 B9R0.11 C[C@](N)(CC(=O)O)C(=O)O MCULE-4314292616 [0,1,0,0,0,0|0,0,0]=1 573 B9R0.11 C[C@](O)(CC(=O)O)C(=O)O MCULE-1934088864 [0,1,0,0,0,0|1,0,0]=2 574 B9R0.11 O=C(O)CC(F)(F)C(=O)O MCULE-7706048377 [0,1,0,0,0,0|1,0,0]=2 575 B9R0.11 O=C(O)CC(S)(S)C(=O)O MCULE-7344489814 [0,1,0,0,0,0|1,0,0]=2 576 B9R0.23 C(N)(CC(=O)O)C(=O)OC MCULE-3786901582 [0,1,0,0,0,0|0,0,0]=1 577 B9R0.23 C=C(C)CC(N)C(=O)OC MCULE-2770411625 [0,1,0,0,0,0|2,0,0]=3 578 B9R0.23 C=C(CC(=O)O)C(=O)OC MCULE-6964816559 [0,1,0,0,0,0|1,0,1]=3 579 B9R0.23 C=CC(=O)N(C)CC(=O)O MCULE-9771391783 [0,1,0,0,0,0|3,0,0]=4 580 B9R0.23 CCC(=O)N(C)CC(=O)O MCULE-1259899510 [0,1,0,0,0,0|3,0,0]=4 581 B9R0.23 CCC(C)C(N)CC(=O)O MCULE-4327977098 [0,1,0,0,0,0|2,0,1]=4 582 B9R0.23 CCC(C)C(N)CC(=O)O MCULE-9731178196 [0,1,0,0,0,0|2,0,1]=4 583 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-3497593262 [0,1,0,0,0,0|2,0,1]=4 584 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-4155901879 [0,1,0,0,0,0|2,0,1]=4 585 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-8221314475 [0,1,0,0,0,0|2,0,1]=4 586 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-9196761404 [0,1,0,0,0,0|2,0,1]=4 587 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O MCULE-2430009158 [0,1,0,0,0,0|2,0,1]=4 588 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O MCULE-9647386489 [0,1,0,0,0,0|2,0,1]=4 589 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-2618743733 [0,1,0,0,0,0|2,0,1]=4 590 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-5773439736 [0,1,0,0,0,0|2,0,1]=4 591 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-6590436922 [0,1,0,0,0,0|2,0,1]=4 592 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-9722049324 [0,1,0,0,0,0|2,0,1]=4 593 B9R0.23 CN(CC(=O)O)C(=O)CCl MCULE-5510442150 [0,1,0,0,0,0|3,0,0]=4 594 B9R0.23 CN(CC(=O)O)C(=O)CN MCULE-9356220331 [0,1,0,0,0,0|3,0,0]=4 595 B9R0.23 COC(=O)/C(=C/C(=O)O)/Br MCULE-9236300450 [0,1,0,0,0,0|1,0,2]=4 596 B9R0.23 COC(=O)C(=CC(=O)O)Br MCULE-7067392588 [0,1,0,0,0,0|1,0,2]=4 597 B9R0.23 COC(=O)C(=O)CC(=O)C MCULE-8074026108 [0,1,0,0,0,0|2,0,1]=4 598 B9R0.23 COC(=O)C(C)CC(=O)C MCULE-2131243248 [0,1,0,0,0,0|2,0,0]=3 599 B9R0.23 COC(=O)C(C)CC(=O)O MCULE-5268313344 [0,1,0,0,0,0|1,0,0]=2 600 B9R0.23 COC(=O)C(C)CS(=O)[O-] MCULE-6308173188 [0,1,0,0,0,0|2,0,1]=4 601 B9R0.23 COC(=O)C(C)CS(=O)[O-] MCULE-6522031658 [0,1,0,0,0,0|2,0,1]=4 602 B9R0.23 COC(=O)C(C)NC(=O)C MCULE-7499205437 [0,1,0,0,0,0|3,0,0]=4 603 B9R0.23 COC(=O)C(C)NC(=O)C MCULE-9931125485 [0,1,0,0,0,0|3,0,0]=4 604 B9R0.23 COC(=O)C(C)OC(=O)C MCULE-7908136641 [0,1,0,0,0,0|3,0,0]=4 605 B9R0.23 COC(=O)C(N)CC(=O)N MCULE-1752536252 [0,1,0,0,0,0|1,0,0]=2 606 B9R0.23 COC(=O)C(N)CC(=O)N MCULE-5054924778 [0,1,0,0,0,0|1,0,0]=2 607 B9R0.23 COC(=O)C(N)CC(=O)O MCULE-7519781259 [0,1,0,0,0,0|0,0,0]=1 608 B9R0.23 COC(=O)C(N)CC(C)C MCULE-1433046496 [0,1,0,0,0,0|2,0,1]=4 609 B9R0.23 COC(=O)C(N)CC(C)C MCULE-1553759943 [0,1,0,0,0,0|2,0,1]=4 610 B9R0.23 COC(=O)C(N)CC(C)C MCULE-4557025081 [0,1,0,0,0,0|2,0,1]=4 611 B9R0.23 COC(=O)C(N)CC(C)C MCULE-8510501543 [0,1,0,0,0,0|2,0,1]=4 612 B9R0.23 COC(=O)C(N)CC(F)F MCULE-3550560326 [0,1,0,0,0,0|2,0,1]=4 613 B9R0.23 COC(=O)C(N)CC(F)F MCULE-5671328379 [0,1,0,0,0,0|2,0,1]=4 614 B9R0.23 COC(=O)C(N)CN(C)C MCULE-3941198962 [0,1,0,0,0,0|3,0,0]=4 615 B9R0.23 COC(=O)C(N)CN(C)C MCULE-4688594748 [0,1,0,0,0,0|3,0,0]=4 616 B9R0.23 COC(=O)N(C)CC(=O)O MCULE-6066208018 [0,1,0,0,0,0|2,0,0]=3 617 B9R0.23 COC(=O)[C@@H](C)CC(=O)O MCULE-8145746541 [0,1,0,0,0,0|1,0,0]=2 618 B9R0.23 COC(=O)[C@@H](C)NC(=O)C MCULE-3683972950 [0,1,0,0,0,0|3,0,0]=4 619 B9R0.23 COC(=O)[C@@H](C)NC(=O)C MCULE-9078107491 [0,1,0,0,0,0|3,0,0]=4 620 B9R0.23 COC(=O)[C@@H](N)CC(=O)N MCULE-2903193624 [0,1,0,0,0,0|1,0,0]=2 621 B9R0.23 COC(=O)[C@@H](N)CC(=O)N MCULE-3686406545 [0,1,0,0,0,0|1,0,0]=2 622 B9R0.23 COC(=O)[C@@H](N)CC(=O)N MCULE-3726434187 [0,1,0,0,0,0|1,0,0]=2 623 B9R0.23 COC(=O)[C@@H](N)CC(=O)N MCULE-9719605200 [0,1,0,0,0,0|1,0,0]=2 624 B9R0.23 COC(=O)[C@@H](N)CC(=O)O MCULE-2094999701 [0,1,0,0,0,0|0,0,0]=1 625 B9R0.23 COC(=O)[C@@H](N)CC(=O)O MCULE-9407721038 [0,1,0,0,0,0|0,0,0]=1 626 B9R0.23 COC(=O)[C@@H](N)CC(C)C MCULE-1309132346 [0,1,0,0,0,0|2,0,1]=4 627 B9R0.23 COC(=O)[C@@H](N)CC(C)C MCULE-6938469474 [0,1,0,0,0,0|2,0,1]=4 628 B9R0.23 COC(=O)[C@@H](N)CC(C)C MCULE-7583568111 [0,1,0,0,0,0|2,0,1]=4 629 B9R0.23 COC(=O)[C@@H](N)CC(C)C MCULE-7793954010 [0,1,0,0,0,0|2,0,1]=4 630 B9R0.23 COC(=O)[C@@H](N)CC(F)F MCULE-3708128404 [0,1,0,0,0,0|2,0,1]=4 631 B9R0.23 COC(=O)[C@@H](O)CC(=O)O MCULE-4149383309 [0,1,0,0,0,0|1,0,0]=2 632 B9R0.23 COC(=O)[C@@H](O)CC(=O)O MCULE-4834047702 [0,1,0,0,0,0|1,0,0]=2 633 B9R0.23 COC(=O)[C@H](C)NC(=O)C MCULE-9272877417 [0,1,0,0,0,0|3,0,0]=4 634 B9R0.23 COC(=O)[C@H](C)NC(=O)C MCULE-9675191541 [0,1,0,0,0,0|3,0,0]=4 635 B9R0.23 COC(=O)[C@H](C)OC(=O)C MCULE-7231856462 [0,1,0,0,0,0|3,0,0]=4 636 B9R0.23 COC(=O)[C@H](C)OC(=O)C MCULE-9967813219 [0,1,0,0,0,0|3,0,0]=4 637 B9R0.23 COC(=O)[C@H](N)CC(=O)N MCULE-3007207072 [0,1,0,0,0,0|1,0,0]=2 638 B9R0.23 COC(=O)[C@H](N)CC(=O)N MCULE-3103219361 [0,1,0,0,0,0|1,0,0]=2 639 B9R0.23 COC(=O)[C@H](N)CC(=O)N MCULE-6097450650 [0,1,0,0,0,0|1,0,0]=2 640 B9R0.23 COC(=O)[C@H](N)CC(=O)N MCULE-7427879831 [0,1,0,0,0,0|1,0,0]=2 641 B9R0.23 COC(=O)[C@H](N)CC(=O)O MCULE-1453787543 [0,1,0,0,0,0|0,0,0]=1 642 B9R0.23 COC(=O)[C@H](N)CC(=O)O MCULE-8348108837 [0,1,0,0,0,0|0,0,0]=1 643 B9R0.23 COC(=O)[C@H](N)CC(=O)O MCULE-8725707708 [0,1,0,0,0,0|0,0,0]=1 644 B9R0.23 COC(=O)[C@H](N)CC(C)C MCULE-2152247835 [0,1,0,0,0,0|2,0,1]=4 645 B9R0.23 COC(=O)[C@H](N)CC(C)C MCULE-2779062182 [0,1,0,0,0,0|2,0,1]=4 646 B9R0.23 COC(=O)[C@H](N)CC(C)C MCULE-7100635788 [0,1,0,0,0,0|2,0,1]=4 647 B9R0.23 COC(=O)[C@H](N)CC(C)C MCULE-8729140960 [0,1,0,0,0,0|2,0,1]=4 648 B9R0.23 COC(=O)[C@H](N)CC(F)F MCULE-9898046452 [0,1,0,0,0,0|2,0,1]=4 649 B9R0.23 COC(=O)[C@H](O)CC(=O)O MCULE-2124989741 [0,1,0,0,0,0|1,0,0]=2 650 B9R0.23 COC(=O)[C@H](O)CC(=O)O MCULE-9803650256 [0,1,0,0,0,0|1,0,0]=2 651 B9R0.23 O=C(O)CC(Br)C(=O)CBr MCULE-5319460867 [0,1,0,0,0,0|2,0,0]=3 652 B9R0.23 O=C(O)C[C@@H](O)[C@@H](O)CO MCULE-5394522095 [0,1,0,0,0,0|1,0,2]=4 653 B9R0.23 O=C(O)C[C@H](O)[C@H](O)CO MCULE-2704229472 [0,1,0,0,0,0|1,0,2]=4 654 B9R0.23 [C@H](N)(CC(=O)O)C(=O)OC MCULE-3013306674 [0,1,0,0,0,0|0,0,0]=1 655 B9R0.39 CC(=O)NC(CO)C(=O)O MCULE-1309560741 [0,1,0,0,0,0|3,0,0]=4 656 B9R0.39 CC(=O)NC(CS)C(=O)O MCULE-6378320219 [0,1,0,0,0,0|3,0,0]=4 657 B9R0.39 CC(=O)NC(CS)C(=O)O MCULE-8740981134 [0,1,0,0,0,0|3,0,0]=4 658 B9R0.39 CC(=O)N[C@@H](CO)C(=O)O MCULE-1874809708 [0,1,0,0,0,0|3,0,0]=4 659 B9R0.39 CC(=O)N[C@@H](CO)C(=O)O MCULE-6388016375 [0,1,0,0,0,0|3,0,0]=4 660 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O MCULE-3293270590 [0,1,0,0,0,0|3,0,0]=4 661 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O MCULE-8632971295 [0,1,0,0,0,0|3,0,0]=4 662 B9R0.39 CC(=O)N[C@H](CO)C(=O)O MCULE-3723348697 [0,1,0,0,0,0|3,0,0]=4 663 B9R0.39 CC(=O)N[C@H](CS)C(=O)O MCULE-2338539483 [0,1,0,0,0,0|3,0,0]=4 664 B9R0.39 CC(=O)N[C@H](CS)C(=O)O MCULE-7287452762 [0,1,0,0,0,0|3,0,0]=4 665 B9R0.39 CC(C)CC(CN)C(=O)O MCULE-3679366313 [0,1,0,0,0,0|2,0,1]=4 666 B9R0.39 CC(C)CC(CN)C(=O)O MCULE-4357118038 [0,1,0,0,0,0|2,0,1]=4 667 B9R0.39 CC(C)CC(CN)C(=O)O MCULE-5464779902 [0,1,0,0,0,0|2,0,1]=4 668 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-1199418849 [0,1,0,0,0,0|2,0,1]=4 669 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-2007636867 [0,1,0,0,0,0|2,0,1]=4 670 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-3151357434 [0,1,0,0,0,0|2,0,1]=4 671 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-6826376648 [0,1,0,0,0,0|2,0,1]=4 672 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-1897946062 [0,1,0,0,0,0|2,0,1]=4 673 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-5204739284 [0,1,0,0,0,0|2,0,1]=4 674 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-5587093761 [0,1,0,0,0,0|2,0,1]=4 675 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-6247275234 [0,1,0,0,0,0|2,0,1]=4 676 B9R0.39 CC=C(CC(=O)O)C(=O)O MCULE-9255608800 [0,1,0,0,0,0|1,0,1]=3 677 B9R0.39 CCC(CC(=O)Cl)C(=O)Cl MCULE-4134104716 [0,1,0,0,0,0|3,0,0]=4 678 B9R0.39 CCC(CC(=O)O)C(=O)O MCULE-6275256194 [0,1,0,0,0,0|1,0,0]=2 679 B9R0.39 CCC(NC(=O)C)C(=O)O MCULE-1309294109 [0,1,0,0,0,0|3,0,0]=4 680 B9R0.39 CCC(NC(=O)C)C(=O)O MCULE-9698129539 [0,1,0,0,0,0|3,0,0]=4 681 B9R0.39 CCC(NC(=O)N)C(=O)O MCULE-1973871135 [0,1,0,0,0,0|3,0,0]=4 682 B9R0.39 CC[C@@H](NC(=O)C)C(=O)O MCULE-4606830483 [0,1,0,0,0,0|3,0,0]=4 683 B9R0.39 CC[C@@H](NC(=O)C)C(=O)O MCULE-7396715663 [0,1,0,0,0,0|3,0,0]=4 684 B9R0.39 CNC(CC(=O)O)C(=O)O MCULE-5049531079 [0,1,0,0,0,0|0,0,0]=1 685 B9R0.39 CNC(CC(C)C)C(=O)O MCULE-4940999271 [0,1,0,0,0,0|2,0,1]=4 686 B9R0.39 CNC(CC(C)C)C(=O)O MCULE-7266045564 [0,1,0,0,0,0|2,0,1]=4 687 B9R0.39 CN[C@@H](CC(=O)N)C(=O)O MCULE-2449462396 [0,1,0,0,0,0|1,0,0]=2 688 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-4725692041 [0,1,0,0,0,0|0,0,0]=1 689 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-6356483886 [0,1,0,0,0,0|0,0,0]=1 690 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-9428412153 [0,1,0,0,0,0|0,0,0]=1 691 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-2758691344 [0,1,0,0,0,0|2,0,1]=4 692 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-3349649810 [0,1,0,0,0,0|2,0,1]=4 693 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-4487326533 [0,1,0,0,0,0|2,0,1]=4 694 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-7740057854 [0,1,0,0,0,0|2,0,1]=4 695 B9R0.39 CN[C@H](CC(=O)N)C(=O)O MCULE-2092394249 [0,1,0,0,0,0|1,0,0]=2 696 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-1405442072 [0,1,0,0,0,0|0,0,0]=1 697 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-8611804669 [0,1,0,0,0,0|0,0,0]=1 698 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-9080466863 [0,1,0,0,0,0|0,0,0]=1 699 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2279011654 [0,1,0,0,0,0|2,0,1]=4 700 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2290136385 [0,1,0,0,0,0|2,0,1]=4 701 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2552934491 [0,1,0,0,0,0|2,0,1]=4 702 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-8319051174 [0,1,0,0,0,0|2,0,1]=4 703 B9R0.39 COC(CC(=O)O)C(=O)O MCULE-3778948045 [0,1,0,0,0,0|1,0,0]=2 704 B9R0.39 NC(=O)NC(CO)C(=O)O MCULE-8322024012 [0,1,0,0,0,0|3,0,0]=4 705 B9R0.39 NC(=O)NC(CS)C(=O)O MCULE-3558033323 [0,1,0,0,0,0|3,0,0]=4 706 B9R0.39 NC(=O)N[C@@H](CS)C(=O)O MCULE-9735857877 [0,1,0,0,0,0|3,0,0]=4 707 B9R0.39 NCC(CC(=O)O)C(=O)O MCULE-1683659350 [0,1,0,0,0,0|0,0,0]=1 708 B9R0.39 NCC(CC(=O)O)C(=O)O MCULE-8428141166 [0,1,0,0,0,0|0,0,0]=1 709 B9R0.39 NCC(CC(=O)O)C(F)F MCULE-2405781497 [0,1,0,0,0,0|2,0,1]=4 710 B9R0.39 NCC(CC(=O)O)C(F)F MCULE-7311956768 [0,1,0,0,0,0|2,0,1]=4 711 B9R0.39 NCN(CC(=O)O)C(=O)O MCULE-9677383798 [0,1,0,0,0,0|1,0,0]=2 712 B9R0.39 O=C(O)CC(CS)C(=O)O MCULE-7352825049 [0,1,0,0,0,0|1,0,0]=2 713 B9R0.42 C(N)(CC(=O)OC)C(=O)O MCULE-8015036052 [0,1,0,0,0,0|0,0,0]=1 714 B9R0.42 C=C(CC(=O)NC)C(=O)O MCULE-5432016245 [0,1,0,0,0,0|2,0,1]=4 715 B9R0.42 C=C(CC(=O)OC)C(=O)O MCULE-1728748664 [0,1,0,0,0,0|1,0,1]=3 716 B9R0.42 C=CC(=O)NC(O)C(=O)O MCULE-6399920412 [0,1,0,0,0,0|3,0,0]=4 717 B9R0.42 CC(CO)CC(N)C(=O)O MCULE-1659842949 [0,1,0,0,0,0|1,0,1]=3 718 B9R0.42 CC(NC(=O)CCl)C(=O)O MCULE-6899086052 [0,1,0,0,0,0|3,0,0]=4 719 B9R0.42 CC(NC(=O)CN)C(=O)O MCULE-2027405418 [0,1,0,0,0,0|3,0,0]=4 720 B9R0.42 CCC(=O)CC(N)C(=O)O MCULE-7167843152 [0,1,0,0,0,0|1,0,0]=2 721 B9R0.42 CCC(=O)CC(N)C(=O)O MCULE-9225518491 [0,1,0,0,0,0|1,0,0]=2 722 B9R0.42 CCC(=O)NC(C)C(=O)O MCULE-5488194337 [0,1,0,0,0,0|3,0,0]=4 723 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O MCULE-5552061501 [0,1,0,0,0,0|3,0,0]=4 724 B9R0.42 CCC(C)CC(N)C(=O)O MCULE-1321158720 [0,1,0,0,0,0|2,0,1]=4 725 B9R0.42 CCC(C)CC(N)C(=O)O MCULE-9833457318 [0,1,0,0,0,0|2,0,1]=4 726 B9R0.42 CNC(=O)CC(N)C(=O)O MCULE-1910017583 [0,1,0,0,0,0|1,0,0]=2 727 B9R0.42 CNC(=O)CC(N)C(=O)O MCULE-2273353640 [0,1,0,0,0,0|1,0,0]=2 728 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O MCULE-6316771422 [0,1,0,0,0,0|1,0,0]=2 729 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O MCULE-8833942582 [0,1,0,0,0,0|1,0,0]=2 730 B9R0.42 CNC(=O)C[C@H](N)C(=O)O MCULE-7953918935 [0,1,0,0,0,0|1,0,0]=2 731 B9R0.42 CNC(=O)C[C@H](N)C(=O)O MCULE-9595811834 [0,1,0,0,0,0|1,0,0]=2 732 B9R0.42 COC(=O)C=C(N)C(=O)N MCULE-5883616486 [0,1,0,0,0,0|1,0,2]=4 733 B9R0.42 COC(=O)CC(=O)C(=O)O MCULE-5008305161 [0,1,0,0,0,0|1,0,1]=3 734 B9R0.42 COC(=O)CC(Br)C(=O)C MCULE-7344095898 [0,1,0,0,0,0|2,0,0]=3 735 B9R0.42 COC(=O)CC(C)C(=O)O MCULE-5595331018 [0,1,0,0,0,0|1,0,0]=2 736 B9R0.42 COC(=O)CC(C)C(=O)O MCULE-9262719853 [0,1,0,0,0,0|1,0,0]=2 737 B9R0.42 COC(=O)CC(N)C(=O)O MCULE-1915038693 [0,1,0,0,0,0|0,0,0]=1 738 B9R0.42 COC(=O)CC(N)C(=O)O MCULE-4452484594 [0,1,0,0,0,0|0,0,0]=1 739 B9R0.42 COC(=O)CC(N)C(=O)O MCULE-8573910427 [0,1,0,0,0,0|0,0,0]=1 740 B9R0.42 COC(=O)CC(N)C(C)C MCULE-4687021873 [0,1,0,0,0,0|2,0,1]=4 741 B9R0.42 COC(=O)CC(N)C(C)C MCULE-5881192435 [0,1,0,0,0,0|2,0,1]=4 742 B9R0.42 COC(=O)CC(O)C(=O)O MCULE-7105554854 [0,1,0,0,0,0|1,0,0]=2 743 B9R0.42 COC(=O)CN(C)C(=O)Cl MCULE-2845541726 [0,1,0,0,0,0|3,0,0]=4 744 B9R0.42 COC(=O)C[C@@H](C)C(=O)Cl MCULE-7326666072 [0,1,0,0,0,0|2,0,0]=3 745 B9R0.42 COC(=O)C[C@@H](C)C(=O)O MCULE-4861767896 [0,1,0,0,0,0|1,0,0]=2 746 B9R0.42 COC(=O)C[C@@H](C)C(=O)O MCULE-6107558545 [0,1,0,0,0,0|1,0,0]=2 747 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-2364792775 [0,1,0,0,0,0|0,0,0]=1 748 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-3240459376 [0,1,0,0,0,0|0,0,0]=1 749 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-5997294610 [0,1,0,0,0,0|0,0,0]=1 750 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-6955235147 [0,1,0,0,0,0|0,0,0]=1 751 B9R0.42 COC(=O)C[C@@H](N)C(C)C MCULE-1882017857 [0,1,0,0,0,0|2,0,1]=4 752 B9R0.42 COC(=O)C[C@@H](N)C(C)C MCULE-6118582349 [0,1,0,0,0,0|2,0,1]=4 753 B9R0.42 COC(=O)C[C@@H](N)C(C)C MCULE-8893364344 [0,1,0,0,0,0|2,0,1]=4 754 B9R0.42 COC(=O)C[C@@H](N)C(C)C MCULE-8898462968 [0,1,0,0,0,0|2,0,1]=4 755 B9R0.42 COC(=O)C[C@@H](O)C(=O)O MCULE-8916007864 [0,1,0,0,0,0|1,0,0]=2 756 B9R0.42 COC(=O)C[C@H](C)C(=O)O MCULE-1205037322 [0,1,0,0,0,0|1,0,0]=2 757 B9R0.42 COC(=O)C[C@H](C)C(=O)O MCULE-7536209773 [0,1,0,0,0,0|1,0,0]=2 758 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-3838383924 [0,1,0,0,0,0|0,0,0]=1 759 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-4621655906 [0,1,0,0,0,0|0,0,0]=1 760 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-5113413935 [0,1,0,0,0,0|0,0,0]=1 761 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-9857677224 [0,1,0,0,0,0|0,0,0]=1 762 B9R0.42 COC(=O)C[C@H](N)C(C)C MCULE-1217251393 [0,1,0,0,0,0|2,0,1]=4 763 B9R0.42 COC(=O)C[C@H](N)C(C)C MCULE-6304676369 [0,1,0,0,0,0|2,0,1]=4 764 B9R0.42 COC(=O)C[C@H](N)C(C)C MCULE-6792292051 [0,1,0,0,0,0|2,0,1]=4 765 B9R0.42 COC(=O)C[C@H](N)C(C)C MCULE-7632733566 [0,1,0,0,0,0|2,0,1]=4 766 B9R0.42 COC(=O)C[C@H](O)C(=O)O MCULE-9897810817 [0,1,0,0,0,0|1,0,0]=2 767 B9R0.42 COC(=O)NC(C)C(=O)O MCULE-9255316794 [0,1,0,0,0,0|2,0,0]=3 768 B9R0.42 COC(=O)N[C@@H](C)C(=O)O MCULE-3970003504 [0,1,0,0,0,0|2,0,0]=3 769 B9R0.42 COC(=O)N[C@@H](C)C(=O)O MCULE-7941497211 [0,1,0,0,0,0|2,0,0]=3 770 B9R0.42 C[C@H](NC(=O)CBr)C(=O)O MCULE-2038149065 [0,1,0,0,0,0|3,0,0]=4 771 B9R0.42 C[C@H](NC(=O)CCl)C(=O)O MCULE-3478867157 [0,1,0,0,0,0|3,0,0]=4 772 B9R0.42 C[C@H](NC(=O)CCl)C(=O)O MCULE-8272505742 [0,1,0,0,0,0|3,0,0]=4 773 B9R0.42 C[C@H](NC(=O)CN)C(=O)O MCULE-2496637228 [0,1,0,0,0,0|3,0,0]=4 774 B9R0.42 NC(CN(O)N=O)C(=O)O MCULE-5880257959 [0,1,0,0,0,0|1,0,0]=2 775 B9R0.42 NCC(=O)CC(N)C(=O)O MCULE-5617919538 [0,1,0,0,0,0|1,0,0]=2 776 B9R0.42 NCC(=O)CC(N)C(=O)O MCULE-5853178152 [0,1,0,0,0,0|1,0,0]=2 777 B9R0.42 N[C@@H](CC(=O)NO)C(=O)O MCULE-2694436901 [0,1,0,0,0,0|0,0,0]=1 778 B9R0.42 N[C@@H](CN(O)N=O)C(=O)O MCULE-5513289219 [0,1,0,0,0,0|1,0,0]=2 779 B9R0.42 [C@@H](C)(NC(=O)CN)C(=O)O MCULE-7578084271 [0,1,0,0,0,0|3,0,0]=4 780 B9R0.42 [C@H](N)(CN(O)N=O)C(=O)O MCULE-4128156769 [0,1,0,0,0,0|1,0,0]=2 781 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-1846409149 [0,1,0,0,0,0|2,0,1]=4 782 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-6496394437 [0,1,0,0,0,0|2,0,1]=4 783 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-6507277407 [0,1,0,0,0,0|2,0,1]=4 784 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O MCULE-6215032420 [0,1,0,0,0,0|2,0,1]=4 785 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O MCULE-8005575699 [0,1,0,0,0,0|2,0,1]=4 786 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O MCULE-1515081556 [0,1,0,0,0,0|2,0,1]=4 787 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O MCULE-3358775275 [0,1,0,0,0,0|2,0,1]=4 788 B9R0.57 CC(C)(F)CC(N)C(=O)O MCULE-2499553394 [0,1,0,0,0,0|2,0,1]=4 789 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O MCULE-2670827731 [0,1,0,0,0,0|2,0,1]=4 790 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O MCULE-7946625431 [0,1,0,0,0,0|2,0,1]=4 791 B9R0.57 CC(C)(O)CC(N)C(=O)[O-] MCULE-2378112153 [0,1,0,0,0,0|1,0,2]=4 792 B9R0.57 CC(C)(O)CC(N)C(=O)[O-] MCULE-2969041989 [0,1,0,0,0,0|1,0,2]=4 793 B9R0.57 CC(CS(=O)(=O)C)C(=O)O MCULE-2992876868 [0,1,0,0,0,0|2,0,1]=4 794 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O MCULE-1117561111 [0,1,0,0,0,0|1,0,1]=3 795 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O MCULE-3044564695 [0,1,0,0,0,0|1,0,1]=3 796 B9R0.57 C[Si](C)(C)C[C@H](N)C(=O)O MCULE-5057039244 [0,1,0,0,0,0|2,1,0]=4 797 B9R0.57 NC(CC(F)(F)F)C(=O)O MCULE-4670432872 [0,1,0,0,0,0|2,0,1]=4 798 B9R0.57 NC(CC(F)(F)F)C(=O)O MCULE-7906484739 [0,1,0,0,0,0|2,0,1]=4 799 B9R0.57 NC(CP(=O)(O)O)C(=O)O MCULE-3742656954 [0,1,0,0,0,0|1,0,0]=2 800 B9R0.57 NC(CS(=O)(=O)O)C(=O)O MCULE-3360025136 [0,1,0,0,0,0|1,0,0]=2 801 B9R0.57 NC(CS(=O)(=O)O)C(=O)O MCULE-4680118250 [0,1,0,0,0,0|1,0,0]=2 802 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O MCULE-3474800558 [0,1,0,0,0,0|2,0,1]=4 803 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O MCULE-5230934404 [0,1,0,0,0,0|2,0,1]=4 804 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O MCULE-6065207677 [0,1,0,0,0,0|2,0,1]=4 805 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O MCULE-6989845390 [0,1,0,0,0,0|2,0,1]=4 806 B9R0.57 N[C@@H](CP(=O)(O)O)C(=O)O MCULE-6935567843 [0,1,0,0,0,0|1,0,0]=2 807 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O MCULE-1558128725 [0,1,0,0,0,0|1,0,0]=2 808 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O MCULE-6109276112 [0,1,0,0,0,0|1,0,0]=2 809 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O MCULE-1211212478 [0,1,0,0,0,0|2,0,1]=4 810 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O MCULE-1864367361 [0,1,0,0,0,0|2,0,1]=4 811 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O MCULE-4616647635 [0,1,0,0,0,0|2,0,1]=4 812 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O MCULE-6212697927 [0,1,0,0,0,0|2,0,1]=4 813 B9R0.57 O=C(O)C(O)OP(=O)(O)O MCULE-2072428473 [0,1,0,0,0,0|3,0,0]=4 814 B9R0.79 C=C(O)[C@@H](O)[C@@H](O)C(=C)O MCULE-4802689848 [0,1,0,0,0,0|3,0,0]=4 815 B9R0.79 CC(=C(C)C(=O)O)C(=O)O MCULE-7892331868 [0,1,0,0,0,0|1,0,2]=4 816 B9R0.79 CC(=O)C(C)C(C)C(=O)C MCULE-1642593127 [0,1,0,0,0,0|3,0,0]=4 817 B9R0.79 CC(=O)N(C)C(C)C(=O)O MCULE-8770175961 [0,1,0,0,0,0|3,0,0]=4 818 B9R0.79 CC(C(=O)O)C(C)C(=O)O MCULE-6112773421 [0,1,0,0,0,0|1,0,0]=2 819 B9R0.79 CC(C(=O)O)C(N)C(=O)O MCULE-7699599383 [0,1,0,0,0,0|0,0,0]=1 820 B9R0.79 CC(C(=O)O)C(O)C(=O)O MCULE-1644748819 [0,1,0,0,0,0|1,0,0]=2 821 B9R0.79 CC(C(=O)O)[C@H](N)C(=O)O MCULE-1516476673 [0,1,0,0,0,0|0,0,0]=1 822 B9R0.79 CC(C)C(O)C(N)C(=O)O MCULE-8766263714 [0,1,0,0,0,0|2,0,1]=4 823 B9R0.79 CC(C)C(O)[C@H](N)C(=O)O MCULE-5332720895 [0,1,0,0,0,0|2,0,1]=4 824 B9R0.79 CC(C)[C@@H](O)[C@@H](N)C(=O)O MCULE-2425417830 [0,1,0,0,0,0|2,0,1]=4 825 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-5438285037 [0,1,0,0,0,0|2,0,1]=4 826 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-6278820254 [0,1,0,0,0,0|2,0,1]=4 827 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-7542741263 [0,1,0,0,0,0|2,0,1]=4 828 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-8101644962 [0,1,0,0,0,0|2,0,1]=4 829 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O MCULE-6429723072 [0,1,0,0,0,0|2,0,1]=4 830 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O MCULE-8455636907 [0,1,0,0,0,0|2,0,1]=4 831 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O MCULE-9657202987 [0,1,0,0,0,0|2,0,1]=4 832 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O MCULE-9762128000 [0,1,0,0,0,0|2,0,1]=4 833 B9R0.79 CC(O)C(C)C(N)C(=O)O MCULE-2897656809 [0,1,0,0,0,0|1,0,1]=3 834 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O MCULE-6535308910 [0,1,0,0,0,0|1,0,1]=3 835 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O MCULE-8450789997 [0,1,0,0,0,0|1,0,1]=3 836 B9R0.79 C[C@H](C(=O)O)[C@@H](C)C(=O)O MCULE-1961663558 [0,1,0,0,0,0|1,0,0]=2 837 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O MCULE-1232463081 [0,1,0,0,0,0|0,0,0]=1 838 B9R0.79 C[C@H](C(=O)O)[C@H](N)C(=O)O MCULE-3277052139 [0,1,0,0,0,0|0,0,0]=1 839 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O MCULE-1376333194 [0,1,0,0,0,0|1,0,1]=3 840 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O MCULE-4005119004 [0,1,0,0,0,0|1,0,1]=3 841 B9R0.79 NC(=O)C(O)C(O)C(=O)N MCULE-9698453363 [0,1,0,0,0,0|3,0,0]=4 842 B9R0.79 NC(C(=O)O)C(N)C(=O)O MCULE-8316230798 [0,1,0,0,0,0|0,0,0]=1 843 B9R0.79 NC(C(=O)O)C(O)C(=O)O MCULE-9532787420 [0,1,0,0,0,0|0,0,0]=1 844 B9R0.79 N[C@@H](C(=O)O)[C@@H](F)C(=O)O MCULE-2171226271 [0,1,0,0,0,0|0,0,0]=1 845 B9R0.79 N[C@H](C(=O)O)[C@@H](N)C(=O)O MCULE-6540811499 [0,1,0,0,0,0|0,0,0]=1 846 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O MCULE-1913101511 [0,1,0,0,0,0|0,0,0]=1 847 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O MCULE-9488918896 [0,1,0,0,0,0|0,0,0]=1 848 B9R0.79 O=C(O)/C(=C(\O)/C(=O)O)/O MCULE-4694187983 [0,1,0,0,0,0|1,0,2]=4 849 B9R0.79 O=C(O)C(=C(Br)C(=O)O)Br MCULE-6375677777 [0,1,0,0,0,0|1,0,2]=4 850 B9R0.79 O=C(O)C(=C(O)C(=O)O)O MCULE-1231900319 [0,1,0,0,0,0|1,0,2]=4 851 B9R0.79 O=C(O)C(Br)C(Br)C(=O)O MCULE-5784765255 [0,1,0,0,0,0|1,0,0]=2 852 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-1129308393 [0,1,0,0,0,0|1,0,0]=2 853 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-2045308981 [0,1,0,0,0,0|1,0,0]=2 854 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-2628563960 [0,1,0,0,0,0|1,0,0]=2 855 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-3711883524 [0,1,0,0,0,0|1,0,0]=2 856 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-3867000095 [0,1,0,0,0,0|1,0,0]=2 857 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-4358223174 [0,1,0,0,0,0|1,0,0]=2 858 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-4807487882 [0,1,0,0,0,0|1,0,0]=2 859 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-5140635020 [0,1,0,0,0,0|1,0,0]=2 860 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-6522296758 [0,1,0,0,0,0|1,0,0]=2 861 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-6821495270 [0,1,0,0,0,0|1,0,0]=2 862 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-7561074998 [0,1,0,0,0,0|1,0,0]=2 863 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-8089597216 [0,1,0,0,0,0|1,0,0]=2 864 B9R0.79 O=C(O)C(O)[C@@H](O)C(=O)O MCULE-5751523258 [0,1,0,0,0,0|1,0,0]=2 865 B9R0.79 O=C(O)C(O)[C@@H](O)C(=O)O MCULE-9550173577 [0,1,0,0,0,0|1,0,0]=2 866 B9R0.79 O=C(O)C(O)[C@H](O)C(=O)O MCULE-7402521361 [0,1,0,0,0,0|1,0,0]=2 867 B9R0.79 O=C(O)C(S)C(S)C(=O)O MCULE-6206640169 [0,1,0,0,0,0|1,0,0]=2 868 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-2640391251 [0,1,0,0,0,0|1,0,0]=2 869 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-3329629643 [0,1,0,0,0,0|1,0,0]=2 870 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-3643444072 [0,1,0,0,0,0|1,0,0]=2 871 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-4107297969 [0,1,0,0,0,0|1,0,0]=2 872 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-6410123526 [0,1,0,0,0,0|1,0,0]=2 873 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-6491788082 [0,1,0,0,0,0|1,0,0]=2 874 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-8917357121 [0,1,0,0,0,0|1,0,0]=2 875 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-9727943205 [0,1,0,0,0,0|1,0,0]=2 876 B9R0.79 O=C(O)[C@H](Br)[C@H](Br)C(=O)O MCULE-4542712392 [0,1,0,0,0,0|1,0,0]=2 877 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-1568229930 [0,1,0,0,0,0|1,0,0]=2 878 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-2241188013 [0,1,0,0,0,0|1,0,0]=2 879 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-2831813022 [0,1,0,0,0,0|1,0,0]=2 880 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-3942804599 [0,1,0,0,0,0|1,0,0]=2 881 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-5431486019 [0,1,0,0,0,0|1,0,0]=2 882 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-5579731165 [0,1,0,0,0,0|1,0,0]=2 883 B9R0.79 O=C(O)[C@H](S)[C@H](S)C(=O)O MCULE-4953802229 [0,1,0,0,0,0|1,0,0]=2 884 B9R0.79 O=C([O-])C(O)C(O)C(=O)O MCULE-7425540478 [0,1,0,0,0,0|1,0,1]=3 885 B9R0.79 O=C([O-])C(O)C(O)C(=O)O MCULE-8338522673 [0,1,0,0,0,0|1,0,1]=3 886 B9R0.79 O=C([O-])C(O)C(O)C(=O)[O-] MCULE-1120076524 [0,1,0,0,0,0|1,0,2]=4 887 B9R0.79 O=C([O-])C(O)C(O)C(=O)[O-] MCULE-4518735246 [0,1,0,0,0,0|1,0,2]=4 888 B9R0.79 O=C([O-])[C@@H](O)[C@H](O)C(=O)O MCULE-2803273406 [0,1,0,0,0,0|1,0,1]=3 889 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)O MCULE-3429484887 [0,1,0,0,0,0|1,0,1]=3 890 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)O MCULE-5385898917 [0,1,0,0,0,0|1,0,1]=3 891 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)O MCULE-9680288022 [0,1,0,0,0,0|1,0,1]=3 892 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)[O-] MCULE-5904390200 [0,1,0,0,0,0|1,0,2]=4 893 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)[O-] MCULE-7305038555 [0,1,0,0,0,0|1,0,2]=4 894 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)[O-] MCULE-9168226203 [0,1,0,0,0,0|1,0,2]=4 895 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)[O-] MCULE-9463773027 [0,1,0,0,0,0|1,0,2]=4 896 B9R0.79 [C@@H](N)(C(=O)O)[C@@H](C)C(C)O MCULE-7488780154 [0,1,0,0,0,0|1,0,1]=3 897 B9R0.79 [C@@H](O)(C(=O)O)[C@H](O)C(=O)O MCULE-5798988872 [0,1,0,0,0,0|1,0,0]=2 898 B9R0.79 [C@H](O)(C(=O)O)[C@@H](O)C(=O)O MCULE-9974976226 [0,1,0,0,0,0|1,0,0]=2 899 B9R0.79 [C@H](O)(C(=O)[O-])[C@@H](O)C(=O)O MCULE-7449957572 [0,1,0,0,0,0|1,0,1]=3 900 B9R1.35 C1(CCC(=O)C1)C(=O)O MCULE-7485965564 [0,0,0,1,0,0|2,0,0]=3 901 B9R1.35 C1(CCC(=O)O1)C(=O)O MCULE-6663255579 [0,0,0,1,0,0|3,0,0]=4 902 B9R1.35 C=C1CCC(C1)C(=O)O MCULE-7982355069 [0,0,0,1,0,0|3,0,0]=4 903 B9R1.35 CC(=O)C1COC(=O)C1 MCULE-4262262510 [0,0,0,1,0,0|2,0,0]=3 904 B9R1.35 CC1=NOC(C1)C(=O)O MCULE-4730152545 [0,0,0,1,0,0|3,0,0]=4 905 B9R1.35 CC1=NO[C@@H](C1)C(=O)O MCULE-4081165004 [0,0,0,1,0,0|3,0,0]=4 906 B9R1.35 CC1CC(CO1)C(=O)O MCULE-6422706201 [0,0,0,1,0,0|2,0,1]=4 907 B9R1.35 CC1CNC(C1)C(=O)O MCULE-5999128275 [0,0,0,1,0,0|2,0,1]=4 908 B9R1.35 CC1CNC(C1)C(=O)O MCULE-9035040660 [0,0,0,1,0,0|2,0,1]=4 909 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1541572989 [0,0,0,1,0,0|2,0,1]=4 910 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1821254522 [0,0,0,1,0,0|2,0,1]=4 911 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7426280517 [0,0,0,1,0,0|2,0,1]=4 912 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-8599307960 [0,0,0,1,0,0|2,0,1]=4 913 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O MCULE-2036600768 [0,0,0,1,0,0|2,0,1]=4 914 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O MCULE-4646350445 [0,0,0,1,0,0|2,0,1]=4 915 B9R1.35 C[C@H]1CN[C@H](C1)C(=O)O MCULE-2974063836 [0,0,0,1,0,0|2,0,1]=4 916 B9R1.35 C[C@H]1CN[C@H](C1)C(=O)O MCULE-7564386283 [0,0,0,1,0,0|2,0,1]=4 917 B9R1.35 NC(=O)C1CC(CN1)O MCULE-8628888959 [0,0,0,1,0,0|2,0,1]=4 918 B9R1.35 NC(=O)C1CC(CN1)O MCULE-9327040437 [0,0,0,1,0,0|2,0,1]=4 919 B9R1.35 NC(=O)C1CNC(=O)C1 MCULE-2954653092 [0,0,0,1,0,0|3,0,0]=4 920 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O MCULE-1506534259 [0,0,0,1,0,0|2,0,1]=4 921 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O MCULE-4335155413 [0,0,0,1,0,0|2,0,1]=4 922 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-1442980635 [0,0,0,1,0,0|2,0,1]=4 923 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-4854132547 [0,0,0,1,0,0|2,0,1]=4 924 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-8175631848 [0,0,0,1,0,0|2,0,1]=4 925 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-9092665787 [0,0,0,1,0,0|2,0,1]=4 926 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-1212665796 [0,0,0,1,0,0|2,0,1]=4 927 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-2172080185 [0,0,0,1,0,0|2,0,1]=4 928 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-2463066874 [0,0,0,1,0,0|2,0,1]=4 929 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-7245012102 [0,0,0,1,0,0|2,0,1]=4 930 B9R1.35 NC1=NNC(N1)C(=O)O MCULE-8622860614 [0,0,0,1,0,0|3,0,0]=4 931 B9R1.35 NC1CNC(C1)C(=O)O MCULE-1416144501 [0,0,0,1,0,0|2,0,1]=4 932 B9R1.35 NC1CNC(C1)C(=O)O MCULE-4706388278 [0,0,0,1,0,0|2,0,1]=4 933 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-4990800122 [0,0,0,1,0,0|2,0,1]=4 934 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-5172267597 [0,0,0,1,0,0|2,0,1]=4 935 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7010431429 [0,0,0,1,0,0|2,0,1]=4 936 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-8754522437 [0,0,0,1,0,0|2,0,1]=4 937 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-4906071490 [0,0,0,1,0,0|2,0,1]=4 938 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-7656739611 [0,0,0,1,0,0|2,0,1]=4 939 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-8732136397 [0,0,0,1,0,0|2,0,1]=4 940 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-9871023526 [0,0,0,1,0,0|2,0,1]=4 941 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-1698400731 [0,0,0,1,0,0|2,0,1]=4 942 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-1983861108 [0,0,0,1,0,0|2,0,1]=4 943 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-2838978471 [0,0,0,1,0,0|2,0,1]=4 944 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-5103662767 [0,0,0,1,0,0|2,0,1]=4 945 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-5299594489 [0,0,0,1,0,0|2,0,1]=4 946 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-6235136925 [0,0,0,1,0,0|2,0,1]=4 947 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-8629641721 [0,0,0,1,0,0|2,0,1]=4 948 B9R1.35 N[C@H]1CN[C@H](C1)C(=O)O MCULE-2973551231 [0,0,0,1,0,0|2,0,1]=4 949 B9R1.35 N[C@H]1CN[C@H](C1)C(=O)O MCULE-3190600485 [0,0,0,1,0,0|2,0,1]=4 950 B9R1.35 O=C(O)C1CC(=NO1)Br MCULE-8217813426 [0,0,0,1,0,0|3,0,0]=4 951 B9R1.35 O=C(O)C1CC(CN1)Br MCULE-3420644560 [0,0,0,1,0,0|2,0,1]=4 952 B9R1.35 O=C(O)C1CC(CN1)F MCULE-1909829604 [0,0,0,1,0,0|2,0,1]=4 953 B9R1.35 O=C(O)C1CC(CN1)F MCULE-4908563055 [0,0,0,1,0,0|2,0,1]=4 954 B9R1.35 O=C(O)C1CC(CN1)O MCULE-3129945874 [0,0,0,1,0,0|1,0,1]=3 955 B9R1.35 O=C(O)C1CC(CN1)O MCULE-5090896550 [0,0,0,1,0,0|1,0,1]=3 956 B9R1.35 O=C(O)C1CC(CN1)S MCULE-3928449068 [0,0,0,1,0,0|1,1,1]=4 957 B9R1.35 O=C(O)C1CC(CN1)S MCULE-7523385510 [0,0,0,1,0,0|1,1,1]=4 958 B9R1.35 O=C(O)C1CCC(C1)O MCULE-3301759971 [0,0,0,1,0,0|2,0,1]=4 959 B9R1.35 O=C(O)[C@@H]1CC(CN1)O MCULE-9602889253 [0,0,0,1,0,0|1,0,1]=3 960 B9R1.35 O=C(O)[C@@H]1CC(CN1)S MCULE-6078892837 [0,0,0,1,0,0|1,1,1]=4 961 B9R1.35 O=C(O)[C@@H]1CC(CN1)S MCULE-6607761456 [0,0,0,1,0,0|1,1,1]=4 962 B9R1.35 O=C(O)[C@@H]1CC[C@@H](C1)O MCULE-2017780821 [0,0,0,1,0,0|2,0,1]=4 963 B9R1.35 O=C(O)[C@@H]1CC[C@@H](C1)O MCULE-8789755356 [0,0,0,1,0,0|2,0,1]=4 964 B9R1.35 O=C(O)[C@@H]1CC[C@H](C1)O MCULE-6133795580 [0,0,0,1,0,0|2,0,1]=4 965 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)Br MCULE-2600938020 [0,0,0,1,0,0|2,0,1]=4 966 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)Br MCULE-3945615781 [0,0,0,1,0,0|2,0,1]=4 967 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-2626475344 [0,0,0,1,0,0|2,0,1]=4 968 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-4367319835 [0,0,0,1,0,0|2,0,1]=4 969 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-9011373659 [0,0,0,1,0,0|2,0,1]=4 970 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-9484602400 [0,0,0,1,0,0|2,0,1]=4 971 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-2778155463 [0,0,0,1,0,0|1,0,1]=3 972 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-3005368457 [0,0,0,1,0,0|1,0,1]=3 973 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-3510440810 [0,0,0,1,0,0|1,0,1]=3 974 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-6982589556 [0,0,0,1,0,0|1,0,1]=3 975 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-8797295826 [0,0,0,1,0,0|1,0,1]=3 976 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-5195240463 [0,0,0,1,0,0|1,1,1]=4 977 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-6442187313 [0,0,0,1,0,0|1,1,1]=4 978 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-6472004515 [0,0,0,1,0,0|1,1,1]=4 979 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-8668690351 [0,0,0,1,0,0|1,1,1]=4 980 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-2784186920 [0,0,0,1,0,0|2,0,1]=4 981 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-5745425542 [0,0,0,1,0,0|2,0,1]=4 982 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-9253930917 [0,0,0,1,0,0|2,0,1]=4 983 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-9892414269 [0,0,0,1,0,0|2,0,1]=4 984 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-4157512603 [0,0,0,1,0,0|1,0,1]=3 985 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-5389747201 [0,0,0,1,0,0|1,0,1]=3 986 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-6465399562 [0,0,0,1,0,0|1,0,1]=3 987 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-7830616263 [0,0,0,1,0,0|1,0,1]=3 988 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-1140594774 [0,0,0,1,0,0|1,1,1]=4 989 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-2383846785 [0,0,0,1,0,0|1,1,1]=4 990 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-2747224270 [0,0,0,1,0,0|1,1,1]=4 991 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-5598470577 [0,0,0,1,0,0|1,1,1]=4 992 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-7268471922 [0,0,0,1,0,0|1,1,1]=4 993 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-9896850390 [0,0,0,1,0,0|1,1,1]=4 994 B9R1.35 O=C(O)[C@H]1CC[C@@H](C1)O MCULE-3061487094 [0,0,0,1,0,0|2,0,1]=4 995 B9R1.35 O=C(O)[C@H]1CC[C@@H](C1)O MCULE-8079944181 [0,0,0,1,0,0|2,0,1]=4 996 B9R1.35 O=C(O)[C@H]1CC[C@H](C1)O MCULE-2713143734 [0,0,0,1,0,0|2,0,1]=4 997 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-1499004749 [0,0,0,1,0,0|2,0,1]=4 998 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-4961028667 [0,0,0,1,0,0|2,0,1]=4 999 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-9323854334 [0,0,0,1,0,0|2,0,1]=4 1000 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-1222229718 [0,0,0,1,0,0|1,0,1]=3 1001 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-1998693022 [0,0,0,1,0,0|1,0,1]=3 1002 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-3836053642 [0,0,0,1,0,0|1,0,1]=3 1003 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-4545441904 [0,0,0,1,0,0|1,0,1]=3 1004 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-8358409700 [0,0,0,1,0,0|1,0,1]=3 1005 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-1326882154 [0,0,0,1,0,0|2,0,1]=4 1006 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-4409765623 [0,0,0,1,0,0|2,0,1]=4 1007 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-5169579313 [0,0,0,1,0,0|2,0,1]=4 1008 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-8834390438 [0,0,0,1,0,0|2,0,1]=4 1009 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-3080568728 [0,0,0,1,0,0|1,0,1]=3 1010 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-4521316626 [0,0,0,1,0,0|1,0,1]=3 1011 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-5972935636 [0,0,0,1,0,0|1,0,1]=3 1012 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-7908625938 [0,0,0,1,0,0|1,0,1]=3 1013 B9R1.35 O=C1C=C(NN1)C(=O)O MCULE-2820101826 [0,0,0,1,0,0|1,0,2]=4 1014 B9R1.35 O=C1CC(=NN1)C(=O)O MCULE-2135539733 [0,0,0,1,0,0|1,0,2]=4 1015 B9R1.35 O=C1CC(CN1)C(=O)O MCULE-2190630193 [0,0,0,1,0,0|2,0,0]=3 1016 B9R1.35 O=C1CC(CO1)C(=O)O MCULE-4876585769 [0,0,0,1,0,0|1,0,0]=2 1017 B9R1.35 O=C1CC(CO1)P(=O)[O-] MCULE-1427817828 [0,0,0,1,0,0|2,0,1]=4 1018 B9R1.35 O=C1CC(CO1)P(=O)[O-] MCULE-4673203835 [0,0,0,1,0,0|2,0,1]=4 1019 B9R1.35 O=C1CC(CS1)C(=O)O MCULE-5763665475 [0,0,0,1,0,0|1,1,0]=3 1020 B9R1.35 O=C1CC(NN1)C(=O)O MCULE-3197471189 [0,0,0,1,0,0|1,0,0]=2 1021 B9R1.35 O=C1CCC(C1)C(=O)O MCULE-8715651663 [0,0,0,1,0,0|2,0,0]=3 1022 B9R1.35 O=C1CCC(N1)C(=O)O MCULE-4175874303 [0,0,0,1,0,0|3,0,0]=4 1023 B9R1.35 O=C1CCC(N1)C(=O)O MCULE-9028773140 [0,0,0,1,0,0|3,0,0]=4 1024 B9R1.35 O=C1CCC(O1)C(=O)O MCULE-1992756541 [0,0,0,1,0,0|3,0,0]=4 1025 B9R1.35 O=C1CCC(S1)C(=O)O MCULE-8929436839 [0,0,0,1,0,0|3,0,0]=4 1026 B9R1.35 O=C1CC[C@@H](C1)C(=O)O MCULE-1554776363 [0,0,0,1,0,0|2,0,0]=3 1027 B9R1.35 O=C1CC[C@@H](C1)C(=O)O MCULE-4649943680 [0,0,0,1,0,0|2,0,0]=3 1028 B9R1.35 O=C1CC[C@@H](N1)C(=O)O MCULE-5900221010 [0,0,0,1,0,0|3,0,0]=4 1029 B9R1.35 O=C1CC[C@@H](N1)C(=O)O MCULE-8170238114 [0,0,0,1,0,0|3,0,0]=4 1030 B9R1.35 O=C1CC[C@@H](O1)C(=O)O MCULE-1446049605 [0,0,0,1,0,0|3,0,0]=4 1031 B9R1.35 O=C1CC[C@@H](O1)C(=O)O MCULE-6745317325 [0,0,0,1,0,0|3,0,0]=4 1032 B9R1.35 O=C1CC[C@H](C1)C(=O)O MCULE-6597072682 [0,0,0,1,0,0|2,0,0]=3 1033 B9R1.35 O=C1CC[C@H](C1)C(=O)O MCULE-7880064966 [0,0,0,1,0,0|2,0,0]=3 1034 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-4204877494 [0,0,0,1,0,0|3,0,0]=4 1035 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-4908547112 [0,0,0,1,0,0|3,0,0]=4 1036 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-6422141688 [0,0,0,1,0,0|3,0,0]=4 1037 B9R1.35 O=C1CC[C@H](O1)C(=O)O MCULE-5669975621 [0,0,0,1,0,0|3,0,0]=4 1038 B9R1.35 O=C1CC[C@H](O1)C(=O)O MCULE-7113736527 [0,0,0,1,0,0|3,0,0]=4 1039 B9R1.35 O=C1CC[C@H](S1)C(=O)O MCULE-4843749267 [0,0,0,1,0,0|3,0,0]=4 1040 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-7418065190 [0,0,0,1,0,0|1,0,0]=2 1041 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-7697956784 [0,0,0,1,0,0|1,0,0]=2 1042 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-9520720032 [0,0,0,1,0,0|1,0,0]=2 1043 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-2573903934 [0,0,0,1,0,0|1,0,0]=2 1044 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-3585746586 [0,0,0,1,0,0|1,0,0]=2 1045 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-4771747932 [0,0,0,1,0,0|1,0,0]=2 1046 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-4795592072 [0,0,0,1,0,0|1,0,0]=2 1047 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-6928857625 [0,0,0,1,0,0|1,0,0]=2 1048 B9R1.35 O=C1COC(C1)C(=O)O MCULE-4720798204 [0,0,0,1,0,0|2,0,0]=3 1049 B9R1.35 O=C1CSC(C1)C(=O)O MCULE-3309649635 [0,0,0,1,0,0|2,0,0]=3 1050 B9R1.35 O=C1C[C@@H](CN1)C(=O)O MCULE-5673992530 [0,0,0,1,0,0|2,0,0]=3 1051 B9R1.35 O=C1C[C@@H](CN1)C(=O)O MCULE-8443757903 [0,0,0,1,0,0|2,0,0]=3 1052 B9R1.35 O=C1C[C@H](CN1)C(=O)O MCULE-1024601569 [0,0,0,1,0,0|2,0,0]=3 1053 B9R1.35 O=C1C[C@H](CN1)C(=O)O MCULE-4280238532 [0,0,0,1,0,0|2,0,0]=3 1054 B9R1.35 O=C1N=C(NO1)C(=O)[O-] MCULE-2321750529 [0,0,0,1,0,0|1,0,2]=4 1055 B9R1.35 O=C1NC(=CO1)C(=O)O MCULE-2610586771 [0,0,0,1,0,0|2,0,1]=4 1056 B9R1.35 O=C1NC(=NO1)C(=O)O MCULE-5897124585 [0,0,0,1,0,0|1,0,2]=4 1057 B9R1.35 O=C1NC(CO1)C(=O)O MCULE-5946769187 [0,0,0,1,0,0|2,0,0]=3 1058 B9R1.35 O=C1NC(CS1)C(=O)O MCULE-4574359237 [0,0,0,1,0,0|2,1,0]=4 1059 B9R1.35 O=C1NCC(N1)C(=O)O MCULE-5872947769 [0,0,0,1,0,0|3,0,0]=4 1060 B9R1.35 O=C1NCC(O1)C(=O)O MCULE-2773613806 [0,0,0,1,0,0|3,0,0]=4 1061 B9R1.35 O=C1NC[C@@H](N1)C(=O)O MCULE-3499982275 [0,0,0,1,0,0|3,0,0]=4 1062 B9R1.35 O=C1NC[C@@H](N1)C(=O)O MCULE-9995046216 [0,0,0,1,0,0|3,0,0]=4 1063 B9R1.35 O=C1NC[C@H](N1)C(=O)O MCULE-2524102915 [0,0,0,1,0,0|3,0,0]=4 1064 B9R1.35 O=C1NC[C@H](N1)C(=O)O MCULE-5992511798 [0,0,0,1,0,0|3,0,0]=4 1065 B9R1.35 O=C1NC[C@H](O1)C(=O)O MCULE-5972751457 [0,0,0,1,0,0|3,0,0]=4 1066 B9R1.35 O=C1NC[C@H](O1)C(=O)O MCULE-6879191654 [0,0,0,1,0,0|3,0,0]=4 1067 B9R1.35 O=C1N[C@@H](CO1)C(=O)O MCULE-2786614278 [0,0,0,1,0,0|2,0,0]=3 1068 B9R1.35 O=C1N[C@@H](CO1)C(=O)O MCULE-8589745511 [0,0,0,1,0,0|2,0,0]=3 1069 B9R1.35 O=C1N[C@@H](CS1)C(=O)O MCULE-8232416107 [0,0,0,1,0,0|2,1,0]=4 1070 B9R1.35 O=C1N[C@@H](CS1)C(=O)O MCULE-9439896780 [0,0,0,1,0,0|2,1,0]=4 1071 B9R1.35 O=C1N[C@H](CO1)C(=O)O MCULE-3716829138 [0,0,0,1,0,0|2,0,0]=3 1072 B9R1.35 O=C1N[C@H](CO1)C(=O)O MCULE-9300998688 [0,0,0,1,0,0|2,0,0]=3 1073 B9R1.35 O=C1N[C@H](CS1)C(=O)O MCULE-3120744944 [0,0,0,1,0,0|2,1,0]=4 1074 B9R1.35 O=C1OCC(O1)C(=O)O MCULE-2772637927 [0,0,0,1,0,0|2,0,0]=3 1075 B9R1.35 [C@@H]1(CN[C@H](C1)C(=O)O)O MCULE-3075663401 [0,0,0,1,0,0|1,0,1]=3 1076 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)F MCULE-1784559931 [0,0,0,1,0,0|2,0,1]=4 1077 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)F MCULE-8392302309 [0,0,0,1,0,0|2,0,1]=4 1078 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)S MCULE-7662717521 [0,0,0,1,0,0|1,1,1]=4 1079 B9R1.35 [C@H]1(CN[C@H](C1)C(=O)O)F MCULE-2026019561 [0,0,0,1,0,0|2,0,1]=4 1080 B9R1.35 [C@H]1(CN[C@H](C1)C(=O)O)F MCULE-8023038198 [0,0,0,1,0,0|2,0,1]=4 1081 B9R1.35 [C@H]1(C[C@H](CN1)O)C(=O)O MCULE-3462627258 [0,0,0,1,0,0|1,0,1]=3 1082 B9R1.36 CC1(CC(C(=O)O1)N)C MCULE-7823096614 [0,0,0,1,0,0|2,0,1]=4 1083 B9R1.36 CC1(CC(C(=O)O1)N)C MCULE-8973330971 [0,0,0,1,0,0|2,0,1]=4 1084 B9R1.36 NC1CS(=O)(=O)NC1=O MCULE-5308687626 [0,0,0,1,0,0|2,0,1]=4 1085 B9R1.36 NC1CS(=O)(=O)NC1=O MCULE-7250097397 [0,0,0,1,0,0|2,0,1]=4 1086 B9R1.45 C=C1CC1C(N)C(=O)O MCULE-7249491598 [0,0,0,1,0,0|2,0,0]=3 1087 B9R1.69 CC1CC(=O)CCC1=O MCULE-2258739718 [0,0,0,1,0,0|3,0,0]=4 1088 B9R1.69 CC1OC(=O)COC1=O MCULE-8718960339 [0,0,0,1,0,0|3,0,0]=4 1089 B9R1.69 N[C@H]1C[C@H](CNC1=O)O MCULE-9955363059 [0,0,0,1,0,0|2,0,1]=4 1090 B9R1.112 NC(CC1CC1)C(=O)O MCULE-2093088646 [0,0,0,1,0,0|2,0,1]=4 1091 B9R1.112 NC(CC1CC1)C(=O)O MCULE-2184599799 [0,0,0,1,0,0|2,0,1]=4 1092 B9R1.112 NC(CC1CC1)C(=O)O MCULE-6147797529 [0,0,0,1,0,0|2,0,1]=4 1093 B9R1.112 N[C@@H](CC1CC1)C(=O)O MCULE-6048291861 [0,0,0,1,0,0|2,0,1]=4 1094 B9R1.112 N[C@@H](CC1CC1)C(=O)O MCULE-9266785362 [0,0,0,1,0,0|2,0,1]=4 1095 B9R1.112 N[C@H](CC1CC1)C(=O)O MCULE-5333410932 [0,0,0,1,0,0|2,0,1]=4 1096 B9R1.112 N[C@H](CC1CC1)C(=O)O MCULE-6150609140 [0,0,0,1,0,0|2,0,1]=4 1097 B9R1.137 NC(CC(=O)O)C1CC1 MCULE-8804808816 [0,0,0,1,0,0|2,0,1]=4 1098 B9R1.137 N[C@@H](CC(=O)O)C1CC1 MCULE-9237422000 [0,0,0,1,0,0|2,0,1]=4 1099 B9R1.137 N[C@@H](CC(=O)O)C1CC1 MCULE-9835342571 [0,0,0,1,0,0|2,0,1]=4 1100 B9R1.152 C=C1CC(C1)(C)C(=O)O MCULE-7205894158 [0,0,0,1,0,0|3,0,0]=4 1101 B9R1.152 C=C1CC(C1)(O)C(=O)O MCULE-9531189314 [0,0,0,1,0,0|3,0,0]=4 1102 B9R1.152 CC1(CC(=O)C1)C(=O)O MCULE-5766836727 [0,0,0,1,0,0|2,0,0]=3 1103 B9R1.152 C[C@H]1C[C@@](C1)(N)C(=O)O MCULE-7807418833 [0,0,0,1,0,0|2,0,1]=4 1104 B9R1.152 C[C@H]1C[C@](C1)(N)C(=O)O MCULE-2634950955 [0,0,0,1,0,0|2,0,1]=4 1105 B9R1.152 NC1(CC(C1)F)C(=O)O MCULE-5206815009 [0,0,0,1,0,0|2,0,1]=4 1106 B9R1.152 NC1(CC(C1)F)C(=O)O MCULE-9944960595 [0,0,0,1,0,0|2,0,1]=4 1107 B9R1.152 NC1(CC(C1)O)C(=O)O MCULE-8304595021 [0,0,0,1,0,0|1,0,1]=3 1108 B9R1.152 NC1(CC(C1)O)C(=O)O MCULE-8353432396 [0,0,0,1,0,0|1,0,1]=3 1109 B9R1.152 N[C@@]1(C[C@@H](C1)F)C(=O)O MCULE-3535102578 [0,0,0,1,0,0|2,0,1]=4 1110 B9R1.152 N[C@@]1(C[C@@H](C1)O)C(=O)O MCULE-3919423791 [0,0,0,1,0,0|1,0,1]=3 1111 B9R1.152 N[C@@]1(C[C@H](C1)F)C(=O)O MCULE-4417403698 [0,0,0,1,0,0|2,0,1]=4 1112 B9R1.152 O=C(O)C1(CC(C1)O)O MCULE-4321795643 [0,0,0,1,0,0|2,0,1]=4 1113 B9R1.152 O=C(O)[C@@]1(C[C@@H](C1)O)F MCULE-1599041261 [0,0,0,1,0,0|2,0,1]=4 1114 B9R1.152 O=C(O)[C@@]1(C[C@@H](C1)O)O MCULE-3005775021 [0,0,0,1,0,0|2,0,1]=4 1115 B9R1.152 O=C(O)[C@@]1(C[C@H](C1)O)F MCULE-8929901678 [0,0,0,1,0,0|2,0,1]=4 1116 B9R1.152 O=C(O)[C@@]1(C[C@H](C1)O)O MCULE-2152193030 [0,0,0,1,0,0|2,0,1]=4 1117 B9R1.161 NC(=O)C1CC1C(=O)O MCULE-6146043873 [0,0,0,1,0,0|2,0,0]=3 1118 B9R1.161 O=C(Cl)C1OC1C(=O)Cl MCULE-9383694320 [0,0,0,1,0,0|3,0,0]=4 1119 B9R1.161 O=C(O)C1CC1C(=O)O MCULE-5636831869 [0,0,0,1,0,0|1,0,0]=2 1120 B9R1.161 O=C(O)C1CC1N(=O)=O MCULE-4711426088 [0,0,0,1,0,0|2,0,1]=4 1121 B9R1.161 O=C(O)C1OC1C(=O)O MCULE-2308875813 [0,0,0,1,0,0|1,0,0]=2 1122 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O MCULE-2176178577 [0,0,0,1,0,0|1,0,0]=2 1123 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O MCULE-7341169681 [0,0,0,1,0,0|1,0,0]=2 1124 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O MCULE-9766210553 [0,0,0,1,0,0|1,0,0]=2 1125 B9R1.161 O=C(O)[C@@H]1O[C@H]1C(=O)O MCULE-2854301838 [0,0,0,1,0,0|1,0,0]=2 1126 B9R1.161 O=C(O)[C@@H]1O[C@H]1C(=O)O MCULE-7193163448 [0,0,0,1,0,0|1,0,0]=2 1127 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O MCULE-8230558967 [0,0,0,1,0,0|1,0,0]=2 1128 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O MCULE-9433538416 [0,0,0,1,0,0|1,0,0]=2 1129 B9R1.161 O=C(O)[C@H]1C[C@@H]1[N+](=O)[O-] MCULE-1350888359 [0,0,0,1,0,0|2,0,1]=4 1130 B9R1.161 O=C(O)[C@H]1C[C@H]1C(=O)O MCULE-4280807741 [0,0,0,1,0,0|1,0,0]=2 1131 B9R1.161 O=C(O)[C@H]1O[C@H]1C(=O)O MCULE-6088596771 [0,0,0,1,0,0|1,0,0]=2 1132 B9R1.161 O=C([O-])[C@H]1O[C@H]1C(=O)[O-] MCULE-9392079342 [0,0,0,1,0,0|1,0,2]=4 1133 B9R1.164 CC1(CC(C1)C(=O)O)O MCULE-2222519984 [0,0,0,1,0,0|2,0,1]=4 1134 B9R1.164 C[C@@]1(C[C@@H](C1)C(=O)O)O MCULE-4467958139 [0,0,0,1,0,0|2,0,1]=4 1135 B9R1.164 C[C@@]1(C[C@H](C1)C(=O)O)O MCULE-3757447768 [0,0,0,1,0,0|2,0,1]=4 1136 B9R1.164 O=C(O)C1CS(=O)(=O)C1 MCULE-7280424141 [0,0,0,1,0,0|2,0,1]=4 1137 B7R0.16 C=C(C(=O)O)C(=O)O MCULE-7540749901 [0,0,0,0,1,0|1,0,1]=3 1138 B7R0.16 C=C(C)C(N)C(=O)O MCULE-1815568719 [0,0,0,0,1,0|2,0,0]=3 1139 B7R0.16 C=C(C)C(N)C(=O)O MCULE-2839869274 [0,0,0,0,1,0|2,0,0]=3 1140 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5015326828 [0,0,0,0,1,0|2,0,0]=3 1141 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5043630144 [0,0,0,0,1,0|2,0,0]=3 1142 B7R0.16 C=C(C)[C@@H](N)C(=C)O MCULE-5278584348 [0,0,0,0,1,0|3,0,0]=4 1143 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-2007035571 [0,0,0,0,1,0|2,0,0]=3 1144 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-6240689602 [0,0,0,0,1,0|2,0,0]=3 1145 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-8025014656 [0,0,0,0,1,0|2,0,0]=3 1146 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-9704891439 [0,0,0,0,1,0|2,0,0]=3 1147 B7R0.16 CC(=O)C(Br)C(=O)C MCULE-2980550700 [0,0,0,0,1,0|3,0,0]=4 1148 B7R0.16 CC(=O)C(C)C(=O)C MCULE-9607259412 [0,0,0,0,1,0|3,0,0]=4 1149 B7R0.16 CC(=O)C(Cl)C(=O)C MCULE-4716617423 [0,0,0,0,1,0|3,0,0]=4 1150 B7R0.16 CC(=O)C(F)C(=O)C MCULE-4665621902 [0,0,0,0,1,0|3,0,0]=4 1151 B7R0.16 CC(=O)C(N)C(=O)C MCULE-6440496769 [0,0,0,0,1,0|2,0,0]=3 1152 B7R0.16 CC(=O)C(N)C(=O)C MCULE-8525737264 [0,0,0,0,1,0|2,0,0]=3 1153 B7R0.16 CC(C(=O)Cl)C(=O)Cl MCULE-5269923120 [0,0,0,0,1,0|3,0,0]=4 1154 B7R0.16 CC(C(=O)N)C(=O)N MCULE-4912037399 [0,0,0,0,1,0|3,0,0]=4 1155 B7R0.16 CC(C(=O)O)C(=O)O MCULE-7232226851 [0,0,0,0,1,0|1,0,0]=2 1156 B7R0.16 CC(C(=O)[O-])C(=O)[O-] MCULE-4632089491 [0,0,0,0,1,0|1,0,2]=4 1157 B7R0.16 CC(C(=O)[O-])C(=O)[O-] MCULE-8764180648 [0,0,0,0,1,0|1,0,2]=4 1158 B7R0.16 CC(C)C(N)C(=O)O MCULE-8140660263 [0,0,0,0,1,0|2,0,1]=4 1159 B7R0.16 CC(C)C(N)C(=O)O MCULE-9199801639 [0,0,0,0,1,0|2,0,1]=4 1160 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-1338052740 [0,0,0,0,1,0|2,0,1]=4 1161 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-2459930572 [0,0,0,0,1,0|2,0,1]=4 1162 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-2507309072 [0,0,0,0,1,0|2,0,1]=4 1163 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-9143825935 [0,0,0,0,1,0|2,0,1]=4 1164 B7R0.16 CC(F)C(N)C(=O)O MCULE-8810968604 [0,0,0,0,1,0|2,0,1]=4 1165 B7R0.16 CC(O)C(C)C(=O)O MCULE-2499360516 [0,0,0,0,1,0|2,0,1]=4 1166 B7R0.16 CC(O)C(N)C(=O)N MCULE-1234785834 [0,0,0,0,1,0|2,0,1]=4 1167 B7R0.16 CC(O)C(N)C(=O)N MCULE-5867306342 [0,0,0,0,1,0|2,0,1]=4 1168 B7R0.16 CC(O)C(N)C(=O)O MCULE-1563595722 [0,0,0,0,1,0|1,0,1]=3 1169 B7R0.16 CC(O)C(N)C(=O)O MCULE-5581920538 [0,0,0,0,1,0|1,0,1]=3 1170 B7R0.16 C[C@@H](N)[C@@H](N)C(=O)O MCULE-5302456851 [0,0,0,0,1,0|2,0,1]=4 1171 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-1663687439 [0,0,0,0,1,0|1,0,1]=3 1172 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-3863591433 [0,0,0,0,1,0|1,0,1]=3 1173 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-8080019797 [0,0,0,0,1,0|1,0,1]=3 1174 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-9284411012 [0,0,0,0,1,0|1,0,1]=3 1175 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-1969228933 [0,0,0,0,1,0|2,0,1]=4 1176 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-3285041526 [0,0,0,0,1,0|2,0,1]=4 1177 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-5018319528 [0,0,0,0,1,0|2,0,1]=4 1178 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-6080625355 [0,0,0,0,1,0|2,0,1]=4 1179 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-9393787536 [0,0,0,0,1,0|2,0,1]=4 1180 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-9925689829 [0,0,0,0,1,0|2,0,1]=4 1181 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2430667007 [0,0,0,0,1,0|1,0,1]=3 1182 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2676185993 [0,0,0,0,1,0|1,0,1]=3 1183 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5254477364 [0,0,0,0,1,0|1,0,1]=3 1184 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5505393195 [0,0,0,0,1,0|1,0,1]=3 1185 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-7379719940 [0,0,0,0,1,0|1,0,1]=3 1186 B7R0.16 C[C@@H](O)[C@H](O)C(=O)O MCULE-9383777855 [0,0,0,0,1,0|2,0,1]=4 1187 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O MCULE-8875933839 [0,0,0,0,1,0|2,0,1]=4 1188 B7R0.16 C[C@H](N)[C@@H](N)C(=O)O MCULE-9507122128 [0,0,0,0,1,0|2,0,1]=4 1189 B7R0.16 C[C@H](N)[C@H](N)C(=O)O MCULE-3178389621 [0,0,0,0,1,0|2,0,1]=4 1190 B7R0.16 C[C@H](O)C(N)C(=O)O MCULE-6661175670 [0,0,0,0,1,0|1,0,1]=3 1191 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-6288272506 [0,0,0,0,1,0|1,0,1]=3 1192 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-7203096302 [0,0,0,0,1,0|1,0,1]=3 1193 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-9531951265 [0,0,0,0,1,0|1,0,1]=3 1194 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-2246314901 [0,0,0,0,1,0|1,0,1]=3 1195 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-9478987169 [0,0,0,0,1,0|1,0,1]=3 1196 B7R0.16 NC(=O)C(Br)C(=O)N MCULE-7519162871 [0,0,0,0,1,0|3,0,0]=4 1197 B7R0.16 NC(=O)C(N)C(=O)N MCULE-5338329205 [0,0,0,0,1,0|2,0,0]=3 1198 B7R0.16 NC(C(=O)O)C(=O)O MCULE-6118746267 [0,0,0,0,1,0|0,0,0]=1 1199 B7R0.16 O=C(O)C(=O)C(=O)O MCULE-9031084199 [0,0,0,0,1,0|1,0,1]=3 1200 B7R0.16 O=C(O)C(Cl)C(=O)O MCULE-9776364495 [0,0,0,0,1,0|1,0,0]=2 1201 B7R0.16 O=C(O)C(F)C(=O)O MCULE-9969055570 [0,0,0,0,1,0|1,0,0]=2 1202 B7R0.16 O=C(O)C(O)C(=O)O MCULE-4232935518 [0,0,0,0,1,0|1,0,0]=2 1203 B9R0.7 C(N)(CCC(=O)[O-])C(=O)O MCULE-5359010340 [0,0,0,0,0,1|0,0,1]=2 1204 B9R0.7 C=C(CCC(=O)O)C(=O)O MCULE-3502029665 [0,0,0,0,0,1|1,0,1]=3 1205 B9R0.7 CC(=CCC(N)C(=O)O)C MCULE-9020150203 [0,0,0,0,0,1|2,0,0]=3 1206 B9R0.7 CC(=CC[C@@H](N)C(=O)O)C MCULE-7822845293 [0,0,0,0,0,1|2,0,0]=3 1207 B9R0.7 CC(=CC[C@H](N)C(=O)O)C MCULE-6208618845 [0,0,0,0,0,1|2,0,0]=3 1208 B9R0.7 CC(=O)C(C)CCC(=O)O MCULE-9124111940 [0,0,0,0,0,1|2,0,0]=3 1209 B9R0.7 CC(=O)C(C)CCC(=O)[O-] MCULE-8051941482 [0,0,0,0,0,1|2,0,1]=4 1210 B9R0.7 CC(=O)N(C)CCC(=O)O MCULE-3939402773 [0,0,0,0,0,1|3,0,0]=4 1211 B9R0.7 CC(=O)OCC(N)C(=O)O MCULE-4063734192 [0,0,0,0,0,1|1,0,0]=2 1212 B9R0.7 CC(=O)OCC(N)C(=O)O MCULE-6252379108 [0,0,0,0,0,1|1,0,0]=2 1213 B9R0.7 CC(=O)OCC(N)C(=O)O MCULE-6448707862 [0,0,0,0,0,1|1,0,0]=2 1214 B9R0.7 CC(=O)OCC(N)C(=O)O MCULE-8255582994 [0,0,0,0,0,1|1,0,0]=2 1215 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O MCULE-2377153563 [0,0,0,0,0,1|1,0,0]=2 1216 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O MCULE-2469027462 [0,0,0,0,0,1|1,0,0]=2 1217 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O MCULE-4796013964 [0,0,0,0,0,1|1,0,0]=2 1218 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O MCULE-9408226443 [0,0,0,0,0,1|1,0,0]=2 1219 B9R0.7 CC(=O)OC[C@H](N)C(=O)O MCULE-1751945139 [0,0,0,0,0,1|1,0,0]=2 1220 B9R0.7 CC(=O)OC[C@H](N)C(=O)O MCULE-3822387628 [0,0,0,0,0,1|1,0,0]=2 1221 B9R0.7 CC(=O)OC[C@H](N)C(=O)O MCULE-6052634347 [0,0,0,0,0,1|1,0,0]=2 1222 B9R0.7 CC(=O)OC[C@H](N)C(=O)O MCULE-6909390355 [0,0,0,0,0,1|1,0,0]=2 1223 B9R0.7 CC(=O)SCC(C)C(=O)N MCULE-5520753765 [0,0,0,0,0,1|3,0,0]=4 1224 B9R0.7 CC(=O)SCC(C)C(=O)O MCULE-5116238206 [0,0,0,0,0,1|2,0,0]=3 1225 B9R0.7 CC(=O)SCC(N)C(=O)O MCULE-2891442308 [0,0,0,0,0,1|1,0,0]=2 1226 B9R0.7 CC(=O)SCC(N)C(=O)O MCULE-4623851451 [0,0,0,0,0,1|1,0,0]=2 1227 B9R0.7 CC(=O)SC[C@@H](C)C(=O)O MCULE-8028939364 [0,0,0,0,0,1|2,0,0]=3 1228 B9R0.7 CC(=O)SC[C@@H](C)C(=O)O MCULE-8973266419 [0,0,0,0,0,1|2,0,0]=3 1229 B9R0.7 CC(=O)SC[C@H](N)C(=O)O MCULE-1698125004 [0,0,0,0,0,1|1,0,0]=2 1230 B9R0.7 CC(=O)SC[C@H](N)C(=O)O MCULE-6046193594 [0,0,0,0,0,1|1,0,0]=2 1231 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-1719574078 [0,0,0,0,0,1|2,0,1]=4 1232 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-7494642848 [0,0,0,0,0,1|2,0,1]=4 1233 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-7934601656 [0,0,0,0,0,1|2,0,1]=4 1234 B9R0.7 CC(C)CC[C@@H](N)C(=O)O MCULE-3738071496 [0,0,0,0,0,1|2,0,1]=4 1235 B9R0.7 CC(C)CC[C@@H](N)C(=O)O MCULE-6646418122 [0,0,0,0,0,1|2,0,1]=4 1236 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-1152840736 [0,0,0,0,0,1|2,0,1]=4 1237 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-2931632246 [0,0,0,0,0,1|2,0,1]=4 1238 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-6463365282 [0,0,0,0,0,1|2,0,1]=4 1239 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-7649870164 [0,0,0,0,0,1|2,0,1]=4 1240 B9R0.7 CC(C)OC[C@H](N)C(=O)O MCULE-1578143302 [0,0,0,0,0,1|2,0,1]=4 1241 B9R0.7 CC(C)SCC(N)C(=O)O MCULE-2486867814 [0,0,0,0,0,1|2,0,1]=4 1242 B9R0.7 CC(CCC(=O)O)C(=O)O MCULE-1523371907 [0,0,0,0,0,1|1,0,0]=2 1243 B9R0.7 CC(CCC(=O)O)C(=O)O MCULE-1939523418 [0,0,0,0,0,1|1,0,0]=2 1244 B9R0.7 CC(CNC(=O)N)C(=O)O MCULE-6367938073 [0,0,0,0,0,1|2,0,0]=3 1245 B9R0.7 CC(NCC(=O)O)C(=O)O MCULE-1111290878 [0,0,0,0,0,1|1,0,0]=2 1246 B9R0.7 CC(NCC(=O)O)C(=O)O MCULE-6569987660 [0,0,0,0,0,1|1,0,0]=2 1247 B9R0.7 CC(SCC(=O)O)C(=O)O MCULE-8523268796 [0,0,0,0,0,1|1,0,0]=2 1248 B9R0.7 CN(C)CCC(N)C(=O)O MCULE-8874115334 [0,0,0,0,0,1|3,0,0]=4 1249 B9R0.7 CN(C)CC[C@H](N)C(=O)O MCULE-7859718042 [0,0,0,0,0,1|3,0,0]=4 1250 B9R0.7 CN(C)CC[C@H](N)C(=O)O MCULE-7883746105 [0,0,0,0,0,1|3,0,0]=4 1251 B9R0.7 CS(=O)CCC(N)C(=O)O MCULE-2810141962 [0,0,0,0,0,1|2,0,0]=3 1252 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O MCULE-3901672243 [0,0,0,0,0,1|2,0,0]=3 1253 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O MCULE-3967415982 [0,0,0,0,0,1|2,0,0]=3 1254 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O MCULE-6481206030 [0,0,0,0,0,1|2,0,0]=3 1255 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O MCULE-6787807393 [0,0,0,0,0,1|2,0,0]=3 1256 B9R0.7 CS(=O)CC[C@H](N)C(=O)O MCULE-1832499155 [0,0,0,0,0,1|2,0,0]=3 1257 B9R0.7 C[C@@H](CCC(=O)O)C(=O)O MCULE-7515023265 [0,0,0,0,0,1|1,0,0]=2 1258 B9R0.7 C[C@H](CCC(=O)O)C(=O)O MCULE-8441860655 [0,0,0,0,0,1|1,0,0]=2 1259 B9R0.7 C[C@H](CCC(=O)O)C(=O)O MCULE-9071150671 [0,0,0,0,0,1|1,0,0]=2 1260 B9R0.7 C[C@H](CC[N+](=O)[O-])C(=O)O MCULE-1884928652 [0,0,0,0,0,1|2,0,1]=4 1261 B9R0.7 C[C@H](NCC(=O)O)C(=O)O MCULE-1511229567 [0,0,0,0,0,1|1,0,0]=2 1262 B9R0.7 C[C@H](NCC(=O)O)C(=O)O MCULE-4530562082 [0,0,0,0,0,1|1,0,0]=2 1263 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-1226059178 [0,0,0,0,0,1|3,0,0]=4 1264 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-2190014040 [0,0,0,0,0,1|3,0,0]=4 1265 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-5712047901 [0,0,0,0,0,1|3,0,0]=4 1266 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-6819299220 [0,0,0,0,0,1|3,0,0]=4 1267 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-9030836699 [0,0,0,0,0,1|3,0,0]=4 1268 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O MCULE-4590755313 [0,0,0,0,0,1|3,0,0]=4 1269 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O MCULE-5450461647 [0,0,0,0,0,1|3,0,0]=4 1270 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O MCULE-6366850762 [0,0,0,0,0,1|3,0,0]=4 1271 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-1022001641 [0,0,0,0,0,1|3,0,0]=4 1272 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-2164538601 [0,0,0,0,0,1|3,0,0]=4 1273 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-4494909498 [0,0,0,0,0,1|3,0,0]=4 1274 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-6858051266 [0,0,0,0,0,1|3,0,0]=4 1275 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-7758450855 [0,0,0,0,0,1|3,0,0]=4 1276 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-8877605547 [0,0,0,0,0,1|3,0,0]=4 1277 B9R0.7 N=C(N)NCC(N)C(=O)O MCULE-1177262947 [0,0,0,0,0,1|2,0,0]=3 1278 B9R0.7 N=C(N)NCC(N)C(=O)O MCULE-2474644851 [0,0,0,0,0,1|2,0,0]=3 1279 B9R0.7 N=C(N)NCC(N)C(=O)O MCULE-5671557476 [0,0,0,0,0,1|2,0,0]=3 1280 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-3050097417 [0,0,0,0,0,1|2,0,0]=3 1281 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-3499032906 [0,0,0,0,0,1|2,0,0]=3 1282 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-4835798272 [0,0,0,0,0,1|2,0,0]=3 1283 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-8355456866 [0,0,0,0,0,1|2,0,0]=3 1284 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-8635327390 [0,0,0,0,0,1|2,0,0]=3 1285 B9R0.7 NC(=O)C(N)CCC(=O)O MCULE-7109792615 [0,0,0,0,0,1|1,0,0]=2 1286 B9R0.7 NC(=O)C(N)CCC(=O)O MCULE-8741984156 [0,0,0,0,0,1|1,0,0]=2 1287 B9R0.7 NC(=O)CCC(N)C(=O)O MCULE-1418655814 [0,0,0,0,0,1|1,0,0]=2 1288 B9R0.7 NC(=O)CC[C@@H](N)C(=O)N MCULE-3069717045 [0,0,0,0,0,1|2,0,0]=3 1289 B9R0.7 NC(=O)CC[C@@H](N)C(=O)N MCULE-3964283106 [0,0,0,0,0,1|2,0,0]=3 1290 B9R0.7 NC(=O)CC[C@@H](N)C(=O)N MCULE-8749190773 [0,0,0,0,0,1|2,0,0]=3 1291 B9R0.7 NC(=O)CC[C@@H](N)C(=O)N MCULE-8900435477 [0,0,0,0,0,1|2,0,0]=3 1292 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O MCULE-7870225738 [0,0,0,0,0,1|1,0,0]=2 1293 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O MCULE-9711806580 [0,0,0,0,0,1|1,0,0]=2 1294 B9R0.7 NC(=O)CC[C@H](N)C(=O)N MCULE-2293558876 [0,0,0,0,0,1|2,0,0]=3 1295 B9R0.7 NC(=O)CC[C@H](N)C(=O)N MCULE-5457304555 [0,0,0,0,0,1|2,0,0]=3 1296 B9R0.7 NC(=O)CC[C@H](N)C(=O)N MCULE-7482897734 [0,0,0,0,0,1|2,0,0]=3 1297 B9R0.7 NC(=O)CC[C@H](N)C(=O)N MCULE-9074108708 [0,0,0,0,0,1|2,0,0]=3 1298 B9R0.7 NC(=O)CC[C@H](N)C(=O)O MCULE-7234937947 [0,0,0,0,0,1|1,0,0]=2 1299 B9R0.7 NC(=O)CC[C@H](N)C(=O)O MCULE-8718820108 [0,0,0,0,0,1|1,0,0]=2 1300 B9R0.7 NC(=O)NCC(N)C(=O)O MCULE-4609961006 [0,0,0,0,0,1|1,0,0]=2 1301 B9R0.7 NC(=O)NC[C@@H](N)C(=O)O MCULE-7506737023 [0,0,0,0,0,1|1,0,0]=2 1302 B9R0.7 NC(=O)NC[C@H](N)C(=O)O MCULE-3123973606 [0,0,0,0,0,1|1,0,0]=2 1303 B9R0.7 NC(=O)NC[C@H]([NH3+])C(=O)[O-] MCULE-2674726108 [0,0,0,0,0,1|1,0,2]=4 1304 B9R0.7 NC(=O)SCC(N)C(=O)O MCULE-7865241343 [0,0,0,0,0,1|1,0,0]=2 1305 B9R0.7 NC(=O)SC[C@H](N)C(=O)O MCULE-6647567669 [0,0,0,0,0,1|1,0,0]=2 1306 B9R0.7 NC(=O)SC[C@H](N)C(=O)O MCULE-7995535877 [0,0,0,0,0,1|1,0,0]=2 1307 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O MCULE-7404893649 [0,0,0,0,0,1|1,0,0]=2 1308 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O MCULE-7580681383 [0,0,0,0,0,1|1,0,0]=2 1309 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-3142698040 [0,0,0,0,0,1|1,0,0]=2 1310 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-3865619229 [0,0,0,0,0,1|1,0,0]=2 1311 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-8184010011 [0,0,0,0,0,1|1,0,0]=2 1312 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-8981731652 [0,0,0,0,0,1|1,0,0]=2 1313 B9R0.7 NC(CCC(=O)O)C(=O)O MCULE-4203507491 [0,0,0,0,0,1|0,0,0]=1 1314 B9R0.7 NC(CCC(=O)O)C(=O)O MCULE-4600207704 [0,0,0,0,0,1|0,0,0]=1 1315 B9R0.7 NC(CCC(=O)O)C(=O)O MCULE-8107432729 [0,0,0,0,0,1|0,0,0]=1 1316 B9R0.7 NC(CCC(=O)[O-])C(=O)O MCULE-5012956158 [0,0,0,0,0,1|0,0,1]=2 1317 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-6077524166 [0,0,0,0,0,1|0,0,0]=1 1318 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-7201150413 [0,0,0,0,0,1|0,0,0]=1 1319 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-7328895736 [0,0,0,0,0,1|0,0,0]=1 1320 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-7782530856 [0,0,0,0,0,1|0,0,0]=1 1321 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-9447720868 [0,0,0,0,0,1|0,0,0]=1 1322 B9R0.7 N[C@@H](CCC(=O)O)C(=O)[O-] MCULE-3042990215 [0,0,0,0,0,1|0,0,1]=2 1323 B9R0.7 N[C@@H](CCC(=O)O)C(O)O MCULE-4882070910 [0,0,0,0,0,1|0,0,2]=3 1324 B9R0.7 N[C@@H](CCC(=O)[O-])C(=O)O MCULE-2315425063 [0,0,0,0,0,1|0,0,1]=2 1325 B9R0.7 N[C@@H](CCC(=O)[O-])C(=O)O MCULE-4367391999 [0,0,0,0,0,1|0,0,1]=2 1326 B9R0.7 N[C@H](CCC(=O)O)C(=O)O MCULE-5884691541 [0,0,0,0,0,1|0,0,0]=1 1327 B9R0.7 N[C@H](CCC(=O)O)C(=O)O MCULE-6647836957 [0,0,0,0,0,1|0,0,0]=1 1328 B9R0.7 O=C(O)CCC(=O)C(=O)O MCULE-5148157449 [0,0,0,0,0,1|1,0,1]=3 1329 B9R0.7 O=C(O)CCC(=O)C(=O)[O-] MCULE-3585102694 [0,0,0,0,0,1|1,0,2]=4 1330 B9R0.7 O=C(O)CCC(Cl)C(=O)O MCULE-8696439839 [0,0,0,0,0,1|1,0,0]=2 1331 B9R0.7 O=C(O)CCC(O)C(=O)O MCULE-5732806069 [0,0,0,0,0,1|1,0,0]=2 1332 B9R0.7 O=C(O)CC[C@@H](O)C(=O)O MCULE-2990674754 [0,0,0,0,0,1|1,0,0]=2 1333 B9R0.7 O=C(O)CC[C@@H](O)C(=O)O MCULE-9463608806 [0,0,0,0,0,1|1,0,0]=2 1334 B9R0.7 O=C(O)CC[C@H](Br)C(=O)O MCULE-3541564241 [0,0,0,0,0,1|1,0,0]=2 1335 B9R0.7 O=C(O)CC[C@H](Br)C(=O)O MCULE-5484001209 [0,0,0,0,0,1|1,0,0]=2 1336 B9R0.7 O=C(O)CC[C@H](Cl)C(=O)O MCULE-4338578978 [0,0,0,0,0,1|1,0,0]=2 1337 B9R0.7 O=C(O)CC[C@H](O)C(=O)O MCULE-4494756126 [0,0,0,0,0,1|1,0,0]=2 1338 B9R0.7 O=C(O)CNC(=O)C(=O)O MCULE-6181171802 [0,0,0,0,0,1|1,0,1]=3 1339 B9R0.7 O=C([O-])CCC(=O)C(=O)O MCULE-3931336643 [0,0,0,0,0,1|1,0,2]=4 1340 B9R0.7 O=C([O-])CCC(O)C(=O)[O-] MCULE-1880842258 [0,0,0,0,0,1|1,0,2]=4 1341 B9R0.7 O=C([O-])CCC(O)C(=O)[O-] MCULE-4254561979 [0,0,0,0,0,1|1,0,2]=4 1342 B9R0.7 O=C([O-])CCC(O)C(=O)[O-] MCULE-4348197971 [0,0,0,0,0,1|1,0,2]=4 1343 B9R0.7 O=C([O-])CC[C@@H](O)C(=O)[O-] MCULE-2376048296 [0,0,0,0,0,1|1,0,2]=4 1344 B9R0.7 O=C([O-])CC[C@@H](O)C(=O)[O-] MCULE-3046517186 [0,0,0,0,0,1|1,0,2]=4 1345 B9R0.7 O=C([O-])CC[C@H](O)C(=O)[O-] MCULE-2350068178 [0,0,0,0,0,1|1,0,2]=4 1346 B9R0.7 O=C([O-])CC[C@H](O)C(=O)[O-] MCULE-8971415546 [0,0,0,0,0,1|1,0,2]=4 1347 B9R0.7 P(=O)(O)CC[C@H](N)C(=O)O MCULE-2875179933 [0,0,0,0,0,1|1,0,0]=2 1348 B9R0.7 [C@H](N)(CCC(=O)O)C(=O)N MCULE-1881473683 [0,0,0,0,0,1|1,0,0]=2 1349 B9R0.7 [C@H](N)(CCC(=O)O)C(=O)O MCULE-8526087521 [0,0,0,0,0,1|0,0,0]=1 1350 B9R0.7 [C@H](N)(CCS(=O)C)C(=O)O MCULE-2995684872 [0,0,0,0,0,1|2,0,0]=3 1351 B9R0.7 [C@H](O)(CCC(=O)O)C(=O)O MCULE-8564542509 [0,0,0,0,0,1|1,0,0]=2 1352 B9R0.7 [NH3+][C@@H](CCC(=O)[O-])C(=O)[O-] MCULE-6350748495 [0,0,0,0,0,1|0,0,3]=4 1353 B9R0.53 C/C(=C\C(=O)O)/CC(=O)O MCULE-1345660635 [0,0,0,0,0,1|1,0,1]=3 1354 B9R0.53 CC(=CC(=O)O)CC(=O)O MCULE-8165055939 [0,0,0,0,0,1|1,0,1]=3 1355 B9R0.53 CC(=O)NC(C)CC(=O)O MCULE-8603148812 [0,0,0,0,0,1|2,0,0]=3 1356 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-3491123553 [0,0,0,0,0,1|2,0,1]=4 1357 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-4917004131 [0,0,0,0,0,1|2,0,1]=4 1358 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-9751191377 [0,0,0,0,0,1|2,0,1]=4 1359 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-1906257031 [0,0,0,0,0,1|2,0,1]=4 1360 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-5676550364 [0,0,0,0,0,1|2,0,1]=4 1361 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-8752852377 [0,0,0,0,0,1|2,0,1]=4 1362 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-9926372034 [0,0,0,0,0,1|2,0,1]=4 1363 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-5502640895 [0,0,0,0,0,1|2,0,1]=4 1364 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-5602246196 [0,0,0,0,0,1|2,0,1]=4 1365 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-6522397846 [0,0,0,0,0,1|2,0,1]=4 1366 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-8594791252 [0,0,0,0,0,1|2,0,1]=4 1367 B9R0.53 CC(CC(=O)N)CC(=O)N MCULE-8411499627 [0,0,0,0,0,1|3,0,0]=4 1368 B9R0.53 CC(CC(=O)O)CC(=O)O MCULE-7399673381 [0,0,0,0,0,1|1,0,0]=2 1369 B9R0.53 CC(CC(=O)O)NC(=O)N MCULE-2917505998 [0,0,0,0,0,1|2,0,0]=3 1370 B9R0.53 CN(CC(=O)O)CC(=O)O MCULE-6535937676 [0,0,0,0,0,1|2,0,0]=3 1371 B9R0.53 CN(CC(=O)O)CC(=O)O MCULE-9119313390 [0,0,0,0,0,1|2,0,0]=3 1372 B9R0.53 NC(CC(=O)O)CC(=O)O MCULE-4205352281 [0,0,0,0,0,1|0,0,0]=1 1373 B9R0.53 NC(CC(=O)O)CC(=O)O MCULE-5754399431 [0,0,0,0,0,1|0,0,0]=1 1374 B9R0.53 NN(CC(=O)O)CC(=O)O MCULE-6707699178 [0,0,0,0,0,1|1,0,0]=2 1375 B9R0.53 O=C(O)C=C(Cl)CC(=O)O MCULE-4643738898 [0,0,0,0,0,1|1,0,1]=3 1376 B9R0.53 O=C(O)CC(=O)CC(=O)O MCULE-7760127170 [0,0,0,0,0,1|1,0,1]=3 1377 B9R0.53 O=C(O)CC(O)CC(=O)O MCULE-7670149511 [0,0,0,0,0,1|1,0,0]=2 1378 B9R0.53 O=C(O)CS(=O)CC(=O)O MCULE-8117628584 [0,0,0,0,0,1|2,0,0]=3 1379 B6R0.1 C=CC(N)CCO MCULE-7781906138 [2,0,0,0,0,0|1,0,1]=4 1380 B6R0.1 C=CCC(C)C=O MCULE-3981206051 [2,0,0,0,0,0|2,0,0]=4 1381 B6R0.1 C=CCC(N)CO MCULE-3854217705 [2,0,0,0,0,0|1,0,1]=4 1382 B6R0.1 C=CCC(N)CO MCULE-6104194102 [2,0,0,0,0,0|1,0,1]=4 1383 B6R0.1 C=CCC(N)CO MCULE-6473126335 [2,0,0,0,0,0|1,0,1]=4 1384 B6R0.1 C=CCC(N)CO MCULE-8430673873 [2,0,0,0,0,0|1,0,1]=4 1385 B6R0.1 C=CC[C@@H](N)CO MCULE-1869015815 [2,0,0,0,0,0|1,0,1]=4 1386 B6R0.1 C=CC[C@@H](N)CO MCULE-2792980070 [2,0,0,0,0,0|1,0,1]=4 1387 B6R0.1 C=CC[C@@H](N)CO MCULE-3168704187 [2,0,0,0,0,0|1,0,1]=4 1388 B6R0.1 C=CC[C@@H](N)CO MCULE-4796522209 [2,0,0,0,0,0|1,0,1]=4 1389 B6R0.1 C=CC[C@H](C)C=O MCULE-6968117309 [2,0,0,0,0,0|2,0,0]=4 1390 B6R0.1 C=CC[C@H](N)CO MCULE-2427943513 [2,0,0,0,0,0|1,0,1]=4 1391 B6R0.1 C=CC[C@H](N)CO MCULE-4244461120 [2,0,0,0,0,0|1,0,1]=4 1392 B6R0.1 C=CC[C@H](N)CO MCULE-6760610212 [2,0,0,0,0,0|1,0,1]=4 1393 B6R0.1 C=CC[C@H](N)CO MCULE-7914934929 [2,0,0,0,0,0|1,0,1]=4 1394 B6R0.1 NC(CO)CCO MCULE-3703088648 [2,0,0,0,0,0|0,0,2]=4 1395 B6R0.1 NC(CO)CCO MCULE-7609576462 [2,0,0,0,0,0|0,0,2]=4 1396 B6R0.1 N[C@@H](CO)CCO MCULE-4583236919 [2,0,0,0,0,0|0,0,2]=4 1397 B6R0.1 N[C@@H](CO)CCO MCULE-5489716742 [2,0,0,0,0,0|0,0,2]=4 1398 B6R0.1 N[C@H](CO)CCO MCULE-5338659573 [2,0,0,0,0,0|0,0,2]=4 1399 B6R0.1 N[C@H](CO)CCO MCULE-8998003003 [2,0,0,0,0,0|0,0,2]=4 1400 B6R0.2 C=C(C)CC(=O)O MCULE-5404023928 [2,0,0,0,0,0|1,0,1]=4 1401 B6R0.2 C=C(I)CC(=O)O MCULE-3849925169 [2,0,0,0,0,0|1,0,1]=4 1402 B6R0.2 CC(=O)CC(=O)N MCULE-1618058771 [2,0,0,0,0,0|1,0,1]=4 1403 B6R0.2 CC(=O)CC(=O)O MCULE-2601276539 [2,0,0,0,0,0|1,0,1]=4 1404 B6R0.2 CC(=O)CC(C)N MCULE-1028280795 [2,0,0,0,0,0|1,0,1]=4 1405 B6R0.2 CC(=O)CC(C)N MCULE-7911343070 [2,0,0,0,0,0|1,0,1]=4 1406 B6R0.2 CC(=O)CC(C)O MCULE-5175367575 [2,0,0,0,0,0|2,0,0]=4 1407 B6R0.2 CC(=O)C[C@@H](C)N MCULE-1260669737 [2,0,0,0,0,0|1,0,1]=4 1408 B6R0.2 CC(=O)C[C@@H](C)N MCULE-6556661125 [2,0,0,0,0,0|1,0,1]=4 1409 B6R0.2 CC(Br)CC(=O)O MCULE-3353526571 [2,0,0,0,0,0|1,0,1]=4 1410 B6R0.2 CC(C)CC(=O)O MCULE-5805071360 [2,0,0,0,0,0|1,0,1]=4 1411 B6R0.2 CC(Cl)CC(=O)O MCULE-1436146199 [2,0,0,0,0,0|1,0,1]=4 1412 B6R0.2 CC(F)CC(=O)O MCULE-9214258715 [2,0,0,0,0,0|1,0,1]=4 1413 B6R0.2 CC(N)CC(=O)N MCULE-8604112274 [2,0,0,0,0,0|1,0,1]=4 1414 B6R0.2 CC(N)CC(=O)N MCULE-8651032460 [2,0,0,0,0,0|1,0,1]=4 1415 B6R0.2 CC(N)CC(=O)O MCULE-2960589915 [2,0,0,0,0,0|0,0,1]=3 1416 B6R0.2 CC(N)CC(=O)O MCULE-5772407106 [2,0,0,0,0,0|0,0,1]=3 1417 B6R0.2 CC(N)CC(=O)O MCULE-7818257350 [2,0,0,0,0,0|0,0,1]=3 1418 B6R0.2 CC(N)CC(=O)O MCULE-7847644131 [2,0,0,0,0,0|0,0,1]=3 1419 B6R0.2 CC(O)CC(=O)N MCULE-7442557911 [2,0,0,0,0,0|2,0,0]=4 1420 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [2,0,0,0,0,0|1,0,0]=3 1421 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [2,0,0,0,0,0|1,0,0]=3 1422 B6R0.2 CC(O)CC(=O)[O-] MCULE-1109368801 [2,0,0,0,0,0|1,0,1]=4 1423 B6R0.2 CC(O)CC(=O)[O-] MCULE-5681138302 [2,0,0,0,0,0|1,0,1]=4 1424 B6R0.2 C[C@@H](N)CC(=O)O MCULE-2652696372 [2,0,0,0,0,0|0,0,1]=3 1425 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7054489636 [2,0,0,0,0,0|0,0,1]=3 1426 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7621851215 [2,0,0,0,0,0|0,0,1]=3 1427 B6R0.2 C[C@@H](N)CC(=O)O MCULE-8671397640 [2,0,0,0,0,0|0,0,1]=3 1428 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [2,0,0,0,0,0|1,0,0]=3 1429 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [2,0,0,0,0,0|1,0,0]=3 1430 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7081161048 [2,0,0,0,0,0|1,0,1]=4 1431 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7886150665 [2,0,0,0,0,0|1,0,1]=4 1432 B6R0.2 C[C@H](Br)CC(=O)O MCULE-1601745040 [2,0,0,0,0,0|1,0,1]=4 1433 B6R0.2 C[C@H](Br)CC(=O)O MCULE-2894930407 [2,0,0,0,0,0|1,0,1]=4 1434 B6R0.2 C[C@H](N)CC(=O)O MCULE-2656839691 [2,0,0,0,0,0|0,0,1]=3 1435 B6R0.2 C[C@H](N)CC(=O)O MCULE-4695512293 [2,0,0,0,0,0|0,0,1]=3 1436 B6R0.2 C[C@H](N)CC(=O)O MCULE-5288044169 [2,0,0,0,0,0|0,0,1]=3 1437 B6R0.2 C[C@H](N)CC(=O)O MCULE-6641912058 [2,0,0,0,0,0|0,0,1]=3 1438 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [2,0,0,0,0,0|1,0,0]=3 1439 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [2,0,0,0,0,0|1,0,0]=3 1440 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-3624690550 [2,0,0,0,0,0|1,0,1]=4 1441 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-5550257128 [2,0,0,0,0,0|1,0,1]=4 1442 B6R0.2 NC(=O)CC(=O)N MCULE-7675159766 [2,0,0,0,0,0|1,0,1]=4 1443 B6R0.2 NC(=O)CC(=O)O MCULE-1168254626 [2,0,0,0,0,0|0,0,1]=3 1444 B6R0.2 NC(F)CC(=O)O MCULE-1563194776 [2,0,0,0,0,0|1,0,0]=3 1445 B6R0.2 NC(F)CC(=O)O MCULE-1655564430 [2,0,0,0,0,0|1,0,0]=3 1446 B6R0.2 O=C(O)CB(O)O MCULE-6408403753 [2,0,0,0,0,0|2,0,0]=4 1447 B6R0.2 O=C(O)CC(=O)O MCULE-5893043131 [2,0,0,0,0,0|1,0,1]=4 1448 B6R0.2 O=C(O)CC(F)F MCULE-9388620099 [2,0,0,0,0,0|2,0,0]=4 1449 B6R0.2 O=C(O)CN(=O)=O MCULE-4962751453 [2,0,0,0,0,0|2,0,0]=4 1450 B6R0.4 C#CCCC(=O)O MCULE-6669146060 [2,0,0,0,0,0|1,0,1]=4 1451 B6R0.4 C/C=C/CC(=O)O MCULE-4626577048 [2,0,0,0,0,0|1,0,1]=4 1452 B6R0.4 C=CCCC(=O)C MCULE-9598399930 [2,0,0,0,0,0|2,0,0]=4 1453 B6R0.4 C=CCCC(=O)Cl MCULE-7378353157 [2,0,0,0,0,0|2,0,0]=4 1454 B6R0.4 C=CCCC(=O)N MCULE-7202462484 [2,0,0,0,0,0|2,0,0]=4 1455 B6R0.4 C=CCCC(=O)O MCULE-6221951425 [2,0,0,0,0,0|1,0,0]=3 1456 B6R0.4 C=CNCC(=O)O MCULE-5142273921 [2,0,0,0,0,0|2,0,0]=4 1457 B6R0.4 CC(=O)CCC=O MCULE-4767690464 [2,0,0,0,0,0|1,0,0]=3 1458 B6R0.4 CC(=O)CCCO MCULE-1335342150 [2,0,0,0,0,0|1,0,1]=4 1459 B6R0.4 CC=CCC(=O)O MCULE-9174714653 [2,0,0,0,0,0|1,0,1]=4 1460 B6R0.4 CCCCC(=O)O MCULE-2333640078 [2,0,0,0,0,0|1,0,1]=4 1461 B6R0.4 CNCCC(=O)O MCULE-3627988097 [2,0,0,0,0,0|2,0,0]=4 1462 B6R0.4 CNCCC(=O)O MCULE-9858204248 [2,0,0,0,0,0|2,0,0]=4 1463 B6R0.4 COCCC(=O)O MCULE-3436347115 [2,0,0,0,0,0|2,0,0]=4 1464 B6R0.4 CSCCC(=O)O MCULE-9550032941 [2,0,0,0,0,0|2,0,0]=4 1465 B6R0.4 N#CCCC(=O)O MCULE-3165189228 [2,0,0,0,0,0|1,0,1]=4 1466 B6R0.4 NC(=O)CCCO MCULE-3779341561 [2,0,0,0,0,0|1,0,1]=4 1467 B6R0.4 NCCCC(=O)O MCULE-3615304273 [2,0,0,0,0,0|1,0,1]=4 1468 B6R0.4 NCCCC(=O)O MCULE-7613134021 [2,0,0,0,0,0|1,0,1]=4 1469 B6R0.4 NOCCC(=O)O MCULE-1529492904 [2,0,0,0,0,0|2,0,0]=4 1470 B6R0.4 NOCCC(=O)O MCULE-6297331357 [2,0,0,0,0,0|2,0,0]=4 1471 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [2,0,0,0,0,0|1,0,1]=4 1472 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [2,0,0,0,0,0|1,0,1]=4 1473 B6R0.4 O=C(O)CCCF MCULE-2415675768 [2,0,0,0,0,0|1,0,1]=4 1474 B6R0.4 O=C(O)CCCI MCULE-7794841553 [2,0,0,0,0,0|1,0,1]=4 1475 B6R0.4 O=C(O)CCCS MCULE-3352840152 [2,0,0,0,0,0|0,1,1]=4 1476 B6R0.4 O=C(O)CNCO MCULE-4092998319 [2,0,0,0,0,0|1,0,1]=4 1477 B6R0.4 O=CCCC(=O)O MCULE-7183864722 [2,0,0,0,0,0|0,0,0]=2 1478 B6R0.4 O=CCCN(=O)=O MCULE-3692892497 [2,0,0,0,0,0|1,0,1]=4 1479 B6R0.4 O=CNCC(=O)O MCULE-3251128290 [2,0,0,0,0,0|1,0,0]=3 1480 B6R0.3 C(N)(CO)C(=O)N MCULE-5512645571 [2,0,0,0,0,0|1,0,0]=3 1481 B6R0.3 C(N)(CO)C(=O)N MCULE-5852943337 [2,0,0,0,0,0|1,0,0]=3 1482 B6R0.3 C=C(CO)C(=O)O MCULE-9731648602 [2,0,0,0,0,0|1,0,1]=4 1483 B6R0.3 C=CC(C)C(=O)O MCULE-7280145889 [2,0,0,0,0,0|1,0,1]=4 1484 B6R0.3 C=CC(N)C(=O)O MCULE-2000511750 [2,0,0,0,0,0|0,0,1]=3 1485 B6R0.3 C=CC(N)C(=O)O MCULE-7504415267 [2,0,0,0,0,0|0,0,1]=3 1486 B6R0.3 C=CC(N)C(=O)O MCULE-9012490000 [2,0,0,0,0,0|0,0,1]=3 1487 B6R0.3 C=CC(N)C(=O)O MCULE-9978294266 [2,0,0,0,0,0|0,0,1]=3 1488 B6R0.3 C=CC(O)C(=O)O MCULE-3847595710 [2,0,0,0,0,0|1,0,1]=4 1489 B6R0.3 C=C[C@@H](C)C(=O)O MCULE-9719548038 [2,0,0,0,0,0|1,0,1]=4 1490 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-3678761806 [2,0,0,0,0,0|0,0,1]=3 1491 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6682447306 [2,0,0,0,0,0|0,0,1]=3 1492 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6779191781 [2,0,0,0,0,0|0,0,1]=3 1493 B6R0.3 C=C[C@H](C)C(=O)O MCULE-1694697840 [2,0,0,0,0,0|1,0,1]=4 1494 B6R0.3 C=C[C@H](C)C(=O)O MCULE-2601438258 [2,0,0,0,0,0|1,0,1]=4 1495 B6R0.3 C=C[C@H](C)C(=O)O MCULE-6098133430 [2,0,0,0,0,0|1,0,1]=4 1496 B6R0.3 C=C[C@H](N)C(=O)O MCULE-2657488498 [2,0,0,0,0,0|0,0,1]=3 1497 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5103456570 [2,0,0,0,0,0|0,0,1]=3 1498 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5936124947 [2,0,0,0,0,0|0,0,1]=3 1499 B6R0.3 C=C[C@H](N)C(=O)O MCULE-9631686254 [2,0,0,0,0,0|0,0,1]=3 1500 B6R0.3 CC(=O)C(Br)C=O MCULE-6904531970 [2,0,0,0,0,0|2,0,0]=4 1501 B6R0.3 CC(=O)C(C)C=O MCULE-7133682970 [2,0,0,0,0,0|2,0,0]=4 1502 B6R0.3 CC(=O)C(C)CO MCULE-9026658672 [2,0,0,0,0,0|2,0,0]=4 1503 B6R0.3 CC(=O)C(N)CO MCULE-4063057020 [2,0,0,0,0,0|1,0,0]=3 1504 B6R0.3 CC(=O)[C@@H](N)CO MCULE-9046372356 [2,0,0,0,0,0|1,0,0]=3 1505 B6R0.3 CC(CBr)C(=O)O MCULE-1430003780 [2,0,0,0,0,0|2,0,0]=4 1506 B6R0.3 CC(CF)C(=O)O MCULE-7390028409 [2,0,0,0,0,0|2,0,0]=4 1507 B6R0.3 CC(CN)C(=O)O MCULE-5485986433 [2,0,0,0,0,0|2,0,0]=4 1508 B6R0.3 CC(CN)C(=O)O MCULE-5638884438 [2,0,0,0,0,0|2,0,0]=4 1509 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [2,0,0,0,0,0|1,0,0]=3 1510 B6R0.3 CC(CO)C(=O)[O-] MCULE-6956620176 [2,0,0,0,0,0|1,0,1]=4 1511 B6R0.3 CC(CS)C(=O)O MCULE-9982386135 [2,0,0,0,0,0|1,1,0]=4 1512 B6R0.3 CC(O)C(N)CO MCULE-7733336449 [2,0,0,0,0,0|1,0,1]=4 1513 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [2,0,0,0,0,0|1,0,1]=4 1514 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [2,0,0,0,0,0|1,0,1]=4 1515 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [2,0,0,0,0,0|1,0,1]=4 1516 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [2,0,0,0,0,0|1,0,1]=4 1517 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [2,0,0,0,0,0|1,0,1]=4 1518 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [2,0,0,0,0,0|1,0,1]=4 1519 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [2,0,0,0,0,0|1,0,1]=4 1520 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [2,0,0,0,0,0|1,0,1]=4 1521 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [2,0,0,0,0,0|1,0,1]=4 1522 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [2,0,0,0,0,0|0,0,1]=3 1523 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [2,0,0,0,0,0|0,0,1]=3 1524 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [2,0,0,0,0,0|0,0,1]=3 1525 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [2,0,0,0,0,0|0,0,1]=3 1526 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [2,0,0,0,0,0|1,0,1]=4 1527 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [2,0,0,0,0,0|1,0,1]=4 1528 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [2,0,0,0,0,0|1,0,1]=4 1529 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [2,0,0,0,0,0|1,0,1]=4 1530 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [2,0,0,0,0,0|1,0,1]=4 1531 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [2,0,0,0,0,0|1,0,1]=4 1532 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [2,0,0,0,0,0|1,0,1]=4 1533 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [2,0,0,0,0,0|1,0,1]=4 1534 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [2,0,0,0,0,0|1,0,1]=4 1535 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [2,0,0,0,0,0|1,0,1]=4 1536 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [2,0,0,0,0,0|1,0,1]=4 1537 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [2,0,0,0,0,0|1,0,1]=4 1538 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [2,0,0,0,0,0|1,0,1]=4 1539 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [2,0,0,0,0,0|0,0,1]=3 1540 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [2,0,0,0,0,0|0,0,1]=3 1541 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [2,0,0,0,0,0|0,0,1]=3 1542 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [2,0,0,0,0,0|0,0,1]=3 1543 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [2,0,0,0,0,0|1,0,1]=4 1544 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [2,0,0,0,0,0|1,0,1]=4 1545 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [2,0,0,0,0,0|1,0,1]=4 1546 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [2,0,0,0,0,0|1,0,1]=4 1547 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [2,0,0,0,0,0|1,0,1]=4 1548 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [2,0,0,0,0,0|1,0,1]=4 1549 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [2,0,0,0,0,0|1,0,1]=4 1550 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [2,0,0,0,0,0|1,0,1]=4 1551 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [2,0,0,0,0,0|1,0,1]=4 1552 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [2,0,0,0,0,0|1,0,1]=4 1553 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [2,0,0,0,0,0|1,0,1]=4 1554 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [2,0,0,0,0,0|0,0,1]=3 1555 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [2,0,0,0,0,0|0,0,1]=3 1556 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [2,0,0,0,0,0|0,0,1]=3 1557 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [2,0,0,0,0,0|0,0,1]=3 1558 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-2161876558 [2,0,0,0,0,0|0,1,1]=4 1559 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-6045953433 [2,0,0,0,0,0|0,1,1]=4 1560 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [2,0,0,0,0,0|1,0,1]=4 1561 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [2,0,0,0,0,0|1,0,1]=4 1562 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4438181090 [2,0,0,0,0,0|2,0,0]=4 1563 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4599481344 [2,0,0,0,0,0|2,0,0]=4 1564 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5826933618 [2,0,0,0,0,0|2,0,0]=4 1565 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5914856504 [2,0,0,0,0,0|2,0,0]=4 1566 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [2,0,0,0,0,0|1,0,0]=3 1567 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [2,0,0,0,0,0|1,0,0]=3 1568 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-1499224916 [2,0,0,0,0,0|1,0,1]=4 1569 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-3539522955 [2,0,0,0,0,0|1,0,1]=4 1570 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-1381786707 [2,0,0,0,0,0|1,0,1]=4 1571 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-3627537672 [2,0,0,0,0,0|1,0,1]=4 1572 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-5429038645 [2,0,0,0,0,0|1,0,1]=4 1573 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-6146168744 [2,0,0,0,0,0|1,0,1]=4 1574 B6R0.3 C[C@H](CN)C(=O)O MCULE-3703540023 [2,0,0,0,0,0|2,0,0]=4 1575 B6R0.3 C[C@H](CN)C(=O)O MCULE-5714771083 [2,0,0,0,0,0|2,0,0]=4 1576 B6R0.3 C[C@H](CN)C(=O)O MCULE-9009901306 [2,0,0,0,0,0|2,0,0]=4 1577 B6R0.3 C[C@H](CN)C(=O)O MCULE-9217365463 [2,0,0,0,0,0|2,0,0]=4 1578 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [2,0,0,0,0,0|1,0,0]=3 1579 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [2,0,0,0,0,0|1,0,0]=3 1580 B6R0.3 C[C@H](CO)C(=O)[O-] MCULE-5733737039 [2,0,0,0,0,0|1,0,1]=4 1581 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-5329315346 [2,0,0,0,0,0|1,0,1]=4 1582 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7239426628 [2,0,0,0,0,0|1,0,1]=4 1583 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7437797788 [2,0,0,0,0,0|1,0,1]=4 1584 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-2378004602 [2,0,0,0,0,0|1,0,1]=4 1585 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-9436764758 [2,0,0,0,0,0|1,0,1]=4 1586 B6R0.3 NC(=O)C(N)CO MCULE-4842751232 [2,0,0,0,0,0|1,0,0]=3 1587 B6R0.3 NC(=O)C(N)CO MCULE-6854366147 [2,0,0,0,0,0|1,0,0]=3 1588 B6R0.3 NC(=O)C(N)CS MCULE-3144051628 [2,0,0,0,0,0|1,1,0]=4 1589 B6R0.3 NC(=O)C(N)CS MCULE-7739536595 [2,0,0,0,0,0|1,1,0]=4 1590 B6R0.3 NC(=O)[C@@H](N)CO MCULE-2185844038 [2,0,0,0,0,0|1,0,0]=3 1591 B6R0.3 NC(=O)[C@@H](N)CO MCULE-3623516041 [2,0,0,0,0,0|1,0,0]=3 1592 B6R0.3 NC(=O)[C@@H](N)CO MCULE-6218638108 [2,0,0,0,0,0|1,0,0]=3 1593 B6R0.3 NC(=O)[C@@H](N)CS MCULE-9790378691 [2,0,0,0,0,0|1,1,0]=4 1594 B6R0.3 NC(=O)[C@H](N)CO MCULE-2061645482 [2,0,0,0,0,0|1,0,0]=3 1595 B6R0.3 NC(=O)[C@H](N)CO MCULE-5920366137 [2,0,0,0,0,0|1,0,0]=3 1596 B6R0.3 NC(=O)[C@H](N)CO MCULE-7612340519 [2,0,0,0,0,0|1,0,0]=3 1597 B6R0.3 NC(=O)[C@H](N)CO MCULE-7734326153 [2,0,0,0,0,0|1,0,0]=3 1598 B6R0.3 NC(CCl)C(=O)O MCULE-1601405489 [2,0,0,0,0,0|1,0,0]=3 1599 B6R0.3 NC(CCl)C(=O)O MCULE-3020306643 [2,0,0,0,0,0|1,0,0]=3 1600 B6R0.3 NC(CCl)C(=O)O MCULE-5440349631 [2,0,0,0,0,0|1,0,0]=3 1601 B6R0.3 NC(CF)C(=O)O MCULE-3274339636 [2,0,0,0,0,0|1,0,0]=3 1602 B6R0.3 NC(CO)C(=O)O MCULE-2425237422 [2,0,0,0,0,0|0,0,0]=2 1603 B6R0.3 NC(CO)C(=O)O MCULE-6460387318 [2,0,0,0,0,0|0,0,0]=2 1604 B6R0.3 NC(CS)C(=O)O MCULE-1666411258 [2,0,0,0,0,0|0,1,0]=3 1605 B6R0.3 NC(CS)C(=O)O MCULE-2938329352 [2,0,0,0,0,0|0,1,0]=3 1606 B6R0.3 NC(CS)C(=O)O MCULE-7203902929 [2,0,0,0,0,0|0,1,0]=3 1607 B6R0.3 NC(CS)C(=O)O MCULE-7790846545 [2,0,0,0,0,0|0,1,0]=3 1608 B6R0.3 NCC(Br)C(=O)O MCULE-2289205408 [2,0,0,0,0,0|2,0,0]=4 1609 B6R0.3 NCC(Br)C(=O)O MCULE-9361399143 [2,0,0,0,0,0|2,0,0]=4 1610 B6R0.3 NCC(F)C(=O)O MCULE-5666887061 [2,0,0,0,0,0|2,0,0]=4 1611 B6R0.3 NCC(F)C(=O)O MCULE-6134707533 [2,0,0,0,0,0|2,0,0]=4 1612 B6R0.3 NCC(N)C(=O)O MCULE-1867799207 [2,0,0,0,0,0|1,0,0]=3 1613 B6R0.3 NCC(N)C(=O)O MCULE-4853376364 [2,0,0,0,0,0|1,0,0]=3 1614 B6R0.3 NCC(N)C(=O)O MCULE-7636331821 [2,0,0,0,0,0|1,0,0]=3 1615 B6R0.3 NCC(N)C(=O)O MCULE-7735444546 [2,0,0,0,0,0|1,0,0]=3 1616 B6R0.3 NCC(N)C(=O)O MCULE-9197553017 [2,0,0,0,0,0|1,0,0]=3 1617 B6R0.3 NCC(O)C(=O)O MCULE-2137675488 [2,0,0,0,0,0|2,0,0]=4 1618 B6R0.3 NCC(O)C(=O)O MCULE-3348306437 [2,0,0,0,0,0|2,0,0]=4 1619 B6R0.3 NC[C@@H](F)C(=O)O MCULE-3544959183 [2,0,0,0,0,0|2,0,0]=4 1620 B6R0.3 NC[C@@H](F)C(=O)O MCULE-4122418685 [2,0,0,0,0,0|2,0,0]=4 1621 B6R0.3 NC[C@@H](F)C(=O)O MCULE-8592364466 [2,0,0,0,0,0|2,0,0]=4 1622 B6R0.3 NC[C@@H](F)C(=O)O MCULE-9106826144 [2,0,0,0,0,0|2,0,0]=4 1623 B6R0.3 NC[C@@H](N)C(=O)O MCULE-5363126654 [2,0,0,0,0,0|1,0,0]=3 1624 B6R0.3 NC[C@@H](N)C(=O)O MCULE-8998345978 [2,0,0,0,0,0|1,0,0]=3 1625 B6R0.3 NC[C@@H](N)C(=O)O MCULE-9125384126 [2,0,0,0,0,0|1,0,0]=3 1626 B6R0.3 NC[C@@H](O)C(=O)O MCULE-5922773276 [2,0,0,0,0,0|2,0,0]=4 1627 B6R0.3 NC[C@@H](O)C(=O)O MCULE-8921832932 [2,0,0,0,0,0|2,0,0]=4 1628 B6R0.3 NC[C@H](F)C(=O)O MCULE-2695037152 [2,0,0,0,0,0|2,0,0]=4 1629 B6R0.3 NC[C@H](F)C(=O)O MCULE-4323150722 [2,0,0,0,0,0|2,0,0]=4 1630 B6R0.3 NC[C@H](F)C(=O)O MCULE-6701791437 [2,0,0,0,0,0|2,0,0]=4 1631 B6R0.3 NC[C@H](F)C(=O)O MCULE-7674783008 [2,0,0,0,0,0|2,0,0]=4 1632 B6R0.3 NC[C@H](N)C(=O)O MCULE-1389567062 [2,0,0,0,0,0|1,0,0]=3 1633 B6R0.3 NC[C@H](N)C(=O)O MCULE-1833064192 [2,0,0,0,0,0|1,0,0]=3 1634 B6R0.3 NC[C@H](N)C(=O)O MCULE-2347369254 [2,0,0,0,0,0|1,0,0]=3 1635 B6R0.3 NC[C@H](N)C(=O)O MCULE-2781423323 [2,0,0,0,0,0|1,0,0]=3 1636 B6R0.3 NC[C@H](N)C(=O)O MCULE-6498458695 [2,0,0,0,0,0|1,0,0]=3 1637 B6R0.3 NC[C@H](N)C(=O)O MCULE-8313668715 [2,0,0,0,0,0|1,0,0]=3 1638 B6R0.3 NC[C@H](O)C(=O)O MCULE-5854124012 [2,0,0,0,0,0|2,0,0]=4 1639 B6R0.3 NC[C@H](O)C(=O)O MCULE-7536593166 [2,0,0,0,0,0|2,0,0]=4 1640 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-2896868744 [2,0,0,0,0,0|1,0,0]=3 1641 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-5799339909 [2,0,0,0,0,0|1,0,0]=3 1642 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-7445121230 [2,0,0,0,0,0|1,0,0]=3 1643 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-9137000163 [2,0,0,0,0,0|1,0,0]=3 1644 B6R0.3 N[C@@H](CO)C(=O)O MCULE-4580794842 [2,0,0,0,0,0|0,0,0]=2 1645 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5604658333 [2,0,0,0,0,0|0,0,0]=2 1646 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5884286841 [2,0,0,0,0,0|0,0,0]=2 1647 B6R0.3 N[C@@H](CO)C(=O)O MCULE-6118038121 [2,0,0,0,0,0|0,0,0]=2 1648 B6R0.3 N[C@@H](CS)C(=O)O MCULE-1896679526 [2,0,0,0,0,0|0,1,0]=3 1649 B6R0.3 N[C@@H](CS)C(=O)O MCULE-2206038012 [2,0,0,0,0,0|0,1,0]=3 1650 B6R0.3 N[C@@H](CS)C(=O)O MCULE-6337217524 [2,0,0,0,0,0|0,1,0]=3 1651 B6R0.3 N[C@@H](CS)C(=O)O MCULE-9685479191 [2,0,0,0,0,0|0,1,0]=3 1652 B6R0.3 N[C@H](CCl)C(=O)O MCULE-2647266636 [2,0,0,0,0,0|1,0,0]=3 1653 B6R0.3 N[C@H](CCl)C(=O)O MCULE-7797369596 [2,0,0,0,0,0|1,0,0]=3 1654 B6R0.3 N[C@H](CCl)C(=O)O MCULE-8133148482 [2,0,0,0,0,0|1,0,0]=3 1655 B6R0.3 N[C@H](CCl)C(=O)O MCULE-9324545858 [2,0,0,0,0,0|1,0,0]=3 1656 B6R0.3 N[C@H](CF)C(=O)O MCULE-4766495272 [2,0,0,0,0,0|1,0,0]=3 1657 B6R0.3 N[C@H](CF)C(=O)O MCULE-7679315401 [2,0,0,0,0,0|1,0,0]=3 1658 B6R0.3 N[C@H](CO)C(=O)O MCULE-3271603208 [2,0,0,0,0,0|0,0,0]=2 1659 B6R0.3 N[C@H](CO)C(=O)O MCULE-8560981570 [2,0,0,0,0,0|0,0,0]=2 1660 B6R0.3 N[C@H](CS)C(=O)O MCULE-2137827959 [2,0,0,0,0,0|0,1,0]=3 1661 B6R0.3 N[C@H](CS)C(=O)O MCULE-4521387126 [2,0,0,0,0,0|0,1,0]=3 1662 B6R0.3 N[C@H](CS)C(=O)O MCULE-7201506202 [2,0,0,0,0,0|0,1,0]=3 1663 B6R0.3 N[C@H](CS)C(=O)O MCULE-9147562606 [2,0,0,0,0,0|0,1,0]=3 1664 B6R0.3 O=C(O)C(=O)CO MCULE-2263002631 [2,0,0,0,0,0|1,0,1]=4 1665 B6R0.3 O=C(O)C(Br)CBr MCULE-9991448725 [2,0,0,0,0,0|2,0,0]=4 1666 B6R0.3 O=C(O)C(Br)CF MCULE-6577995297 [2,0,0,0,0,0|2,0,0]=4 1667 B6R0.3 O=C(O)C(Br)CO MCULE-9060407295 [2,0,0,0,0,0|1,0,0]=3 1668 B6R0.3 O=C(O)C(Cl)CCl MCULE-4757238565 [2,0,0,0,0,0|2,0,0]=4 1669 B6R0.3 O=C(O)C(Cl)CO MCULE-3671026398 [2,0,0,0,0,0|1,0,0]=3 1670 B6R0.3 O=C(O)C(F)CF MCULE-4323199927 [2,0,0,0,0,0|2,0,0]=4 1671 B6R0.3 O=C(O)C(O)CBr MCULE-2600199692 [2,0,0,0,0,0|2,0,0]=4 1672 B6R0.3 O=C(O)C(O)CCl MCULE-6346810624 [2,0,0,0,0,0|2,0,0]=4 1673 B6R0.3 O=C(O)C(O)CO MCULE-3634533503 [2,0,0,0,0,0|1,0,0]=3 1674 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-4486884639 [2,0,0,0,0,0|1,0,0]=3 1675 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-8586594526 [2,0,0,0,0,0|1,0,0]=3 1676 B6R0.3 O=C(O)[C@@H](O)CCl MCULE-4927034524 [2,0,0,0,0,0|2,0,0]=4 1677 B6R0.3 O=C(O)[C@@H](O)CO MCULE-4917119993 [2,0,0,0,0,0|1,0,0]=3 1678 B6R0.3 O=C(O)[C@@H](O)CO MCULE-7996851129 [2,0,0,0,0,0|1,0,0]=3 1679 B6R0.3 O=C(O)[C@H](Br)CO MCULE-3770944978 [2,0,0,0,0,0|1,0,0]=3 1680 B6R0.3 O=C(O)[C@H](Br)CO MCULE-6926119866 [2,0,0,0,0,0|1,0,0]=3 1681 B6R0.3 O=C(O)[C@H](O)CF MCULE-4453713074 [2,0,0,0,0,0|2,0,0]=4 1682 B6R0.3 O=C([O-])[C@@H](O)CO MCULE-4498291090 [2,0,0,0,0,0|1,0,1]=4 1683 B6R0.3 [C@@H](N)(C=C)C(=O)O MCULE-9406839633 [2,0,0,0,0,0|0,0,1]=3 1684 B6R0.3 [C@@H](N)(CN)C(=O)O MCULE-2844054083 [2,0,0,0,0,0|1,0,0]=3 1685 B6R0.3 [C@H](N)(CO)C(=O)N MCULE-2792784400 [2,0,0,0,0,0|1,0,0]=3 1686 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [2,0,0,0,0,0|1,0,1]=4 1687 B6R0.3 [SeH]C[C@H](N)C(=O)O MCULE-8205075370 [2,0,0,0,0,0|0,1,0]=3 1688 B8R0.2 C=CC(C)C(C)C(=O)O MCULE-6762624939 [1,1,0,0,0,0|2,0,0]=4 1689 B8R0.2 O=C(O)C(O)C(O)CO MCULE-1397527919 [1,1,0,0,0,0|1,0,1]=4 1690 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO MCULE-1531474304 [1,1,0,0,0,0|1,0,1]=4 1691 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO MCULE-3829421433 [1,1,0,0,0,0|1,0,1]=4 1692 B8R0.5 C#CCC(N)CC(=O)O MCULE-2010410671 [1,1,0,0,0,0|1,0,1]=4 1693 B8R0.5 C#CCC(N)CC(=O)O MCULE-9655976746 [1,1,0,0,0,0|1,0,1]=4 1694 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-1849013560 [1,1,0,0,0,0|1,0,1]=4 1695 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-5050240935 [1,1,0,0,0,0|1,0,1]=4 1696 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-7394019004 [1,1,0,0,0,0|1,0,1]=4 1697 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-8376747540 [1,1,0,0,0,0|1,0,1]=4 1698 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-1446527937 [1,1,0,0,0,0|1,0,1]=4 1699 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-4559086818 [1,1,0,0,0,0|1,0,1]=4 1700 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-5154381271 [1,1,0,0,0,0|1,0,1]=4 1701 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-9666448400 [1,1,0,0,0,0|1,0,1]=4 1702 B8R0.5 C/C=C/C(O)CC(=O)O MCULE-3416519692 [1,1,0,0,0,0|2,0,0]=4 1703 B8R0.5 C=CCC(N)CC(=O)O MCULE-1468461223 [1,1,0,0,0,0|1,0,0]=3 1704 B8R0.5 C=CCC(N)CC(=O)O MCULE-3288937491 [1,1,0,0,0,0|1,0,0]=3 1705 B8R0.5 C=CCC(N)CC(=O)O MCULE-4022730599 [1,1,0,0,0,0|1,0,0]=3 1706 B8R0.5 C=CCC(N)CC(=O)O MCULE-5843795649 [1,1,0,0,0,0|1,0,0]=3 1707 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-4754294062 [1,1,0,0,0,0|1,0,0]=3 1708 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-7831408077 [1,1,0,0,0,0|1,0,0]=3 1709 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-8503288377 [1,1,0,0,0,0|1,0,0]=3 1710 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-9398972010 [1,1,0,0,0,0|1,0,0]=3 1711 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-1784444892 [1,1,0,0,0,0|1,0,0]=3 1712 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-3247296447 [1,1,0,0,0,0|1,0,0]=3 1713 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-5484030094 [1,1,0,0,0,0|1,0,0]=3 1714 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-8982980423 [1,1,0,0,0,0|1,0,0]=3 1715 B8R0.5 CC=CC(O)CC(=O)O MCULE-9449456878 [1,1,0,0,0,0|2,0,0]=4 1716 B8R0.5 CCCC(N)CC(=O)O MCULE-1356349547 [1,1,0,0,0,0|1,0,1]=4 1717 B8R0.5 CCCC(N)CC(=O)O MCULE-4946770886 [1,1,0,0,0,0|1,0,1]=4 1718 B8R0.5 CCCC(N)CC(=O)O MCULE-5502250330 [1,1,0,0,0,0|1,0,1]=4 1719 B8R0.5 CCCC(N)CC(=O)O MCULE-9959180111 [1,1,0,0,0,0|1,0,1]=4 1720 B8R0.5 CCC[C@@H](N)CC(=O)O MCULE-9961668094 [1,1,0,0,0,0|1,0,1]=4 1721 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-1726586898 [1,1,0,0,0,0|1,0,1]=4 1722 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-5359238908 [1,1,0,0,0,0|1,0,1]=4 1723 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-5593873511 [1,1,0,0,0,0|1,0,1]=4 1724 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-7588873691 [1,1,0,0,0,0|1,0,1]=4 1725 B8R0.5 COCC(C)CC(=O)O MCULE-7551495663 [1,1,0,0,0,0|1,0,1]=4 1726 B8R0.16 C=CC(CC)CC(=O)O MCULE-3976460208 [1,1,0,0,0,0|2,0,0]=4 1727 B8R0.16 COC(CN)CC(=O)O MCULE-5640667137 [1,1,0,0,0,0|2,0,0]=4 1728 B8R0.16 COC(CN)CC(=O)O MCULE-6451369002 [1,1,0,0,0,0|2,0,0]=4 1729 B8R0.16 NCC(CO)CC(=O)O MCULE-2939268634 [1,1,0,0,0,0|0,0,1]=3 1730 B8R0.19 CCC(N)CC(=O)OC MCULE-4861062224 [1,1,0,0,0,0|1,0,1]=4 1731 B8R0.19 CCC(N)CC(=O)OC MCULE-5474414259 [1,1,0,0,0,0|1,0,1]=4 1732 B8R0.19 CCC(N)CC(=O)OC MCULE-6614411962 [1,1,0,0,0,0|1,0,1]=4 1733 B8R0.19 CCC(N)CC(=O)OC MCULE-8833088600 [1,1,0,0,0,0|1,0,1]=4 1734 B8R0.19 CC[C@@H](N)CC(=O)OC MCULE-2253918492 [1,1,0,0,0,0|1,0,1]=4 1735 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-1636989319 [1,1,0,0,0,0|1,0,1]=4 1736 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-6253948831 [1,1,0,0,0,0|1,0,1]=4 1737 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-7924708820 [1,1,0,0,0,0|1,0,1]=4 1738 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-8911472049 [1,1,0,0,0,0|1,0,1]=4 1739 B8R0.19 COC(=O)CC(C)C=O MCULE-1183479071 [1,1,0,0,0,0|1,0,0]=3 1740 B8R0.19 COC(=O)CC(N)CN MCULE-3079708048 [1,1,0,0,0,0|1,0,1]=4 1741 B8R0.19 COC(=O)CC(N)CN MCULE-5046271852 [1,1,0,0,0,0|1,0,1]=4 1742 B8R0.19 COC(=O)CC(N)CO MCULE-4803123890 [1,1,0,0,0,0|0,0,1]=3 1743 B8R0.19 COC(=O)CC(N)CO MCULE-5372024399 [1,1,0,0,0,0|0,0,1]=3 1744 B8R0.19 COC(=O)CC(O)CO MCULE-1721395490 [1,1,0,0,0,0|1,0,1]=4 1745 B8R0.19 COC(=O)CC(O)CO MCULE-7578547932 [1,1,0,0,0,0|1,0,1]=4 1746 B8R0.19 COC(=O)CN(C)C=O MCULE-9266775990 [1,1,0,0,0,0|2,0,0]=4 1747 B8R0.19 COC(=O)C[C@H](O)CO MCULE-3243102477 [1,1,0,0,0,0|1,0,1]=4 1748 B8R0.19 COC(=O)C[C@H](O)CO MCULE-7538479392 [1,1,0,0,0,0|1,0,1]=4 1749 B8R0.19 O=C(CO)CC(O)CO MCULE-2853556664 [1,1,0,0,0,0|1,0,1]=4 1750 B8R0.19 [C@@H](N)(CC)CC(=O)OC MCULE-3287738066 [1,1,0,0,0,0|1,0,1]=4 1751 B8R0.34 C=CC(C)(C)CC(=O)O MCULE-5164134544 [1,1,0,0,0,0|2,0,0]=4 1752 B8R0.34 C=CC(C)(N)CC(=O)O MCULE-6219975516 [1,1,0,0,0,0|1,0,0]=3 1753 B8R0.34 C=CC(C)(N)CC(=O)O MCULE-7181187393 [1,1,0,0,0,0|1,0,0]=3 1754 B8R0.34 C=CC(C)(O)CC(=O)O MCULE-2178203310 [1,1,0,0,0,0|2,0,0]=4 1755 B8R0.34 CC(C)(CO)CC(=O)O MCULE-8595593482 [1,1,0,0,0,0|1,0,1]=4 1756 B8R0.3 C#CCC(N)C(=O)OC MCULE-2178950640 [1,1,0,0,0,0|1,0,1]=4 1757 B8R0.3 C#CCC(N)C(=O)OC MCULE-6758978147 [1,1,0,0,0,0|1,0,1]=4 1758 B8R0.3 C#CC[C@@H](N)C(=O)OC MCULE-1974908886 [1,1,0,0,0,0|1,0,1]=4 1759 B8R0.3 C#CC[C@@H](N)C(=O)OC MCULE-4511622416 [1,1,0,0,0,0|1,0,1]=4 1760 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-1519824425 [1,1,0,0,0,0|1,0,1]=4 1761 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-2744971317 [1,1,0,0,0,0|1,0,1]=4 1762 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-4813964115 [1,1,0,0,0,0|1,0,1]=4 1763 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-6433911913 [1,1,0,0,0,0|1,0,1]=4 1764 B8R0.3 C=CCC(Cl)C(=O)OC MCULE-6530091518 [1,1,0,0,0,0|2,0,0]=4 1765 B8R0.3 C=CCC(N)C(=O)OC MCULE-1390503391 [1,1,0,0,0,0|1,0,0]=3 1766 B8R0.3 C=CCC(N)C(=O)OC MCULE-6527008669 [1,1,0,0,0,0|1,0,0]=3 1767 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1188632168 [1,1,0,0,0,0|1,0,0]=3 1768 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1561172370 [1,1,0,0,0,0|1,0,0]=3 1769 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1592773442 [1,1,0,0,0,0|1,0,0]=3 1770 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-2928833845 [1,1,0,0,0,0|1,0,0]=3 1771 B8R0.3 C=CC[C@@H](O)C(=O)OC MCULE-5528424936 [1,1,0,0,0,0|2,0,0]=4 1772 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-1184647267 [1,1,0,0,0,0|1,0,0]=3 1773 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-6782970786 [1,1,0,0,0,0|1,0,0]=3 1774 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-7213365607 [1,1,0,0,0,0|1,0,0]=3 1775 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-9811834405 [1,1,0,0,0,0|1,0,0]=3 1776 B8R0.3 CCCC(N)C(=O)NO MCULE-2069838283 [1,1,0,0,0,0|1,0,1]=4 1777 B8R0.3 CCCC(N)C(=O)OC MCULE-1453218994 [1,1,0,0,0,0|1,0,1]=4 1778 B8R0.3 CCCC(N)C(=O)OC MCULE-4171872835 [1,1,0,0,0,0|1,0,1]=4 1779 B8R0.3 CCCC(N)C(=O)OC MCULE-4324009425 [1,1,0,0,0,0|1,0,1]=4 1780 B8R0.3 CCCC(N)C(=O)OC MCULE-9533158990 [1,1,0,0,0,0|1,0,1]=4 1781 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-1310673609 [1,1,0,0,0,0|1,0,1]=4 1782 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5850698619 [1,1,0,0,0,0|1,0,1]=4 1783 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5854286766 [1,1,0,0,0,0|1,0,1]=4 1784 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-9793822862 [1,1,0,0,0,0|1,0,1]=4 1785 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-2009036281 [1,1,0,0,0,0|1,0,1]=4 1786 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5609199650 [1,1,0,0,0,0|1,0,1]=4 1787 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5628439347 [1,1,0,0,0,0|1,0,1]=4 1788 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-8724830592 [1,1,0,0,0,0|1,0,1]=4 1789 B8R0.3 CNC[C@H](N)C(=O)OC MCULE-6377659413 [1,1,0,0,0,0|2,0,0]=4 1790 B8R0.3 CNC[C@H](N)C(=O)OC MCULE-9611469994 [1,1,0,0,0,0|2,0,0]=4 1791 B8R0.3 COC(=O)C(C)NC=O MCULE-7583002028 [1,1,0,0,0,0|2,0,0]=4 1792 B8R0.3 COC(=O)C(N)CCBr MCULE-5668145888 [1,1,0,0,0,0|1,0,1]=4 1793 B8R0.3 COC(=O)C(N)CCBr MCULE-5831054247 [1,1,0,0,0,0|1,0,1]=4 1794 B8R0.3 COC(=O)C(N)CCF MCULE-3356013030 [1,1,0,0,0,0|1,0,1]=4 1795 B8R0.3 COC(=O)C(N)CCF MCULE-6443244944 [1,1,0,0,0,0|1,0,1]=4 1796 B8R0.3 COC(=O)C(N)CCS MCULE-8178229832 [1,1,0,0,0,0|0,1,1]=4 1797 B8R0.3 COC(=O)C(N)CSC MCULE-6702025743 [1,1,0,0,0,0|2,0,0]=4 1798 B8R0.3 COC(=O)C(N)CSC MCULE-7180641175 [1,1,0,0,0,0|2,0,0]=4 1799 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-1252477377 [1,1,0,0,0,0|1,0,1]=4 1800 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-6780159971 [1,1,0,0,0,0|1,0,1]=4 1801 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-8129635461 [1,1,0,0,0,0|1,0,1]=4 1802 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-9824385803 [1,1,0,0,0,0|1,0,1]=4 1803 B8R0.3 COC(=O)[C@@H](N)CCN MCULE-5345736899 [1,1,0,0,0,0|1,0,1]=4 1804 B8R0.3 COC(=O)[C@@H](N)CCN MCULE-8434362314 [1,1,0,0,0,0|1,0,1]=4 1805 B8R0.3 COC(=O)[C@@H](N)CCS MCULE-1895611205 [1,1,0,0,0,0|0,1,1]=4 1806 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-2532401863 [1,1,0,0,0,0|2,0,0]=4 1807 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-3321267517 [1,1,0,0,0,0|2,0,0]=4 1808 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-5693942065 [1,1,0,0,0,0|2,0,0]=4 1809 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-7597642447 [1,1,0,0,0,0|2,0,0]=4 1810 B8R0.3 COC(=O)[C@H](C)NC=O MCULE-3891029916 [1,1,0,0,0,0|2,0,0]=4 1811 B8R0.3 COC(=O)[C@H](C)NC=O MCULE-5938491065 [1,1,0,0,0,0|2,0,0]=4 1812 B8R0.3 COC(=O)[C@H](N)CCN MCULE-1821826306 [1,1,0,0,0,0|1,0,1]=4 1813 B8R0.3 COC(=O)[C@H](N)CCN MCULE-8161776969 [1,1,0,0,0,0|1,0,1]=4 1814 B8R0.3 COC(=O)[C@H](N)CCO MCULE-1194830786 [1,1,0,0,0,0|0,0,1]=3 1815 B8R0.3 COC(=O)[C@H](N)CCO MCULE-2532522705 [1,1,0,0,0,0|0,0,1]=3 1816 B8R0.3 COC(=O)[C@H](N)CCS MCULE-8558179208 [1,1,0,0,0,0|0,1,1]=4 1817 B8R0.3 COCC(N)C(=O)OC MCULE-1717271658 [1,1,0,0,0,0|2,0,0]=4 1818 B8R0.3 COCC(N)C(=O)OC MCULE-4567479747 [1,1,0,0,0,0|2,0,0]=4 1819 B8R0.3 COCC(N)C(=O)OC MCULE-4859095599 [1,1,0,0,0,0|2,0,0]=4 1820 B8R0.3 COCC(N)C(=O)OC MCULE-8125210840 [1,1,0,0,0,0|2,0,0]=4 1821 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-2867072950 [1,1,0,0,0,0|2,0,0]=4 1822 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-5445193744 [1,1,0,0,0,0|2,0,0]=4 1823 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8505505456 [1,1,0,0,0,0|2,0,0]=4 1824 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8525451378 [1,1,0,0,0,0|2,0,0]=4 1825 B8R0.8 C#CCCC(N)C(=O)O MCULE-2306841483 [1,1,0,0,0,0|1,0,1]=4 1826 B8R0.8 C#CCC[C@@H](N)C(=O)O MCULE-3328230047 [1,1,0,0,0,0|1,0,1]=4 1827 B8R0.8 C#CCC[C@@H](N)C(=O)O MCULE-8588363102 [1,1,0,0,0,0|1,0,1]=4 1828 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-3269292516 [1,1,0,0,0,0|1,0,1]=4 1829 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-6769399323 [1,1,0,0,0,0|1,0,1]=4 1830 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-6930343823 [1,1,0,0,0,0|1,0,1]=4 1831 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-9522590396 [1,1,0,0,0,0|1,0,1]=4 1832 B8R0.8 C=CCCC(C)C(=O)O MCULE-3089071984 [1,1,0,0,0,0|2,0,0]=4 1833 B8R0.8 C=CCCC(N)C(=O)N MCULE-3025865201 [1,1,0,0,0,0|2,0,0]=4 1834 B8R0.8 C=CCCC(N)C(=O)N MCULE-6477490851 [1,1,0,0,0,0|2,0,0]=4 1835 B8R0.8 C=CCCC(N)C(=O)O MCULE-1524160350 [1,1,0,0,0,0|1,0,0]=3 1836 B8R0.8 C=CCCC(N)C(=O)O MCULE-5522822192 [1,1,0,0,0,0|1,0,0]=3 1837 B8R0.8 C=CCCC(N)C(=O)O MCULE-7998584890 [1,1,0,0,0,0|1,0,0]=3 1838 B8R0.8 C=CCC[C@@H](N)C(=O)O MCULE-4571532321 [1,1,0,0,0,0|1,0,0]=3 1839 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-2235047291 [1,1,0,0,0,0|1,0,0]=3 1840 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-4644458098 [1,1,0,0,0,0|1,0,0]=3 1841 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-7821274952 [1,1,0,0,0,0|1,0,0]=3 1842 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-9807212949 [1,1,0,0,0,0|1,0,0]=3 1843 B8R0.8 C=CCOC(C)C(=O)O MCULE-4801958900 [1,1,0,0,0,0|2,0,0]=4 1844 B8R0.8 C=CCSC(C)C(=O)O MCULE-4683246165 [1,1,0,0,0,0|2,0,0]=4 1845 B8R0.8 CC#CCC(N)C(=O)O MCULE-2943446929 [1,1,0,0,0,0|1,0,1]=4 1846 B8R0.8 CC#CCC(N)C(=O)O MCULE-8126081664 [1,1,0,0,0,0|1,0,1]=4 1847 B8R0.8 CC#CC[C@@H](N)C(=O)O MCULE-5156383275 [1,1,0,0,0,0|1,0,1]=4 1848 B8R0.8 CC#CC[C@H](N)C(=O)O MCULE-4618959735 [1,1,0,0,0,0|1,0,1]=4 1849 B8R0.8 CC#CC[C@H](N)C(=O)O MCULE-7818390064 [1,1,0,0,0,0|1,0,1]=4 1850 B8R0.8 CC(OCCO)C(=O)O MCULE-4305620136 [1,1,0,0,0,0|1,0,1]=4 1851 B8R0.8 CCCCC(N)C(=O)O MCULE-4930484202 [1,1,0,0,0,0|1,0,1]=4 1852 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-3687527484 [1,1,0,0,0,0|1,0,1]=4 1853 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-9410581572 [1,1,0,0,0,0|1,0,1]=4 1854 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-3656145338 [1,1,0,0,0,0|1,0,1]=4 1855 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-7427914532 [1,1,0,0,0,0|1,0,1]=4 1856 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9199053225 [1,1,0,0,0,0|1,0,1]=4 1857 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9684903914 [1,1,0,0,0,0|1,0,1]=4 1858 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-6351196285 [1,1,0,0,0,0|1,0,1]=4 1859 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-7653589662 [1,1,0,0,0,0|1,0,1]=4 1860 B8R0.8 CCSCC(N)C(=O)O MCULE-9449250733 [1,1,0,0,0,0|1,0,1]=4 1861 B8R0.8 COCCC(C)C(=O)O MCULE-5066180613 [1,1,0,0,0,0|1,0,1]=4 1862 B8R0.8 COCCC(N)C(=O)N MCULE-4212561129 [1,1,0,0,0,0|1,0,1]=4 1863 B8R0.8 COCCC(N)C(=O)N MCULE-5370323024 [1,1,0,0,0,0|1,0,1]=4 1864 B8R0.8 COCCC(N)C(=O)O MCULE-3018605108 [1,1,0,0,0,0|0,0,1]=3 1865 B8R0.8 COCC[C@H](N)C(=O)O MCULE-6748608543 [1,1,0,0,0,0|0,0,1]=3 1866 B8R0.8 COCC[C@H](N)C(=O)O MCULE-8586358852 [1,1,0,0,0,0|0,0,1]=3 1867 B8R0.8 CSCCC(N)C(=O)O MCULE-5626142345 [1,1,0,0,0,0|0,1,1]=4 1868 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-2209985195 [1,1,0,0,0,0|0,1,1]=4 1869 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-9944164883 [1,1,0,0,0,0|0,1,1]=4 1870 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-3383932641 [1,1,0,0,0,0|0,1,1]=4 1871 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-4603455639 [1,1,0,0,0,0|0,1,1]=4 1872 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-7228063662 [1,1,0,0,0,0|0,1,1]=4 1873 B8R0.8 C[Se]CCC(N)C(=O)O MCULE-9212969564 [1,1,0,0,0,0|0,1,1]=4 1874 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5333020269 [1,1,0,0,0,0|0,1,1]=4 1875 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5980340572 [1,1,0,0,0,0|0,1,1]=4 1876 B8R0.8 NC(CCCO)C(=O)O MCULE-5421732564 [1,1,0,0,0,0|0,0,1]=3 1877 B8R0.8 NCCCC(N)C(=O)O MCULE-1970642620 [1,1,0,0,0,0|1,0,1]=4 1878 B8R0.8 NCCCC(N)C(=O)O MCULE-4486209373 [1,1,0,0,0,0|1,0,1]=4 1879 B8R0.8 NCCCC(N)C(=O)O MCULE-8193724048 [1,1,0,0,0,0|1,0,1]=4 1880 B8R0.8 NCCCC(N)C(=O)O MCULE-9223414094 [1,1,0,0,0,0|1,0,1]=4 1881 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-1634156072 [1,1,0,0,0,0|1,0,1]=4 1882 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2602820298 [1,1,0,0,0,0|1,0,1]=4 1883 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2719848774 [1,1,0,0,0,0|1,0,1]=4 1884 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-8413545449 [1,1,0,0,0,0|1,0,1]=4 1885 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2588005079 [1,1,0,0,0,0|1,0,1]=4 1886 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2852667696 [1,1,0,0,0,0|1,0,1]=4 1887 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-3029872280 [1,1,0,0,0,0|1,0,1]=4 1888 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-4242810787 [1,1,0,0,0,0|1,0,1]=4 1889 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-6924538097 [1,1,0,0,0,0|1,0,1]=4 1890 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-8642266626 [1,1,0,0,0,0|1,0,1]=4 1891 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9352931710 [1,1,0,0,0,0|1,0,1]=4 1892 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9532999202 [1,1,0,0,0,0|1,0,1]=4 1893 B8R0.8 NOCCC(N)C(=O)O MCULE-1540658941 [1,1,0,0,0,0|0,0,1]=3 1894 B8R0.8 NOCCC(N)C(=O)O MCULE-3729513992 [1,1,0,0,0,0|0,0,1]=3 1895 B8R0.8 NOCC[C@@H](N)C(=O)O MCULE-3273727827 [1,1,0,0,0,0|0,0,1]=3 1896 B8R0.8 NOCC[C@H](N)C(=O)O MCULE-2315172974 [1,1,0,0,0,0|0,0,1]=3 1897 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-3220645027 [1,1,0,0,0,0|0,0,1]=3 1898 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-4608316868 [1,1,0,0,0,0|0,0,1]=3 1899 B8R0.8 O=C(O)C(O)CCCO MCULE-9386031706 [1,1,0,0,0,0|1,0,1]=4 1900 B8R0.8 [C@@H](N)(CCC=C)C(=O)O MCULE-9648209291 [1,1,0,0,0,0|1,0,0]=3 1901 B8R0.8 [C@H](N)(CCON)C(=O)O MCULE-1309966773 [1,1,0,0,0,0|0,0,1]=3 1902 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O MCULE-4562460888 [1,1,0,0,0,0|2,0,0]=4 1903 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O MCULE-4736712462 [1,1,0,0,0,0|2,0,0]=4 1904 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O MCULE-6764345986 [1,1,0,0,0,0|2,0,0]=4 1905 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O MCULE-1901194070 [1,1,0,0,0,0|2,0,0]=4 1906 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O MCULE-2129950967 [1,1,0,0,0,0|2,0,0]=4 1907 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O MCULE-4531641107 [1,1,0,0,0,0|2,0,0]=4 1908 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O MCULE-9554569949 [1,1,0,0,0,0|2,0,0]=4 1909 B8R0.12 C#CCC(C)(N)C(=O)O MCULE-8114982544 [1,1,0,0,0,0|1,0,1]=4 1910 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-2326062849 [1,1,0,0,0,0|1,0,1]=4 1911 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-2897598223 [1,1,0,0,0,0|1,0,1]=4 1912 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-6332359697 [1,1,0,0,0,0|1,0,1]=4 1913 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-9265618717 [1,1,0,0,0,0|1,0,1]=4 1914 B8R0.12 C#CC[C@](C)(N)C(=O)O MCULE-2976528694 [1,1,0,0,0,0|1,0,1]=4 1915 B8R0.12 C#CC[C@](C)(N)C(=O)O MCULE-7418052843 [1,1,0,0,0,0|1,0,1]=4 1916 B8R0.12 C=CCC(C)(C)C(=O)O MCULE-7428318853 [1,1,0,0,0,0|2,0,0]=4 1917 B8R0.12 C=CCC(C)(N)C(=O)O MCULE-7144199889 [1,1,0,0,0,0|1,0,0]=3 1918 B8R0.12 C=CCC(F)(F)C(=O)O MCULE-5503944687 [1,1,0,0,0,0|2,0,0]=4 1919 B8R0.12 C=CC[C@@](C)(N)C(=O)O MCULE-4753726738 [1,1,0,0,0,0|1,0,0]=3 1920 B8R0.12 C=CC[C@@](C)(N)C(=O)O MCULE-8270551752 [1,1,0,0,0,0|1,0,0]=3 1921 B8R0.12 C=CC[C@](C)(N)C(=O)O MCULE-2471413685 [1,1,0,0,0,0|1,0,0]=3 1922 B8R0.12 C=CC[C@](C)(N)C(=O)O MCULE-5595289174 [1,1,0,0,0,0|1,0,0]=3 1923 B8R0.12 CC(C)(CCO)C(=O)O MCULE-1566648548 [1,1,0,0,0,0|1,0,1]=4 1924 B8R0.12 CC(N)(CCF)C(=O)O MCULE-5797177130 [1,1,0,0,0,0|1,0,1]=4 1925 B8R0.12 CC(N)(CCF)C(=O)O MCULE-9911119608 [1,1,0,0,0,0|1,0,1]=4 1926 B8R0.12 CCCC(C)(N)C(=O)O MCULE-3079931045 [1,1,0,0,0,0|1,0,1]=4 1927 B8R0.12 CCC[C@](C)(N)C(=O)O MCULE-8569302783 [1,1,0,0,0,0|1,0,1]=4 1928 B8R0.15 C=CCC(CC)C(=O)O MCULE-8599414655 [1,1,0,0,0,0|2,0,0]=4 1929 B8R0.15 CCC(NC=O)C(=O)O MCULE-6163876154 [1,1,0,0,0,0|2,0,0]=4 1930 B8R0.15 CCCC(NC)C(=O)O MCULE-5292420123 [1,1,0,0,0,0|1,0,1]=4 1931 B8R0.15 CCCC(NC)C(=O)O MCULE-5734283547 [1,1,0,0,0,0|1,0,1]=4 1932 B8R0.15 CCCC(NC)C(=O)O MCULE-9559460593 [1,1,0,0,0,0|1,0,1]=4 1933 B8R0.15 CCCC(NO)C(=O)O MCULE-7484331195 [1,1,0,0,0,0|1,0,1]=4 1934 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-3394704356 [1,1,0,0,0,0|1,0,1]=4 1935 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-8140893147 [1,1,0,0,0,0|1,0,1]=4 1936 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-1028689544 [1,1,0,0,0,0|1,0,1]=4 1937 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-4848752673 [1,1,0,0,0,0|1,0,1]=4 1938 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-5585839502 [1,1,0,0,0,0|1,0,1]=4 1939 B8R0.15 CCC[C@H](NO)C(=O)O MCULE-7455558431 [1,1,0,0,0,0|1,0,1]=4 1940 B8R0.15 CNC(CCN)C(=O)O MCULE-6687313255 [1,1,0,0,0,0|1,0,1]=4 1941 B8R0.15 CNC(COC)C(=O)O MCULE-4091913769 [1,1,0,0,0,0|2,0,0]=4 1942 B8R0.15 CNC(COC)C(=O)O MCULE-6745647660 [1,1,0,0,0,0|2,0,0]=4 1943 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-4209872941 [1,1,0,0,0,0|0,0,1]=3 1944 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-7202916887 [1,1,0,0,0,0|0,0,1]=3 1945 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-1874728709 [1,1,0,0,0,0|0,0,1]=3 1946 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-3716592032 [1,1,0,0,0,0|0,0,1]=3 1947 B8R0.15 COCC(ON)C(=O)O MCULE-4466158339 [1,1,0,0,0,0|2,0,0]=4 1948 B8R0.15 COCC(ON)C(=O)O MCULE-6084078663 [1,1,0,0,0,0|2,0,0]=4 1949 B8R0.15 O=CN[C@@H](CS)C(=O)O MCULE-9815114026 [1,1,0,0,0,0|2,0,0]=4 1950 B8R0.9 C=CC(=O)NCC(=O)O MCULE-6459513586 [1,1,0,0,0,0|2,0,0]=4 1951 B8R0.9 CC(=NO)CCC(=O)O MCULE-2481442220 [1,1,0,0,0,0|1,0,0]=3 1952 B8R0.9 CCC(=O)CCC(=O)C MCULE-7923444653 [1,1,0,0,0,0|2,0,0]=4 1953 B8R0.9 CCC(=O)CCC(=O)O MCULE-4505750030 [1,1,0,0,0,0|1,0,0]=3 1954 B8R0.9 CCC(=O)NCC(=O)O MCULE-9173889437 [1,1,0,0,0,0|2,0,0]=4 1955 B8R0.9 CCC(O)CCC(=O)O MCULE-1512608136 [1,1,0,0,0,0|1,0,1]=4 1956 B8R0.9 CCS(=O)CCC(=O)O MCULE-4027618720 [1,1,0,0,0,0|2,0,0]=4 1957 B8R0.9 CNC(=O)CCC(=O)O MCULE-8340443315 [1,1,0,0,0,0|1,0,0]=3 1958 B8R0.9 CNC(=O)NCC(=O)O MCULE-9575946804 [1,1,0,0,0,0|2,0,0]=4 1959 B8R0.9 COC(=O)/C=C/C(=O)O MCULE-6611318809 [1,1,0,0,0,0|0,0,2]=4 1960 B8R0.9 COC(=O)/C=C\C(=O)O MCULE-6268249504 [1,1,0,0,0,0|0,0,2]=4 1961 B8R0.9 COC(=O)C=CC(=O)O MCULE-3111892186 [1,1,0,0,0,0|0,0,2]=4 1962 B8R0.9 COC(=O)CCC(=O)C MCULE-6324755148 [1,1,0,0,0,0|1,0,0]=3 1963 B8R0.9 COC(=O)CCC(=O)Cl MCULE-2684320402 [1,1,0,0,0,0|1,0,0]=3 1964 B8R0.9 COC(=O)CCC(=O)N MCULE-1154081515 [1,1,0,0,0,0|1,0,0]=3 1965 B8R0.9 COC(=O)CCC(=O)O MCULE-4083173324 [1,1,0,0,0,0|0,0,0]=2 1966 B8R0.9 COC(=O)CCC(=S)N MCULE-4037707510 [1,1,0,0,0,0|1,1,0]=4 1967 B8R0.9 COC(=O)CCN(=O)=O MCULE-3836108700 [1,1,0,0,0,0|1,0,1]=4 1968 B8R0.9 COC(=O)CCS(=O)O MCULE-4935012562 [1,1,0,0,0,0|1,0,0]=3 1969 B8R0.9 COC(=O)CCS(=O)[O-] MCULE-5802411922 [1,1,0,0,0,0|1,0,1]=4 1970 B8R0.9 COC(=O)CNC(=O)C MCULE-3795072377 [1,1,0,0,0,0|2,0,0]=4 1971 B8R0.9 COC(=O)NCC(=O)C MCULE-1043877696 [1,1,0,0,0,0|2,0,0]=4 1972 B8R0.9 COC(=O)NCC(=O)O MCULE-3693365728 [1,1,0,0,0,0|1,0,0]=3 1973 B8R0.9 COC(C)CCC(=O)O MCULE-5873043454 [1,1,0,0,0,0|1,0,1]=4 1974 B8R0.9 NCC(=O)CCC(=O)O MCULE-6371115085 [1,1,0,0,0,0|1,0,0]=3 1975 B8R0.9 NCC(=O)CCC(=O)O MCULE-8125179397 [1,1,0,0,0,0|1,0,0]=3 1976 B8R0.9 NCC(=O)CCC(=O)O MCULE-8676354165 [1,1,0,0,0,0|1,0,0]=3 1977 B8R0.9 NCC(=O)NCC(=O)O MCULE-1239116894 [1,1,0,0,0,0|2,0,0]=4 1978 B8R0.9 NCC(=O)NCC(=O)O MCULE-2139302839 [1,1,0,0,0,0|2,0,0]=4 1979 B8R0.9 NNC(=O)CCC(=O)N MCULE-9710004878 [1,1,0,0,0,0|2,0,0]=4 1980 B8R0.9 NNC(=O)CCC(=O)O MCULE-7643180740 [1,1,0,0,0,0|1,0,0]=3 1981 B8R0.9 NNC(=O)CCC(=O)O MCULE-9888193887 [1,1,0,0,0,0|1,0,0]=3 1982 B8R0.9 NNC(=O)NCC(=O)O MCULE-6013763993 [1,1,0,0,0,0|2,0,0]=4 1983 B8R0.9 NNC(=O)NCC(=O)O MCULE-8104731063 [1,1,0,0,0,0|2,0,0]=4 1984 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-1233079264 [1,1,0,0,0,0|1,0,1]=4 1985 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-8091475267 [1,1,0,0,0,0|1,0,1]=4 1986 B8R0.9 O=C(O)CCC(=O)CBr MCULE-8373387398 [1,1,0,0,0,0|1,0,0]=3 1987 B8R0.9 O=C(O)CCC(=O)NO MCULE-2226202964 [1,1,0,0,0,0|0,0,0]=2 1988 B8R0.9 O=C(O)CCP(=O)CO MCULE-3163541128 [1,1,0,0,0,0|1,0,0]=3 1989 B8R0.9 O=C(O)CNC(=O)CCl MCULE-2917654196 [1,1,0,0,0,0|2,0,0]=4 1990 B8R0.9 O=C(O)COC(=O)CO MCULE-4022202206 [1,1,0,0,0,0|1,0,0]=3 1991 B8R0.29 CP(=O)(C)CCC(=O)O MCULE-4161237740 [1,1,0,0,0,0|2,0,0]=4 1992 B8R0.29 CP(=O)(O)CCC(=O)O MCULE-7722406670 [1,1,0,0,0,0|1,0,0]=3 1993 B8R0.29 CS(=O)(=O)CCC(=O)O MCULE-6100062469 [1,1,0,0,0,0|1,0,1]=4 1994 B8R0.29 NS(=O)(=O)CCC(=O)O MCULE-7062523969 [1,1,0,0,0,0|1,0,1]=4 1995 B8R0.29 O=C(O)CCP(=O)(O)O MCULE-5647723204 [1,1,0,0,0,0|1,0,0]=3 1996 B8R0.29 O=C(O)CCS(=O)(=O)O MCULE-8973025218 [1,1,0,0,0,0|1,0,0]=3 1997 B8R0.18 CCC(C(=O)O)C(=O)O MCULE-3288957588 [0,1,0,0,1,0|1,0,0]=3 1998 B8R0.18 CNC(C(=O)O)C(C)O MCULE-8017224741 [0,1,0,0,1,0|1,0,1]=4 1999 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-5405618703 [0,1,0,0,1,0|1,0,1]=4 2000 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-6470355986 [0,1,0,0,1,0|1,0,1]=4 2001 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-7261692258 [0,1,0,0,1,0|1,0,1]=4 2002 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-7763091319 [0,1,0,0,1,0|1,0,1]=4 2003 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-8429501411 [0,1,0,0,1,0|1,0,1]=4 2004 B8R0.18 O=C(O)C(=CBr)C(=O)O MCULE-6610352716 [0,1,0,0,1,0|1,0,1]=4 2005 B8R0.27 CC(C(=O)O)P(=O)(O)O MCULE-8565461015 [0,1,0,0,1,0|2,0,0]=4 2006 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-4257891769 [0,1,0,0,1,0|1,0,1]=4 2007 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-4291820573 [0,1,0,0,1,0|1,0,1]=4 2008 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-8731964950 [0,1,0,0,1,0|1,0,1]=4 2009 B8R0.27 CC(C)(O)[C@@H](N)C(=O)O MCULE-2953137860 [0,1,0,0,1,0|1,0,1]=4 2010 B8R0.27 CC(C)(O)[C@@H](N)C(=O)O MCULE-3424625974 [0,1,0,0,1,0|1,0,1]=4 2011 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-3721152032 [0,1,0,0,1,0|1,0,1]=4 2012 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-7599346102 [0,1,0,0,1,0|1,0,1]=4 2013 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-9499245205 [0,1,0,0,1,0|1,0,1]=4 2014 B8R0.27 O=C(O)C(Cl)P(=O)(O)O MCULE-8492715834 [0,1,0,0,1,0|2,0,0]=4 2015 B8R0.27 O=C(O)C(O)P(=O)(O)O MCULE-5564177953 [0,1,0,0,1,0|2,0,0]=4 2016 B8R0.27 [C@@H](N)(C(=O)O)C(C)(C)O MCULE-5116872005 [0,1,0,0,1,0|1,0,1]=4 2017 B8R0.37 CC(=O)C(C)(C)C(=O)O MCULE-5093326895 [0,1,0,0,1,0|2,0,0]=4 2018 B8R0.37 CC(C)(C(=O)N)C(=O)O MCULE-2390691265 [0,1,0,0,1,0|2,0,0]=4 2019 B8R0.37 CC(C)(C(=O)O)C(=O)O MCULE-7318511088 [0,1,0,0,1,0|1,0,0]=3 2020 B8R0.37 CC(O)C(C)(N)C(=O)O MCULE-9781647782 [0,1,0,0,1,0|1,0,1]=4 2021 B8R0.37 C[C@@H](O)[C@](C)(N)C(=O)O MCULE-4212497890 [0,1,0,0,1,0|1,0,1]=4 2022 B8R0.37 C[C@@H](O)[C@](C)(N)C(=O)O MCULE-7382680634 [0,1,0,0,1,0|1,0,1]=4 2023 B8R0.37 C[C@H](O)[C@@](C)(N)C(=O)O MCULE-5661079280 [0,1,0,0,1,0|1,0,1]=4 2024 B8R0.37 O=C(O)C(F)(F)C(=O)O MCULE-4438516030 [0,1,0,0,1,0|1,0,0]=3 2025 B8R0.37 O=C(O)C(O)(O)C(=O)O MCULE-1610310703 [0,1,0,0,1,0|1,0,0]=3 2026 B10R0.13 CC(=O)C(C)C(C)CC(=O)O MCULE-2467523561 [0,1,0,0,0,1|2,0,0]=4 2027 B10R0.13 CC(=O)OC(C)C(N)C(=O)O MCULE-2960070749 [0,1,0,0,0,1|1,0,0]=3 2028 B10R0.13 CC(=O)OC(C)C(N)C(=O)O MCULE-7223559986 [0,1,0,0,0,1|1,0,0]=3 2029 B10R0.13 CC(=O)O[C@H](C)[C@H](N)C(=O)O MCULE-3196057448 [0,1,0,0,0,1|1,0,0]=3 2030 B10R0.13 CC(=O)O[C@H](C)[C@H](N)C(=O)O MCULE-4987228190 [0,1,0,0,0,1|1,0,0]=3 2031 B10R0.13 CC(=O)O[C@H](C)[C@H](N)C(=O)O MCULE-8785750681 [0,1,0,0,0,1|1,0,0]=3 2032 B10R0.13 CC(=O)O[C@H](C)[C@H](N)C(=O)O MCULE-9094583167 [0,1,0,0,0,1|1,0,0]=3 2033 B10R0.13 CN(CC(=O)O)C(=O)C(=O)O MCULE-2539412176 [0,1,0,0,0,1|1,0,1]=4 2034 B10R0.13 C[C@@H](CC(=O)O)[C@@H](N)C(=O)O MCULE-3332620674 [0,1,0,0,0,1|0,0,0]=2 2035 B10R0.13 C[C@@H](CC(=O)O)[C@H](N)C(=O)O MCULE-1191810017 [0,1,0,0,0,1|0,0,0]=2 2036 B10R0.13 C[C@H](CC(=O)O)[C@@H](N)C(=O)O MCULE-6898866017 [0,1,0,0,0,1|0,0,0]=2 2037 B10R0.13 C[C@H](CC(=O)O)[C@H](N)C(=O)O MCULE-5584040869 [0,1,0,0,0,1|0,0,0]=2 2038 B10R0.13 N[C@@H](C(=O)O)[C@H](O)CC(=O)O MCULE-6540374220 [0,1,0,0,0,1|0,0,0]=2 2039 B10R0.13 N[C@H](C(=O)O)[C@@H](F)CC(=O)O MCULE-4546449636 [0,1,0,0,0,1|0,0,0]=2 2040 B10R0.13 O=C(O)CC(O)C(O)C(=O)[O-] MCULE-4149978058 [0,1,0,0,0,1|1,0,1]=4 2041 B10R0.13 O=C(O)CC(O)C(O)C(=O)[O-] MCULE-8718049660 [0,1,0,0,0,1|1,0,1]=4 2042 B10R0.43 CC(=O)C(C)(C)CCC(=O)O MCULE-2019736202 [0,1,0,0,0,1|2,0,0]=4 2043 B10R0.43 CC(=O)CCC(C)(C)C(=O)O MCULE-7949244890 [0,1,0,0,0,1|2,0,0]=4 2044 B10R0.43 CC(=O)NCC(C)(C)C(=O)O MCULE-5666730658 [0,1,0,0,0,1|2,0,0]=4 2045 B10R0.43 CC(C)(CCC(=O)O)C(=O)O MCULE-3722680536 [0,1,0,0,0,1|1,0,0]=3 2046 B10R0.43 CC(C)(SCC(=O)O)C(=O)O MCULE-9761119610 [0,1,0,0,0,1|1,0,0]=3 2047 B10R0.43 CC(N)(CCC(=O)O)C(=O)O MCULE-3734637690 [0,1,0,0,0,1|0,0,0]=2 2048 B10R0.43 C[C@@](N)(CCC(=O)O)C(=O)O MCULE-5201150112 [0,1,0,0,0,1|0,0,0]=2 2049 B10R0.43 O=C(O)CCC(F)(F)C(=O)O MCULE-3909124499 [0,1,0,0,0,1|1,0,0]=3 2050 B10R0.57 C(N)(CCC(=O)O)C(=O)OC MCULE-6082605624 [0,1,0,0,0,1|0,0,0]=2 2051 B10R0.57 COC(=O)C(N)CCC(=O)N MCULE-3871381696 [0,1,0,0,0,1|1,0,0]=3 2052 B10R0.57 COC(=O)C(N)CCC(=O)N MCULE-6424537354 [0,1,0,0,0,1|1,0,0]=3 2053 B10R0.57 COC(=O)C(N)CCC(=O)O MCULE-3294558028 [0,1,0,0,0,1|0,0,0]=2 2054 B10R0.57 COC(=O)C(N)CCC(=O)O MCULE-4645787805 [0,1,0,0,0,1|0,0,0]=2 2055 B10R0.57 COC(=O)C(N)CCC(=O)O MCULE-8573479107 [0,1,0,0,0,1|0,0,0]=2 2056 B10R0.57 COC(=O)[C@@H](C)CSC(=O)C MCULE-1724066289 [0,1,0,0,0,1|2,0,0]=4 2057 B10R0.57 COC(=O)[C@@H](N)CCC(=O)N MCULE-2647128583 [0,1,0,0,0,1|1,0,0]=3 2058 B10R0.57 COC(=O)[C@@H](N)CCC(=O)N MCULE-3301910394 [0,1,0,0,0,1|1,0,0]=3 2059 B10R0.57 COC(=O)[C@@H](N)CCC(=O)N MCULE-6377888321 [0,1,0,0,0,1|1,0,0]=3 2060 B10R0.57 COC(=O)[C@@H](N)CCC(=O)N MCULE-8642069122 [0,1,0,0,0,1|1,0,0]=3 2061 B10R0.57 COC(=O)[C@@H](N)CCC(=O)O MCULE-3694424519 [0,1,0,0,0,1|0,0,0]=2 2062 B10R0.57 COC(=O)[C@@H](N)CCC(=O)O MCULE-3908913342 [0,1,0,0,0,1|0,0,0]=2 2063 B10R0.57 COC(=O)[C@H](N)CCC(=O)N MCULE-3332396919 [0,1,0,0,0,1|1,0,0]=3 2064 B10R0.57 COC(=O)[C@H](N)CCC(=O)N MCULE-4801234666 [0,1,0,0,0,1|1,0,0]=3 2065 B10R0.57 COC(=O)[C@H](N)CCC(=O)N MCULE-5791932848 [0,1,0,0,0,1|1,0,0]=3 2066 B10R0.57 COC(=O)[C@H](N)CCC(=O)N MCULE-7827323262 [0,1,0,0,0,1|1,0,0]=3 2067 B10R0.57 COC(=O)[C@H](N)CCC(=O)O MCULE-4899971591 [0,1,0,0,0,1|0,0,0]=2 2068 B10R0.57 COC(=O)[C@H](N)CCC(=O)O MCULE-5340713177 [0,1,0,0,0,1|0,0,0]=2 2069 B10R0.57 COC(=O)[C@H](N)CCC(=O)O MCULE-6573369964 [0,1,0,0,0,1|0,0,0]=2 2070 B10R0.57 COC(=O)[C@H](N)CCC(=O)O MCULE-9402335659 [0,1,0,0,0,1|0,0,0]=2 2071 B10R0.57 NCC(=O)C(N)CCC(=O)O MCULE-6909697909 [0,1,0,0,0,1|1,0,0]=3 2072 B10R0.82 CNC(=O)CCC(N)C(=O)O MCULE-2815144960 [0,1,0,0,0,1|1,0,0]=3 2073 B10R0.82 COC(=O)CCC(N)C(=O)N MCULE-2008488408 [0,1,0,0,0,1|1,0,0]=3 2074 B10R0.82 COC(=O)CCC(N)C(=O)N MCULE-4056733947 [0,1,0,0,0,1|1,0,0]=3 2075 B10R0.82 COC(=O)CCC(N)C(=O)O MCULE-1417445261 [0,1,0,0,0,1|0,0,0]=2 2076 B10R0.82 COC(=O)CCC(N)C(=O)O MCULE-1495018790 [0,1,0,0,0,1|0,0,0]=2 2077 B10R0.82 COC(=O)CC[C@@H](N)C(=O)O MCULE-3233905582 [0,1,0,0,0,1|0,0,0]=2 2078 B10R0.82 COC(=O)CC[C@@H](N)C(=O)O MCULE-4870656159 [0,1,0,0,0,1|0,0,0]=2 2079 B10R0.82 COC(=O)CC[C@H](N)C(=O)N MCULE-4563541396 [0,1,0,0,0,1|1,0,0]=3 2080 B10R0.82 COC(=O)CC[C@H](N)C(=O)N MCULE-5542631622 [0,1,0,0,0,1|1,0,0]=3 2081 B10R0.82 COC(=O)CC[C@H](N)C(=O)N MCULE-5671338567 [0,1,0,0,0,1|1,0,0]=3 2082 B10R0.82 COC(=O)CC[C@H](N)C(=O)N MCULE-7766792787 [0,1,0,0,0,1|1,0,0]=3 2083 B10R0.82 COC(=O)CC[C@H](N)C(=O)O MCULE-1607830290 [0,1,0,0,0,1|0,0,0]=2 2084 B10R0.82 COC(=O)CC[C@H](N)C(=O)O MCULE-7380350089 [0,1,0,0,0,1|0,0,0]=2 2085 B10R0.82 COC(=O)CC[C@H](N)C(=O)O MCULE-7654158848 [0,1,0,0,0,1|0,0,0]=2 2086 B10R0.82 COC(=O)CC[C@H](N)C(=O)O MCULE-8680968839 [0,1,0,0,0,1|0,0,0]=2 2087 B10R0.82 NC(CCC(=O)NO)C(=O)O MCULE-9353366308 [0,1,0,0,0,1|0,0,0]=2 2088 B10R0.82 NC(CCP(=O)CO)C(=O)O MCULE-2901685887 [0,1,0,0,0,1|1,0,0]=3 2089 B10R0.82 NC(CCP(=O)CO)C(=O)[O-] MCULE-4812114882 [0,1,0,0,0,1|1,0,1]=4 2090 B10R0.82 NC(CS/C(=C\Cl)/Cl)C(=O)O MCULE-9787799918 [0,1,0,0,0,1|2,0,0]=4 2091 B10R0.82 NC(CSC(=CCl)Cl)C(=O)O MCULE-3439601737 [0,1,0,0,0,1|2,0,0]=4 2092 B10R0.82 NCC(O)CCC(N)C(=O)O MCULE-6064290143 [0,1,0,0,0,1|1,0,1]=4 2093 B10R0.82 NCC(O)CCC(N)C(=O)O MCULE-6546706417 [0,1,0,0,0,1|1,0,1]=4 2094 B10R0.82 NCC(O)CC[C@H](N)C(=O)O MCULE-4925093695 [0,1,0,0,0,1|1,0,1]=4 2095 B10R0.82 NCC(O)CC[C@H](N)C(=O)O MCULE-7103430731 [0,1,0,0,0,1|1,0,1]=4 2096 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O MCULE-1390178110 [0,1,0,0,0,1|1,0,1]=4 2097 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O MCULE-7788161688 [0,1,0,0,0,1|1,0,1]=4 2098 B10R0.82 N[C@@H](CS/C(=C\Cl)/Cl)C(=O)O MCULE-8518825069 [0,1,0,0,0,1|2,0,0]=4 2099 B10R0.82 N[C@@H](CSC(=CCl)Cl)C(=O)O MCULE-2279209273 [0,1,0,0,0,1|2,0,0]=4 2100 B10R0.82 N[C@@H](CSC(=CCl)Cl)C(=O)O MCULE-6627444633 [0,1,0,0,0,1|2,0,0]=4 2101 B10R0.84 CCC(CCC(=O)C)C(=O)O MCULE-2983781440 [0,1,0,0,0,1|2,0,0]=4 2102 B10R0.84 CNC(CCC(=O)O)C(=O)O MCULE-7159441787 [0,1,0,0,0,1|0,0,0]=2 2103 B10R0.84 CNC(CCC(=O)O)C(=O)O MCULE-9982940361 [0,1,0,0,0,1|0,0,0]=2 2104 B10R0.84 CN[C@@H](CCC(=O)N)C(=O)O MCULE-1463462281 [0,1,0,0,0,1|1,0,0]=3 2105 B10R0.84 CN[C@@H](CCC(=O)O)C(=O)O MCULE-1322979818 [0,1,0,0,0,1|0,0,0]=2 2106 B10R0.84 CN[C@@H](CCC(=O)O)C(=O)O MCULE-9405643691 [0,1,0,0,0,1|0,0,0]=2 2107 B10R0.84 CN[C@H](CCC(=O)N)C(=O)O MCULE-2123714471 [0,1,0,0,0,1|1,0,0]=3 2108 B10R0.84 CN[C@H](CCC(=O)O)C(=O)O MCULE-1735782000 [0,1,0,0,0,1|0,0,0]=2 2109 B10R0.84 NN=C(CCC(=O)O)C(=O)O MCULE-4661582416 [0,1,0,0,0,1|0,0,1]=3 2110 B10R0.92 CP(=O)(O)CCC(N)C(=O)O MCULE-1038057082 [0,1,0,0,0,1|1,0,0]=3 2111 B10R0.92 CP(=O)(O)CCC(N)C(=O)O MCULE-7761179555 [0,1,0,0,0,1|1,0,0]=3 2112 B10R0.92 CS(=N)(=O)CCC(N)C(=O)O MCULE-2268954465 [0,1,0,0,0,1|2,0,0]=4 2113 B10R0.92 CS(=N)(=O)CCC(N)C(=O)O MCULE-2804558075 [0,1,0,0,0,1|2,0,0]=4 2114 B10R0.92 CS(=N)(=O)CCC(N)C(=O)O MCULE-7485004955 [0,1,0,0,0,1|2,0,0]=4 2115 B10R0.92 CS(=N)(=O)CC[C@@H](N)C(=O)O MCULE-3997574746 [0,1,0,0,0,1|2,0,0]=4 2116 B10R0.92 CS(=N)(=O)CC[C@H](N)C(=O)O MCULE-1068341907 [0,1,0,0,0,1|2,0,0]=4 2117 B10R0.92 CS(=N)(=O)CC[C@H](N)C(=O)O MCULE-3093123817 [0,1,0,0,0,1|2,0,0]=4 2118 B10R0.92 CS(=O)(=O)CCC(N)C(=O)O MCULE-8107053430 [0,1,0,0,0,1|1,0,1]=4 2119 B10R0.92 CS(=O)(=O)CC[C@@H](N)C(=O)O MCULE-1126326759 [0,1,0,0,0,1|1,0,1]=4 2120 B10R0.92 CS(=O)(=O)CC[C@@H](N)C(=O)O MCULE-3558725435 [0,1,0,0,0,1|1,0,1]=4 2121 B10R0.92 CS(=O)(=O)CC[C@H](N)C(=O)O MCULE-2269540933 [0,1,0,0,0,1|1,0,1]=4 2122 B10R0.92 CS(=O)(=O)CC[C@H](N)C(=O)O MCULE-4203364916 [0,1,0,0,0,1|1,0,1]=4 2123 B10R0.92 CS(=O)(=O)SCC(N)C(=O)O MCULE-1061975394 [0,1,0,0,0,1|1,0,1]=4 2124 B10R0.92 NC(CCP(=O)(O)O)C(=O)O MCULE-2756478197 [0,1,0,0,0,1|1,0,0]=3 2125 B10R0.92 NC(CCS(=O)(=O)O)C(=O)O MCULE-7377602601 [0,1,0,0,0,1|1,0,0]=3 2126 B10R0.92 NC(COP(=O)(O)O)C(=O)O MCULE-1695816394 [0,1,0,0,0,1|1,0,0]=3 2127 B10R0.92 NC(COS(=O)(=O)O)C(=O)O MCULE-5049646882 [0,1,0,0,0,1|1,0,0]=3 2128 B10R0.92 NC(CSS(=O)(=O)O)C(=O)[O-] MCULE-4046079265 [0,1,0,0,0,1|1,0,1]=4 2129 B10R0.92 N[C@@H](CCP(=O)(O)O)C(=O)O MCULE-3863533502 [0,1,0,0,0,1|1,0,0]=3 2130 B10R0.92 N[C@@H](CCP(=O)(O)O)C(=O)O MCULE-3988880216 [0,1,0,0,0,1|1,0,0]=3 2131 B10R0.92 N[C@@H](CCS(=O)(=O)O)C(=O)O MCULE-8204260402 [0,1,0,0,0,1|1,0,0]=3 2132 B10R0.92 N[C@@H](COP(=O)(O)O)C(=O)O MCULE-3199737084 [0,1,0,0,0,1|1,0,0]=3 2133 B10R0.92 N[C@@H](COP(=O)(O)O)C(=O)O MCULE-4907212979 [0,1,0,0,0,1|1,0,0]=3 2134 B10R0.92 N[C@@H](COS(=O)(=O)O)C(=O)O MCULE-3746813647 [0,1,0,0,0,1|1,0,0]=3 2135 B10R0.92 N[C@@H](COS(=O)(=O)O)C(=O)O MCULE-9474608832 [0,1,0,0,0,1|1,0,0]=3 2136 B10R0.92 N[C@@H](COS(=O)(=O)[O-])C(=O)O MCULE-9200207665 [0,1,0,0,0,1|1,0,1]=4 2137 B10R0.92 N[C@@H](CSS(=O)(=O)O)C(=O)O MCULE-5127296011 [0,1,0,0,0,1|1,0,0]=3 2138 B10R0.92 N[C@@H](CSS(=O)(=O)O)C(=O)[O-] MCULE-1017024868 [0,1,0,0,0,1|1,0,1]=4 2139 B10R0.92 N[C@@H](CSS(=O)(=O)O)C(=O)[O-] MCULE-7847954389 [0,1,0,0,0,1|1,0,1]=4 2140 B10R0.92 N[C@H](CCP(=O)(O)O)C(=O)O MCULE-4319868114 [0,1,0,0,0,1|1,0,0]=3 2141 B10R0.92 N[C@H](CCP(=O)([O-])O)C(=O)O MCULE-5292220353 [0,1,0,0,0,1|1,0,0]=3 2142 B10R0.92 N[C@H](COP(=O)(O)O)C(=O)O MCULE-4002733556 [0,1,0,0,0,1|1,0,0]=3 2143 B10R0.92 N[C@H](COP(=O)(O)O)C(=O)O MCULE-5554704102 [0,1,0,0,0,1|1,0,0]=3 2144 B10R0.92 O=C(O)C(O)COP(=O)(O)O MCULE-4022388447 [0,1,0,0,0,1|2,0,0]=4 2145 B10R0.92 [C@H](N)(CSS(=O)(=O)O)C(=O)O MCULE-9668444815 [0,1,0,0,0,1|1,0,0]=3 2146 B10R0.93 CC(=CC(C)C(=O)O)C(=O)O MCULE-3307721023 [0,1,0,0,0,1|1,0,1]=4 2147 B10R0.93 CC(CC(C)C(=O)O)C(=O)O MCULE-1153209267 [0,1,0,0,0,1|1,0,0]=3 2148 B10R0.93 CC(CC(N)C(=O)O)C(=O)O MCULE-4117547649 [0,1,0,0,0,1|0,0,0]=2 2149 B10R0.93 CC(N[C@@H](C)C(=O)O)C(=O)O MCULE-6318508526 [0,1,0,0,0,1|1,0,0]=3 2150 B10R0.93 C[C@H](C[C@H](N)C(=O)O)C(=O)O MCULE-2754578678 [0,1,0,0,0,1|0,0,0]=2 2151 B10R0.93 C[C@H](C[C@H](N)C(=O)O)C(=O)O MCULE-7169309772 [0,1,0,0,0,1|0,0,0]=2 2152 B10R0.93 NC(=O)[C@H](F)C[C@H](N)C(=O)O MCULE-6469307664 [0,1,0,0,0,1|1,0,0]=3 2153 B10R0.93 NC(=O)[C@H](F)C[C@H](N)C(=O)O MCULE-6602424535 [0,1,0,0,0,1|1,0,0]=3 2154 B10R0.93 NC(CC(F)C(=O)O)C(=O)O MCULE-9589470454 [0,1,0,0,0,1|0,0,0]=2 2155 B10R0.93 NC(CC(N)C(=O)O)C(=O)O MCULE-1335465688 [0,1,0,0,0,1|0,0,0]=2 2156 B10R0.93 NC(CC(N)C(=O)O)C(=O)O MCULE-4470732128 [0,1,0,0,0,1|0,0,0]=2 2157 B10R0.93 NC(CC(O)C(=O)O)C(=O)O MCULE-2122152001 [0,1,0,0,0,1|0,0,0]=2 2158 B10R0.93 N[C@@H](CC(F)C(=O)O)C(=O)O MCULE-2625841366 [0,1,0,0,0,1|0,0,0]=2 2159 B10R0.93 N[C@@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-5445779612 [0,1,0,0,0,1|0,0,0]=2 2160 B10R0.93 N[C@@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-9351036941 [0,1,0,0,0,1|0,0,0]=2 2161 B10R0.93 N[C@@H](C[C@@H](O)C(=O)O)C(=O)O MCULE-2660596864 [0,1,0,0,0,1|0,0,0]=2 2162 B10R0.93 N[C@@H](C[C@@H](O)C(=O)O)C(=O)O MCULE-6180379673 [0,1,0,0,0,1|0,0,0]=2 2163 B10R0.93 N[C@@H](C[C@H](F)C(=O)O)C(=O)O MCULE-5145554613 [0,1,0,0,0,1|0,0,0]=2 2164 B10R0.93 N[C@@H](C[C@H](F)C(=O)O)C(=O)O MCULE-9443069690 [0,1,0,0,0,1|0,0,0]=2 2165 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-2341577942 [0,1,0,0,0,1|0,0,0]=2 2166 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-4495746010 [0,1,0,0,0,1|0,0,0]=2 2167 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-6284302068 [0,1,0,0,0,1|0,0,0]=2 2168 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-6384488635 [0,1,0,0,0,1|0,0,0]=2 2169 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-6724681365 [0,1,0,0,0,1|0,0,0]=2 2170 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-8957870380 [0,1,0,0,0,1|0,0,0]=2 2171 B10R0.93 N[C@@H](C[C@H](O)C(=O)O)C(=O)O MCULE-2217204949 [0,1,0,0,0,1|0,0,0]=2 2172 B10R0.93 N[C@@H](C[C@H](O)C(=O)O)C(=O)O MCULE-8271752005 [0,1,0,0,0,1|0,0,0]=2 2173 B10R0.93 N[C@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-3848928339 [0,1,0,0,0,1|0,0,0]=2 2174 B10R0.93 N[C@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-4424451348 [0,1,0,0,0,1|0,0,0]=2 2175 B10R0.93 N[C@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-5729704628 [0,1,0,0,0,1|0,0,0]=2 2176 B10R0.93 N[C@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-8441844155 [0,1,0,0,0,1|0,0,0]=2 2177 B10R0.93 N[C@H](C[C@H](O)C(=O)O)C(=O)O MCULE-8040485498 [0,1,0,0,0,1|0,0,0]=2 2178 B10R0.93 O=C(O)C(Br)CC(Br)C(=O)O MCULE-2429859248 [0,1,0,0,0,1|1,0,0]=3 2179 B10R0.93 O=C(O)C(O)SC(O)C(=O)O MCULE-2925160633 [0,1,0,0,0,1|1,0,0]=3 2180 B10R0.31 NC(=CC(=O)O)CP(=O)(O)O MCULE-1305156195 [0,1,0,0,0,1|1,0,1]=4 2181 B10R0.44 COC(=O)CC(C)CC(=O)O MCULE-2040975724 [0,1,0,0,0,1|1,0,0]=3 2182 B10R0.44 COC(=O)CC(C)CC(=O)O MCULE-8664626816 [0,1,0,0,0,1|1,0,0]=3 2183 B10R0.44 COC(=O)C[C@H](C)CC(=O)O MCULE-3674114279 [0,1,0,0,0,1|1,0,0]=3 2184 B10R0.44 COC(=O)C[C@H](C)CC(=O)O MCULE-7834226828 [0,1,0,0,0,1|1,0,0]=3 2185 B10R0.70 CC(=O)O[C@H](CBr)CC(=O)O MCULE-9706634607 [0,1,0,0,0,1|2,0,0]=4 2186 B10R0.165 CC(=O)CC(C)(C)CC(=O)O MCULE-4874610800 [0,1,0,0,0,1|2,0,0]=4 2187 B10R0.165 CC(C)(CC(=O)O)CC(=O)O MCULE-3688310273 [0,1,0,0,0,1|1,0,0]=3 2188 B10R0.165 CC(O)(CC(=O)O)CC(=O)O MCULE-9846508304 [0,1,0,0,0,1|1,0,0]=3 2189 B10R0.165 O=C(O)CC(F)(F)CC(=O)O MCULE-1340481205 [0,1,0,0,0,1|1,0,0]=3 2190 B10R0.165 O=C(O)CS(=O)(=O)CC(=O)O MCULE-1359587275 [0,1,0,0,0,1|2,0,0]=4 2191 B10R0.47 COC(=O)CC(C)(C)C(=O)O MCULE-4222068236 [0,2,0,0,0,0|1,0,0]=3 2192 B10R0.47 COC(=O)NC(C)(C)C(=O)O MCULE-9719165017 [0,2,0,0,0,0|2,0,0]=4 2193 B10R0.117 CC(C)(C(N)C(=O)O)N(=O)=O MCULE-9002564501 [0,2,0,0,0,0|1,0,1]=4 2194 B10R0.117 CC(C)([C@H](N)C(=O)O)[N+](=O)[O-] MCULE-3869741264 [0,2,0,0,0,0|1,0,1]=4 2195 B10R0.117 O=C(O)C(F)C(F)(F)C(=O)O MCULE-7067726417 [0,2,0,0,0,0|1,0,0]=3 2196 B10R0.119 CC(CN)(CC(=O)O)C(=O)O MCULE-2103588985 [0,2,0,0,0,0|0,0,0]=2 2197 B10R0.119 CC(CN)(CC(=O)O)C(=O)O MCULE-8467010129 [0,2,0,0,0,0|0,0,0]=2 2198 B10R0.119 CCC(C)(CC(=O)O)C(=O)O MCULE-5857208842 [0,2,0,0,0,0|1,0,0]=3 2199 B10R0.141 COC(=O)C(C)(C)CC(=O)C MCULE-6735820439 [0,2,0,0,0,0|2,0,0]=4 2200 B10R0.141 COC(=O)C(C)(C)CC(=O)O MCULE-6122847743 [0,2,0,0,0,0|1,0,0]=3 2201 B10R0.32 C=C(C)CC(N)C(=O)OCC MCULE-8178008186 [0,2,0,0,0,0|2,0,0]=4 2202 B10R0.32 C=C(Cl)CC(N)C(=O)OCC MCULE-3973817457 [0,2,0,0,0,0|2,0,0]=4 2203 B10R0.32 CCOC(=O)C(C)CC(=O)C MCULE-5239572746 [0,2,0,0,0,0|2,0,0]=4 2204 B10R0.32 CCOC(=O)C(N)CC(=O)C MCULE-5271354905 [0,2,0,0,0,0|1,0,0]=3 2205 B10R0.32 CCOC(=O)C(N)CC(=O)C MCULE-7720988971 [0,2,0,0,0,0|1,0,0]=3 2206 B10R0.32 CCOC(=O)C(N)CC(=O)N MCULE-2155920173 [0,2,0,0,0,0|1,0,0]=3 2207 B10R0.32 CCOC(=O)C(N)CC(=O)N MCULE-6061365230 [0,2,0,0,0,0|1,0,0]=3 2208 B10R0.32 CCOC(=O)N(C)CC(=O)O MCULE-9866294020 [0,2,0,0,0,0|2,0,0]=4 2209 B10R0.32 CCOC(=O)[C@@H](N)CC(=O)O MCULE-8240292825 [0,2,0,0,0,0|0,0,0]=2 2210 B10R0.32 COCC(=O)N(C)CC(=O)O MCULE-5380620856 [0,2,0,0,0,0|2,0,0]=4 2211 B10R0.37 COC(=O)C(N)CC(C)(C)O MCULE-5883346797 [0,2,0,0,0,0|1,0,1]=4 2212 B10R0.46 C=C(CC(=O)OC)C(=O)OC MCULE-1752583150 [0,2,0,0,0,0|1,0,1]=4 2213 B10R0.46 COC(=O)C=C(N)C(=O)OC MCULE-2138750334 [0,2,0,0,0,0|0,0,2]=4 2214 B10R0.46 COC(=O)CC(=O)C(=O)OC MCULE-3316439224 [0,2,0,0,0,0|1,0,1]=4 2215 B10R0.46 COC(=O)CC(Br)C(=O)OC MCULE-3739337867 [0,2,0,0,0,0|1,0,0]=3 2216 B10R0.46 COC(=O)CC(C)C(=O)OC MCULE-1613501642 [0,2,0,0,0,0|1,0,0]=3 2217 B10R0.46 COC(=O)CC(N)C(=O)OC MCULE-1114099871 [0,2,0,0,0,0|0,0,0]=2 2218 B10R0.46 COC(=O)CC(N)C(=O)OC MCULE-3051634308 [0,2,0,0,0,0|0,0,0]=2 2219 B10R0.46 COC(=O)CC(N)C(=O)OC MCULE-6777150813 [0,2,0,0,0,0|0,0,0]=2 2220 B10R0.46 COC(=O)CC(N)C(=O)OC MCULE-8623143776 [0,2,0,0,0,0|0,0,0]=2 2221 B10R0.46 COC(=O)CC(O)C(=O)OC MCULE-7469251782 [0,2,0,0,0,0|1,0,0]=3 2222 B10R0.46 COC(=O)C[C@@H](C)C(=O)OC MCULE-3416186452 [0,2,0,0,0,0|1,0,0]=3 2223 B10R0.46 COC(=O)C[C@@H](C)C(=O)OC MCULE-8307638859 [0,2,0,0,0,0|1,0,0]=3 2224 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC MCULE-1851128210 [0,2,0,0,0,0|0,0,0]=2 2225 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC MCULE-2435405009 [0,2,0,0,0,0|0,0,0]=2 2226 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC MCULE-5664472093 [0,2,0,0,0,0|0,0,0]=2 2227 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC MCULE-9555102277 [0,2,0,0,0,0|0,0,0]=2 2228 B10R0.46 COC(=O)C[C@@H](O)C(=O)OC MCULE-1517388811 [0,2,0,0,0,0|1,0,0]=3 2229 B10R0.46 COC(=O)C[C@@H](O)C(=O)OC MCULE-9934344103 [0,2,0,0,0,0|1,0,0]=3 2230 B10R0.46 COC(=O)C[C@H](C)C(=O)OC MCULE-6913107439 [0,2,0,0,0,0|1,0,0]=3 2231 B10R0.46 COC(=O)C[C@H](C)C(=O)OC MCULE-7249009101 [0,2,0,0,0,0|1,0,0]=3 2232 B10R0.46 COC(=O)C[C@H](N)C(=O)OC MCULE-1761054458 [0,2,0,0,0,0|0,0,0]=2 2233 B10R0.46 COC(=O)C[C@H](N)C(=O)OC MCULE-2463653671 [0,2,0,0,0,0|0,0,0]=2 2234 B10R0.46 COC(=O)C[C@H](N)C(=O)OC MCULE-8138790792 [0,2,0,0,0,0|0,0,0]=2 2235 B10R0.46 COC(=O)C[C@H](N)C(=O)OC MCULE-9097536857 [0,2,0,0,0,0|0,0,0]=2 2236 B10R0.46 COC(=O)C[C@H](O)C(=O)OC MCULE-5763222655 [0,2,0,0,0,0|1,0,0]=3 2237 B10R0.46 COC(=O)C[C@H](O)C(=O)OC MCULE-8038750949 [0,2,0,0,0,0|1,0,0]=3 2238 B10R0.46 COC(=O)C[C@H](S)C(=O)OC MCULE-7841191977 [0,2,0,0,0,0|1,0,0]=3 2239 B10R0.54 CN[C@@H](CC(=O)O)C(=O)OC MCULE-4180877161 [0,2,0,0,0,0|0,0,0]=2 2240 B10R0.54 CN[C@@H](CC(=O)O)C(=O)OC MCULE-8047613409 [0,2,0,0,0,0|0,0,0]=2 2241 B10R0.56 COC(=O)C(O)C(O)C(=O)O MCULE-5767592339 [0,2,0,0,0,0|1,0,0]=3 2242 B10R0.56 COC(=O)N(C)C(C)C(=O)O MCULE-4638063780 [0,2,0,0,0,0|2,0,0]=4 2243 B10R0.56 COC(=O)N(C)[C@@H](C)C(=O)O MCULE-1516990203 [0,2,0,0,0,0|2,0,0]=4 2244 B10R0.56 COC(=O)N(C)[C@@H](C)C(=O)O MCULE-7050195142 [0,2,0,0,0,0|2,0,0]=4 2245 B10R0.56 COC(=O)N(C)[C@H](C)C(=O)O MCULE-3862916687 [0,2,0,0,0,0|2,0,0]=4 2246 B10R0.144 COC(OC)C(N)CC(=O)O MCULE-3271762028 [0,2,0,0,0,0|0,0,2]=4 2247 B10R0.23 CCC=C(CC(=O)O)C(=O)O MCULE-1387104032 [0,2,0,0,0,0|1,0,1]=4 2248 B10R0.23 CCCC(CC(=O)C)C(=O)O MCULE-7988753662 [0,2,0,0,0,0|2,0,0]=4 2249 B10R0.23 CCCC(CC(=O)O)C(=O)O MCULE-5222720019 [0,2,0,0,0,0|1,0,0]=3 2250 B10R0.23 CNCC(NC(=O)C)C(=O)O MCULE-4047191308 [0,2,0,0,0,0|2,0,0]=4 2251 B10R0.23 CNC[C@H](NC(=O)C)C(=O)O MCULE-3833734431 [0,2,0,0,0,0|2,0,0]=4 2252 B10R0.23 COCC(CC(=O)O)C(=O)O MCULE-7211279043 [0,2,0,0,0,0|1,0,0]=3 2253 B10R0.23 O=CNC(CC(=O)O)C(=O)O MCULE-1319737382 [0,2,0,0,0,0|0,0,0]=2 2254 B10R0.162 CC(=C(CC(=O)O)C(=O)O)C MCULE-6667375823 [0,2,0,0,0,0|1,0,1]=4 2255 B10R0.162 CC(C)C(CC(=O)O)C(=O)O MCULE-8647740549 [0,2,0,0,0,0|1,0,0]=3 2256 B10R0.162 CN(C)[C@@H](CC(=O)O)C(=O)O MCULE-5975487097 [0,2,0,0,0,0|0,0,0]=2 2257 B10R0.162 CN(C)[C@H](CC(=O)N)C(=O)O MCULE-9653422208 [0,2,0,0,0,0|1,0,0]=3 2258 B10R0.162 CN(C)[C@H](CC(=O)O)C(=O)O MCULE-7438928757 [0,2,0,0,0,0|0,0,0]=2 2259 B10R0.26 C=C(CC(=O)OCC)C(=O)O MCULE-4101935574 [0,2,0,0,0,0|1,0,1]=4 2260 B10R0.26 C=CCS(=O)CC(N)C(=O)O MCULE-1644221115 [0,2,0,0,0,0|2,0,0]=4 2261 B10R0.26 C=CCS(=O)C[C@H](N)C(=O)O MCULE-5403139844 [0,2,0,0,0,0|2,0,0]=4 2262 B10R0.26 C=CCS(=O)C[C@H](N)C(=O)O MCULE-6091538783 [0,2,0,0,0,0|2,0,0]=4 2263 B10R0.26 C=CC[S@](=O)C[C@H](N)C(=O)O MCULE-2127698614 [0,2,0,0,0,0|2,0,0]=4 2264 B10R0.26 C=CC[S@](=O)C[C@H](N)C(=O)O MCULE-6116290976 [0,2,0,0,0,0|2,0,0]=4 2265 B10R0.26 CC=CS(=O)C[C@H](N)C(=O)O MCULE-4397511090 [0,2,0,0,0,0|2,0,0]=4 2266 B10R0.26 CCCS(=O)CC(N)C(=O)O MCULE-8745806923 [0,2,0,0,0,0|2,0,0]=4 2267 B10R0.26 CCCS(=O)C[C@H](N)C(=O)O MCULE-6968745632 [0,2,0,0,0,0|2,0,0]=4 2268 B10R0.26 CCOC(=O)CC(Br)C(=O)C MCULE-1787389456 [0,2,0,0,0,0|2,0,0]=4 2269 B10R0.26 CCOC(=O)CC(C)C(=O)C MCULE-2715750632 [0,2,0,0,0,0|2,0,0]=4 2270 B10R0.26 CCOC(=O)CC(N)C(=O)O MCULE-1325477968 [0,2,0,0,0,0|0,0,0]=2 2271 B10R0.26 CCOC(=O)NC(C)C(=O)O MCULE-2656045762 [0,2,0,0,0,0|2,0,0]=4 2272 B10R0.26 CCOC(=O)N[C@@H](C)C(=O)O MCULE-7713689747 [0,2,0,0,0,0|2,0,0]=4 2273 B10R0.26 COCC(=O)NC(C)C(=O)O MCULE-8358486718 [0,2,0,0,0,0|2,0,0]=4 2274 B10R0.67 COC(C)(C)CC(N)C(=O)O MCULE-1291000987 [0,2,0,0,0,0|1,0,1]=4 2275 B8R1.1 C=CC1COC(=O)C1 MCULE-5888906344 [1,0,0,1,0,0|2,0,0]=4 2276 B8R1.1 C=CC1COC(=O)C1 MCULE-8602073759 [1,0,0,1,0,0|2,0,0]=4 2277 B8R1.1 C=C[C@@H]1COC(=O)C1 MCULE-1274088394 [1,0,0,1,0,0|2,0,0]=4 2278 B8R1.1 C=C[C@@H]1COC(=O)C1 MCULE-3162707973 [1,0,0,1,0,0|2,0,0]=4 2279 B8R1.1 O=C1CC(CO1)CO MCULE-7403068263 [1,0,0,1,0,0|1,0,1]=4 2280 B8R1.1 O=CC1COC(=O)C1 MCULE-7312168752 [1,0,0,1,0,0|1,0,0]=3 2281 B8R1.1 [C@@H]1(COC(=O)C1)C=C MCULE-1356778810 [1,0,0,1,0,0|2,0,0]=4 2282 B8R1.4 NC1COCC(=O)C1 MCULE-4958107203 [1,0,0,1,0,0|1,0,1]=4 2283 B8R1.4 NC1COCC(=O)C1 MCULE-9645630994 [1,0,0,1,0,0|1,0,1]=4 2284 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-3299834957 [1,0,0,1,0,0|1,0,1]=4 2285 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-6683156371 [1,0,0,1,0,0|1,0,1]=4 2286 B8R1.18 C=C1CC(=O)OC1=O MCULE-1819893564 [1,0,0,1,0,0|1,0,1]=4 2287 B8R1.18 CC1CC(=O)NC1=O MCULE-2962850802 [1,0,0,1,0,0|2,0,0]=4 2288 B8R1.18 CC1CC(=O)OC1=O MCULE-6043315810 [1,0,0,1,0,0|1,0,0]=3 2289 B8R1.18 CC1CC(=O)OC1O MCULE-7140241012 [1,0,0,1,0,0|1,0,1]=4 2290 B8R1.18 CC1CC(C(=O)O1)N MCULE-4414809681 [1,0,0,1,0,0|1,0,1]=4 2291 B8R1.18 CC1CC(C(=O)O1)N MCULE-7247771680 [1,0,0,1,0,0|1,0,1]=4 2292 B8R1.18 CC1NC(=O)OC1=O MCULE-5437194910 [1,0,0,1,0,0|2,0,0]=4 2293 B8R1.18 CC1NC(=O)OC1=O MCULE-6711218397 [1,0,0,1,0,0|2,0,0]=4 2294 B8R1.18 CN1CC(=O)OC1=O MCULE-7537862268 [1,0,0,1,0,0|2,0,0]=4 2295 B8R1.18 C[C@@H]1CC(=O)NC1=O MCULE-9043552998 [1,0,0,1,0,0|2,0,0]=4 2296 B8R1.18 C[C@@H]1NC(=O)OC1=O MCULE-3338806314 [1,0,0,1,0,0|2,0,0]=4 2297 B8R1.18 C[C@@H]1NC(=O)OC1=O MCULE-9892061668 [1,0,0,1,0,0|2,0,0]=4 2298 B8R1.18 C[C@H]1CC(=O)OC1=O MCULE-7764909201 [1,0,0,1,0,0|1,0,0]=3 2299 B8R1.18 C[C@H]1NC(=O)OC1=O MCULE-2658468572 [1,0,0,1,0,0|2,0,0]=4 2300 B8R1.18 C[C@H]1NC(=O)OC1=O MCULE-9205776561 [1,0,0,1,0,0|2,0,0]=4 2301 B8R1.18 NC1CC(=O)NC1=O MCULE-6692452440 [1,0,0,1,0,0|1,0,0]=3 2302 B8R1.18 NC1CC(=O)NC1=O MCULE-8447671567 [1,0,0,1,0,0|1,0,0]=3 2303 B8R1.18 NC1CC(=O)OC1=O MCULE-1406790351 [1,0,0,1,0,0|0,0,0]=2 2304 B8R1.18 NC1CC(=O)OC1=O MCULE-2807590870 [1,0,0,1,0,0|0,0,0]=2 2305 B8R1.18 NC1SC(=O)NC1=O MCULE-8460816262 [1,0,0,1,0,0|2,0,0]=4 2306 B8R1.18 NN1CC(=O)NC1=O MCULE-6319474334 [1,0,0,1,0,0|2,0,0]=4 2307 B8R1.18 NN1CC(=O)NC1=O MCULE-7370713803 [1,0,0,1,0,0|2,0,0]=4 2308 B8R1.18 N[C@@H]1CC(=O)NC1=O MCULE-1292090753 [1,0,0,1,0,0|1,0,0]=3 2309 B8R1.18 N[C@@H]1CC(=O)NC1=O MCULE-9676397018 [1,0,0,1,0,0|1,0,0]=3 2310 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-1937927503 [1,0,0,1,0,0|0,0,0]=2 2311 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-2080587685 [1,0,0,1,0,0|0,0,0]=2 2312 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-8793349665 [1,0,0,1,0,0|0,0,0]=2 2313 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-9640337170 [1,0,0,1,0,0|0,0,0]=2 2314 B8R1.18 N[C@H]1CC(=O)NC1=O MCULE-1052396743 [1,0,0,1,0,0|1,0,0]=3 2315 B8R1.18 N[C@H]1CC(=O)NC1=O MCULE-1965803095 [1,0,0,1,0,0|1,0,0]=3 2316 B8R1.18 N[C@H]1CC(=O)OC1=O MCULE-3191926438 [1,0,0,1,0,0|0,0,0]=2 2317 B8R1.18 N[C@H]1CC(=O)OC1=O MCULE-4503342222 [1,0,0,1,0,0|0,0,0]=2 2318 B8R1.31 NC1CCC1C(=O)O MCULE-1271890671 [1,0,0,1,0,0|1,0,1]=4 2319 B8R1.31 NC1CCC1C(=O)O MCULE-6203451123 [1,0,0,1,0,0|1,0,1]=4 2320 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O MCULE-7309195085 [1,0,0,1,0,0|1,0,1]=4 2321 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-1231832702 [1,0,0,1,0,0|1,0,1]=4 2322 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-4120413857 [1,0,0,1,0,0|1,0,1]=4 2323 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-7581321099 [1,0,0,1,0,0|1,0,1]=4 2324 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-8814127531 [1,0,0,1,0,0|1,0,1]=4 2325 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O MCULE-1877122488 [1,0,0,1,0,0|1,0,1]=4 2326 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-2323153571 [1,0,0,1,0,0|1,0,1]=4 2327 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3627026930 [1,0,0,1,0,0|1,0,1]=4 2328 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3814908416 [1,0,0,1,0,0|1,0,1]=4 2329 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-8552378194 [1,0,0,1,0,0|1,0,1]=4 2330 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-3693378535 [1,0,0,1,0,0|1,0,1]=4 2331 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-4998471402 [1,0,0,1,0,0|1,0,1]=4 2332 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-1179436878 [1,0,0,1,0,0|1,0,1]=4 2333 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-6666180327 [1,0,0,1,0,0|1,0,1]=4 2334 B8R1.34 O=C(O)CC1CCN1 MCULE-4161960358 [1,0,0,1,0,0|1,0,1]=4 2335 B8R1.34 O=C(O)CC1COC1 MCULE-1090518485 [1,0,0,1,0,0|1,0,1]=4 2336 B8R1.42 NC1(CC1)CC(=O)O MCULE-3593224967 [1,0,0,1,0,0|1,0,1]=4 2337 B8R1.42 NC1(CC1)CC(=O)O MCULE-8049209917 [1,0,0,1,0,0|1,0,1]=4 2338 B8R1.43 C=C[C@@H]1C[C@H]1C(=O)O MCULE-6323262453 [1,0,0,1,0,0|2,0,0]=4 2339 B8R1.43 C=C[C@H]1C[C@H]1C(=O)O MCULE-6983531899 [1,0,0,1,0,0|2,0,0]=4 2340 B8R1.43 O=C(O)C1CC1CO MCULE-5433690867 [1,0,0,1,0,0|1,0,1]=4 2341 B8R1.43 O=C(O)[C@@H]1C[C@H]1CO MCULE-9657133495 [1,0,0,1,0,0|1,0,1]=4 2342 B8R1.43 O=C(O)[C@H]1C[C@@H]1CO MCULE-1395497386 [1,0,0,1,0,0|1,0,1]=4 2343 B8R1.7 C1(CCOC1)C(=O)O MCULE-4859263225 [1,0,0,1,0,0|1,0,1]=4 2344 B8R1.7 O=C(O)C1C=CCN1 MCULE-2141949922 [1,0,0,1,0,0|1,0,1]=4 2345 B8R1.7 O=C(O)C1C=CCN1 MCULE-3068035697 [1,0,0,1,0,0|1,0,1]=4 2346 B8R1.7 O=C(O)C1C=CCN1 MCULE-4825351403 [1,0,0,1,0,0|1,0,1]=4 2347 B8R1.7 O=C(O)C1C=CCN1 MCULE-9928071710 [1,0,0,1,0,0|1,0,1]=4 2348 B8R1.7 O=C(O)C1CC=CC1 MCULE-7876630177 [1,0,0,1,0,0|2,0,0]=4 2349 B8R1.7 O=C(O)C1CCCN1 MCULE-2229401513 [1,0,0,1,0,0|1,0,1]=4 2350 B8R1.7 O=C(O)C1CCCN1 MCULE-6305507014 [1,0,0,1,0,0|1,0,1]=4 2351 B8R1.7 O=C(O)C1CCCN1 MCULE-8387491590 [1,0,0,1,0,0|1,0,1]=4 2352 B8R1.7 O=C(O)C1CCCN1 MCULE-8611160929 [1,0,0,1,0,0|1,0,1]=4 2353 B8R1.7 O=C(O)C1CCOC1 MCULE-3567941338 [1,0,0,1,0,0|1,0,1]=4 2354 B8R1.7 O=C(O)C1COCN1 MCULE-4997392610 [1,0,0,1,0,0|2,0,0]=4 2355 B8R1.7 O=C(O)C1COCN1 MCULE-7001651226 [1,0,0,1,0,0|2,0,0]=4 2356 B8R1.7 O=C(O)C1CSCN1 MCULE-2391637686 [1,0,0,1,0,0|2,0,0]=4 2357 B8R1.7 O=C(O)C1CSCN1 MCULE-9622331370 [1,0,0,1,0,0|2,0,0]=4 2358 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-2515045579 [1,0,0,1,0,0|1,0,1]=4 2359 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-3589058117 [1,0,0,1,0,0|1,0,1]=4 2360 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-7995918745 [1,0,0,1,0,0|1,0,1]=4 2361 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-8155212892 [1,0,0,1,0,0|1,0,1]=4 2362 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-1020921088 [1,0,0,1,0,0|1,0,1]=4 2363 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6398060480 [1,0,0,1,0,0|1,0,1]=4 2364 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6772131264 [1,0,0,1,0,0|1,0,1]=4 2365 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-8415049837 [1,0,0,1,0,0|1,0,1]=4 2366 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-4807765276 [1,0,0,1,0,0|1,0,1]=4 2367 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-7912413581 [1,0,0,1,0,0|1,0,1]=4 2368 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1547472283 [1,0,0,1,0,0|2,0,0]=4 2369 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1876089066 [1,0,0,1,0,0|2,0,0]=4 2370 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1926856350 [1,0,0,1,0,0|2,0,0]=4 2371 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-9876695932 [1,0,0,1,0,0|2,0,0]=4 2372 B8R1.7 O=C(O)[C@@H]1CSCN1 MCULE-4243406881 [1,0,0,1,0,0|2,0,0]=4 2373 B8R1.7 O=C(O)[C@@H]1CSCN1 MCULE-6343154165 [1,0,0,1,0,0|2,0,0]=4 2374 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-2145380755 [1,0,0,1,0,0|1,0,1]=4 2375 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-5768283844 [1,0,0,1,0,0|1,0,1]=4 2376 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-8522372891 [1,0,0,1,0,0|1,0,1]=4 2377 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-5856142508 [1,0,0,1,0,0|1,0,1]=4 2378 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-7748032436 [1,0,0,1,0,0|1,0,1]=4 2379 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-3213766488 [1,0,0,1,0,0|1,0,1]=4 2380 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-9627397250 [1,0,0,1,0,0|1,0,1]=4 2381 B8R1.7 O=C(O)[C@H]1CSCN1 MCULE-6095527710 [1,0,0,1,0,0|2,0,0]=4 2382 B8R1.7 O=C(O)[C@H]1CSCN1 MCULE-9117444908 [1,0,0,1,0,0|2,0,0]=4 2383 B8R1.23 C1(CC(=O)N1)C(=O)O MCULE-3416083471 [1,0,0,1,0,0|0,0,0]=2 2384 B8R1.23 C=C1CC(C1)C(=O)O MCULE-6435857280 [1,0,0,1,0,0|2,0,0]=4 2385 B8R1.23 CC1CC(N1)C(=O)O MCULE-2803934033 [1,0,0,1,0,0|1,0,1]=4 2386 B8R1.23 C[C@@H]1C[C@H](N1)C(=O)O MCULE-6318758002 [1,0,0,1,0,0|1,0,1]=4 2387 B8R1.23 C[C@H]1C[C@H](N1)C(=O)O MCULE-2969381793 [1,0,0,1,0,0|1,0,1]=4 2388 B8R1.23 O=C(O)C1CC(C1)O MCULE-4341192467 [1,0,0,1,0,0|1,0,1]=4 2389 B8R1.23 O=C(O)[C@H]1C[C@@H](C1)O MCULE-9908072079 [1,0,0,1,0,0|1,0,1]=4 2390 B8R1.23 O=C(O)[C@H]1C[C@H](C1)O MCULE-5181925767 [1,0,0,1,0,0|1,0,1]=4 2391 B8R1.23 O=C1CC(C1)C(=O)Cl MCULE-5261758509 [1,0,0,1,0,0|2,0,0]=4 2392 B8R1.23 O=C1CC(C1)C(=O)O MCULE-8672788982 [1,0,0,1,0,0|1,0,0]=3 2393 B8R1.23 O=C1CC(N1)C(=O)O MCULE-3167823583 [1,0,0,1,0,0|0,0,0]=2 2394 B8R1.23 O=C1CC(O1)C(=O)O MCULE-1791104685 [1,0,0,1,0,0|1,0,0]=3 2395 B8R1.23 O=C1C[C@@H](N1)C(=O)O MCULE-2118093307 [1,0,0,1,0,0|0,0,0]=2 2396 B8R1.23 O=C1C[C@@H](N1)C(=O)O MCULE-7784171286 [1,0,0,1,0,0|0,0,0]=2 2397 B8R1.23 O=C1C[C@H](N1)C(=O)O MCULE-1255798587 [1,0,0,1,0,0|0,0,0]=2 2398 B8R1.23 O=C1C[C@H](N1)C(=O)O MCULE-6947698869 [1,0,0,1,0,0|0,0,0]=2 2399 B8R1.54 C(N)(C(=O)O)C1CC1 MCULE-4833544032 [1,0,0,1,0,0|1,0,1]=4 2400 B8R1.54 NC(C(=O)O)C1CC1 MCULE-1974514713 [1,0,0,1,0,0|1,0,1]=4 2401 B8R1.54 NC(C(=O)O)C1CC1 MCULE-3126466096 [1,0,0,1,0,0|1,0,1]=4 2402 B8R1.54 N[C@@H](C(=O)O)C1CC1 MCULE-5662004537 [1,0,0,1,0,0|1,0,1]=4 2403 B8R1.54 N[C@@H](C(=O)O)C1CC1 MCULE-9004548949 [1,0,0,1,0,0|1,0,1]=4 2404 B8R1.54 N[C@H](C(=O)O)C1CC1 MCULE-4323013494 [1,0,0,1,0,0|1,0,1]=4 2405 B8R1.54 N[C@H](C(=O)O)C1CC1 MCULE-9475774396 [1,0,0,1,0,0|1,0,1]=4 2406 B8R1.78 CC1(CCO1)C(=O)O MCULE-3206195959 [1,0,0,1,0,0|1,0,1]=4 2407 B8R1.78 C[C@@]1(CCO1)C(=O)O MCULE-1153504060 [1,0,0,1,0,0|1,0,1]=4 2408 B8R1.78 NC1(CCC1)C(=O)O MCULE-7741753062 [1,0,0,1,0,0|1,0,1]=4 2409 B8R1.78 NC1(CCC1)C(=O)O MCULE-8986168461 [1,0,0,1,0,0|1,0,1]=4 2410 B8R1.78 NC1(CNC1)C(=O)O MCULE-1078717796 [1,0,0,1,0,0|2,0,0]=4 2411 B8R1.78 NC1(CNC1)C(=O)O MCULE-1597584418 [1,0,0,1,0,0|2,0,0]=4 2412 B8R1.78 NC1(COC1)C(=O)O MCULE-2048452241 [1,0,0,1,0,0|2,0,0]=4 2413 B8R1.78 NC1(CSC1)C(=O)O MCULE-3865165435 [1,0,0,1,0,0|2,0,0]=4 2414 B8R1.78 NC1(CSC1)C(=O)O MCULE-7335919130 [1,0,0,1,0,0|2,0,0]=4 2415 B8R1.3 O=C1CCC(=O)CC1 MCULE-5432049567 [1,0,0,1,0,0|2,0,0]=4 2416 B8R1.3 O=C1CCC(=O)NC1 MCULE-8297515560 [1,0,0,1,0,0|2,0,0]=4 2417 B8R1.3 O=C1CCC(=O)NN1 MCULE-3404255918 [1,0,0,1,0,0|2,0,0]=4 2418 B8R1.3 O=C1CCC(=O)OC1 MCULE-5478039984 [1,0,0,1,0,0|1,0,0]=3 2419 B8R1.3 O=C1CCC(CO1)O MCULE-6372408261 [1,0,0,1,0,0|1,0,1]=4 2420 B8R1.3 O=C1COC(=O)CN1 MCULE-4171313774 [1,0,0,1,0,0|2,0,0]=4 2421 B8R1.3 O=C1COC(=O)CO1 MCULE-8927291216 [1,0,0,1,0,0|2,0,0]=4 2422 B8R1.35 O=C(O)CCC1CO1 MCULE-1859826371 [1,0,0,1,0,0|1,0,1]=4 2423 B8R1.50 CC1C(=O)COC1=O MCULE-4188541096 [0,0,0,1,1,0|2,0,0]=4 2424 B8R1.50 O=C1COC(=O)C1Br MCULE-7458581655 [0,0,0,1,1,0|2,0,0]=4 2425 B8R1.50 O=C1COC(=O)C1Cl MCULE-1326411169 [0,0,0,1,1,0|2,0,0]=4 2426 B10R1.13 O=C(O)C1CCC(CN1)O MCULE-3204705068 [0,0,0,1,0,1|1,0,1]=4 2427 B10R1.13 O=C(O)C1CCC(CN1)O MCULE-7178398033 [0,0,0,1,0,1|1,0,1]=4 2428 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-1384355113 [0,0,0,1,0,1|1,0,1]=4 2429 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-1678351091 [0,0,0,1,0,1|1,0,1]=4 2430 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-5287470680 [0,0,0,1,0,1|1,0,1]=4 2431 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-7907264464 [0,0,0,1,0,1|1,0,1]=4 2432 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-2425882122 [0,0,0,1,0,1|1,0,1]=4 2433 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-3071319870 [0,0,0,1,0,1|1,0,1]=4 2434 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-3130571634 [0,0,0,1,0,1|1,0,1]=4 2435 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-4156067811 [0,0,0,1,0,1|1,0,1]=4 2436 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-6185299507 [0,0,0,1,0,1|1,0,1]=4 2437 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-8875046289 [0,0,0,1,0,1|1,0,1]=4 2438 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-2267551829 [0,0,0,1,0,1|1,0,1]=4 2439 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-7339394632 [0,0,0,1,0,1|1,0,1]=4 2440 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-7777420620 [0,0,0,1,0,1|1,0,1]=4 2441 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-9629486094 [0,0,0,1,0,1|1,0,1]=4 2442 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-3991583469 [0,0,0,1,0,1|1,0,1]=4 2443 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-8329848691 [0,0,0,1,0,1|1,0,1]=4 2444 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-8730600296 [0,0,0,1,0,1|1,0,1]=4 2445 B10R1.13 O=C1CCC(CC1)C(=O)O MCULE-3268045048 [0,0,0,1,0,1|2,0,0]=4 2446 B10R1.13 O=C1CCC(CN1)C(=O)O MCULE-9788917215 [0,0,0,1,0,1|2,0,0]=4 2447 B10R1.13 O=C1CCC(NC1)C(=O)O MCULE-4067834062 [0,0,0,1,0,1|1,0,0]=3 2448 B10R1.13 O=C1CCC(NC1)C(=O)O MCULE-8147757527 [0,0,0,1,0,1|1,0,0]=3 2449 B10R1.13 O=C1CC[C@@H](CN1)C(=O)O MCULE-3191286949 [0,0,0,1,0,1|2,0,0]=4 2450 B10R1.13 O=C1CC[C@@H](CN1)C(=O)O MCULE-9692186311 [0,0,0,1,0,1|2,0,0]=4 2451 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-4350301488 [0,0,0,1,0,1|1,0,0]=3 2452 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-6122427477 [0,0,0,1,0,1|1,0,0]=3 2453 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-7864506900 [0,0,0,1,0,1|1,0,0]=3 2454 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-8690683788 [0,0,0,1,0,1|1,0,0]=3 2455 B10R1.13 O=C1CC[C@H](CN1)C(=O)O MCULE-6590332785 [0,0,0,1,0,1|2,0,0]=4 2456 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-2845724258 [0,0,0,1,0,1|1,0,0]=3 2457 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-4534690891 [0,0,0,1,0,1|1,0,0]=3 2458 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-5755683417 [0,0,0,1,0,1|1,0,0]=3 2459 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-6015971784 [0,0,0,1,0,1|1,0,0]=3 2460 B10R1.13 O=C1CNC(CN1)C(=O)O MCULE-1011618274 [0,0,0,1,0,1|1,0,0]=3 2461 B10R1.13 O=C1CNC(CN1)C(=O)O MCULE-9345081526 [0,0,0,1,0,1|1,0,0]=3 2462 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-1270509503 [0,0,0,1,0,1|1,0,0]=3 2463 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-5912128916 [0,0,0,1,0,1|1,0,0]=3 2464 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-6974754540 [0,0,0,1,0,1|1,0,0]=3 2465 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-9137341829 [0,0,0,1,0,1|1,0,0]=3 2466 B10R1.13 O=C1CN[C@H](CN1)C(=O)O MCULE-8928326150 [0,0,0,1,0,1|1,0,0]=3 2467 B10R1.13 [C@@H]1(CC[C@H](NC1)C(=O)O)O MCULE-1423621462 [0,0,0,1,0,1|1,0,1]=4 2468 B10R1.13 [C@@H]1(CC[C@H](NC1)C(=O)O)O MCULE-1814136074 [0,0,0,1,0,1|1,0,1]=4 2469 B10R1.58 CN1CC(OC1=O)C(=O)O MCULE-1158187923 [0,0,0,1,0,1|2,0,0]=4 2470 B10R1.58 N[C@@H]1C[C@@H](C[C@H]1O)C(=O)O MCULE-2019095795 [0,0,0,1,0,1|1,0,1]=4 2471 B10R1.58 N[C@@H]1C[C@@H](C[C@H]1O)C(=O)O MCULE-7012514700 [0,0,0,1,0,1|1,0,1]=4 2472 B10R1.58 O=C(O)[C@@H]1C[C@H](C(=O)N1)F MCULE-3594620408 [0,0,0,1,0,1|2,0,0]=4 2473 B10R1.58 O=C(O)[C@@H]1C[C@H](C(=O)N1)F MCULE-7616817872 [0,0,0,1,0,1|2,0,0]=4 2474 B10R1.58 O=C1NC(CC1F)C(=O)O MCULE-5782471146 [0,0,0,1,0,1|2,0,0]=4 2475 B10R1.58 O=C1N[C@@H](C[C@@H]1F)C(=O)O MCULE-5667846232 [0,0,0,1,0,1|2,0,0]=4 2476 B10R1.58 O=C1N[C@@H](C[C@@H]1F)C(=O)O MCULE-8319847079 [0,0,0,1,0,1|2,0,0]=4 2477 B10R1.349 CC(=O)N1CC(C1)C(=O)O MCULE-3908865552 [0,0,0,1,0,1|2,0,0]=4 2478 B10R1.349 NC(=O)N1CC(C1)C(=O)O MCULE-3854559032 [0,0,0,1,0,1|2,0,0]=4 2479 B10R1.349 O=C(O)C1CC(C1)C(=O)O MCULE-7515334695 [0,0,0,1,0,1|1,0,0]=3 2480 B10R1.349 O=C(O)C1CC(N1)C(=O)O MCULE-2441047831 [0,0,0,1,0,1|0,0,0]=2 2481 B10R1.349 O=C(O)[C@H]1C[C@@H](C1)C(=O)O MCULE-7021077384 [0,0,0,1,0,1|1,0,0]=3 2482 B10R1.349 O=C(O)[C@H]1C[C@H](C1)C(=O)O MCULE-2423808428 [0,0,0,1,0,1|1,0,0]=3 2483 B10R1.359 O=C(O)C1CCS(=O)(=O)N1 MCULE-5768819085 [0,0,0,1,0,1|1,0,1]=4 2484 B10R1.360 CC1(CC1C(=O)O)C(=O)O MCULE-1315514899 [0,0,0,1,0,1|1,0,0]=3 2485 B10R1.470 CC1(CCC(=O)C1)C(=O)O MCULE-8301527257 [0,0,0,1,0,1|2,0,0]=4 2486 B10R1.470 CC1(CCC(=O)N1)C(=O)O MCULE-6271364258 [0,0,0,1,0,1|2,0,0]=4 2487 B10R1.470 CC1(CCC(=O)O1)C(=O)O MCULE-2009596037 [0,0,0,1,0,1|1,0,0]=3 2488 B10R1.470 CC1(CNC(=O)C1)C(=O)O MCULE-2188595466 [0,0,0,1,0,1|2,0,0]=4 2489 B10R1.470 C[C@@]1(CCC(=O)N1)C(=O)O MCULE-6399167225 [0,0,0,1,0,1|2,0,0]=4 2490 B10R1.470 C[C@@]1(CCC(=O)N1)C(=O)O MCULE-7144294782 [0,0,0,1,0,1|2,0,0]=4 2491 B10R1.470 C[C@]1(CCC(=O)N1)C(=O)O MCULE-6153592913 [0,0,0,1,0,1|2,0,0]=4 2492 B10R1.470 C[C@]1(CCC(=O)N1)C(=O)O MCULE-6971506580 [0,0,0,1,0,1|2,0,0]=4 2493 B10R1.54 O=C(O)CC1=CC(=O)NN1 MCULE-5112159197 [0,0,0,1,0,1|1,0,1]=4 2494 B10R1.54 O=C(O)CC1CC(CN1)O MCULE-7161298106 [0,0,0,1,0,1|1,0,1]=4 2495 B10R1.54 O=C(O)CC1CC(CN1)O MCULE-8476180516 [0,0,0,1,0,1|1,0,1]=4 2496 B10R1.54 O=C(O)CC1CCC(=O)C1 MCULE-8065311815 [0,0,0,1,0,1|2,0,0]=4 2497 B10R1.54 O=C(O)CC1CCC(=O)N1 MCULE-4378271581 [0,0,0,1,0,1|2,0,0]=4 2498 B10R1.54 O=C(O)CC1CCC(=O)O1 MCULE-3722776234 [0,0,0,1,0,1|2,0,0]=4 2499 B10R1.54 O=C(O)CC1CNC(=O)C1 MCULE-1228415378 [0,0,0,1,0,1|2,0,0]=4 2500 B10R1.54 O=C(O)CC1COC(=O)C1 MCULE-9024324984 [0,0,0,1,0,1|1,0,0]=3 2501 B10R1.54 O=C(O)C[C@@H]1CC(CN1)O MCULE-5520496479 [0,0,0,1,0,1|1,0,1]=4 2502 B10R1.54 O=C(O)C[C@@H]1CC(CN1)O MCULE-9606256613 [0,0,0,1,0,1|1,0,1]=4 2503 B10R1.54 O=C(O)C[C@@H]1CCC(=O)N1 MCULE-2294433482 [0,0,0,1,0,1|2,0,0]=4 2504 B10R1.54 O=C(O)C[C@@H]1CCC(=O)N1 MCULE-6637712682 [0,0,0,1,0,1|2,0,0]=4 2505 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-1516021519 [0,0,0,1,0,1|1,0,1]=4 2506 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-4246846585 [0,0,0,1,0,1|1,0,1]=4 2507 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-5090681884 [0,0,0,1,0,1|1,0,1]=4 2508 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-6554402545 [0,0,0,1,0,1|1,0,1]=4 2509 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-8720083389 [0,0,0,1,0,1|1,0,1]=4 2510 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-9359661762 [0,0,0,1,0,1|1,0,1]=4 2511 B10R1.54 O=C(O)C[C@H]1CCC(=O)C1 MCULE-1700675888 [0,0,0,1,0,1|2,0,0]=4 2512 B10R1.54 O=C(O)C[C@H]1CCC(=O)C1 MCULE-3179723751 [0,0,0,1,0,1|2,0,0]=4 2513 B10R1.54 O=C(O)C[C@H]1CCC(=O)N1 MCULE-1080082151 [0,0,0,1,0,1|2,0,0]=4 2514 B10R1.54 O=C(O)C[C@H]1CCC(=O)N1 MCULE-2947978966 [0,0,0,1,0,1|2,0,0]=4 2515 B10R1.54 O=C(O)C[C@H]1COC(=O)N1 MCULE-1807368276 [0,0,0,1,0,1|1,0,0]=3 2516 B10R1.59 C=C1C[C@@H]([C@@H](C1)C(=O)O)N MCULE-9822470688 [0,0,0,1,0,1|2,0,0]=4 2517 B10R1.59 CC1CC(=O)NC1C(=O)O MCULE-1142843058 [0,0,0,1,0,1|2,0,0]=4 2518 B10R1.59 CC1NC(=O)CC1C(=O)O MCULE-1109266882 [0,0,0,1,0,1|2,0,0]=4 2519 B10R1.59 CC1OC(=O)NC1C(=O)O MCULE-7595794618 [0,0,0,1,0,1|2,0,0]=4 2520 B10R1.59 C[C@@H]1CC(=O)N[C@@H]1C(=O)O MCULE-5687745727 [0,0,0,1,0,1|2,0,0]=4 2521 B10R1.59 C[C@@H]1CC(=O)N[C@H]1C(=O)O MCULE-3978079245 [0,0,0,1,0,1|2,0,0]=4 2522 B10R1.59 C[C@H]1CC(=O)N[C@@H]1C(=O)O MCULE-1352855018 [0,0,0,1,0,1|2,0,0]=4 2523 B10R1.59 C[C@H]1CC(=O)N[C@H]1C(=O)O MCULE-6205979547 [0,0,0,1,0,1|2,0,0]=4 2524 B10R1.282 C=C1C(C1C(=O)O)C(=O)O MCULE-8215023904 [0,0,0,1,0,1|1,0,1]=4 2525 B10R1.282 C=C1[C@@H]([C@H]1C(=O)O)C(=O)O MCULE-9621561536 [0,0,0,1,0,1|1,0,1]=4 2526 B10R1.282 C=C1[C@H]([C@@H]1C(=O)O)C(=O)O MCULE-3101001045 [0,0,0,1,0,1|1,0,1]=4 2527 B10R1.282 CC1C(C1C(=O)O)C(=O)O MCULE-6282240195 [0,0,0,1,0,1|1,0,0]=3 2528 B10R1.442 O=C(O)CC1(CC1)C(=O)O MCULE-5389842845 [0,1,0,1,0,0|1,0,0]=3 2529 B10R1.566 NC1(CS(=O)(=O)C1)C(=O)O MCULE-6225932613 [0,1,0,1,0,0|1,0,1]=4 2530 B10R1.14 C1(CCC(=O)C1)C(=O)OC MCULE-8334918383 [0,1,0,1,0,0|2,0,0]=4 2531 B10R1.14 C=C1CNC(C1)C(=O)OC MCULE-4635683717 [0,1,0,1,0,0|2,0,0]=4 2532 B10R1.14 C=C1CNC(C1)C(=O)OC MCULE-9917502383 [0,1,0,1,0,0|2,0,0]=4 2533 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-2960661877 [0,1,0,1,0,0|2,0,0]=4 2534 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-3356870567 [0,1,0,1,0,0|2,0,0]=4 2535 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-5709460460 [0,1,0,1,0,0|2,0,0]=4 2536 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-5969395974 [0,1,0,1,0,0|2,0,0]=4 2537 B10R1.14 COC(=O)C1C=CC(=O)C1 MCULE-4348671758 [0,1,0,1,0,0|2,0,0]=4 2538 B10R1.14 COC(=O)C1CC(=O)CO1 MCULE-2471814999 [0,1,0,1,0,0|2,0,0]=4 2539 B10R1.14 COC(=O)C1CC(CN1)O MCULE-7417308251 [0,1,0,1,0,0|1,0,1]=4 2540 B10R1.14 COC(=O)C1CC(CN1)O MCULE-8127150549 [0,1,0,1,0,0|1,0,1]=4 2541 B10R1.14 COC(=O)C1CCC(=O)C1 MCULE-5952382453 [0,1,0,1,0,0|2,0,0]=4 2542 B10R1.14 COC(=O)C1CNC(=O)C1 MCULE-5678646707 [0,1,0,1,0,0|2,0,0]=4 2543 B10R1.14 COC(=O)C1COC(=O)N1 MCULE-5827623021 [0,1,0,1,0,0|2,0,0]=4 2544 B10R1.14 COC(=O)[C@@H]1CC(CN1)O MCULE-1283857272 [0,1,0,1,0,0|1,0,1]=4 2545 B10R1.14 COC(=O)[C@@H]1CC(CN1)O MCULE-1946068889 [0,1,0,1,0,0|1,0,1]=4 2546 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 MCULE-7952909342 [0,1,0,1,0,0|2,0,0]=4 2547 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 MCULE-8638772412 [0,1,0,1,0,0|2,0,0]=4 2548 B10R1.14 COC(=O)[C@@H]1CNC(=O)C1 MCULE-9225925550 [0,1,0,1,0,0|2,0,0]=4 2549 B10R1.14 COC(=O)[C@@H]1COC(=O)N1 MCULE-6173112740 [0,1,0,1,0,0|2,0,0]=4 2550 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)O MCULE-5518895757 [0,1,0,1,0,0|1,0,1]=4 2551 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)O MCULE-5601019886 [0,1,0,1,0,0|1,0,1]=4 2552 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)O MCULE-7806570596 [0,1,0,1,0,0|1,0,1]=4 2553 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)O MCULE-9487428732 [0,1,0,1,0,0|1,0,1]=4 2554 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)O MCULE-3617032083 [0,1,0,1,0,0|1,0,1]=4 2555 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)O MCULE-3763938961 [0,1,0,1,0,0|1,0,1]=4 2556 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)O MCULE-4682429159 [0,1,0,1,0,0|1,0,1]=4 2557 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)O MCULE-5777795887 [0,1,0,1,0,0|1,0,1]=4 2558 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 MCULE-6859943891 [0,1,0,1,0,0|2,0,0]=4 2559 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 MCULE-7172592478 [0,1,0,1,0,0|2,0,0]=4 2560 B10R1.14 COC(=O)[C@H]1CNC(=O)C1 MCULE-9231955159 [0,1,0,1,0,0|2,0,0]=4 2561 B10R1.14 COC(=O)[C@H]1COC(=O)N1 MCULE-1359293106 [0,1,0,1,0,0|2,0,0]=4 2562 B10R1.14 COC(=O)[C@H]1COC(=O)N1 MCULE-8105273052 [0,1,0,1,0,0|2,0,0]=4 2563 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O MCULE-1245408761 [0,1,0,1,0,0|1,0,1]=4 2564 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O MCULE-3057383638 [0,1,0,1,0,0|1,0,1]=4 2565 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O MCULE-4148644588 [0,1,0,1,0,0|1,0,1]=4 2566 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O MCULE-9267825535 [0,1,0,1,0,0|1,0,1]=4 2567 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)O MCULE-1940578186 [0,1,0,1,0,0|1,0,1]=4 2568 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)O MCULE-2778952777 [0,1,0,1,0,0|1,0,1]=4 2569 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)O MCULE-5090473531 [0,1,0,1,0,0|1,0,1]=4 2570 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)O MCULE-6223710798 [0,1,0,1,0,0|1,0,1]=4 2571 B10R1.14 [C@@H]1(CNC(=O)C1)C(=O)OC MCULE-5277165389 [0,1,0,1,0,0|2,0,0]=4 2572 B10R1.14 [C@@H]1(CN[C@H](C1)C(=O)OC)O MCULE-2597929891 [0,1,0,1,0,0|1,0,1]=4 2573 B10R1.14 [C@@H]1(CN[C@H](C1)C(=O)OC)O MCULE-4487472832 [0,1,0,1,0,0|1,0,1]=4 2574 B10R1.14 [C@H]1(CNC(=O)C1)C(=O)OC MCULE-1672375650 [0,1,0,1,0,0|2,0,0]=4 2575 B10R1.14 [C@H]1(COC(=O)N1)C(=O)OC MCULE-6209661780 [0,1,0,1,0,0|2,0,0]=4 2576 B10R1.64 O=C(O)CC1=CNN=C1O MCULE-1830909072 [0,1,0,1,0,0|1,0,1]=4 2577 B10R1.64 O=C(O)CC1CCCC1=O MCULE-9371811615 [0,1,0,1,0,0|2,0,0]=4 2578 B10R1.64 O=C(O)CC1CCNC1=O MCULE-4096969007 [0,1,0,1,0,0|2,0,0]=4 2579 B10R1.64 O=C(O)CN1CCOC1=O MCULE-4152481351 [0,1,0,1,0,0|2,0,0]=4 2580 B10R1.194 CC1C(=O)OCC1C(=O)O MCULE-8491867617 [0,1,0,1,0,0|1,0,0]=3 2581 B10R1.194 CN1C(=O)OCC1C(=O)O MCULE-8242069751 [0,1,0,1,0,0|2,0,0]=4 2582 B10R1.408 CNC(=O)C1CC1C(=O)O MCULE-5991575859 [0,1,0,1,0,0|2,0,0]=4 2583 B10R1.408 CNC(=O)[C@H]1C[C@@H]1C(=O)O MCULE-5485938531 [0,1,0,1,0,0|2,0,0]=4 2584 B10R1.408 COC(=O)C1CC1C(=O)C MCULE-9692510329 [0,1,0,1,0,0|2,0,0]=4 2585 B10R1.408 COC(=O)C1CC1C(=O)O MCULE-7866234212 [0,1,0,1,0,0|1,0,0]=3 2586 B10R1.408 COC(=O)[C@@H]1C[C@@H]1C(=O)O MCULE-3699835184 [0,1,0,1,0,0|1,0,0]=3 2587 B10R1.408 COC(=O)[C@@H]1C[C@@H]1C(=O)O MCULE-8154738068 [0,1,0,1,0,0|1,0,0]=3 2588 B10R1.408 COC(=O)[C@@H]1C[C@H]1C(=O)O MCULE-5512209759 [0,1,0,1,0,0|1,0,0]=3 2589 B10R1.408 COC(=O)[C@@H]1C[C@H]1C(=O)O MCULE-9728286418 [0,1,0,1,0,0|1,0,0]=3 2590 B10R1.408 COC(=O)[C@H]1C[C@@H]1C(=O)O MCULE-2394122729 [0,1,0,1,0,0|1,0,0]=3 2591 B10R1.408 COC(=O)[C@H]1C[C@H]1C(=O)O MCULE-9017164187 [0,1,0,1,0,0|1,0,0]=3 2592 B10R1.408 [C@H]1(C[C@H]1C(=O)OC)C(=O)O MCULE-5989838336 [0,1,0,1,0,0|1,0,0]=3 2593 B10R1.424 COC(=O)C1(CC(=O)C1)C MCULE-2114624885 [0,1,0,1,0,0|2,0,0]=4 2594 B10R1.424 COC(=O)C1(CC(=O)C1)F MCULE-3044103306 [0,1,0,1,0,0|2,0,0]=4 2595 B10R1.424 COC(=O)C1(CC(C1)O)N MCULE-2255959476 [0,1,0,1,0,0|1,0,1]=4 2596 B10R1.424 COC(=O)C1(CC(C1)O)N MCULE-4743840504 [0,1,0,1,0,0|1,0,1]=4 2597 B10R1.113 O=C(O)C1CC(CCN1)O MCULE-2758341308 [0,1,0,1,0,0|1,0,1]=4 2598 B10R1.113 O=C(O)C1CC(CCN1)O MCULE-7585455422 [0,1,0,1,0,0|1,0,1]=4 2599 B10R1.113 O=C(O)C1CNCC(C1)O MCULE-1307689360 [0,1,0,1,0,0|1,0,1]=4 2600 B10R1.113 O=C(O)C1CNCC(C1)O MCULE-6671293935 [0,1,0,1,0,0|1,0,1]=4 2601 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-2725116552 [0,1,0,1,0,0|2,0,0]=4 2602 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-7493333189 [0,1,0,1,0,0|2,0,0]=4 2603 B10R1.113 O=C(O)[C@@H]1C[C@@H](CCN1)O MCULE-1390000123 [0,1,0,1,0,0|1,0,1]=4 2604 B10R1.113 O=C(O)[C@@H]1C[C@@H](CCN1)O MCULE-5873942206 [0,1,0,1,0,0|1,0,1]=4 2605 B10R1.113 O=C(O)[C@@H]1C[C@H](CCN1)O MCULE-5317131791 [0,1,0,1,0,0|1,0,1]=4 2606 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-1474484031 [0,1,0,1,0,0|1,0,1]=4 2607 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-1820373402 [0,1,0,1,0,0|1,0,1]=4 2608 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-4771226737 [0,1,0,1,0,0|1,0,1]=4 2609 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-4907773186 [0,1,0,1,0,0|1,0,1]=4 2610 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-8175624129 [0,1,0,1,0,0|1,0,1]=4 2611 B10R1.113 O=C(O)[C@H]1C[C@H](CCN1)O MCULE-4751772547 [0,1,0,1,0,0|1,0,1]=4 2612 B10R1.113 O=C(O)[C@H]1C[C@H](CCN1)O MCULE-6686826243 [0,1,0,1,0,0|1,0,1]=4 2613 B10R1.113 O=C1C=CCC(C1)C(=O)O MCULE-3511234259 [0,1,0,1,0,0|2,0,0]=4 2614 B10R1.113 O=C1CC(CCN1)C(=O)O MCULE-8037650535 [0,1,0,1,0,0|2,0,0]=4 2615 B10R1.113 O=C1CC(CNN1)C(=O)O MCULE-4653652849 [0,1,0,1,0,0|1,0,0]=3 2616 B10R1.113 O=C1CC(CNN1)C(=O)O MCULE-5555795045 [0,1,0,1,0,0|1,0,0]=3 2617 B10R1.113 O=C1CCCC(C1)C(=O)O MCULE-6286773194 [0,1,0,1,0,0|2,0,0]=4 2618 B10R1.113 O=C1CCC[C@@H](C1)C(=O)O MCULE-5396925186 [0,1,0,1,0,0|2,0,0]=4 2619 B10R1.113 O=C1CCC[C@H](C1)C(=O)O MCULE-8936667281 [0,1,0,1,0,0|2,0,0]=4 2620 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-6916176336 [0,1,0,1,0,0|1,0,0]=3 2621 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-9262761817 [0,1,0,1,0,0|1,0,0]=3 2622 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-1115212106 [0,1,0,1,0,0|1,0,0]=3 2623 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5896394571 [0,1,0,1,0,0|1,0,0]=3 2624 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5937606037 [0,1,0,1,0,0|1,0,0]=3 2625 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-7073629862 [0,1,0,1,0,0|1,0,0]=3 2626 B10R1.113 O=C1CNCC(N1)C(=O)O MCULE-4117148380 [0,1,0,1,0,0|2,0,0]=4 2627 B10R1.113 O=C1CNC[C@@H](N1)C(=O)O MCULE-3006600193 [0,1,0,1,0,0|2,0,0]=4 2628 B10R1.113 O=C1CNC[C@H](N1)C(=O)O MCULE-4345470043 [0,1,0,1,0,0|2,0,0]=4 2629 B10R1.113 O=C1C[C@@H](CCN1)C(=O)O MCULE-5205458306 [0,1,0,1,0,0|2,0,0]=4 2630 B10R1.113 O=C1C[C@H](CCN1)C(=O)O MCULE-6254957663 [0,1,0,1,0,0|2,0,0]=4 2631 B10R1.113 O=C1C[C@H](CCN1)C(=O)O MCULE-9670666580 [0,1,0,1,0,0|2,0,0]=4 2632 B10R1.113 O=C1NC(CCO1)C(=O)O MCULE-4281750243 [0,1,0,1,0,0|2,0,0]=4 2633 B10R1.113 O=C1N[C@@H](CCO1)C(=O)O MCULE-7121690603 [0,1,0,1,0,0|2,0,0]=4 2634 B10R1.234 N#CC1(CC(=O)C1)C(=O)O MCULE-7934005669 [0,1,0,1,0,0|1,0,1]=4 2635 B10R1.361 NC(=O)C1CCC1C(=O)O MCULE-3903818494 [0,1,0,1,0,0|2,0,0]=4 2636 B10R1.361 O=C(O)C1CCC1C(=O)O MCULE-6136792366 [0,1,0,1,0,0|1,0,0]=3 2637 B10R1.361 O=C(O)[C@@H]1CC[C@H]1C(=O)O MCULE-2743190923 [0,1,0,1,0,0|1,0,0]=3 2638 B10R1.361 O=C(O)[C@@H]1CC[C@H]1C(=O)O MCULE-6841335407 [0,1,0,1,0,0|1,0,0]=3 2639 B10R1.361 O=C(O)[C@H]1CC[C@@H]1C(=O)O MCULE-3432000151 [0,1,0,1,0,0|1,0,0]=3 2640 B10R1.361 O=C(O)[C@H]1CC[C@@H]1C(=O)O MCULE-6937334278 [0,1,0,1,0,0|1,0,0]=3 2641 B10R1.361 O=C(O)[C@H]1CC[C@H]1C(=O)O MCULE-8609403409 [0,1,0,1,0,0|1,0,0]=3 2642 B10R1.361 [C@@H]1(CC[C@@H]1C(=O)O)C(=O)O MCULE-4637916300 [0,1,0,1,0,0|1,0,0]=3 2643 B10R1.31 CO[C@@H]1CN[C@@H](C1)C(=O)O MCULE-2339543928 [0,1,0,1,0,0|1,0,1]=4 2644 B10R1.31 CO[C@H]1CN[C@@H](C1)C(=O)O MCULE-2951589630 [0,1,0,1,0,0|1,0,1]=4 2645 B10R1.31 O=C(O)C1CCC(=NO)C1 MCULE-1447348290 [0,1,0,1,0,0|2,0,0]=4 2646 B10R1.490 CO[C@H]1C[C@](C1)(N)C(=O)O MCULE-7267565968 [0,1,0,1,0,0|1,0,1]=4 2647 B10R1.490 NC1(CC(C1)CO)C(=O)O MCULE-1855927879 [0,1,0,1,0,0|1,0,1]=4 2648 B10R1.490 N[C@@]1(C[C@H](C1)CO)C(=O)O MCULE-2462435991 [0,1,0,1,0,0|1,0,1]=4 2649 B8R0.28 C=C(Br)CCCC(=O)O MCULE-5394609034 [1,0,0,0,0,1|2,0,0]=4 2650 B8R0.28 C=C(C)CCCC(=O)O MCULE-1282031449 [1,0,0,0,0,1|2,0,0]=4 2651 B8R0.28 C=C(Cl)CCCC(=O)O MCULE-9525654231 [1,0,0,0,0,1|2,0,0]=4 2652 B8R0.28 CC(=CCCC(=O)O)C MCULE-5848388333 [1,0,0,0,0,1|2,0,0]=4 2653 B8R0.28 CC(=O)CC=CC(=O)O MCULE-9526483708 [1,0,0,0,0,1|1,0,1]=4 2654 B8R0.28 CC(=O)CCCC(=O)C MCULE-9250637004 [1,0,0,0,0,1|2,0,0]=4 2655 B8R0.28 CC(=O)CCCC(=O)N MCULE-8753142022 [1,0,0,0,0,1|2,0,0]=4 2656 B8R0.28 CC(=O)CCCC(=O)O MCULE-2498129200 [1,0,0,0,0,1|1,0,0]=3 2657 B8R0.28 CC(=O)CCOC(=O)C MCULE-5123903575 [1,0,0,0,0,1|2,0,0]=4 2658 B8R0.28 CC(=O)COCC(=O)C MCULE-1945925794 [1,0,0,0,0,1|2,0,0]=4 2659 B8R0.28 CC(=O)NCCC(=O)N MCULE-6090839432 [1,0,0,0,0,1|2,0,0]=4 2660 B8R0.28 CC(=O)NCCC(=O)O MCULE-8867286578 [1,0,0,0,0,1|1,0,0]=3 2661 B8R0.28 CC(=O)OCCC(=O)O MCULE-6617841906 [1,0,0,0,0,1|1,0,0]=3 2662 B8R0.28 CC(=O)SCCC(=O)Cl MCULE-7772328654 [1,0,0,0,0,1|2,0,0]=4 2663 B8R0.28 CC(=O)SCCC(=O)O MCULE-2263963171 [1,0,0,0,0,1|1,0,0]=3 2664 B8R0.28 CC(O)CCCC(=O)O MCULE-6696855762 [1,0,0,0,0,1|1,0,1]=4 2665 B8R0.28 N=C(N)NCCC(=O)O MCULE-6783592689 [1,0,0,0,0,1|2,0,0]=4 2666 B8R0.28 N=C(N)SCCC(=O)O MCULE-6820090813 [1,0,0,0,0,1|2,0,0]=4 2667 B8R0.28 N=C(N)SCCC(=O)O MCULE-9820250060 [1,0,0,0,0,1|2,0,0]=4 2668 B8R0.28 N=C(S)NCCC(=O)O MCULE-7149670288 [1,0,0,0,0,1|1,1,0]=4 2669 B8R0.28 NC(=O)CCCC(=O)N MCULE-8380308624 [1,0,0,0,0,1|2,0,0]=4 2670 B8R0.28 NC(=O)CCCC(=O)O MCULE-9714346244 [1,0,0,0,0,1|1,0,0]=3 2671 B8R0.28 NC(=O)CNCC(=O)N MCULE-7451569201 [1,0,0,0,0,1|2,0,0]=4 2672 B8R0.28 NC(=O)CNCC(=O)O MCULE-2816922286 [1,0,0,0,0,1|1,0,0]=3 2673 B8R0.28 NC(=O)COCC(=O)O MCULE-3868584388 [1,0,0,0,0,1|1,0,0]=3 2674 B8R0.28 NC(=O)CSCC(=O)N MCULE-1673116541 [1,0,0,0,0,1|2,0,0]=4 2675 B8R0.28 NC(=O)CSCC(=O)O MCULE-1419621262 [1,0,0,0,0,1|1,0,0]=3 2676 B8R0.28 NC(=O)NCCC(=O)O MCULE-3799706782 [1,0,0,0,0,1|1,0,0]=3 2677 B8R0.28 NC(=S)SCCC(=O)O MCULE-1371836153 [1,0,0,0,0,1|1,1,0]=4 2678 B8R0.28 O=C(Cl)CCCC(=O)Cl MCULE-6157663188 [1,0,0,0,0,1|2,0,0]=4 2679 B8R0.28 O=C(Cl)COCC(=O)Cl MCULE-4828514058 [1,0,0,0,0,1|2,0,0]=4 2680 B8R0.28 O=C(O)/C=C/CC(=O)O MCULE-3754065542 [1,0,0,0,0,1|0,0,1]=3 2681 B8R0.28 O=C(O)C=CCC(=O)O MCULE-2034660220 [1,0,0,0,0,1|0,0,1]=3 2682 B8R0.28 O=C(O)CCCC(=O)O MCULE-4286022994 [1,0,0,0,0,1|0,0,0]=2 2683 B8R0.28 O=C(O)CCCN(=O)=O MCULE-2601801792 [1,0,0,0,0,1|1,0,1]=4 2684 B8R0.28 O=C(O)CNCC(=O)O MCULE-4131542591 [1,0,0,0,0,1|0,0,0]=2 2685 B8R0.28 O=C(O)COCC(=O)O MCULE-5687758679 [1,0,0,0,0,1|0,0,0]=2 2686 B8R0.28 O=C(O)CSCC(=O)O MCULE-8112166808 [1,0,0,0,0,1|0,0,0]=2 2687 B8R0.28 O=C([O-])CCCC(=O)[O-] MCULE-3809476672 [1,0,0,0,0,1|0,0,2]=4 2688 B8R0.28 O=C([O-])CNCC(=O)[O-] MCULE-1067264838 [1,0,0,0,0,1|0,0,2]=4 2689 B8R0.28 O=C([O-])COCC(=O)O MCULE-3773620396 [1,0,0,0,0,1|0,0,1]=3 2690 B8R0.28 O=C([O-])COCC(=O)O MCULE-5768077440 [1,0,0,0,0,1|0,0,1]=3 2691 B8R0.28 OC(=S)COCC(=S)O MCULE-1054878793 [1,0,0,0,0,1|0,2,0]=4 2692 B8R0.28 [NH2+](CC(=O)N)CC(=O)N MCULE-7548046822 [1,0,0,0,0,1|2,0,0]=4 2693 B10R0.96 CC(CCC(=O)O)CC(=O)O MCULE-7386549049 [0,0,0,0,0,2|1,0,0]=3 2694 B10R0.96 C[C@H](CCC(=O)O)CC(=O)O MCULE-1721699813 [0,0,0,0,0,2|1,0,0]=3 2695 B10R0.96 C[C@H](CCC(=O)O)CC(=O)O MCULE-7525360323 [0,0,0,0,0,2|1,0,0]=3 2696 B10R0.96 NC(=O)CCC(N)CC(=O)O MCULE-3003314518 [0,0,0,0,0,2|1,0,0]=3 2697 B10R0.96 NC(=O)CCC(N)CC(=O)O MCULE-7683510788 [0,0,0,0,0,2|1,0,0]=3 2698 B10R0.96 NC(=O)CC[C@@H](N)CC(=O)O MCULE-8316748928 [0,0,0,0,0,2|1,0,0]=3 2699 B10R0.96 NC(=O)CC[C@@H](N)CC(=O)O MCULE-8667775229 [0,0,0,0,0,2|1,0,0]=3 2700 B10R0.96 NC(=O)CC[C@H](N)CC(=O)O MCULE-2836546299 [0,0,0,0,0,2|1,0,0]=3 2701 B10R0.96 NC(=O)CC[C@H](N)CC(=O)O MCULE-4298371176 [0,0,0,0,0,2|1,0,0]=3 2702 B10R0.96 NC(=O)CC[C@H](N)CC(=O)O MCULE-4441176096 [0,0,0,0,0,2|1,0,0]=3 2703 B10R0.96 NC(=O)CC[C@H](N)CC(=O)O MCULE-5599562900 [0,0,0,0,0,2|1,0,0]=3 2704 B10R0.96 NC(CCC(=O)O)CC(=O)O MCULE-8155260586 [0,0,0,0,0,2|0,0,0]=2 2705 B10R0.96 NC(CCC(=O)O)CC(=O)O MCULE-8574900055 [0,0,0,0,0,2|0,0,0]=2 2706 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-5068946859 [0,0,0,0,0,2|0,0,0]=2 2707 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-8151605170 [0,0,0,0,0,2|0,0,0]=2 2708 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-8505675120 [0,0,0,0,0,2|0,0,0]=2 2709 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-9871725008 [0,0,0,0,0,2|0,0,0]=2 2710 B10R0.96 N[C@H](CCC(=O)O)CC(=O)O MCULE-3923729315 [0,0,0,0,0,2|0,0,0]=2 2711 B10R0.96 N[C@H](CCC(=O)O)CC(=O)O MCULE-6851763365 [0,0,0,0,0,2|0,0,0]=2 2712 B10R0.98 CC(=O)CCCC(C)C(=O)O MCULE-5760169093 [0,0,0,0,0,2|2,0,0]=4 2713 B10R0.98 CC(=O)NCC[C@H](N)C(=O)O MCULE-5384056558 [0,0,0,0,0,2|1,0,0]=3 2714 B10R0.98 CC(=O)NCC[C@H](N)C(=O)O MCULE-9151560319 [0,0,0,0,0,2|1,0,0]=3 2715 B10R0.98 CC(=O)OCCC(N)C(=O)O MCULE-7691334763 [0,0,0,0,0,2|1,0,0]=3 2716 B10R0.98 CC(=O)OCCC(N)C(=O)O MCULE-9993433450 [0,0,0,0,0,2|1,0,0]=3 2717 B10R0.98 CC(=O)OCC[C@H](N)C(=O)O MCULE-5425852779 [0,0,0,0,0,2|1,0,0]=3 2718 B10R0.98 CC(=O)OCC[C@H](N)C(=O)O MCULE-6909234177 [0,0,0,0,0,2|1,0,0]=3 2719 B10R0.98 N=C(N)NCCC(N)C(=O)O MCULE-2234773343 [0,0,0,0,0,2|2,0,0]=4 2720 B10R0.98 N=C(N)NCCC(N)C(=O)O MCULE-9635728361 [0,0,0,0,0,2|2,0,0]=4 2721 B10R0.98 N=C(N)NCC[C@H](N)C(=O)O MCULE-5360635274 [0,0,0,0,0,2|2,0,0]=4 2722 B10R0.98 N=C(N)NCC[C@H](N)C(=O)O MCULE-7633853490 [0,0,0,0,0,2|2,0,0]=4 2723 B10R0.98 NC(CCCC(=O)O)C(=O)O MCULE-3021567253 [0,0,0,0,0,2|0,0,0]=2 2724 B10R0.98 NC(CCCC(=O)O)C(=O)O MCULE-7434229402 [0,0,0,0,0,2|0,0,0]=2 2725 B10R0.98 NC(CCCC(=O)O)C(=O)O MCULE-8474963048 [0,0,0,0,0,2|0,0,0]=2 2726 B10R0.98 NC(CSCC(=O)O)C(=O)O MCULE-1997609241 [0,0,0,0,0,2|0,0,0]=2 2727 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O MCULE-1991686030 [0,0,0,0,0,2|0,0,0]=2 2728 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O MCULE-6053925503 [0,0,0,0,0,2|0,0,0]=2 2729 B10R0.98 N[C@@H](CSC=C(Cl)Cl)C(=O)O MCULE-5838139886 [0,0,0,0,0,2|2,0,0]=4 2730 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O MCULE-3291004829 [0,0,0,0,0,2|0,0,0]=2 2731 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O MCULE-3828091379 [0,0,0,0,0,2|0,0,0]=2 2732 B10R0.98 N[C@H](CCCC(=O)O)C(=O)O MCULE-3179500404 [0,0,0,0,0,2|0,0,0]=2 2733 B10R0.98 N[C@H](CCCC(=O)O)C(=O)O MCULE-9722366772 [0,0,0,0,0,2|0,0,0]=2 2734 B10R0.98 O=C(O)CCCC(=O)C(=O)O MCULE-5978557881 [0,0,0,0,0,2|1,0,1]=4 2735 B10R0.98 O=C(O)CCCC(O)C(=O)O MCULE-5970708862 [0,0,0,0,0,2|1,0,0]=3 2736 B10R0.98 O=C(O)CCC[C@H](O)C(=O)O MCULE-4157551693 [0,0,0,0,0,2|1,0,0]=3 2737 B10R0.98 O=C(O)CONC(=O)C(=O)O MCULE-7932028761 [0,0,0,0,0,2|1,0,1]=4