0 B8R0.23 C(=C(Br)C(=O)O)C(=O)O MCULE-1343964958 [0,0,0,0,0,0|2,0,2]=4 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|2,0,2]=4 4 B8R0.23 C/C(=C\C(=O)O)/C(=O)O MCULE-1060050416 [0,0,0,0,0,0|2,0,2]=4 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|3,0,0]=3 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|4,0,0]=4 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|2,0,1]=3 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|2,0,2]=4 24 B8R0.23 CC(=NC(=O)N)C(=O)O MCULE-5921330982 [0,0,0,0,0,0|2,0,1]=3 25 B8R0.23 CC(=O)C(C)CC(=O)O MCULE-9095166615 [0,0,0,0,0,0|3,0,0]=3 26 B8R0.23 CC(=O)C(N)CC(=O)O MCULE-7043175556 [0,0,0,0,0,0|2,0,0]=2 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|4,0,0]=4 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(N)CC(=O)O MCULE-1591106639 [0,0,0,0,0,0|3,0,1]=4 58 B8R0.23 CC(C)C(N)CC(=O)O MCULE-2785677086 [0,0,0,0,0,0|3,0,1]=4 59 B8R0.23 CC(C)C(N)CC(=O)O MCULE-7741390676 [0,0,0,0,0,0|3,0,1]=4 60 B8R0.23 CC(C)C(N)CC(=O)O MCULE-7820976140 [0,0,0,0,0,0|3,0,1]=4 61 B8R0.23 CC(C)CC(Br)C(=O)O MCULE-2778142655 [0,0,0,0,0,0|3,0,1]=4 62 B8R0.23 CC(C)CC(Br)C(=O)O MCULE-7689846956 [0,0,0,0,0,0|3,0,1]=4 63 B8R0.23 CC(C)CC(C)C(=O)O MCULE-7217536279 [0,0,0,0,0,0|3,0,1]=4 64 B8R0.23 CC(C)CC(Cl)C(=O)O MCULE-6347367806 [0,0,0,0,0,0|3,0,1]=4 65 B8R0.23 CC(C)CC(F)C(=O)O MCULE-6908911956 [0,0,0,0,0,0|3,0,1]=4 66 B8R0.23 CC(C)CC(N)C(=O)N MCULE-8974870406 [0,0,0,0,0,0|3,0,1]=4 67 B8R0.23 CC(C)CC(N)C(=O)N MCULE-9193295179 [0,0,0,0,0,0|3,0,1]=4 68 B8R0.23 CC(C)CC(N)C(=O)O MCULE-2550986320 [0,0,0,0,0,0|2,0,1]=3 69 B8R0.23 CC(C)CC(N)C(=O)O MCULE-7657212416 [0,0,0,0,0,0|2,0,1]=3 70 B8R0.23 CC(C)CC(O)C(=O)O MCULE-3638762911 [0,0,0,0,0,0|3,0,1]=4 71 B8R0.23 CC(C)CC(O)C(=O)O MCULE-4315013875 [0,0,0,0,0,0|3,0,1]=4 72 B8R0.23 CC(C)C[C@@H](Br)C(=O)O MCULE-2325122781 [0,0,0,0,0,0|3,0,1]=4 73 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O MCULE-6797937420 [0,0,0,0,0,0|3,0,1]=4 74 B8R0.23 CC(C)C[C@@H](N)C(=O)N MCULE-6195005494 [0,0,0,0,0,0|3,0,1]=4 75 B8R0.23 CC(C)C[C@@H](N)C(=O)O MCULE-3041792060 [0,0,0,0,0,0|2,0,1]=3 76 B8R0.23 CC(C)C[C@@H](N)C(=O)O MCULE-8280206722 [0,0,0,0,0,0|2,0,1]=3 77 B8R0.23 CC(C)C[C@@H](O)C(=O)O MCULE-4108530385 [0,0,0,0,0,0|3,0,1]=4 78 B8R0.23 CC(C)C[C@@H](O)C(=O)O MCULE-5253943571 [0,0,0,0,0,0|3,0,1]=4 79 B8R0.23 CC(C)C[C@H](Br)C(=O)O MCULE-4423121396 [0,0,0,0,0,0|3,0,1]=4 80 B8R0.23 CC(C)C[C@H](Br)C(=O)O MCULE-7601821889 [0,0,0,0,0,0|3,0,1]=4 81 B8R0.23 CC(C)C[C@H](Cl)C(=O)O MCULE-1038344796 [0,0,0,0,0,0|3,0,1]=4 82 B8R0.23 CC(C)C[C@H](Cl)C(=O)O MCULE-9007168250 [0,0,0,0,0,0|3,0,1]=4 83 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-3907393760 [0,0,0,0,0,0|3,0,1]=4 84 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-5393472198 [0,0,0,0,0,0|3,0,1]=4 85 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-7425207205 [0,0,0,0,0,0|3,0,1]=4 86 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-8093463847 [0,0,0,0,0,0|3,0,1]=4 87 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-4718215038 [0,0,0,0,0,0|2,0,1]=3 88 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-4930237913 [0,0,0,0,0,0|2,0,1]=3 89 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-8722899457 [0,0,0,0,0,0|2,0,1]=3 90 B8R0.23 CC(C)C[C@H](O)C(=O)O MCULE-1740362996 [0,0,0,0,0,0|3,0,1]=4 91 B8R0.23 CC(C)C[C@H](O)C(=O)O MCULE-4466965907 [0,0,0,0,0,0|3,0,1]=4 92 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-4128027229 [0,0,0,0,0,0|3,0,1]=4 93 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-5111030586 [0,0,0,0,0,0|3,0,1]=4 94 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-7447469347 [0,0,0,0,0,0|3,0,1]=4 95 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-8228659608 [0,0,0,0,0,0|3,0,1]=4 96 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-2362404476 [0,0,0,0,0,0|3,0,1]=4 97 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-4006103633 [0,0,0,0,0,0|3,0,1]=4 98 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-8085621397 [0,0,0,0,0,0|3,0,1]=4 99 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-8783742568 [0,0,0,0,0,0|3,0,1]=4 100 B8R0.23 CC(CC(=O)Cl)C(=O)Cl MCULE-1409735811 [0,0,0,0,0,0|3,0,0]=3 101 B8R0.23 CC(CC(=O)N)C(=O)O MCULE-8238400356 [0,0,0,0,0,0|1,0,0]=1 102 B8R0.23 CC(CC(=O)O)C(=O)O MCULE-4824634360 [0,0,0,0,0,0|2,0,0]=2 103 B8R0.23 CC(CC(=O)O)C(=O)O MCULE-8116748590 [0,0,0,0,0,0|2,0,0]=2 104 B8R0.23 CC(CC(F)F)C(=O)O MCULE-2211206695 [0,0,0,0,0,0|3,0,1]=4 105 B8R0.23 CC(CN(C)C)C(=O)O MCULE-7139783268 [0,0,0,0,0,0|4,0,0]=4 106 B8R0.23 CC(CN(C)C)C(=O)O MCULE-7716649676 [0,0,0,0,0,0|4,0,0]=4 107 B8R0.23 CC(CS(=O)C)C(=O)O MCULE-4855592077 [0,0,0,0,0,0|3,0,0]=3 108 B8R0.23 CC(NC(=N)N)C(=O)O MCULE-1509115617 [0,0,0,0,0,0|3,0,0]=3 109 B8R0.23 CC(NC(=O)N)C(=O)O MCULE-9370944250 [0,0,0,0,0,0|2,0,0]=2 110 B8R0.23 CC(O)C(N)CC(=O)O MCULE-5161755443 [0,0,0,0,0,0|2,0,1]=3 111 B8R0.23 CC(O)C(N)CC(=O)O MCULE-6370326858 [0,0,0,0,0,0|2,0,1]=3 112 B8R0.23 CN(C)CC(N)C(=O)O MCULE-4589211472 [0,0,0,0,0,0|3,0,0]=3 113 B8R0.23 CN(C)CC(N)C(=O)O MCULE-4873136690 [0,0,0,0,0,0|3,0,0]=3 114 B8R0.23 CN(C)CC(O)C(=O)O MCULE-2461037518 [0,0,0,0,0,0|4,0,0]=4 115 B8R0.23 CN(C)C[C@@H](N)C(=O)O MCULE-7056570231 [0,0,0,0,0,0|3,0,0]=3 116 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-1155351106 [0,0,0,0,0,0|3,0,0]=3 117 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-2217543416 [0,0,0,0,0,0|3,0,0]=3 118 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-6989814495 [0,0,0,0,0,0|3,0,0]=3 119 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-7529109312 [0,0,0,0,0,0|3,0,0]=3 120 B8R0.23 CN(C)C[C@H](O)C(=O)O MCULE-7629489364 [0,0,0,0,0,0|4,0,0]=4 121 B8R0.23 CN(CC(=O)O)C(=O)N MCULE-6739535875 [0,0,0,0,0,0|4,0,0]=4 122 B8R0.23 CS(=O)CC(N)C(=O)O MCULE-5699602621 [0,0,0,0,0,0|2,0,0]=2 123 B8R0.23 CS(=O)C[C@@H](N)C(=O)O MCULE-8253087333 [0,0,0,0,0,0|2,0,0]=2 124 B8R0.23 CS(=O)C[C@H](N)C(=O)O MCULE-5080098254 [0,0,0,0,0,0|2,0,0]=2 125 B8R0.23 C[C@@H](CC(=O)O)C(=O)O MCULE-1711994689 [0,0,0,0,0,0|2,0,0]=2 126 B8R0.23 C[C@@H](CC(=O)O)C(=O)O MCULE-6107805812 [0,0,0,0,0,0|2,0,0]=2 127 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-1416044737 [0,0,0,0,0,0|2,0,1]=3 128 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-2990511228 [0,0,0,0,0,0|2,0,1]=3 129 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-3178455647 [0,0,0,0,0,0|2,0,1]=3 130 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-4413833682 [0,0,0,0,0,0|2,0,1]=3 131 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-7332826518 [0,0,0,0,0,0|2,0,1]=3 132 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-7552978009 [0,0,0,0,0,0|2,0,1]=3 133 B8R0.23 C[C@H](CC(=O)O)C(=O)O MCULE-2738295504 [0,0,0,0,0,0|2,0,0]=2 134 B8R0.23 C[C@H](CC(=O)O)C(=O)O MCULE-4544789339 [0,0,0,0,0,0|2,0,0]=2 135 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O MCULE-5195061270 [0,0,0,0,0,0|2,0,1]=3 136 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O MCULE-5975065356 [0,0,0,0,0,0|2,0,1]=3 137 B8R0.23 C[C@H](NC(=O)N)C(=O)O MCULE-7947685696 [0,0,0,0,0,0|2,0,0]=2 138 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O MCULE-8673070329 [0,0,0,0,0,0|2,0,1]=3 139 B8R0.23 C[S@](=O)C[C@@H](N)C(=O)O MCULE-4004385080 [0,0,0,0,0,0|2,0,0]=2 140 B8R0.23 NC(=O)C(N)CC(=O)O MCULE-2277575843 [0,0,0,0,0,0|2,0,0]=2 141 B8R0.23 NC(=O)C=C(N)C(=O)N MCULE-1435081726 [0,0,0,0,0,0|1,0,2]=3 142 B8R0.23 NC(=O)CC(Br)C(=O)O MCULE-2823539046 [0,0,0,0,0,0|1,0,0]=1 143 B8R0.23 NC(=O)CC(N)C(=O)O MCULE-1395307434 [0,0,0,0,0,0|0,0,0]=0 144 B8R0.23 NC(=O)C[C@@H](N)C(=O)N MCULE-7126009795 [0,0,0,0,0,0|1,0,0]=1 145 B8R0.23 NC(=O)C[C@@H](N)C(=O)O MCULE-5685974579 [0,0,0,0,0,0|0,0,0]=0 146 B8R0.23 NC(=O)C[C@@H](N)C(=O)O MCULE-6923060287 [0,0,0,0,0,0|0,0,0]=0 147 B8R0.23 NC(=O)C[C@H](N)C(=O)N MCULE-3049784970 [0,0,0,0,0,0|1,0,0]=1 148 B8R0.23 NC(=O)C[C@H](N)C(=O)N MCULE-6209092318 [0,0,0,0,0,0|1,0,0]=1 149 B8R0.23 NC(=O)C[C@H](N)C(=O)N MCULE-7482170747 [0,0,0,0,0,0|1,0,0]=1 150 B8R0.23 NC(=O)C[C@H](N)C(=O)N MCULE-8939291995 [0,0,0,0,0,0|1,0,0]=1 151 B8R0.23 NC(=O)C[C@H](N)C(=O)O MCULE-1868046141 [0,0,0,0,0,0|0,0,0]=0 152 B8R0.23 NC(=O)C[C@H](N)C(=O)O MCULE-8248953574 [0,0,0,0,0,0|0,0,0]=0 153 B8R0.23 NC(=O)N(N)CC(=O)O MCULE-2553509411 [0,0,0,0,0,0|3,0,0]=3 154 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-1924512659 [0,0,0,0,0,0|2,0,0]=2 155 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-5836180326 [0,0,0,0,0,0|2,0,0]=2 156 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-8799617587 [0,0,0,0,0,0|2,0,0]=2 157 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-9477928215 [0,0,0,0,0,0|2,0,0]=2 158 B8R0.23 NC(=O)[C@H](N)CC(=O)O MCULE-5316198498 [0,0,0,0,0,0|2,0,0]=2 159 B8R0.23 NC(=O)[C@H](N)CC(=O)O MCULE-9833023193 [0,0,0,0,0,0|2,0,0]=2 160 B8R0.23 NC(CC(=O)O)C(=O)O MCULE-1247865301 [0,0,0,0,0,0|1,0,0]=1 161 B8R0.23 NC(CC(=O)O)C(=O)O MCULE-9328817309 [0,0,0,0,0,0|1,0,0]=1 162 B8R0.23 NC(CC(=O)O)C(=O)[O-] MCULE-5149469296 [0,0,0,0,0,0|1,0,1]=2 163 B8R0.23 NC(CC(=O)O)C(=O)[O-] MCULE-6655576025 [0,0,0,0,0,0|1,0,1]=2 164 B8R0.23 NC(CC(=O)[O-])C(=O)O MCULE-9221777365 [0,0,0,0,0,0|1,0,0]=1 165 B8R0.23 NC(CC(=O)[O-])C(=O)[O-] MCULE-5331717218 [0,0,0,0,0,0|1,0,1]=2 166 B8R0.23 NC(CC(=O)[O-])C(=O)[O-] MCULE-5921707862 [0,0,0,0,0,0|1,0,1]=2 167 B8R0.23 NC(CC(F)F)C(=O)O MCULE-1880803967 [0,0,0,0,0,0|2,0,1]=3 168 B8R0.23 NC(CC(F)F)C(=O)O MCULE-7276277891 [0,0,0,0,0,0|2,0,1]=3 169 B8R0.23 N[C@@H](CC(=O)O)C(=O)O MCULE-3710241722 [0,0,0,0,0,0|1,0,0]=1 170 B8R0.23 N[C@@H](CC(=O)O)C(=O)O MCULE-6700641640 [0,0,0,0,0,0|1,0,0]=1 171 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] MCULE-6196524297 [0,0,0,0,0,0|1,0,1]=2 172 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O MCULE-5793000569 [0,0,0,0,0,0|1,0,0]=1 173 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] MCULE-4019077430 [0,0,0,0,0,0|1,0,1]=2 174 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] MCULE-5586538224 [0,0,0,0,0,0|1,0,1]=2 175 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] MCULE-7845714288 [0,0,0,0,0,0|1,0,1]=2 176 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] MCULE-8320700728 [0,0,0,0,0,0|1,0,1]=2 177 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] MCULE-8905060145 [0,0,0,0,0,0|1,0,1]=2 178 B8R0.23 N[C@@H](CC(Cl)Cl)C(=O)O MCULE-9426370618 [0,0,0,0,0,0|2,0,1]=3 179 B8R0.23 N[C@@H](CC(F)F)C(=O)O MCULE-3232895455 [0,0,0,0,0,0|2,0,1]=3 180 B8R0.23 N[C@@H](CC(F)F)C(=O)O MCULE-3771092799 [0,0,0,0,0,0|2,0,1]=3 181 B8R0.23 N[C@@H](CC(F)F)C(=O)O MCULE-5990452255 [0,0,0,0,0,0|2,0,1]=3 182 B8R0.23 N[C@@H](CS(=O)O)C(=O)O MCULE-6647925908 [0,0,0,0,0,0|2,0,0]=2 183 B8R0.23 N[C@@H](CS(=O)O)C(=O)O MCULE-7596867929 [0,0,0,0,0,0|2,0,0]=2 184 B8R0.23 N[C@H](CC(=O)O)C(=O)O MCULE-8102700760 [0,0,0,0,0,0|1,0,0]=1 185 B8R0.23 N[C@H](CC(F)F)C(=O)O MCULE-2615133633 [0,0,0,0,0,0|2,0,1]=3 186 B8R0.23 N[C@H](CC(F)F)C(=O)O MCULE-4923641891 [0,0,0,0,0,0|2,0,1]=3 187 B8R0.23 O=C(O)/C=C(\F)/C(=O)O MCULE-5646698704 [0,0,0,0,0,0|2,0,2]=4 188 B8R0.23 O=C(O)C=C(F)C(=O)O MCULE-9862154394 [0,0,0,0,0,0|2,0,2]=4 189 B8R0.23 O=C(O)C=C(I)C(=O)O MCULE-3104454041 [0,0,0,0,0,0|2,0,2]=4 190 B8R0.23 O=C(O)CC(=O)C(=O)O MCULE-6059222019 [0,0,0,0,0,0|2,0,1]=3 191 B8R0.23 O=C(O)CC(Br)C(=O)O MCULE-8178780603 [0,0,0,0,0,0|2,0,0]=2 192 B8R0.23 O=C(O)CC(Cl)C(=O)O MCULE-6357456691 [0,0,0,0,0,0|2,0,0]=2 193 B8R0.23 O=C(O)CC(F)C(=O)O MCULE-8433198001 [0,0,0,0,0,0|2,0,0]=2 194 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-5852208511 [0,0,0,0,0,0|2,0,0]=2 195 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-9713558868 [0,0,0,0,0,0|2,0,0]=2 196 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-9924961830 [0,0,0,0,0,0|2,0,0]=2 197 B8R0.23 O=C(O)CC(S)C(=O)O MCULE-7005300961 [0,0,0,0,0,0|2,0,0]=2 198 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O MCULE-4598056907 [0,0,0,0,0,0|2,0,0]=2 199 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O MCULE-7861798045 [0,0,0,0,0,0|2,0,0]=2 200 B8R0.23 O=C(O)C[C@@H](O)C(=O)O MCULE-2239273084 [0,0,0,0,0,0|2,0,0]=2 201 B8R0.23 O=C(O)C[C@@H](O)C(=O)O MCULE-4984266891 [0,0,0,0,0,0|2,0,0]=2 202 B8R0.23 O=C(O)C[C@H](Br)C(=O)O MCULE-6763472515 [0,0,0,0,0,0|2,0,0]=2 203 B8R0.23 O=C(O)C[C@H](Br)C(=O)O MCULE-7524683930 [0,0,0,0,0,0|2,0,0]=2 204 B8R0.23 O=C(O)C[C@H](F)C(=O)O MCULE-9607625100 [0,0,0,0,0,0|2,0,0]=2 205 B8R0.23 O=C(O)C[C@H](O)C(=O)O MCULE-8339271078 [0,0,0,0,0,0|2,0,0]=2 206 B8R0.23 O=C(O)C[C@H](O)C(=O)O MCULE-8865188741 [0,0,0,0,0,0|2,0,0]=2 207 B8R0.23 O=C(O)C[C@H](O)C(=O)[O-] MCULE-1033530810 [0,0,0,0,0,0|2,0,1]=3 208 B8R0.23 O=C(O)C[C@H](S)C(=O)O MCULE-6393371024 [0,0,0,0,0,0|2,0,0]=2 209 B8R0.23 OC(=O)CN(C(=O)N)N MCULE-5081763144 [0,0,0,0,0,0|3,0,0]=3 210 B8R0.23 [C@@H](N)(CC(=O)O)C(=O)O MCULE-7899824165 [0,0,0,0,0,0|1,0,0]=1 211 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-4796212792 [0,0,0,0,0,0|3,0,1]=4 212 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-7620299780 [0,0,0,0,0,0|3,0,1]=4 213 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-8990653324 [0,0,0,0,0,0|3,0,1]=4 214 B8R0.23 [C@H](N)(CS(=O)C)C(=O)O MCULE-5084638505 [0,0,0,0,0,0|2,0,0]=2 215 B8R0.23 [NH3+]C(CS(=O)[O-])C(=O)O MCULE-5293441756 [0,0,0,0,0,0|2,0,1]=3 216 B8R0.23 [NH3+][C@@H](CC(=O)[O-])C(=O)[O-] MCULE-1215535631 [0,0,0,0,0,0|1,0,2]=3 217 B7R0.2 C=C(C)CC(N)CO MCULE-9114906744 [1,0,0,0,0,0|2,0,1]=4 218 B7R0.2 C=CC(C)CC(=O)O MCULE-4817084034 [1,0,0,0,0,0|3,0,0]=4 219 B7R0.2 C=CC(N)CC(=O)O MCULE-1733618438 [1,0,0,0,0,0|2,0,0]=3 220 B7R0.2 C=CC(N)CC(=O)O MCULE-9636299966 [1,0,0,0,0,0|2,0,0]=3 221 B7R0.2 C=CC(O)CC(=O)O MCULE-2383393271 [1,0,0,0,0,0|3,0,0]=4 222 B7R0.2 CC(C)C[C@H](N)C=O MCULE-3713415627 [1,0,0,0,0,0|2,0,1]=4 223 B7R0.2 CCC(N)CC(=O)O MCULE-1744910444 [1,0,0,0,0,0|2,0,1]=4 224 B7R0.2 CCC(N)CC(=O)O MCULE-5610499925 [1,0,0,0,0,0|2,0,1]=4 225 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-1158271004 [1,0,0,0,0,0|2,0,1]=4 226 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-2354820947 [1,0,0,0,0,0|2,0,1]=4 227 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-4284161835 [1,0,0,0,0,0|2,0,1]=4 228 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-9523089766 [1,0,0,0,0,0|2,0,1]=4 229 B7R0.2 CC[C@H](N)CC(=O)O MCULE-1463536674 [1,0,0,0,0,0|2,0,1]=4 230 B7R0.2 CC[C@H](N)CC(=O)O MCULE-2865599647 [1,0,0,0,0,0|2,0,1]=4 231 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4506847599 [1,0,0,0,0,0|2,0,1]=4 232 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4819674539 [1,0,0,0,0,0|2,0,1]=4 233 B7R0.2 CN(C=O)CC(=O)O MCULE-2679649056 [1,0,0,0,0,0|3,0,0]=4 234 B7R0.2 CNC(C)CC(=O)N MCULE-1474658720 [1,0,0,0,0,0|3,0,0]=4 235 B7R0.2 CNC(C)CC(=O)N MCULE-4481385519 [1,0,0,0,0,0|3,0,0]=4 236 B7R0.2 N#CC(N)CC(=O)N MCULE-6918234601 [1,0,0,0,0,0|1,0,1]=3 237 B7R0.2 N/C(=N/O)/CC(=O)O MCULE-5236282846 [1,0,0,0,0,0|2,0,1]=4 238 B7R0.2 NC(=O)C/C(=N\O)/N MCULE-7090967368 [1,0,0,0,0,0|1,0,1]=3 239 B7R0.2 NC(CO)CC(=O)O MCULE-4749383822 [1,0,0,0,0,0|1,0,1]=3 240 B7R0.2 NC(CO)CC(=O)O MCULE-7973334774 [1,0,0,0,0,0|1,0,1]=3 241 B7R0.2 NC(CO)CC(=O)O MCULE-8406665261 [1,0,0,0,0,0|1,0,1]=3 242 B7R0.2 NCC(N)CC(=O)O MCULE-5523883615 [1,0,0,0,0,0|2,0,1]=4 243 B7R0.2 NCC(N)CC(=O)O MCULE-7594259237 [1,0,0,0,0,0|2,0,1]=4 244 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-6348974465 [1,0,0,0,0,0|2,0,1]=4 245 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-9397628218 [1,0,0,0,0,0|2,0,1]=4 246 B7R0.2 NC[C@H](N)CC(=O)O MCULE-6133569516 [1,0,0,0,0,0|2,0,1]=4 247 B7R0.2 NC[C@H](N)CC(=O)O MCULE-7098533469 [1,0,0,0,0,0|2,0,1]=4 248 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-1773927420 [1,0,0,0,0,0|1,0,1]=3 249 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-2797951743 [1,0,0,0,0,0|1,0,1]=3 250 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-3839766977 [1,0,0,0,0,0|1,0,1]=3 251 B7R0.2 N[C@H](CO)CC(=O)O MCULE-4130106630 [1,0,0,0,0,0|1,0,1]=3 252 B7R0.2 O=C(O)CC(O)CO MCULE-2851149196 [1,0,0,0,0,0|2,0,1]=4 253 B7R0.2 O=C(O)C[C@H](O)CO MCULE-5671818548 [1,0,0,0,0,0|2,0,1]=4 254 B7R0.2 O=C([O-])CC(O)CO MCULE-5202762172 [1,0,0,0,0,0|2,0,1]=4 255 B7R0.2 O=C([O-])CC(O)CO MCULE-6219855770 [1,0,0,0,0,0|2,0,1]=4 256 B7R0.2 O=CN(O)CC(=O)O MCULE-7408790227 [1,0,0,0,0,0|3,0,0]=4 257 B7R0.2 [NH3+][C@H](CO)CC(=O)[O-] MCULE-5131942851 [1,0,0,0,0,0|1,0,2]=4 258 B7R0.5 C#CCC(C)C(=O)O MCULE-4819055703 [1,0,0,0,0,0|2,0,1]=4 259 B7R0.5 C#CCC(F)C(=O)O MCULE-1070671235 [1,0,0,0,0,0|2,0,1]=4 260 B7R0.5 C#CCC(N)C(=O)O MCULE-2022398365 [1,0,0,0,0,0|1,0,1]=3 261 B7R0.5 C#CCC(N)C(=O)O MCULE-2451098139 [1,0,0,0,0,0|1,0,1]=3 262 B7R0.5 C#CCC(N)C(=O)O MCULE-4330300997 [1,0,0,0,0,0|1,0,1]=3 263 B7R0.5 C#CCC(N)C(=O)O MCULE-5100293043 [1,0,0,0,0,0|1,0,1]=3 264 B7R0.5 C#CCC(O)C(=O)O MCULE-4988425198 [1,0,0,0,0,0|2,0,1]=4 265 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-1266511504 [1,0,0,0,0,0|1,0,1]=3 266 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-2589808316 [1,0,0,0,0,0|1,0,1]=3 267 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-4703021434 [1,0,0,0,0,0|1,0,1]=3 268 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-5616417783 [1,0,0,0,0,0|1,0,1]=3 269 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-1593368546 [1,0,0,0,0,0|1,0,1]=3 270 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-5683421535 [1,0,0,0,0,0|1,0,1]=3 271 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-7302855511 [1,0,0,0,0,0|1,0,1]=3 272 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-9256626051 [1,0,0,0,0,0|1,0,1]=3 273 B7R0.5 C=CCC(C)C(=O)C MCULE-4395269639 [1,0,0,0,0,0|3,0,0]=4 274 B7R0.5 C=CCC(C)C(=O)O MCULE-2912410432 [1,0,0,0,0,0|2,0,0]=3 275 B7R0.5 C=CCC(N)C(=O)O MCULE-1550468430 [1,0,0,0,0,0|1,0,0]=2 276 B7R0.5 C=CCC(N)C(=O)O MCULE-1783682768 [1,0,0,0,0,0|1,0,0]=2 277 B7R0.5 C=CCC(N)C(=O)O MCULE-8721864064 [1,0,0,0,0,0|1,0,0]=2 278 B7R0.5 C=CCC(N)C(=O)O MCULE-9091562338 [1,0,0,0,0,0|1,0,0]=2 279 B7R0.5 C=CCC(O)C(=O)O MCULE-6418899544 [1,0,0,0,0,0|2,0,0]=3 280 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-3817126030 [1,0,0,0,0,0|1,0,0]=2 281 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-5479618260 [1,0,0,0,0,0|1,0,0]=2 282 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-6719393730 [1,0,0,0,0,0|1,0,0]=2 283 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-7577627870 [1,0,0,0,0,0|1,0,0]=2 284 B7R0.5 C=CC[C@@H](O)C(=O)O MCULE-4103471826 [1,0,0,0,0,0|2,0,0]=3 285 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-2073484196 [1,0,0,0,0,0|1,0,0]=2 286 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-3267648941 [1,0,0,0,0,0|1,0,0]=2 287 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-4183531139 [1,0,0,0,0,0|1,0,0]=2 288 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-8225762047 [1,0,0,0,0,0|1,0,0]=2 289 B7R0.5 C=CC[C@H](O)C(=O)O MCULE-8230827617 [1,0,0,0,0,0|2,0,0]=3 290 B7R0.5 CC(CCN)C(=O)O MCULE-8098419324 [1,0,0,0,0,0|1,0,1]=3 291 B7R0.5 CC(CCN)C(=O)O MCULE-8509861009 [1,0,0,0,0,0|1,0,1]=3 292 B7R0.5 CC(CCO)C(=O)O MCULE-9724304469 [1,0,0,0,0,0|1,0,2]=4 293 B7R0.5 CC(NC=O)C(=O)O MCULE-7277951464 [1,0,0,0,0,0|2,0,0]=3 294 B7R0.5 CC=CC(C)C(=O)O MCULE-5584906296 [1,0,0,0,0,0|2,0,1]=4 295 B7R0.5 CC=CC(O)C(=O)O MCULE-5249095255 [1,0,0,0,0,0|2,0,1]=4 296 B7R0.5 CCCC(Br)C(=O)O MCULE-4304229911 [1,0,0,0,0,0|2,0,1]=4 297 B7R0.5 CCCC(C)C(=O)O MCULE-7779384365 [1,0,0,0,0,0|2,0,1]=4 298 B7R0.5 CCCC(Cl)C(=O)O MCULE-1265367924 [1,0,0,0,0,0|2,0,1]=4 299 B7R0.5 CCCC(F)C(=O)O MCULE-5551678948 [1,0,0,0,0,0|2,0,1]=4 300 B7R0.5 CCCC(N)C(=O)N MCULE-5159221123 [1,0,0,0,0,0|2,0,1]=4 301 B7R0.5 CCCC(N)C(=O)N MCULE-5742773956 [1,0,0,0,0,0|2,0,1]=4 302 B7R0.5 CCCC(N)C(=O)O MCULE-1684743992 [1,0,0,0,0,0|1,0,1]=3 303 B7R0.5 CCCC(N)C(=O)O MCULE-5263067403 [1,0,0,0,0,0|1,0,1]=3 304 B7R0.5 CCCC(N)C(=O)O MCULE-7151907627 [1,0,0,0,0,0|1,0,1]=3 305 B7R0.5 CCCC(O)C(=O)O MCULE-8533446195 [1,0,0,0,0,0|2,0,1]=4 306 B7R0.5 CCCC(O)C(=O)O MCULE-9586449213 [1,0,0,0,0,0|2,0,1]=4 307 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-1302378905 [1,0,0,0,0,0|1,0,1]=3 308 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-5246507817 [1,0,0,0,0,0|1,0,1]=3 309 B7R0.5 CCC[C@@H](O)C(=O)O MCULE-2742119346 [1,0,0,0,0,0|2,0,1]=4 310 B7R0.5 CCC[C@H](Br)C(=O)O MCULE-3070253588 [1,0,0,0,0,0|2,0,1]=4 311 B7R0.5 CCC[C@H](N)C(=O)N MCULE-2163059771 [1,0,0,0,0,0|2,0,1]=4 312 B7R0.5 CCC[C@H](N)C(=O)N MCULE-4687172013 [1,0,0,0,0,0|2,0,1]=4 313 B7R0.5 CCC[C@H](N)C(=O)N MCULE-7482592029 [1,0,0,0,0,0|2,0,1]=4 314 B7R0.5 CCC[C@H](N)C(=O)N MCULE-9639796243 [1,0,0,0,0,0|2,0,1]=4 315 B7R0.5 CCC[C@H](N)C(=O)O MCULE-2890516597 [1,0,0,0,0,0|1,0,1]=3 316 B7R0.5 CCC[C@H](N)C(=O)O MCULE-4690406880 [1,0,0,0,0,0|1,0,1]=3 317 B7R0.5 CCC[C@H](N)C(=O)O MCULE-9323049450 [1,0,0,0,0,0|1,0,1]=3 318 B7R0.5 CCC[C@H](O)C(=O)O MCULE-6533548138 [1,0,0,0,0,0|2,0,1]=4 319 B7R0.5 CCC[C@H](O)C(=O)O MCULE-8321722254 [1,0,0,0,0,0|2,0,1]=4 320 B7R0.5 CNCC(C)C(=O)O MCULE-4255373615 [1,0,0,0,0,0|3,0,0]=4 321 B7R0.5 CNCC(C)C(=O)O MCULE-8076489545 [1,0,0,0,0,0|3,0,0]=4 322 B7R0.5 CNCC(N)C(=O)O MCULE-4360775406 [1,0,0,0,0,0|2,0,0]=3 323 B7R0.5 CNCC(N)C(=O)O MCULE-4913403405 [1,0,0,0,0,0|2,0,0]=3 324 B7R0.5 CNC[C@H](N)C(=O)O MCULE-3465445123 [1,0,0,0,0,0|2,0,0]=3 325 B7R0.5 CNC[C@H](N)C(=O)O MCULE-7309489523 [1,0,0,0,0,0|2,0,0]=3 326 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8418254346 [1,0,0,0,0,0|2,0,0]=3 327 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8752314299 [1,0,0,0,0,0|2,0,0]=3 328 B7R0.5 COCC(Br)C(=O)O MCULE-2977381282 [1,0,0,0,0,0|3,0,0]=4 329 B7R0.5 COCC(C)C(=O)O MCULE-9776415948 [1,0,0,0,0,0|3,0,0]=4 330 B7R0.5 COCC(Cl)C(=O)O MCULE-1439107016 [1,0,0,0,0,0|3,0,0]=4 331 B7R0.5 COCC(N)C(=O)N MCULE-2465830538 [1,0,0,0,0,0|3,0,0]=4 332 B7R0.5 COCC(N)C(=O)N MCULE-6194410780 [1,0,0,0,0,0|3,0,0]=4 333 B7R0.5 COCC(N)C(=O)O MCULE-4336440568 [1,0,0,0,0,0|2,0,0]=3 334 B7R0.5 COCC(N)C(=O)O MCULE-4899043582 [1,0,0,0,0,0|2,0,0]=3 335 B7R0.5 COCC(N)C(=O)O MCULE-6964823693 [1,0,0,0,0,0|2,0,0]=3 336 B7R0.5 COCC(N)C(=O)O MCULE-7037870255 [1,0,0,0,0,0|2,0,0]=3 337 B7R0.5 COCC(O)C(=O)O MCULE-3185498869 [1,0,0,0,0,0|3,0,0]=4 338 B7R0.5 COC[C@@H](N)C(=O)O MCULE-1827086666 [1,0,0,0,0,0|2,0,0]=3 339 B7R0.5 COC[C@@H](N)C(=O)O MCULE-4868456769 [1,0,0,0,0,0|2,0,0]=3 340 B7R0.5 COC[C@@H](N)C(=O)O MCULE-5275247485 [1,0,0,0,0,0|2,0,0]=3 341 B7R0.5 COC[C@@H](N)C(=O)O MCULE-7339751251 [1,0,0,0,0,0|2,0,0]=3 342 B7R0.5 COC[C@H](N)C(=O)O MCULE-3719679803 [1,0,0,0,0,0|2,0,0]=3 343 B7R0.5 COC[C@H](N)C(=O)O MCULE-4874807874 [1,0,0,0,0,0|2,0,0]=3 344 B7R0.5 COC[C@H](N)C(=O)O MCULE-5303156917 [1,0,0,0,0,0|2,0,0]=3 345 B7R0.5 COC[C@H](N)C(=O)O MCULE-8138564560 [1,0,0,0,0,0|2,0,0]=3 346 B7R0.5 CSCC(C)C(=O)O MCULE-7112130175 [1,0,0,0,0,0|3,0,0]=4 347 B7R0.5 CSCC(N)C(=O)O MCULE-7668628251 [1,0,0,0,0,0|2,0,0]=3 348 B7R0.5 CSC[C@H](N)C(=O)O MCULE-1178337776 [1,0,0,0,0,0|2,0,0]=3 349 B7R0.5 CSC[C@H](N)C(=O)O MCULE-2769761337 [1,0,0,0,0,0|2,0,0]=3 350 B7R0.5 C[C@@H](CCS)C(=O)O MCULE-2918304262 [1,0,0,0,0,0|1,1,1]=4 351 B7R0.5 C[C@H](NC=O)C(=O)O MCULE-3824082361 [1,0,0,0,0,0|2,0,0]=3 352 B7R0.5 C[C@H](NC=O)C(=O)O MCULE-5248110352 [1,0,0,0,0,0|2,0,0]=3 353 B7R0.5 C[Se]CC(N)C(=O)O MCULE-3357465269 [1,0,0,0,0,0|2,0,0]=3 354 B7R0.5 C[Se]CC(N)C(=O)O MCULE-7671606756 [1,0,0,0,0,0|2,0,0]=3 355 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-5208306365 [1,0,0,0,0,0|2,0,0]=3 356 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6734478742 [1,0,0,0,0,0|2,0,0]=3 357 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6760615750 [1,0,0,0,0,0|2,0,0]=3 358 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-7512025617 [1,0,0,0,0,0|2,0,0]=3 359 B7R0.5 N#CCC(N)C(=O)O MCULE-4929926467 [1,0,0,0,0,0|0,0,2]=3 360 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6294926701 [1,0,0,0,0,0|0,0,2]=3 361 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6432920316 [1,0,0,0,0,0|0,0,2]=3 362 B7R0.5 NC(CCBr)C(=O)O MCULE-1900559475 [1,0,0,0,0,0|1,0,1]=3 363 B7R0.5 NC(CCBr)C(=O)O MCULE-7293320576 [1,0,0,0,0,0|1,0,1]=3 364 B7R0.5 NC(CCF)C(=O)O MCULE-5519595590 [1,0,0,0,0,0|1,0,1]=3 365 B7R0.5 NC(CCF)C(=O)O MCULE-7293194855 [1,0,0,0,0,0|1,0,1]=3 366 B7R0.5 NC(CCO)C(=O)O MCULE-1744838687 [1,0,0,0,0,0|0,0,2]=3 367 B7R0.5 NC(CCO)C(=O)O MCULE-9642233758 [1,0,0,0,0,0|0,0,2]=3 368 B7R0.5 NC(CCS)C(=O)O MCULE-8057550187 [1,0,0,0,0,0|0,1,1]=3 369 B7R0.5 NC(CCS)C(=O)O MCULE-8117596001 [1,0,0,0,0,0|0,1,1]=3 370 B7R0.5 NC(CNO)C(=O)O MCULE-2332662988 [1,0,0,0,0,0|1,0,1]=3 371 B7R0.5 NCCC(F)C(=O)O MCULE-5068755002 [1,0,0,0,0,0|1,0,1]=3 372 B7R0.5 NCCC(F)C(=O)O MCULE-9196695600 [1,0,0,0,0,0|1,0,1]=3 373 B7R0.5 NCCC(N)C(=O)O MCULE-1239764966 [1,0,0,0,0,0|0,0,1]=2 374 B7R0.5 NCCC(N)C(=O)O MCULE-2441123923 [1,0,0,0,0,0|0,0,1]=2 375 B7R0.5 NCCC(N)C(=O)O MCULE-3966593369 [1,0,0,0,0,0|0,0,1]=2 376 B7R0.5 NCCC(N)C(=O)O MCULE-4212078130 [1,0,0,0,0,0|0,0,1]=2 377 B7R0.5 NCCC(N)C(=O)O MCULE-7713366571 [1,0,0,0,0,0|0,0,1]=2 378 B7R0.5 NCCC(N)C(=O)O MCULE-8402131049 [1,0,0,0,0,0|0,0,1]=2 379 B7R0.5 NCCC(N)C(=O)O MCULE-9198187552 [1,0,0,0,0,0|0,0,1]=2 380 B7R0.5 NCCC(O)C(=O)O MCULE-3670080484 [1,0,0,0,0,0|1,0,1]=3 381 B7R0.5 NCCC(O)C(=O)O MCULE-6540935279 [1,0,0,0,0,0|1,0,1]=3 382 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-4000770618 [1,0,0,0,0,0|0,0,1]=2 383 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-5775312784 [1,0,0,0,0,0|0,0,1]=2 384 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-6259961704 [1,0,0,0,0,0|0,0,1]=2 385 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-9871958374 [1,0,0,0,0,0|0,0,1]=2 386 B7R0.5 NCC[C@@H](O)C(=O)O MCULE-9726912888 [1,0,0,0,0,0|1,0,1]=3 387 B7R0.5 NCC[C@H](N)C(=O)O MCULE-1745978456 [1,0,0,0,0,0|0,0,1]=2 388 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3856066353 [1,0,0,0,0,0|0,0,1]=2 389 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3919721317 [1,0,0,0,0,0|0,0,1]=2 390 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5434373726 [1,0,0,0,0,0|0,0,1]=2 391 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5992578597 [1,0,0,0,0,0|0,0,1]=2 392 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6536533546 [1,0,0,0,0,0|0,0,1]=2 393 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6978035806 [1,0,0,0,0,0|0,0,1]=2 394 B7R0.5 NCC[C@H](N)C(=O)O MCULE-8762011291 [1,0,0,0,0,0|0,0,1]=2 395 B7R0.5 NCC[C@H](N)C(=O)O MCULE-9645608127 [1,0,0,0,0,0|0,0,1]=2 396 B7R0.5 NCC[C@H](O)C(=O)O MCULE-3296998083 [1,0,0,0,0,0|1,0,1]=3 397 B7R0.5 NCC[C@H](O)C(=O)O MCULE-7901866019 [1,0,0,0,0,0|1,0,1]=3 398 B7R0.5 NOC[C@H](N)C(=O)O MCULE-1050292176 [1,0,0,0,0,0|1,0,0]=2 399 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2388269464 [1,0,0,0,0,0|1,0,1]=3 400 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2456796412 [1,0,0,0,0,0|1,0,1]=3 401 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-6229782603 [1,0,0,0,0,0|1,0,1]=3 402 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-8123446168 [1,0,0,0,0,0|1,0,1]=3 403 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-2370353784 [1,0,0,0,0,0|0,0,2]=3 404 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-4861747928 [1,0,0,0,0,0|0,0,2]=3 405 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-4021115723 [1,0,0,0,0,0|0,1,1]=3 406 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-7661321953 [1,0,0,0,0,0|0,1,1]=3 407 B7R0.5 N[C@@H](CSS)C(=O)O MCULE-3029500977 [1,0,0,0,0,0|1,1,0]=3 408 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-1975650690 [1,0,0,0,0,0|1,0,1]=3 409 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-7245104465 [1,0,0,0,0,0|1,0,1]=3 410 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8005652100 [1,0,0,0,0,0|0,0,2]=3 411 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8613625039 [1,0,0,0,0,0|0,0,2]=3 412 B7R0.5 N[C@H](CCS)C(=O)O MCULE-1110046008 [1,0,0,0,0,0|0,1,1]=3 413 B7R0.5 N[C@H](CCS)C(=O)O MCULE-7556963357 [1,0,0,0,0,0|0,1,1]=3 414 B7R0.5 O=C(O)C(Br)CCBr MCULE-3091819269 [1,0,0,0,0,0|2,0,1]=4 415 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [1,0,0,0,0,0|1,0,2]=4 416 B7R0.5 [C@H](N)(CC#C)C(=O)O MCULE-7308061694 [1,0,0,0,0,0|1,0,1]=3 417 B7R0.6 C=C(Br)CCC(=O)O MCULE-5257916083 [1,0,0,0,0,0|2,0,0]=3 418 B7R0.6 C=C(C)CCC(=O)C MCULE-4201277876 [1,0,0,0,0,0|3,0,0]=4 419 B7R0.6 C=C(C)CCC(=O)N MCULE-7602727888 [1,0,0,0,0,0|2,0,0]=3 420 B7R0.6 C=C(C)CCC(=O)O MCULE-8738532812 [1,0,0,0,0,0|2,0,0]=3 421 B7R0.6 C=C(C)NCC(=O)O MCULE-6347105994 [1,0,0,0,0,0|3,0,0]=4 422 B7R0.6 C=C(Cl)CCC(=O)O MCULE-8617886776 [1,0,0,0,0,0|2,0,0]=3 423 B7R0.6 CC(=CCC(=O)O)C MCULE-2552993418 [1,0,0,0,0,0|2,0,1]=4 424 B7R0.6 CC(=O)/C=C/C(=O)O MCULE-8768861026 [1,0,0,0,0,0|1,0,2]=4 425 B7R0.6 CC(=O)C=CC(=O)O MCULE-6867353277 [1,0,0,0,0,0|1,0,2]=4 426 B7R0.6 CC(=O)CCC(=O)C MCULE-3166810473 [1,0,0,0,0,0|2,0,0]=3 427 B7R0.6 CC(=O)CCC(=O)N MCULE-8943258659 [1,0,0,0,0,0|1,0,0]=2 428 B7R0.6 CC(=O)CCC(=O)O MCULE-1392778065 [1,0,0,0,0,0|1,0,0]=2 429 B7R0.6 CC(=O)CCC(=O)[O-] MCULE-4975344808 [1,0,0,0,0,0|1,0,1]=3 430 B7R0.6 CC(=O)CCN(=O)=O MCULE-4726243654 [1,0,0,0,0,0|2,0,1]=4 431 B7R0.6 CC(=O)CNC(=O)C MCULE-7941086302 [1,0,0,0,0,0|3,0,0]=4 432 B7R0.6 CC(=O)CNC(=O)Cl MCULE-2043888982 [1,0,0,0,0,0|3,0,0]=4 433 B7R0.6 CC(=O)COC(=O)C MCULE-2994552521 [1,0,0,0,0,0|3,0,0]=4 434 B7R0.6 CC(=O)NCC(=O)Cl MCULE-3900899057 [1,0,0,0,0,0|3,0,0]=4 435 B7R0.6 CC(=O)NCC(=O)N MCULE-7934502236 [1,0,0,0,0,0|2,0,0]=3 436 B7R0.6 CC(=O)NCC(=O)O MCULE-5811325186 [1,0,0,0,0,0|2,0,0]=3 437 B7R0.6 CC(=O)OCC(=O)Cl MCULE-3086938222 [1,0,0,0,0,0|3,0,0]=4 438 B7R0.6 CC(=O)OCC(=O)O MCULE-6837320824 [1,0,0,0,0,0|2,0,0]=3 439 B7R0.6 CC(=O)OCC(=S)N MCULE-7893306089 [1,0,0,0,0,0|2,1,0]=4 440 B7R0.6 CC(=O)SCC(=O)O MCULE-1974657694 [1,0,0,0,0,0|2,0,0]=3 441 B7R0.6 CC(=S)NCC(=O)O MCULE-9052571833 [1,0,0,0,0,0|2,1,0]=4 442 B7R0.6 CC(C)CCC(=O)N MCULE-3571818514 [1,0,0,0,0,0|2,0,1]=4 443 B7R0.6 CC(C)CCC(=O)O MCULE-7691755837 [1,0,0,0,0,0|2,0,1]=4 444 B7R0.6 CC(N)CCC(=O)O MCULE-3711689460 [1,0,0,0,0,0|1,0,1]=3 445 B7R0.6 CC(N)CCC(=O)O MCULE-5008572656 [1,0,0,0,0,0|1,0,1]=3 446 B7R0.6 CC(O)CCC(=O)O MCULE-6352217997 [1,0,0,0,0,0|1,0,2]=4 447 B7R0.6 CC(O)CCC(=O)[O-] MCULE-5872581098 [1,0,0,0,0,0|2,0,1]=4 448 B7R0.6 CC(S)CCC(=O)O MCULE-9612173883 [1,0,0,0,0,0|1,1,1]=4 449 B7R0.6 CN(C)CCC(=O)O MCULE-5553815845 [1,0,0,0,0,0|3,0,0]=4 450 B7R0.6 CN(C)CCC(=O)O MCULE-7454823322 [1,0,0,0,0,0|3,0,0]=4 451 B7R0.6 CS(=O)CCC(=O)O MCULE-8243349779 [1,0,0,0,0,0|2,0,0]=3 452 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-3295260637 [1,0,0,0,0,0|1,0,1]=3 453 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-5409083898 [1,0,0,0,0,0|1,0,1]=3 454 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-6530230723 [1,0,0,0,0,0|1,0,1]=3 455 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-7530095699 [1,0,0,0,0,0|1,0,1]=3 456 B7R0.6 C[C@H](N)CCC(=O)O MCULE-3621527632 [1,0,0,0,0,0|1,0,1]=3 457 B7R0.6 C[C@H](N)CCC(=O)O MCULE-7670557122 [1,0,0,0,0,0|1,0,1]=3 458 B7R0.6 C[S+](C)CCC(=O)O MCULE-8115187503 [1,0,0,0,0,0|3,0,0]=4 459 B7R0.6 C[S+](C)CCC(=O)O MCULE-9668037011 [1,0,0,0,0,0|3,0,0]=4 460 B7R0.6 N=C(N)NCC(=O)O MCULE-8180759180 [1,0,0,0,0,0|2,0,0]=3 461 B7R0.6 N=C(N)NCC(=O)O MCULE-8327589872 [1,0,0,0,0,0|2,0,0]=3 462 B7R0.6 N=C(N)SCC(=O)N MCULE-5295318661 [1,0,0,0,0,0|3,0,0]=4 463 B7R0.6 N=C(N)SCC(=O)N MCULE-9179434239 [1,0,0,0,0,0|3,0,0]=4 464 B7R0.6 N=C(N)SCC(=O)O MCULE-2089510220 [1,0,0,0,0,0|2,0,0]=3 465 B7R0.6 N=C(N)SCC(=O)O MCULE-3427937751 [1,0,0,0,0,0|2,0,0]=3 466 B7R0.6 NC(=O)/C=C/C(=O)N MCULE-4395066945 [1,0,0,0,0,0|1,0,2]=4 467 B7R0.6 NC(=O)/C=C/C(=O)O MCULE-4042951919 [1,0,0,0,0,0|0,0,2]=3 468 B7R0.6 NC(=O)/C=C\C(=O)O MCULE-9066996879 [1,0,0,0,0,0|0,0,2]=3 469 B7R0.6 NC(=O)/N=N/C(=O)N MCULE-4339161906 [1,0,0,0,0,0|3,0,0]=4 470 B7R0.6 NC(=O)C#CC(=O)N MCULE-4585775503 [1,0,0,0,0,0|1,0,2]=4 471 B7R0.6 NC(=O)C=CC(=O)N MCULE-6392282813 [1,0,0,0,0,0|1,0,2]=4 472 B7R0.6 NC(=O)C=CC(=O)O MCULE-2401877342 [1,0,0,0,0,0|0,0,2]=3 473 B7R0.6 NC(=O)CCC(=O)N MCULE-2107382817 [1,0,0,0,0,0|1,0,0]=2 474 B7R0.6 NC(=O)CCC(=O)O MCULE-5813999826 [1,0,0,0,0,0|0,0,0]=1 475 B7R0.6 NC(=O)CNC(=S)N MCULE-6504333241 [1,0,0,0,0,0|2,1,0]=4 476 B7R0.6 NC(=O)N=NC(=O)N MCULE-2129487615 [1,0,0,0,0,0|3,0,0]=4 477 B7R0.6 NC(=O)NCC(=O)O MCULE-7640310218 [1,0,0,0,0,0|1,0,0]=2 478 B7R0.6 NC(=O)NNC(=O)N MCULE-1306740070 [1,0,0,0,0,0|3,0,0]=4 479 B7R0.6 NC(=O)SCC(=O)O MCULE-2409074226 [1,0,0,0,0,0|1,0,0]=2 480 B7R0.6 NC(=S)NCC(=O)O MCULE-7421473219 [1,0,0,0,0,0|1,1,0]=3 481 B7R0.6 O=C(Cl)CCC(=O)Cl MCULE-6220065982 [1,0,0,0,0,0|2,0,0]=3 482 B7R0.6 O=C(O)/C=C/C(=O)O MCULE-3549142744 [1,0,0,0,0,0|1,0,2]=4 483 B7R0.6 O=C(O)/C=C/C(=O)O MCULE-5263906793 [1,0,0,0,0,0|1,0,2]=4 484 B7R0.6 O=C(O)/C=C\C(=O)O MCULE-1113222985 [1,0,0,0,0,0|1,0,2]=4 485 B7R0.6 O=C(O)C#CC(=O)O MCULE-3952041688 [1,0,0,0,0,0|1,0,2]=4 486 B7R0.6 O=C(O)C=CC(=O)O MCULE-5329407890 [1,0,0,0,0,0|1,0,2]=4 487 B7R0.6 O=C(O)C=CC(=O)O MCULE-7492596773 [1,0,0,0,0,0|1,0,2]=4 488 B7R0.6 O=C(O)C=CC(=O)O MCULE-8076793268 [1,0,0,0,0,0|1,0,2]=4 489 B7R0.6 O=C(O)C=CC(=O)O MCULE-9488315563 [1,0,0,0,0,0|1,0,2]=4 490 B7R0.6 O=C(O)C=CC(=O)O MCULE-9920754312 [1,0,0,0,0,0|1,0,2]=4 491 B7R0.6 O=C(O)CCB(O)O MCULE-9351023222 [1,0,0,0,0,0|2,0,1]=4 492 B7R0.6 O=C(O)CCC(=O)O MCULE-1233211613 [1,0,0,0,0,0|1,0,0]=2 493 B7R0.6 O=C(O)CCC(=O)O MCULE-5889111640 [1,0,0,0,0,0|1,0,0]=2 494 B7R0.6 O=C(O)CCC(F)F MCULE-6002651269 [1,0,0,0,0,0|2,0,1]=4 495 B7R0.6 O=C(O)CCN(=O)=O MCULE-1879231817 [1,0,0,0,0,0|2,0,0]=3 496 B7R0.6 O=C(O)N=NC(=O)O MCULE-6858626658 [1,0,0,0,0,0|3,0,0]=4 497 B7R0.6 O=C([O-])C#CC(=O)O MCULE-8275918466 [1,0,0,0,0,0|1,0,2]=4 498 B7R0.6 O=C([O-])CCC(=O)O MCULE-9149947862 [1,0,0,0,0,0|1,0,0]=2 499 B7R0.6 O=C([O-])CCC(=O)[O-] MCULE-6304944077 [1,0,0,0,0,0|1,0,1]=3 500 B9R0.10 NC(=O)CC(N)C(F)(F)F MCULE-5427149055 [0,1,0,0,0,0|2,0,1]=4 501 B9R0.11 C=C(C)C(C)(N)CC(=O)O MCULE-2432744381 [0,1,0,0,0,0|3,0,0]=4 502 B9R0.11 C=C(C)C(C)(N)CC(=O)O MCULE-7800105371 [0,1,0,0,0,0|3,0,0]=4 503 B9R0.11 C=C(C)CC(C)(C)C(=O)O MCULE-2137357994 [0,1,0,0,0,0|3,0,0]=4 504 B9R0.11 CC(=O)C(C)(C)CC(=O)O MCULE-3797968347 [0,1,0,0,0,0|3,0,0]=4 505 B9R0.11 CC(=O)CC(C)(C)C(=O)O MCULE-3548808704 [0,1,0,0,0,0|2,0,0]=3 506 B9R0.11 CC(=O)NC(C)(C)C(=O)O MCULE-7910205661 [0,1,0,0,0,0|3,0,0]=4 507 B9R0.11 CC(=O)OC(C)(C)C(=O)O MCULE-7786541244 [0,1,0,0,0,0|3,0,0]=4 508 B9R0.11 CC(C)(CC(=O)O)C(=O)O MCULE-7005043054 [0,1,0,0,0,0|2,0,0]=3 509 B9R0.11 CC(C)(NC(=O)N)C(=O)O MCULE-3780805662 [0,1,0,0,0,0|2,0,0]=3 510 B9R0.11 CC(C)CC(C)(N)C(=O)O MCULE-4257632982 [0,1,0,0,0,0|2,0,1]=4 511 B9R0.11 CC(C)CC(C)(N)C(=O)O MCULE-6991659149 [0,1,0,0,0,0|2,0,1]=4 512 B9R0.11 CC(C)C[C@@](C)(N)C(=O)O MCULE-4712290479 [0,1,0,0,0,0|2,0,1]=4 513 B9R0.11 CC(C)C[C@@](C)(N)C(=O)O MCULE-9085844136 [0,1,0,0,0,0|2,0,1]=4 514 B9R0.11 CC(C)C[C@](C)(N)C(=O)O MCULE-6073129801 [0,1,0,0,0,0|2,0,1]=4 515 B9R0.11 CC(C)C[C@](C)(N)C(=O)O MCULE-7162987343 [0,1,0,0,0,0|2,0,1]=4 516 B9R0.11 CC(F)(NC(=O)N)C(=O)O MCULE-5893224532 [0,1,0,0,0,0|2,0,0]=3 517 B9R0.11 CC(N)(CC(=O)O)C(=O)O MCULE-3390093551 [0,1,0,0,0,0|1,0,0]=2 518 B9R0.11 CC(N)(CC(=O)O)C(=O)O MCULE-4137717341 [0,1,0,0,0,0|1,0,0]=2 519 B9R0.11 CC(O)(CC(=O)O)C(=O)O MCULE-8670926890 [0,1,0,0,0,0|2,0,0]=3 520 B9R0.11 CN(C)CC(C)(N)C(=O)O MCULE-4857565953 [0,1,0,0,0,0|3,0,0]=4 521 B9R0.11 C[C@@](N)(CC(=O)O)C(=O)O MCULE-5803003392 [0,1,0,0,0,0|1,0,0]=2 522 B9R0.11 C[C@@](N)(CC(=O)O)C(=O)O MCULE-7987571569 [0,1,0,0,0,0|1,0,0]=2 523 B9R0.11 C[C@](N)(CC(=O)N)C(=O)O MCULE-5803295303 [0,1,0,0,0,0|0,0,0]=1 524 B9R0.11 C[C@](N)(CC(=O)N)C(=O)O MCULE-9662132548 [0,1,0,0,0,0|0,0,0]=1 525 B9R0.11 C[C@](N)(CC(=O)O)C(=O)O MCULE-4314292616 [0,1,0,0,0,0|1,0,0]=2 526 B9R0.11 C[C@](O)(CC(=O)O)C(=O)O MCULE-1934088864 [0,1,0,0,0,0|2,0,0]=3 527 B9R0.11 O=C(O)CC(F)(F)C(=O)O MCULE-7706048377 [0,1,0,0,0,0|2,0,0]=3 528 B9R0.11 O=C(O)CC(S)(S)C(=O)O MCULE-7344489814 [0,1,0,0,0,0|2,0,0]=3 529 B9R0.23 C(N)(CC(=O)O)C(=O)OC MCULE-3786901582 [0,1,0,0,0,0|1,0,0]=2 530 B9R0.23 C=C(C)CC(N)C(=O)OC MCULE-2770411625 [0,1,0,0,0,0|2,0,0]=3 531 B9R0.23 C=C(CC(=O)O)C(=O)OC MCULE-6964816559 [0,1,0,0,0,0|2,0,1]=4 532 B9R0.23 COC(=O)C(=O)CC(=O)C MCULE-8074026108 [0,1,0,0,0,0|2,0,1]=4 533 B9R0.23 COC(=O)C(C)CC(=O)C MCULE-2131243248 [0,1,0,0,0,0|2,0,0]=3 534 B9R0.23 COC(=O)C(C)CC(=O)O MCULE-5268313344 [0,1,0,0,0,0|2,0,0]=3 535 B9R0.23 COC(=O)C(C)CS(=O)[O-] MCULE-6308173188 [0,1,0,0,0,0|3,0,0]=4 536 B9R0.23 COC(=O)C(C)CS(=O)[O-] MCULE-6522031658 [0,1,0,0,0,0|3,0,0]=4 537 B9R0.23 COC(=O)C(C)NC(=O)C MCULE-7499205437 [0,1,0,0,0,0|3,0,0]=4 538 B9R0.23 COC(=O)C(C)NC(=O)C MCULE-9931125485 [0,1,0,0,0,0|3,0,0]=4 539 B9R0.23 COC(=O)C(C)OC(=O)C MCULE-7908136641 [0,1,0,0,0,0|3,0,0]=4 540 B9R0.23 COC(=O)C(N)CC(=O)N MCULE-1752536252 [0,1,0,0,0,0|0,0,0]=1 541 B9R0.23 COC(=O)C(N)CC(=O)N MCULE-5054924778 [0,1,0,0,0,0|0,0,0]=1 542 B9R0.23 COC(=O)C(N)CC(=O)O MCULE-7519781259 [0,1,0,0,0,0|1,0,0]=2 543 B9R0.23 COC(=O)C(N)CC(C)C MCULE-1433046496 [0,1,0,0,0,0|2,0,1]=4 544 B9R0.23 COC(=O)C(N)CC(C)C MCULE-1553759943 [0,1,0,0,0,0|2,0,1]=4 545 B9R0.23 COC(=O)C(N)CC(C)C MCULE-4557025081 [0,1,0,0,0,0|2,0,1]=4 546 B9R0.23 COC(=O)C(N)CC(C)C MCULE-8510501543 [0,1,0,0,0,0|2,0,1]=4 547 B9R0.23 COC(=O)C(N)CC(F)F MCULE-3550560326 [0,1,0,0,0,0|2,0,1]=4 548 B9R0.23 COC(=O)C(N)CC(F)F MCULE-5671328379 [0,1,0,0,0,0|2,0,1]=4 549 B9R0.23 COC(=O)C(N)CN(C)C MCULE-3941198962 [0,1,0,0,0,0|3,0,0]=4 550 B9R0.23 COC(=O)C(N)CN(C)C MCULE-4688594748 [0,1,0,0,0,0|3,0,0]=4 551 B9R0.23 COC(=O)N(C)CC(=O)O MCULE-6066208018 [0,1,0,0,0,0|3,0,0]=4 552 B9R0.23 COC(=O)[C@@H](C)CC(=O)O MCULE-8145746541 [0,1,0,0,0,0|2,0,0]=3 553 B9R0.23 COC(=O)[C@@H](C)NC(=O)C MCULE-3683972950 [0,1,0,0,0,0|3,0,0]=4 554 B9R0.23 COC(=O)[C@@H](C)NC(=O)C MCULE-9078107491 [0,1,0,0,0,0|3,0,0]=4 555 B9R0.23 COC(=O)[C@@H](N)CC(=O)N MCULE-2903193624 [0,1,0,0,0,0|0,0,0]=1 556 B9R0.23 COC(=O)[C@@H](N)CC(=O)N MCULE-3686406545 [0,1,0,0,0,0|0,0,0]=1 557 B9R0.23 COC(=O)[C@@H](N)CC(=O)N MCULE-3726434187 [0,1,0,0,0,0|0,0,0]=1 558 B9R0.23 COC(=O)[C@@H](N)CC(=O)N MCULE-9719605200 [0,1,0,0,0,0|0,0,0]=1 559 B9R0.23 COC(=O)[C@@H](N)CC(=O)O MCULE-2094999701 [0,1,0,0,0,0|1,0,0]=2 560 B9R0.23 COC(=O)[C@@H](N)CC(=O)O MCULE-9407721038 [0,1,0,0,0,0|1,0,0]=2 561 B9R0.23 COC(=O)[C@@H](N)CC(C)C MCULE-1309132346 [0,1,0,0,0,0|2,0,1]=4 562 B9R0.23 COC(=O)[C@@H](N)CC(C)C MCULE-6938469474 [0,1,0,0,0,0|2,0,1]=4 563 B9R0.23 COC(=O)[C@@H](N)CC(C)C MCULE-7583568111 [0,1,0,0,0,0|2,0,1]=4 564 B9R0.23 COC(=O)[C@@H](N)CC(C)C MCULE-7793954010 [0,1,0,0,0,0|2,0,1]=4 565 B9R0.23 COC(=O)[C@@H](N)CC(F)F MCULE-3708128404 [0,1,0,0,0,0|2,0,1]=4 566 B9R0.23 COC(=O)[C@@H](O)CC(=O)O MCULE-4149383309 [0,1,0,0,0,0|2,0,0]=3 567 B9R0.23 COC(=O)[C@@H](O)CC(=O)O MCULE-4834047702 [0,1,0,0,0,0|2,0,0]=3 568 B9R0.23 COC(=O)[C@H](C)NC(=O)C MCULE-9272877417 [0,1,0,0,0,0|3,0,0]=4 569 B9R0.23 COC(=O)[C@H](C)NC(=O)C MCULE-9675191541 [0,1,0,0,0,0|3,0,0]=4 570 B9R0.23 COC(=O)[C@H](C)OC(=O)C MCULE-7231856462 [0,1,0,0,0,0|3,0,0]=4 571 B9R0.23 COC(=O)[C@H](C)OC(=O)C MCULE-9967813219 [0,1,0,0,0,0|3,0,0]=4 572 B9R0.23 COC(=O)[C@H](N)CC(=O)N MCULE-3007207072 [0,1,0,0,0,0|0,0,0]=1 573 B9R0.23 COC(=O)[C@H](N)CC(=O)N MCULE-3103219361 [0,1,0,0,0,0|0,0,0]=1 574 B9R0.23 COC(=O)[C@H](N)CC(=O)N MCULE-6097450650 [0,1,0,0,0,0|0,0,0]=1 575 B9R0.23 COC(=O)[C@H](N)CC(=O)N MCULE-7427879831 [0,1,0,0,0,0|0,0,0]=1 576 B9R0.23 COC(=O)[C@H](N)CC(=O)O MCULE-1453787543 [0,1,0,0,0,0|1,0,0]=2 577 B9R0.23 COC(=O)[C@H](N)CC(=O)O MCULE-8348108837 [0,1,0,0,0,0|1,0,0]=2 578 B9R0.23 COC(=O)[C@H](N)CC(=O)O MCULE-8725707708 [0,1,0,0,0,0|1,0,0]=2 579 B9R0.23 COC(=O)[C@H](N)CC(C)C MCULE-2152247835 [0,1,0,0,0,0|2,0,1]=4 580 B9R0.23 COC(=O)[C@H](N)CC(C)C MCULE-2779062182 [0,1,0,0,0,0|2,0,1]=4 581 B9R0.23 COC(=O)[C@H](N)CC(C)C MCULE-7100635788 [0,1,0,0,0,0|2,0,1]=4 582 B9R0.23 COC(=O)[C@H](N)CC(C)C MCULE-8729140960 [0,1,0,0,0,0|2,0,1]=4 583 B9R0.23 COC(=O)[C@H](N)CC(F)F MCULE-9898046452 [0,1,0,0,0,0|2,0,1]=4 584 B9R0.23 COC(=O)[C@H](O)CC(=O)O MCULE-2124989741 [0,1,0,0,0,0|2,0,0]=3 585 B9R0.23 COC(=O)[C@H](O)CC(=O)O MCULE-9803650256 [0,1,0,0,0,0|2,0,0]=3 586 B9R0.23 O=C(O)CC(Br)C(=O)CBr MCULE-5319460867 [0,1,0,0,0,0|3,0,0]=4 587 B9R0.23 [C@H](N)(CC(=O)O)C(=O)OC MCULE-3013306674 [0,1,0,0,0,0|1,0,0]=2 588 B9R0.39 CC(=O)NC(CO)C(=O)O MCULE-1309560741 [0,1,0,0,0,0|3,0,0]=4 589 B9R0.39 CC(=O)NC(CS)C(=O)O MCULE-6378320219 [0,1,0,0,0,0|3,0,0]=4 590 B9R0.39 CC(=O)NC(CS)C(=O)O MCULE-8740981134 [0,1,0,0,0,0|3,0,0]=4 591 B9R0.39 CC(=O)N[C@@H](CO)C(=O)O MCULE-1874809708 [0,1,0,0,0,0|3,0,0]=4 592 B9R0.39 CC(=O)N[C@@H](CO)C(=O)O MCULE-6388016375 [0,1,0,0,0,0|3,0,0]=4 593 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O MCULE-3293270590 [0,1,0,0,0,0|3,0,0]=4 594 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O MCULE-8632971295 [0,1,0,0,0,0|3,0,0]=4 595 B9R0.39 CC(=O)N[C@H](CO)C(=O)O MCULE-3723348697 [0,1,0,0,0,0|3,0,0]=4 596 B9R0.39 CC(=O)N[C@H](CS)C(=O)O MCULE-2338539483 [0,1,0,0,0,0|3,0,0]=4 597 B9R0.39 CC(=O)N[C@H](CS)C(=O)O MCULE-7287452762 [0,1,0,0,0,0|3,0,0]=4 598 B9R0.39 CC(C)CC(CN)C(=O)O MCULE-3679366313 [0,1,0,0,0,0|2,0,1]=4 599 B9R0.39 CC(C)CC(CN)C(=O)O MCULE-4357118038 [0,1,0,0,0,0|2,0,1]=4 600 B9R0.39 CC(C)CC(CN)C(=O)O MCULE-5464779902 [0,1,0,0,0,0|2,0,1]=4 601 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-1199418849 [0,1,0,0,0,0|2,0,1]=4 602 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-2007636867 [0,1,0,0,0,0|2,0,1]=4 603 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-3151357434 [0,1,0,0,0,0|2,0,1]=4 604 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-6826376648 [0,1,0,0,0,0|2,0,1]=4 605 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-1897946062 [0,1,0,0,0,0|2,0,1]=4 606 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-5204739284 [0,1,0,0,0,0|2,0,1]=4 607 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-5587093761 [0,1,0,0,0,0|2,0,1]=4 608 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-6247275234 [0,1,0,0,0,0|2,0,1]=4 609 B9R0.39 CC=C(CC(=O)O)C(=O)O MCULE-9255608800 [0,1,0,0,0,0|2,0,1]=4 610 B9R0.39 CCC(CC(=O)Cl)C(=O)Cl MCULE-4134104716 [0,1,0,0,0,0|3,0,0]=4 611 B9R0.39 CCC(CC(=O)O)C(=O)O MCULE-6275256194 [0,1,0,0,0,0|2,0,0]=3 612 B9R0.39 CCC(NC(=O)C)C(=O)O MCULE-1309294109 [0,1,0,0,0,0|3,0,0]=4 613 B9R0.39 CCC(NC(=O)C)C(=O)O MCULE-9698129539 [0,1,0,0,0,0|3,0,0]=4 614 B9R0.39 CCC(NC(=O)N)C(=O)O MCULE-1973871135 [0,1,0,0,0,0|2,0,0]=3 615 B9R0.39 CC[C@@H](NC(=O)C)C(=O)O MCULE-4606830483 [0,1,0,0,0,0|3,0,0]=4 616 B9R0.39 CC[C@@H](NC(=O)C)C(=O)O MCULE-7396715663 [0,1,0,0,0,0|3,0,0]=4 617 B9R0.39 CNC(CC(=O)O)C(=O)O MCULE-5049531079 [0,1,0,0,0,0|1,0,0]=2 618 B9R0.39 CNC(CC(C)C)C(=O)O MCULE-4940999271 [0,1,0,0,0,0|2,0,1]=4 619 B9R0.39 CNC(CC(C)C)C(=O)O MCULE-7266045564 [0,1,0,0,0,0|2,0,1]=4 620 B9R0.39 CN[C@@H](CC(=O)N)C(=O)O MCULE-2449462396 [0,1,0,0,0,0|0,0,0]=1 621 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-4725692041 [0,1,0,0,0,0|1,0,0]=2 622 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-6356483886 [0,1,0,0,0,0|1,0,0]=2 623 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-9428412153 [0,1,0,0,0,0|1,0,0]=2 624 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-2758691344 [0,1,0,0,0,0|2,0,1]=4 625 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-3349649810 [0,1,0,0,0,0|2,0,1]=4 626 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-4487326533 [0,1,0,0,0,0|2,0,1]=4 627 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-7740057854 [0,1,0,0,0,0|2,0,1]=4 628 B9R0.39 CN[C@H](CC(=O)N)C(=O)O MCULE-2092394249 [0,1,0,0,0,0|0,0,0]=1 629 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-1405442072 [0,1,0,0,0,0|1,0,0]=2 630 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-8611804669 [0,1,0,0,0,0|1,0,0]=2 631 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-9080466863 [0,1,0,0,0,0|1,0,0]=2 632 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2279011654 [0,1,0,0,0,0|2,0,1]=4 633 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2290136385 [0,1,0,0,0,0|2,0,1]=4 634 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2552934491 [0,1,0,0,0,0|2,0,1]=4 635 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-8319051174 [0,1,0,0,0,0|2,0,1]=4 636 B9R0.39 COC(CC(=O)O)C(=O)O MCULE-3778948045 [0,1,0,0,0,0|2,0,0]=3 637 B9R0.39 N=C(N)N[C@@H](CS)C(=O)O MCULE-8761842896 [0,1,0,0,0,0|3,0,0]=4 638 B9R0.39 NC(=O)NC(CO)C(=O)O MCULE-8322024012 [0,1,0,0,0,0|2,0,0]=3 639 B9R0.39 NC(=O)NC(CS)C(=O)O MCULE-3558033323 [0,1,0,0,0,0|2,0,0]=3 640 B9R0.39 NC(=O)N[C@@H](CS)C(=O)O MCULE-9735857877 [0,1,0,0,0,0|2,0,0]=3 641 B9R0.39 NCC(CC(=O)O)C(=O)O MCULE-1683659350 [0,1,0,0,0,0|1,0,0]=2 642 B9R0.39 NCC(CC(=O)O)C(=O)O MCULE-8428141166 [0,1,0,0,0,0|1,0,0]=2 643 B9R0.39 NCN(CC(=O)O)C(=O)O MCULE-9677383798 [0,1,0,0,0,0|2,0,0]=3 644 B9R0.39 O=C(O)CC(CS)C(=O)O MCULE-7352825049 [0,1,0,0,0,0|2,0,0]=3 645 B9R0.42 C(N)(CC(=O)OC)C(=O)O MCULE-8015036052 [0,1,0,0,0,0|1,0,0]=2 646 B9R0.42 C=C(CC(=O)NC)C(=O)O MCULE-5432016245 [0,1,0,0,0,0|1,0,1]=3 647 B9R0.42 C=C(CC(=O)OC)C(=O)O MCULE-1728748664 [0,1,0,0,0,0|2,0,1]=4 648 B9R0.42 C=C(NC(=O)CN)C(=O)O MCULE-8924892837 [0,1,0,0,0,0|2,0,1]=4 649 B9R0.42 C=CC(=O)NC(O)C(=O)O MCULE-6399920412 [0,1,0,0,0,0|3,0,0]=4 650 B9R0.42 CC(CO)CC(N)C(=O)O MCULE-1659842949 [0,1,0,0,0,0|1,0,2]=4 651 B9R0.42 CC(NC(=O)CCl)C(=O)O MCULE-6899086052 [0,1,0,0,0,0|3,0,0]=4 652 B9R0.42 CC(NC(=O)CN)C(=O)N MCULE-2418100977 [0,1,0,0,0,0|3,0,0]=4 653 B9R0.42 CC(NC(=O)CN)C(=O)N MCULE-5562877537 [0,1,0,0,0,0|3,0,0]=4 654 B9R0.42 CC(NC(=O)CN)C(=O)O MCULE-2027405418 [0,1,0,0,0,0|2,0,0]=3 655 B9R0.42 CCC(=O)CC(N)C(=O)O MCULE-7167843152 [0,1,0,0,0,0|1,0,0]=2 656 B9R0.42 CCC(=O)CC(N)C(=O)O MCULE-9225518491 [0,1,0,0,0,0|1,0,0]=2 657 B9R0.42 CCC(=O)NC(C)C(=O)O MCULE-5488194337 [0,1,0,0,0,0|3,0,0]=4 658 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O MCULE-5552061501 [0,1,0,0,0,0|3,0,0]=4 659 B9R0.42 CCC(C)CC(N)C(=O)O MCULE-1321158720 [0,1,0,0,0,0|2,0,1]=4 660 B9R0.42 CCC(C)CC(N)C(=O)O MCULE-9833457318 [0,1,0,0,0,0|2,0,1]=4 661 B9R0.42 CNC(=O)CC(N)C(=O)O MCULE-1910017583 [0,1,0,0,0,0|0,0,0]=1 662 B9R0.42 CNC(=O)CC(N)C(=O)O MCULE-2273353640 [0,1,0,0,0,0|0,0,0]=1 663 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O MCULE-6316771422 [0,1,0,0,0,0|0,0,0]=1 664 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O MCULE-8833942582 [0,1,0,0,0,0|0,0,0]=1 665 B9R0.42 CNC(=O)C[C@H](N)C(=O)O MCULE-7953918935 [0,1,0,0,0,0|0,0,0]=1 666 B9R0.42 CNC(=O)C[C@H](N)C(=O)O MCULE-9595811834 [0,1,0,0,0,0|0,0,0]=1 667 B9R0.42 COC(=O)CC(=O)C(=O)O MCULE-5008305161 [0,1,0,0,0,0|2,0,1]=4 668 B9R0.42 COC(=O)CC(Br)C(=O)C MCULE-7344095898 [0,1,0,0,0,0|3,0,0]=4 669 B9R0.42 COC(=O)CC(C)C(=O)O MCULE-5595331018 [0,1,0,0,0,0|2,0,0]=3 670 B9R0.42 COC(=O)CC(C)C(=O)O MCULE-9262719853 [0,1,0,0,0,0|2,0,0]=3 671 B9R0.42 COC(=O)CC(N)C(=O)O MCULE-1915038693 [0,1,0,0,0,0|1,0,0]=2 672 B9R0.42 COC(=O)CC(N)C(=O)O MCULE-4452484594 [0,1,0,0,0,0|1,0,0]=2 673 B9R0.42 COC(=O)CC(N)C(=O)O MCULE-8573910427 [0,1,0,0,0,0|1,0,0]=2 674 B9R0.42 COC(=O)CC(O)C(=O)O MCULE-7105554854 [0,1,0,0,0,0|2,0,0]=3 675 B9R0.42 COC(=O)C[C@@H](C)C(=O)Cl MCULE-7326666072 [0,1,0,0,0,0|3,0,0]=4 676 B9R0.42 COC(=O)C[C@@H](C)C(=O)O MCULE-4861767896 [0,1,0,0,0,0|2,0,0]=3 677 B9R0.42 COC(=O)C[C@@H](C)C(=O)O MCULE-6107558545 [0,1,0,0,0,0|2,0,0]=3 678 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-2364792775 [0,1,0,0,0,0|1,0,0]=2 679 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-3240459376 [0,1,0,0,0,0|1,0,0]=2 680 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-5997294610 [0,1,0,0,0,0|1,0,0]=2 681 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-6955235147 [0,1,0,0,0,0|1,0,0]=2 682 B9R0.42 COC(=O)C[C@@H](O)C(=O)O MCULE-8916007864 [0,1,0,0,0,0|2,0,0]=3 683 B9R0.42 COC(=O)C[C@H](C)C(=O)O MCULE-1205037322 [0,1,0,0,0,0|2,0,0]=3 684 B9R0.42 COC(=O)C[C@H](C)C(=O)O MCULE-7536209773 [0,1,0,0,0,0|2,0,0]=3 685 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-3838383924 [0,1,0,0,0,0|1,0,0]=2 686 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-4621655906 [0,1,0,0,0,0|1,0,0]=2 687 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-5113413935 [0,1,0,0,0,0|1,0,0]=2 688 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-9857677224 [0,1,0,0,0,0|1,0,0]=2 689 B9R0.42 COC(=O)C[C@H](O)C(=O)O MCULE-9897810817 [0,1,0,0,0,0|2,0,0]=3 690 B9R0.42 COC(=O)NC(C)C(=O)O MCULE-9255316794 [0,1,0,0,0,0|3,0,0]=4 691 B9R0.42 COC(=O)N[C@@H](C)C(=O)O MCULE-3970003504 [0,1,0,0,0,0|3,0,0]=4 692 B9R0.42 COC(=O)N[C@@H](C)C(=O)O MCULE-7941497211 [0,1,0,0,0,0|3,0,0]=4 693 B9R0.42 C[C@H](NC(=O)CBr)C(=O)O MCULE-2038149065 [0,1,0,0,0,0|3,0,0]=4 694 B9R0.42 C[C@H](NC(=O)CCl)C(=O)O MCULE-3478867157 [0,1,0,0,0,0|3,0,0]=4 695 B9R0.42 C[C@H](NC(=O)CCl)C(=O)O MCULE-8272505742 [0,1,0,0,0,0|3,0,0]=4 696 B9R0.42 C[C@H](NC(=O)CN)C(=O)N MCULE-1477107832 [0,1,0,0,0,0|3,0,0]=4 697 B9R0.42 C[C@H](NC(=O)CN)C(=O)N MCULE-7070402577 [0,1,0,0,0,0|3,0,0]=4 698 B9R0.42 C[C@H](NC(=O)CN)C(=O)O MCULE-2496637228 [0,1,0,0,0,0|2,0,0]=3 699 B9R0.42 NC(CN(O)N=O)C(=O)O MCULE-5880257959 [0,1,0,0,0,0|2,0,0]=3 700 B9R0.42 NCC(=O)CC(N)C(=O)O MCULE-5617919538 [0,1,0,0,0,0|0,0,0]=1 701 B9R0.42 NCC(=O)CC(N)C(=O)O MCULE-5853178152 [0,1,0,0,0,0|0,0,0]=1 702 B9R0.42 N[C@@H](CC(=O)NO)C(=O)O MCULE-2694436901 [0,1,0,0,0,0|0,0,0]=1 703 B9R0.42 N[C@@H](CN(O)N=O)C(=O)O MCULE-5513289219 [0,1,0,0,0,0|2,0,0]=3 704 B9R0.42 [C@@H](C)(NC(=O)CN)C(=O)O MCULE-7578084271 [0,1,0,0,0,0|2,0,0]=3 705 B9R0.42 [C@H](N)(CN(O)N=O)C(=O)O MCULE-4128156769 [0,1,0,0,0,0|2,0,0]=3 706 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-1846409149 [0,1,0,0,0,0|2,0,1]=4 707 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-6496394437 [0,1,0,0,0,0|2,0,1]=4 708 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-6507277407 [0,1,0,0,0,0|2,0,1]=4 709 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O MCULE-6215032420 [0,1,0,0,0,0|2,0,1]=4 710 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O MCULE-8005575699 [0,1,0,0,0,0|2,0,1]=4 711 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O MCULE-1515081556 [0,1,0,0,0,0|2,0,1]=4 712 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O MCULE-3358775275 [0,1,0,0,0,0|2,0,1]=4 713 B9R0.57 CC(C)(F)CC(N)C(=O)O MCULE-2499553394 [0,1,0,0,0,0|2,0,1]=4 714 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O MCULE-2670827731 [0,1,0,0,0,0|2,0,1]=4 715 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O MCULE-7946625431 [0,1,0,0,0,0|2,0,1]=4 716 B9R0.57 CC(CC(C)(C)N)C(=O)O MCULE-2497907613 [0,1,0,0,0,0|2,0,1]=4 717 B9R0.57 CC(CC(C)(C)N)C(=O)O MCULE-7900482158 [0,1,0,0,0,0|2,0,1]=4 718 B9R0.57 CC(CS(=O)(=O)C)C(=O)O MCULE-2992876868 [0,1,0,0,0,0|3,0,0]=4 719 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O MCULE-1117561111 [0,1,0,0,0,0|2,0,0]=3 720 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O MCULE-3044564695 [0,1,0,0,0,0|2,0,0]=3 721 B9R0.57 C[Si](C)(C)C[C@H](N)C(=O)O MCULE-5057039244 [0,1,0,0,0,0|2,1,0]=4 722 B9R0.57 NC(CC(F)(F)F)C(=O)O MCULE-4670432872 [0,1,0,0,0,0|2,0,1]=4 723 B9R0.57 NC(CC(F)(F)F)C(=O)O MCULE-7906484739 [0,1,0,0,0,0|2,0,1]=4 724 B9R0.57 NC(CP(=O)(O)O)C(=O)O MCULE-3742656954 [0,1,0,0,0,0|2,0,0]=3 725 B9R0.57 NC(CS(=O)(=O)O)C(=O)O MCULE-3360025136 [0,1,0,0,0,0|2,0,0]=3 726 B9R0.57 NC(CS(=O)(=O)O)C(=O)O MCULE-4680118250 [0,1,0,0,0,0|2,0,0]=3 727 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O MCULE-3474800558 [0,1,0,0,0,0|2,0,1]=4 728 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O MCULE-5230934404 [0,1,0,0,0,0|2,0,1]=4 729 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O MCULE-6065207677 [0,1,0,0,0,0|2,0,1]=4 730 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O MCULE-6989845390 [0,1,0,0,0,0|2,0,1]=4 731 B9R0.57 N[C@@H](CP(=O)(O)O)C(=O)O MCULE-6935567843 [0,1,0,0,0,0|2,0,0]=3 732 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O MCULE-1558128725 [0,1,0,0,0,0|2,0,0]=3 733 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O MCULE-6109276112 [0,1,0,0,0,0|2,0,0]=3 734 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O MCULE-1211212478 [0,1,0,0,0,0|2,0,1]=4 735 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O MCULE-1864367361 [0,1,0,0,0,0|2,0,1]=4 736 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O MCULE-4616647635 [0,1,0,0,0,0|2,0,1]=4 737 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O MCULE-6212697927 [0,1,0,0,0,0|2,0,1]=4 738 B9R0.79 CC(=O)C(C)C(C)C(=O)C MCULE-1642593127 [0,1,0,0,0,0|3,0,0]=4 739 B9R0.79 CC(=O)N(C)C(C)C(=O)O MCULE-8770175961 [0,1,0,0,0,0|3,0,0]=4 740 B9R0.79 CC(C(=O)O)C(C)C(=O)O MCULE-6112773421 [0,1,0,0,0,0|2,0,0]=3 741 B9R0.79 CC(C(=O)O)C(N)C(=O)O MCULE-7699599383 [0,1,0,0,0,0|1,0,0]=2 742 B9R0.79 CC(C(=O)O)C(O)C(=O)O MCULE-1644748819 [0,1,0,0,0,0|2,0,0]=3 743 B9R0.79 CC(C(=O)O)[C@H](N)C(=O)O MCULE-1516476673 [0,1,0,0,0,0|1,0,0]=2 744 B9R0.79 CC(C)C(O)C(N)C(=O)O MCULE-8766263714 [0,1,0,0,0,0|2,0,1]=4 745 B9R0.79 CC(C)C(O)[C@H](N)C(=O)O MCULE-5332720895 [0,1,0,0,0,0|2,0,1]=4 746 B9R0.79 CC(C)[C@@H](O)[C@@H](N)C(=O)O MCULE-2425417830 [0,1,0,0,0,0|2,0,1]=4 747 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-5438285037 [0,1,0,0,0,0|2,0,1]=4 748 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-6278820254 [0,1,0,0,0,0|2,0,1]=4 749 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-7542741263 [0,1,0,0,0,0|2,0,1]=4 750 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-8101644962 [0,1,0,0,0,0|2,0,1]=4 751 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O MCULE-6429723072 [0,1,0,0,0,0|2,0,1]=4 752 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O MCULE-8455636907 [0,1,0,0,0,0|2,0,1]=4 753 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O MCULE-9657202987 [0,1,0,0,0,0|2,0,1]=4 754 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O MCULE-9762128000 [0,1,0,0,0,0|2,0,1]=4 755 B9R0.79 CC(O)C(C)C(N)C(=O)O MCULE-2897656809 [0,1,0,0,0,0|1,0,2]=4 756 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O MCULE-6535308910 [0,1,0,0,0,0|1,0,2]=4 757 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O MCULE-8450789997 [0,1,0,0,0,0|1,0,2]=4 758 B9R0.79 C[C@H](C(=O)O)[C@@H](C)C(=O)O MCULE-1961663558 [0,1,0,0,0,0|2,0,0]=3 759 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O MCULE-1232463081 [0,1,0,0,0,0|1,0,0]=2 760 B9R0.79 C[C@H](C(=O)O)[C@H](N)C(=O)O MCULE-3277052139 [0,1,0,0,0,0|1,0,0]=2 761 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O MCULE-1376333194 [0,1,0,0,0,0|1,0,2]=4 762 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O MCULE-4005119004 [0,1,0,0,0,0|1,0,2]=4 763 B9R0.79 NC(=O)C(O)C(O)C(=O)N MCULE-9698453363 [0,1,0,0,0,0|2,0,0]=3 764 B9R0.79 NC(C(=O)O)C(N)C(=O)O MCULE-8316230798 [0,1,0,0,0,0|1,0,0]=2 765 B9R0.79 NC(C(=O)O)C(O)C(=O)O MCULE-9532787420 [0,1,0,0,0,0|1,0,0]=2 766 B9R0.79 N[C@@H](C(=O)O)[C@@H](F)C(=O)O MCULE-2171226271 [0,1,0,0,0,0|1,0,0]=2 767 B9R0.79 N[C@H](C(=O)O)[C@@H](N)C(=O)O MCULE-6540811499 [0,1,0,0,0,0|1,0,0]=2 768 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O MCULE-1913101511 [0,1,0,0,0,0|1,0,0]=2 769 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O MCULE-9488918896 [0,1,0,0,0,0|1,0,0]=2 770 B9R0.79 O=C(O)C(Br)C(Br)C(=O)O MCULE-5784765255 [0,1,0,0,0,0|2,0,0]=3 771 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-1129308393 [0,1,0,0,0,0|2,0,0]=3 772 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-2045308981 [0,1,0,0,0,0|2,0,0]=3 773 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-2628563960 [0,1,0,0,0,0|2,0,0]=3 774 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-3711883524 [0,1,0,0,0,0|2,0,0]=3 775 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-3867000095 [0,1,0,0,0,0|2,0,0]=3 776 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-4358223174 [0,1,0,0,0,0|2,0,0]=3 777 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-4807487882 [0,1,0,0,0,0|2,0,0]=3 778 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-5140635020 [0,1,0,0,0,0|2,0,0]=3 779 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-6522296758 [0,1,0,0,0,0|2,0,0]=3 780 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-6821495270 [0,1,0,0,0,0|2,0,0]=3 781 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-7561074998 [0,1,0,0,0,0|2,0,0]=3 782 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-8089597216 [0,1,0,0,0,0|2,0,0]=3 783 B9R0.79 O=C(O)C(O)[C@@H](O)C(=O)O MCULE-5751523258 [0,1,0,0,0,0|2,0,0]=3 784 B9R0.79 O=C(O)C(O)[C@@H](O)C(=O)O MCULE-9550173577 [0,1,0,0,0,0|2,0,0]=3 785 B9R0.79 O=C(O)C(O)[C@H](O)C(=O)O MCULE-7402521361 [0,1,0,0,0,0|2,0,0]=3 786 B9R0.79 O=C(O)C(S)C(S)C(=O)O MCULE-6206640169 [0,1,0,0,0,0|2,0,0]=3 787 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-2640391251 [0,1,0,0,0,0|2,0,0]=3 788 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-3329629643 [0,1,0,0,0,0|2,0,0]=3 789 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-3643444072 [0,1,0,0,0,0|2,0,0]=3 790 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-4107297969 [0,1,0,0,0,0|2,0,0]=3 791 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-6410123526 [0,1,0,0,0,0|2,0,0]=3 792 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-6491788082 [0,1,0,0,0,0|2,0,0]=3 793 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-8917357121 [0,1,0,0,0,0|2,0,0]=3 794 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-9727943205 [0,1,0,0,0,0|2,0,0]=3 795 B9R0.79 O=C(O)[C@H](Br)[C@H](Br)C(=O)O MCULE-4542712392 [0,1,0,0,0,0|2,0,0]=3 796 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-1568229930 [0,1,0,0,0,0|2,0,0]=3 797 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-2241188013 [0,1,0,0,0,0|2,0,0]=3 798 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-2831813022 [0,1,0,0,0,0|2,0,0]=3 799 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-3942804599 [0,1,0,0,0,0|2,0,0]=3 800 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-5431486019 [0,1,0,0,0,0|2,0,0]=3 801 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-5579731165 [0,1,0,0,0,0|2,0,0]=3 802 B9R0.79 O=C(O)[C@H](S)[C@H](S)C(=O)O MCULE-4953802229 [0,1,0,0,0,0|2,0,0]=3 803 B9R0.79 O=C([O-])C(O)C(O)C(=O)O MCULE-7425540478 [0,1,0,0,0,0|2,0,0]=3 804 B9R0.79 O=C([O-])C(O)C(O)C(=O)O MCULE-8338522673 [0,1,0,0,0,0|2,0,0]=3 805 B9R0.79 O=C([O-])C(O)C(O)C(=O)[O-] MCULE-1120076524 [0,1,0,0,0,0|2,0,1]=4 806 B9R0.79 O=C([O-])C(O)C(O)C(=O)[O-] MCULE-4518735246 [0,1,0,0,0,0|2,0,1]=4 807 B9R0.79 O=C([O-])[C@@H](O)[C@H](O)C(=O)O MCULE-2803273406 [0,1,0,0,0,0|2,0,0]=3 808 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)O MCULE-3429484887 [0,1,0,0,0,0|2,0,0]=3 809 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)O MCULE-5385898917 [0,1,0,0,0,0|2,0,0]=3 810 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)O MCULE-9680288022 [0,1,0,0,0,0|2,0,0]=3 811 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)[O-] MCULE-5904390200 [0,1,0,0,0,0|2,0,1]=4 812 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)[O-] MCULE-7305038555 [0,1,0,0,0,0|2,0,1]=4 813 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)[O-] MCULE-9168226203 [0,1,0,0,0,0|2,0,1]=4 814 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)[O-] MCULE-9463773027 [0,1,0,0,0,0|2,0,1]=4 815 B9R0.79 [C@@H](N)(C(=O)O)[C@@H](C)C(C)O MCULE-7488780154 [0,1,0,0,0,0|1,0,2]=4 816 B9R0.79 [C@@H](O)(C(=O)O)[C@H](O)C(=O)O MCULE-5798988872 [0,1,0,0,0,0|2,0,0]=3 817 B9R0.79 [C@H](O)(C(=O)O)[C@@H](O)C(=O)O MCULE-9974976226 [0,1,0,0,0,0|2,0,0]=3 818 B9R0.79 [C@H](O)(C(=O)[O-])[C@@H](O)C(=O)O MCULE-7449957572 [0,1,0,0,0,0|2,0,0]=3 819 B9R1.35 C1(CCC(=O)C1)C(=O)O MCULE-7485965564 [0,0,0,1,0,0|2,0,0]=3 820 B9R1.35 C1(CCC(=O)O1)C(=O)O MCULE-6663255579 [0,0,0,1,0,0|3,0,0]=4 821 B9R1.35 C=C1CCC(C1)C(=O)O MCULE-7982355069 [0,0,0,1,0,0|3,0,0]=4 822 B9R1.35 CC(=O)C1COC(=O)C1 MCULE-4262262510 [0,0,0,1,0,0|3,0,0]=4 823 B9R1.35 CC1=NOC(C1)C(=O)O MCULE-4730152545 [0,0,0,1,0,0|2,0,1]=4 824 B9R1.35 CC1=NO[C@@H](C1)C(=O)O MCULE-4081165004 [0,0,0,1,0,0|2,0,1]=4 825 B9R1.35 CC1CNC(C1)C(=O)O MCULE-5999128275 [0,0,0,1,0,0|2,0,1]=4 826 B9R1.35 CC1CNC(C1)C(=O)O MCULE-9035040660 [0,0,0,1,0,0|2,0,1]=4 827 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1541572989 [0,0,0,1,0,0|2,0,1]=4 828 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1821254522 [0,0,0,1,0,0|2,0,1]=4 829 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7426280517 [0,0,0,1,0,0|2,0,1]=4 830 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-8599307960 [0,0,0,1,0,0|2,0,1]=4 831 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O MCULE-2036600768 [0,0,0,1,0,0|2,0,1]=4 832 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O MCULE-4646350445 [0,0,0,1,0,0|2,0,1]=4 833 B9R1.35 C[C@H]1CN[C@H](C1)C(=O)O MCULE-2974063836 [0,0,0,1,0,0|2,0,1]=4 834 B9R1.35 C[C@H]1CN[C@H](C1)C(=O)O MCULE-7564386283 [0,0,0,1,0,0|2,0,1]=4 835 B9R1.35 NC(=O)C1CNC(=O)C1 MCULE-2954653092 [0,0,0,1,0,0|2,0,0]=3 836 B9R1.35 NC1=CNC(=C1)C(=O)O MCULE-5415250073 [0,0,0,1,0,0|1,0,2]=4 837 B9R1.35 NC1=CNC(=N1)C(=O)O MCULE-4133970235 [0,0,0,1,0,0|2,0,1]=4 838 B9R1.35 NC1=NC(CS1)C(=O)O MCULE-3669823666 [0,0,0,1,0,0|2,1,0]=4 839 B9R1.35 NC1=NNC(=C1)C(=O)O MCULE-3685279381 [0,0,0,1,0,0|1,0,2]=4 840 B9R1.35 NC1=NNC(N1)C(=O)O MCULE-8622860614 [0,0,0,1,0,0|2,0,0]=3 841 B9R1.35 NC1=N[C@@H](CS1)C(=O)O MCULE-6192179870 [0,0,0,1,0,0|2,1,0]=4 842 B9R1.35 NC1=N[C@H](CS1)C(=O)O MCULE-7308504151 [0,0,0,1,0,0|2,1,0]=4 843 B9R1.35 NC1C=CC(C1)C(=O)O MCULE-7513224290 [0,0,0,1,0,0|2,0,1]=4 844 B9R1.35 NC1C=CC(C1)C(=O)O MCULE-8369262706 [0,0,0,1,0,0|2,0,1]=4 845 B9R1.35 NC1CCC(C1)C(=O)O MCULE-1740452568 [0,0,0,1,0,0|2,0,1]=4 846 B9R1.35 NC1CCC(C1)C(=O)O MCULE-4067702279 [0,0,0,1,0,0|2,0,1]=4 847 B9R1.35 NC1CNC(C1)C(=O)O MCULE-1416144501 [0,0,0,1,0,0|1,0,1]=3 848 B9R1.35 NC1CNC(C1)C(=O)O MCULE-4706388278 [0,0,0,1,0,0|1,0,1]=3 849 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-2058033578 [0,0,0,1,0,0|2,0,1]=4 850 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-3535904120 [0,0,0,1,0,0|2,0,1]=4 851 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-7864688668 [0,0,0,1,0,0|2,0,1]=4 852 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-9488093105 [0,0,0,1,0,0|2,0,1]=4 853 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-1729778339 [0,0,0,1,0,0|2,0,1]=4 854 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-2964730214 [0,0,0,1,0,0|2,0,1]=4 855 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-6758665117 [0,0,0,1,0,0|2,0,1]=4 856 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-8002401712 [0,0,0,1,0,0|2,0,1]=4 857 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-1941635524 [0,0,0,1,0,0|2,0,1]=4 858 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-3306995596 [0,0,0,1,0,0|2,0,1]=4 859 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-5728201062 [0,0,0,1,0,0|2,0,1]=4 860 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-8515718052 [0,0,0,1,0,0|2,0,1]=4 861 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-4990800122 [0,0,0,1,0,0|1,0,1]=3 862 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-5172267597 [0,0,0,1,0,0|1,0,1]=3 863 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7010431429 [0,0,0,1,0,0|1,0,1]=3 864 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-8754522437 [0,0,0,1,0,0|1,0,1]=3 865 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-4906071490 [0,0,0,1,0,0|1,0,1]=3 866 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-7656739611 [0,0,0,1,0,0|1,0,1]=3 867 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-8732136397 [0,0,0,1,0,0|1,0,1]=3 868 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-9871023526 [0,0,0,1,0,0|1,0,1]=3 869 B9R1.35 N[C@H]1C=C[C@@H](C1)C(=O)O MCULE-1866924065 [0,0,0,1,0,0|2,0,1]=4 870 B9R1.35 N[C@H]1C=C[C@@H](C1)C(=O)O MCULE-5420586850 [0,0,0,1,0,0|2,0,1]=4 871 B9R1.35 N[C@H]1C=C[C@@H](C1)C(=O)O MCULE-6933168017 [0,0,0,1,0,0|2,0,1]=4 872 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-1923367161 [0,0,0,1,0,0|2,0,1]=4 873 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-2558762790 [0,0,0,1,0,0|2,0,1]=4 874 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-2767032719 [0,0,0,1,0,0|2,0,1]=4 875 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-3230012761 [0,0,0,1,0,0|2,0,1]=4 876 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-5898455500 [0,0,0,1,0,0|2,0,1]=4 877 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-8841082803 [0,0,0,1,0,0|2,0,1]=4 878 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-3382663689 [0,0,0,1,0,0|2,0,1]=4 879 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-7889100863 [0,0,0,1,0,0|2,0,1]=4 880 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-9213747671 [0,0,0,1,0,0|2,0,1]=4 881 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-9781594017 [0,0,0,1,0,0|2,0,1]=4 882 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1569946940 [0,0,0,1,0,0|2,0,1]=4 883 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1675680486 [0,0,0,1,0,0|2,0,1]=4 884 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1903292573 [0,0,0,1,0,0|2,0,1]=4 885 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-6695566760 [0,0,0,1,0,0|2,0,1]=4 886 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-6999679319 [0,0,0,1,0,0|2,0,1]=4 887 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-8009804408 [0,0,0,1,0,0|2,0,1]=4 888 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-1698400731 [0,0,0,1,0,0|1,0,1]=3 889 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-1983861108 [0,0,0,1,0,0|1,0,1]=3 890 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-2838978471 [0,0,0,1,0,0|1,0,1]=3 891 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-5103662767 [0,0,0,1,0,0|1,0,1]=3 892 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-5299594489 [0,0,0,1,0,0|1,0,1]=3 893 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-6235136925 [0,0,0,1,0,0|1,0,1]=3 894 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-8629641721 [0,0,0,1,0,0|1,0,1]=3 895 B9R1.35 N[C@H]1CN[C@H](C1)C(=O)O MCULE-2973551231 [0,0,0,1,0,0|1,0,1]=3 896 B9R1.35 N[C@H]1CN[C@H](C1)C(=O)O MCULE-3190600485 [0,0,0,1,0,0|1,0,1]=3 897 B9R1.35 O=C(O)C1CC(=NO1)Br MCULE-8217813426 [0,0,0,1,0,0|2,0,1]=4 898 B9R1.35 O=C(O)C1CC(CN1)Br MCULE-3420644560 [0,0,0,1,0,0|2,0,1]=4 899 B9R1.35 O=C(O)C1CC(CN1)F MCULE-1909829604 [0,0,0,1,0,0|2,0,1]=4 900 B9R1.35 O=C(O)C1CC(CN1)F MCULE-4908563055 [0,0,0,1,0,0|2,0,1]=4 901 B9R1.35 O=C(O)C1CC(CN1)O MCULE-3129945874 [0,0,0,1,0,0|1,0,2]=4 902 B9R1.35 O=C(O)C1CC(CN1)O MCULE-5090896550 [0,0,0,1,0,0|1,0,2]=4 903 B9R1.35 O=C(O)C1CC(CN1)S MCULE-3928449068 [0,0,0,1,0,0|1,1,1]=4 904 B9R1.35 O=C(O)C1CC(CN1)S MCULE-7523385510 [0,0,0,1,0,0|1,1,1]=4 905 B9R1.35 O=C(O)[C@@H]1CC(CN1)O MCULE-9602889253 [0,0,0,1,0,0|1,0,2]=4 906 B9R1.35 O=C(O)[C@@H]1CC(CN1)S MCULE-6078892837 [0,0,0,1,0,0|1,1,1]=4 907 B9R1.35 O=C(O)[C@@H]1CC(CN1)S MCULE-6607761456 [0,0,0,1,0,0|1,1,1]=4 908 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)Br MCULE-2600938020 [0,0,0,1,0,0|2,0,1]=4 909 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)Br MCULE-3945615781 [0,0,0,1,0,0|2,0,1]=4 910 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-2626475344 [0,0,0,1,0,0|2,0,1]=4 911 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-4367319835 [0,0,0,1,0,0|2,0,1]=4 912 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-9011373659 [0,0,0,1,0,0|2,0,1]=4 913 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-9484602400 [0,0,0,1,0,0|2,0,1]=4 914 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-2778155463 [0,0,0,1,0,0|1,0,2]=4 915 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-3005368457 [0,0,0,1,0,0|1,0,2]=4 916 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-3510440810 [0,0,0,1,0,0|1,0,2]=4 917 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-6982589556 [0,0,0,1,0,0|1,0,2]=4 918 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-8797295826 [0,0,0,1,0,0|1,0,2]=4 919 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-5195240463 [0,0,0,1,0,0|1,1,1]=4 920 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-6442187313 [0,0,0,1,0,0|1,1,1]=4 921 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-6472004515 [0,0,0,1,0,0|1,1,1]=4 922 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-8668690351 [0,0,0,1,0,0|1,1,1]=4 923 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-2784186920 [0,0,0,1,0,0|2,0,1]=4 924 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-5745425542 [0,0,0,1,0,0|2,0,1]=4 925 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-9253930917 [0,0,0,1,0,0|2,0,1]=4 926 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-9892414269 [0,0,0,1,0,0|2,0,1]=4 927 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-4157512603 [0,0,0,1,0,0|1,0,2]=4 928 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-5389747201 [0,0,0,1,0,0|1,0,2]=4 929 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-6465399562 [0,0,0,1,0,0|1,0,2]=4 930 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-7830616263 [0,0,0,1,0,0|1,0,2]=4 931 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-1140594774 [0,0,0,1,0,0|1,1,1]=4 932 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-2383846785 [0,0,0,1,0,0|1,1,1]=4 933 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-2747224270 [0,0,0,1,0,0|1,1,1]=4 934 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-5598470577 [0,0,0,1,0,0|1,1,1]=4 935 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-7268471922 [0,0,0,1,0,0|1,1,1]=4 936 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-9896850390 [0,0,0,1,0,0|1,1,1]=4 937 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-1499004749 [0,0,0,1,0,0|2,0,1]=4 938 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-4961028667 [0,0,0,1,0,0|2,0,1]=4 939 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-9323854334 [0,0,0,1,0,0|2,0,1]=4 940 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-1222229718 [0,0,0,1,0,0|1,0,2]=4 941 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-1998693022 [0,0,0,1,0,0|1,0,2]=4 942 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-3836053642 [0,0,0,1,0,0|1,0,2]=4 943 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-4545441904 [0,0,0,1,0,0|1,0,2]=4 944 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-8358409700 [0,0,0,1,0,0|1,0,2]=4 945 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-1326882154 [0,0,0,1,0,0|2,0,1]=4 946 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-4409765623 [0,0,0,1,0,0|2,0,1]=4 947 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-5169579313 [0,0,0,1,0,0|2,0,1]=4 948 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-8834390438 [0,0,0,1,0,0|2,0,1]=4 949 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-3080568728 [0,0,0,1,0,0|1,0,2]=4 950 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-4521316626 [0,0,0,1,0,0|1,0,2]=4 951 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-5972935636 [0,0,0,1,0,0|1,0,2]=4 952 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-7908625938 [0,0,0,1,0,0|1,0,2]=4 953 B9R1.35 O=C1C=C(NN1)C(=O)O MCULE-2820101826 [0,0,0,1,0,0|0,0,2]=3 954 B9R1.35 O=C1CC(=NN1)C(=O)O MCULE-2135539733 [0,0,0,1,0,0|0,0,2]=3 955 B9R1.35 O=C1CC(CN1)C(=O)O MCULE-2190630193 [0,0,0,1,0,0|1,0,0]=2 956 B9R1.35 O=C1CC(CO1)C(=O)O MCULE-4876585769 [0,0,0,1,0,0|2,0,0]=3 957 B9R1.35 O=C1CC(CS1)C(=O)O MCULE-5763665475 [0,0,0,1,0,0|2,0,0]=3 958 B9R1.35 O=C1CC(NN1)C(=O)O MCULE-3197471189 [0,0,0,1,0,0|0,0,0]=1 959 B9R1.35 O=C1CCC(C1)C(=O)O MCULE-8715651663 [0,0,0,1,0,0|2,0,0]=3 960 B9R1.35 O=C1CCC(N1)C(=O)O MCULE-4175874303 [0,0,0,1,0,0|3,0,0]=4 961 B9R1.35 O=C1CCC(N1)C(=O)O MCULE-9028773140 [0,0,0,1,0,0|3,0,0]=4 962 B9R1.35 O=C1CCC(O1)C(=O)O MCULE-1992756541 [0,0,0,1,0,0|3,0,0]=4 963 B9R1.35 O=C1CCC(S1)C(=O)O MCULE-8929436839 [0,0,0,1,0,0|3,0,0]=4 964 B9R1.35 O=C1CC[C@@H](C1)C(=O)O MCULE-1554776363 [0,0,0,1,0,0|2,0,0]=3 965 B9R1.35 O=C1CC[C@@H](C1)C(=O)O MCULE-4649943680 [0,0,0,1,0,0|2,0,0]=3 966 B9R1.35 O=C1CC[C@@H](N1)C(=O)O MCULE-5900221010 [0,0,0,1,0,0|3,0,0]=4 967 B9R1.35 O=C1CC[C@@H](N1)C(=O)O MCULE-8170238114 [0,0,0,1,0,0|3,0,0]=4 968 B9R1.35 O=C1CC[C@@H](O1)C(=O)O MCULE-1446049605 [0,0,0,1,0,0|3,0,0]=4 969 B9R1.35 O=C1CC[C@@H](O1)C(=O)O MCULE-6745317325 [0,0,0,1,0,0|3,0,0]=4 970 B9R1.35 O=C1CC[C@H](C1)C(=O)O MCULE-6597072682 [0,0,0,1,0,0|2,0,0]=3 971 B9R1.35 O=C1CC[C@H](C1)C(=O)O MCULE-7880064966 [0,0,0,1,0,0|2,0,0]=3 972 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-4204877494 [0,0,0,1,0,0|3,0,0]=4 973 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-4908547112 [0,0,0,1,0,0|3,0,0]=4 974 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-6422141688 [0,0,0,1,0,0|3,0,0]=4 975 B9R1.35 O=C1CC[C@H](O1)C(=O)O MCULE-5669975621 [0,0,0,1,0,0|3,0,0]=4 976 B9R1.35 O=C1CC[C@H](O1)C(=O)O MCULE-7113736527 [0,0,0,1,0,0|3,0,0]=4 977 B9R1.35 O=C1CC[C@H](S1)C(=O)O MCULE-4843749267 [0,0,0,1,0,0|3,0,0]=4 978 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-7418065190 [0,0,0,1,0,0|1,0,0]=2 979 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-7697956784 [0,0,0,1,0,0|1,0,0]=2 980 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-9520720032 [0,0,0,1,0,0|1,0,0]=2 981 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-2573903934 [0,0,0,1,0,0|1,0,0]=2 982 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-3585746586 [0,0,0,1,0,0|1,0,0]=2 983 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-4771747932 [0,0,0,1,0,0|1,0,0]=2 984 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-4795592072 [0,0,0,1,0,0|1,0,0]=2 985 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-6928857625 [0,0,0,1,0,0|1,0,0]=2 986 B9R1.35 O=C1COC(C1)C(=O)O MCULE-4720798204 [0,0,0,1,0,0|2,0,0]=3 987 B9R1.35 O=C1CSC(C1)C(=O)O MCULE-3309649635 [0,0,0,1,0,0|2,0,0]=3 988 B9R1.35 O=C1C[C@@H](CN1)C(=O)O MCULE-5673992530 [0,0,0,1,0,0|1,0,0]=2 989 B9R1.35 O=C1C[C@@H](CN1)C(=O)O MCULE-8443757903 [0,0,0,1,0,0|1,0,0]=2 990 B9R1.35 O=C1C[C@H](CN1)C(=O)O MCULE-1024601569 [0,0,0,1,0,0|1,0,0]=2 991 B9R1.35 O=C1C[C@H](CN1)C(=O)O MCULE-4280238532 [0,0,0,1,0,0|1,0,0]=2 992 B9R1.35 O=C1NC(CO1)C(=O)O MCULE-5946769187 [0,0,0,1,0,0|3,0,0]=4 993 B9R1.35 O=C1NC(CS1)C(=O)O MCULE-4574359237 [0,0,0,1,0,0|3,0,0]=4 994 B9R1.35 O=C1NC=C(N1)C(=O)O MCULE-2879870126 [0,0,0,1,0,0|2,0,1]=4 995 B9R1.35 O=C1NC=C(O1)C(=O)O MCULE-1855563319 [0,0,0,1,0,0|2,0,1]=4 996 B9R1.35 O=C1NCC(N1)C(=O)O MCULE-5872947769 [0,0,0,1,0,0|2,0,0]=3 997 B9R1.35 O=C1NCC(O1)C(=O)O MCULE-2773613806 [0,0,0,1,0,0|2,0,0]=3 998 B9R1.35 O=C1NC[C@@H](N1)C(=O)O MCULE-3499982275 [0,0,0,1,0,0|2,0,0]=3 999 B9R1.35 O=C1NC[C@@H](N1)C(=O)O MCULE-9995046216 [0,0,0,1,0,0|2,0,0]=3 1000 B9R1.35 O=C1NC[C@H](N1)C(=O)O MCULE-2524102915 [0,0,0,1,0,0|2,0,0]=3 1001 B9R1.35 O=C1NC[C@H](N1)C(=O)O MCULE-5992511798 [0,0,0,1,0,0|2,0,0]=3 1002 B9R1.35 O=C1NC[C@H](O1)C(=O)O MCULE-5972751457 [0,0,0,1,0,0|2,0,0]=3 1003 B9R1.35 O=C1NC[C@H](O1)C(=O)O MCULE-6879191654 [0,0,0,1,0,0|2,0,0]=3 1004 B9R1.35 O=C1N[C@@H](CO1)C(=O)O MCULE-2786614278 [0,0,0,1,0,0|3,0,0]=4 1005 B9R1.35 O=C1N[C@@H](CO1)C(=O)O MCULE-8589745511 [0,0,0,1,0,0|3,0,0]=4 1006 B9R1.35 O=C1N[C@@H](CS1)C(=O)O MCULE-8232416107 [0,0,0,1,0,0|3,0,0]=4 1007 B9R1.35 O=C1N[C@@H](CS1)C(=O)O MCULE-9439896780 [0,0,0,1,0,0|3,0,0]=4 1008 B9R1.35 O=C1N[C@H](CO1)C(=O)O MCULE-3716829138 [0,0,0,1,0,0|3,0,0]=4 1009 B9R1.35 O=C1N[C@H](CO1)C(=O)O MCULE-9300998688 [0,0,0,1,0,0|3,0,0]=4 1010 B9R1.35 O=C1N[C@H](CS1)C(=O)O MCULE-3120744944 [0,0,0,1,0,0|3,0,0]=4 1011 B9R1.35 O=C1OCC(O1)C(=O)O MCULE-2772637927 [0,0,0,1,0,0|3,0,0]=4 1012 B9R1.35 [C@@H]1(CN[C@H](C1)C(=O)O)O MCULE-3075663401 [0,0,0,1,0,0|1,0,2]=4 1013 B9R1.35 [C@H]1(CC[C@H](C1)C(=O)O)N MCULE-1734860042 [0,0,0,1,0,0|2,0,1]=4 1014 B9R1.35 [C@H]1(CC[C@H](C1)C(=O)O)N MCULE-3698574567 [0,0,0,1,0,0|2,0,1]=4 1015 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 1016 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 1017 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 1018 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 1019 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 1020 B9R1.35 [C@H]1(C[C@H](CN1)O)C(=O)O MCULE-3462627258 [0,0,0,1,0,0|1,0,2]=4 1021 B9R1.36 CC1(CC(C(=O)O1)N)C MCULE-7823096614 [0,0,0,1,0,0|2,0,1]=4 1022 B9R1.36 CC1(CC(C(=O)O1)N)C MCULE-8973330971 [0,0,0,1,0,0|2,0,1]=4 1023 B9R1.36 NC1CS(=O)(=O)NC1=O MCULE-5308687626 [0,0,0,1,0,0|3,0,0]=4 1024 B9R1.36 NC1CS(=O)(=O)NC1=O MCULE-7250097397 [0,0,0,1,0,0|3,0,0]=4 1025 B9R1.38 CC1(NC(=O)CC1N)C MCULE-9628793006 [0,0,0,1,0,0|2,0,1]=4 1026 B9R1.45 C=C1CC1C(N)C(=O)O MCULE-7249491598 [0,0,0,1,0,0|2,0,0]=3 1027 B9R1.69 CC1=NNC(=O)CC1C MCULE-3840929129 [0,0,0,1,0,0|3,0,0]=4 1028 B9R1.69 CC1CC(=O)CCC1=O MCULE-2258739718 [0,0,0,1,0,0|3,0,0]=4 1029 B9R1.69 CC1OC(=O)COC1=O MCULE-8718960339 [0,0,0,1,0,0|3,0,0]=4 1030 B9R1.69 CN1CC(=O)NCC1=O MCULE-2620095873 [0,0,0,1,0,0|3,0,0]=4 1031 B9R1.69 NC1=NC(=O)NCC1=O MCULE-2660856699 [0,0,0,1,0,0|2,0,1]=4 1032 B9R1.69 NC1NC(=O)NC=C1F MCULE-6799586428 [0,0,0,1,0,0|3,0,0]=4 1033 B9R1.112 NC(CC1CC1)C(=O)O MCULE-2093088646 [0,0,0,1,0,0|2,0,1]=4 1034 B9R1.112 NC(CC1CC1)C(=O)O MCULE-2184599799 [0,0,0,1,0,0|2,0,1]=4 1035 B9R1.112 NC(CC1CC1)C(=O)O MCULE-6147797529 [0,0,0,1,0,0|2,0,1]=4 1036 B9R1.112 N[C@@H](CC1CC1)C(=O)O MCULE-6048291861 [0,0,0,1,0,0|2,0,1]=4 1037 B9R1.112 N[C@@H](CC1CC1)C(=O)O MCULE-9266785362 [0,0,0,1,0,0|2,0,1]=4 1038 B9R1.112 N[C@H](CC1CC1)C(=O)O MCULE-5333410932 [0,0,0,1,0,0|2,0,1]=4 1039 B9R1.112 N[C@H](CC1CC1)C(=O)O MCULE-6150609140 [0,0,0,1,0,0|2,0,1]=4 1040 B9R1.152 C=C(C)C1(CC(=O)N1)C MCULE-1394575254 [0,0,0,1,0,0|3,0,0]=4 1041 B9R1.152 C=C1CC(C1)(C)C(=O)O MCULE-7205894158 [0,0,0,1,0,0|3,0,0]=4 1042 B9R1.152 C=C1CC(C1)(O)C(=O)O MCULE-9531189314 [0,0,0,1,0,0|3,0,0]=4 1043 B9R1.152 CC1(CC(=O)C1)C(=O)O MCULE-5766836727 [0,0,0,1,0,0|2,0,0]=3 1044 B9R1.152 CC1(CC(C1)N)C(=O)O MCULE-2576475336 [0,0,0,1,0,0|2,0,1]=4 1045 B9R1.152 CC1(CC(C1)N)C(=O)O MCULE-6535558159 [0,0,0,1,0,0|2,0,1]=4 1046 B9R1.152 C[C@@]1(C[C@@H](C1)N)C(=O)O MCULE-4599601598 [0,0,0,1,0,0|2,0,1]=4 1047 B9R1.152 C[C@@]1(C[C@@H](C1)N)C(=O)O MCULE-4763611062 [0,0,0,1,0,0|2,0,1]=4 1048 B9R1.152 C[C@@]1(C[C@H](C1)N)C(=O)O MCULE-2054460365 [0,0,0,1,0,0|2,0,1]=4 1049 B9R1.152 C[C@@]1(C[C@H](C1)N)C(=O)O MCULE-8615255294 [0,0,0,1,0,0|2,0,1]=4 1050 B9R1.152 C[C@H]1C[C@@](C1)(N)C(=O)O MCULE-7807418833 [0,0,0,1,0,0|2,0,1]=4 1051 B9R1.152 C[C@H]1C[C@](C1)(N)C(=O)O MCULE-2634950955 [0,0,0,1,0,0|2,0,1]=4 1052 B9R1.152 NC1(CC(C1)F)C(=O)O MCULE-5206815009 [0,0,0,1,0,0|2,0,1]=4 1053 B9R1.152 NC1(CC(C1)F)C(=O)O MCULE-9944960595 [0,0,0,1,0,0|2,0,1]=4 1054 B9R1.152 NC1(CC(C1)O)C(=O)O MCULE-8304595021 [0,0,0,1,0,0|1,0,2]=4 1055 B9R1.152 NC1(CC(C1)O)C(=O)O MCULE-8353432396 [0,0,0,1,0,0|1,0,2]=4 1056 B9R1.152 NC1CC(C1)(F)C(=O)O MCULE-8174066741 [0,0,0,1,0,0|2,0,1]=4 1057 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 1058 B9R1.152 N[C@@]1(C[C@@H](C1)O)C(=O)O MCULE-3919423791 [0,0,0,1,0,0|1,0,2]=4 1059 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 1060 B9R1.161 NC(=O)C1CC1C(=O)O MCULE-6146043873 [0,0,0,1,0,0|1,0,0]=2 1061 B9R1.161 NC(=O)C1CC1N(=O)=O MCULE-9623268033 [0,0,0,1,0,0|2,0,1]=4 1062 B9R1.161 O=C(Cl)C1OC1C(=O)Cl MCULE-9383694320 [0,0,0,1,0,0|3,0,0]=4 1063 B9R1.161 O=C(O)C1CC1C(=O)O MCULE-5636831869 [0,0,0,1,0,0|2,0,0]=3 1064 B9R1.161 O=C(O)C1CC1N(=O)=O MCULE-4711426088 [0,0,0,1,0,0|3,0,0]=4 1065 B9R1.161 O=C(O)C1OC1C(=O)O MCULE-2308875813 [0,0,0,1,0,0|2,0,0]=3 1066 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O MCULE-2176178577 [0,0,0,1,0,0|2,0,0]=3 1067 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O MCULE-7341169681 [0,0,0,1,0,0|2,0,0]=3 1068 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O MCULE-9766210553 [0,0,0,1,0,0|2,0,0]=3 1069 B9R1.161 O=C(O)[C@@H]1O[C@H]1C(=O)O MCULE-2854301838 [0,0,0,1,0,0|2,0,0]=3 1070 B9R1.161 O=C(O)[C@@H]1O[C@H]1C(=O)O MCULE-7193163448 [0,0,0,1,0,0|2,0,0]=3 1071 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O MCULE-8230558967 [0,0,0,1,0,0|2,0,0]=3 1072 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O MCULE-9433538416 [0,0,0,1,0,0|2,0,0]=3 1073 B9R1.161 O=C(O)[C@H]1C[C@@H]1[N+](=O)[O-] MCULE-1350888359 [0,0,0,1,0,0|3,0,0]=4 1074 B9R1.161 O=C(O)[C@H]1C[C@H]1C(=O)O MCULE-4280807741 [0,0,0,1,0,0|2,0,0]=3 1075 B9R1.161 O=C(O)[C@H]1O[C@H]1C(=O)O MCULE-6088596771 [0,0,0,1,0,0|2,0,0]=3 1076 B9R1.161 O=C([O-])[C@H]1O[C@H]1C(=O)[O-] MCULE-9392079342 [0,0,0,1,0,0|2,0,1]=4 1077 B9R1.164 O=C(O)C1CS(=O)(=O)C1 MCULE-7280424141 [0,0,0,1,0,0|3,0,0]=4 1078 B7R0.16 C=C(C(=O)O)C(=O)O MCULE-7540749901 [0,0,0,0,1,0|2,0,1]=4 1079 B7R0.16 C=C(C)C(N)C(=O)O MCULE-1815568719 [0,0,0,0,1,0|2,0,0]=3 1080 B7R0.16 C=C(C)C(N)C(=O)O MCULE-2839869274 [0,0,0,0,1,0|2,0,0]=3 1081 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5015326828 [0,0,0,0,1,0|2,0,0]=3 1082 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5043630144 [0,0,0,0,1,0|2,0,0]=3 1083 B7R0.16 C=C(C)[C@@H](N)C(=C)O MCULE-5278584348 [0,0,0,0,1,0|3,0,0]=4 1084 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-2007035571 [0,0,0,0,1,0|2,0,0]=3 1085 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-6240689602 [0,0,0,0,1,0|2,0,0]=3 1086 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-8025014656 [0,0,0,0,1,0|2,0,0]=3 1087 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-9704891439 [0,0,0,0,1,0|2,0,0]=3 1088 B7R0.16 CC(=O)C(Br)C(=O)C MCULE-2980550700 [0,0,0,0,1,0|3,0,0]=4 1089 B7R0.16 CC(=O)C(C)C(=O)C MCULE-9607259412 [0,0,0,0,1,0|3,0,0]=4 1090 B7R0.16 CC(=O)C(Cl)C(=O)C MCULE-4716617423 [0,0,0,0,1,0|3,0,0]=4 1091 B7R0.16 CC(=O)C(F)C(=O)C MCULE-4665621902 [0,0,0,0,1,0|3,0,0]=4 1092 B7R0.16 CC(=O)C(N)C(=O)C MCULE-6440496769 [0,0,0,0,1,0|2,0,0]=3 1093 B7R0.16 CC(=O)C(N)C(=O)C MCULE-8525737264 [0,0,0,0,1,0|2,0,0]=3 1094 B7R0.16 CC(C(=O)Cl)C(=O)Cl MCULE-5269923120 [0,0,0,0,1,0|3,0,0]=4 1095 B7R0.16 CC(C(=O)N)C(=O)N MCULE-4912037399 [0,0,0,0,1,0|2,0,0]=3 1096 B7R0.16 CC(C(=O)O)C(=O)O MCULE-7232226851 [0,0,0,0,1,0|2,0,0]=3 1097 B7R0.16 CC(C(=O)O)N(C)N MCULE-1182323460 [0,0,0,0,1,0|3,0,0]=4 1098 B7R0.16 CC(C(=O)[O-])C(=O)[O-] MCULE-4632089491 [0,0,0,0,1,0|2,0,1]=4 1099 B7R0.16 CC(C(=O)[O-])C(=O)[O-] MCULE-8764180648 [0,0,0,0,1,0|2,0,1]=4 1100 B7R0.16 CC(C)C(N)C(=O)N MCULE-5793065876 [0,0,0,0,1,0|2,0,1]=4 1101 B7R0.16 CC(C)C(N)C(=O)N MCULE-6836215171 [0,0,0,0,1,0|2,0,1]=4 1102 B7R0.16 CC(C)C(N)C(=O)O MCULE-8140660263 [0,0,0,0,1,0|2,0,1]=4 1103 B7R0.16 CC(C)C(N)C(=O)O MCULE-9199801639 [0,0,0,0,1,0|2,0,1]=4 1104 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-2330575489 [0,0,0,0,1,0|2,0,1]=4 1105 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-2653474443 [0,0,0,0,1,0|2,0,1]=4 1106 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-3449326352 [0,0,0,0,1,0|2,0,1]=4 1107 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-7409435805 [0,0,0,0,1,0|2,0,1]=4 1108 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-1338052740 [0,0,0,0,1,0|2,0,1]=4 1109 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-2459930572 [0,0,0,0,1,0|2,0,1]=4 1110 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-1415573194 [0,0,0,0,1,0|2,0,1]=4 1111 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-2742126302 [0,0,0,0,1,0|2,0,1]=4 1112 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-3124084676 [0,0,0,0,1,0|2,0,1]=4 1113 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-4854272542 [0,0,0,0,1,0|2,0,1]=4 1114 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-7430998836 [0,0,0,0,1,0|2,0,1]=4 1115 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-9899853579 [0,0,0,0,1,0|2,0,1]=4 1116 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-2507309072 [0,0,0,0,1,0|2,0,1]=4 1117 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-9143825935 [0,0,0,0,1,0|2,0,1]=4 1118 B7R0.16 CC(F)C(N)C(=O)O MCULE-8810968604 [0,0,0,0,1,0|2,0,1]=4 1119 B7R0.16 CC(N)C(C)C(=O)O MCULE-2921617741 [0,0,0,0,1,0|2,0,1]=4 1120 B7R0.16 CC(N)C(C)C(=O)O MCULE-8511267926 [0,0,0,0,1,0|2,0,1]=4 1121 B7R0.16 CC(N)C(O)C(=O)O MCULE-1086139043 [0,0,0,0,1,0|2,0,1]=4 1122 B7R0.16 CC(N)C(O)C(=O)O MCULE-6405300346 [0,0,0,0,1,0|2,0,1]=4 1123 B7R0.16 CC(O)C(N)C(=O)N MCULE-1234785834 [0,0,0,0,1,0|1,0,1]=3 1124 B7R0.16 CC(O)C(N)C(=O)N MCULE-5867306342 [0,0,0,0,1,0|1,0,1]=3 1125 B7R0.16 CC(O)C(N)C(=O)O MCULE-1563595722 [0,0,0,0,1,0|1,0,2]=4 1126 B7R0.16 CC(O)C(N)C(=O)O MCULE-5581920538 [0,0,0,0,1,0|1,0,2]=4 1127 B7R0.16 C[C@@H](N)[C@@H](N)C(=O)O MCULE-5302456851 [0,0,0,0,1,0|1,0,1]=3 1128 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-1663687439 [0,0,0,0,1,0|1,0,2]=4 1129 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-3863591433 [0,0,0,0,1,0|1,0,2]=4 1130 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-8080019797 [0,0,0,0,1,0|1,0,2]=4 1131 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-9284411012 [0,0,0,0,1,0|1,0,2]=4 1132 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-1969228933 [0,0,0,0,1,0|1,0,1]=3 1133 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-3285041526 [0,0,0,0,1,0|1,0,1]=3 1134 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-5018319528 [0,0,0,0,1,0|1,0,1]=3 1135 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-6080625355 [0,0,0,0,1,0|1,0,1]=3 1136 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-9393787536 [0,0,0,0,1,0|1,0,1]=3 1137 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-9925689829 [0,0,0,0,1,0|1,0,1]=3 1138 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2430667007 [0,0,0,0,1,0|1,0,2]=4 1139 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2676185993 [0,0,0,0,1,0|1,0,2]=4 1140 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5254477364 [0,0,0,0,1,0|1,0,2]=4 1141 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5505393195 [0,0,0,0,1,0|1,0,2]=4 1142 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-7379719940 [0,0,0,0,1,0|1,0,2]=4 1143 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2245171795 [0,0,0,0,1,0|2,0,1]=4 1144 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2727261050 [0,0,0,0,1,0|2,0,1]=4 1145 B7R0.16 C[C@H](N)[C@@H](N)C(=O)O MCULE-9507122128 [0,0,0,0,1,0|1,0,1]=3 1146 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-2574349608 [0,0,0,0,1,0|2,0,1]=4 1147 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-6297204649 [0,0,0,0,1,0|2,0,1]=4 1148 B7R0.16 C[C@H](N)[C@H](N)C(=O)O MCULE-3178389621 [0,0,0,0,1,0|1,0,1]=3 1149 B7R0.16 C[C@H](O)C(N)C(=O)O MCULE-6661175670 [0,0,0,0,1,0|1,0,2]=4 1150 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-6288272506 [0,0,0,0,1,0|1,0,2]=4 1151 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-7203096302 [0,0,0,0,1,0|1,0,2]=4 1152 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-9531951265 [0,0,0,0,1,0|1,0,2]=4 1153 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-2246314901 [0,0,0,0,1,0|1,0,2]=4 1154 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-9478987169 [0,0,0,0,1,0|1,0,2]=4 1155 B7R0.16 NC(=O)C(Br)C(=O)N MCULE-7519162871 [0,0,0,0,1,0|2,0,0]=3 1156 B7R0.16 NC(=O)C(N)C(=O)N MCULE-5338329205 [0,0,0,0,1,0|1,0,0]=2 1157 B7R0.16 NC(C(=O)O)C(=O)O MCULE-6118746267 [0,0,0,0,1,0|1,0,0]=2 1158 B7R0.16 O=C(O)C(=O)C(=O)O MCULE-9031084199 [0,0,0,0,1,0|2,0,1]=4 1159 B7R0.16 O=C(O)C(Cl)C(=O)O MCULE-9776364495 [0,0,0,0,1,0|2,0,0]=3 1160 B7R0.16 O=C(O)C(F)C(=O)O MCULE-9969055570 [0,0,0,0,1,0|2,0,0]=3 1161 B7R0.16 O=C(O)C(O)C(=O)O MCULE-4232935518 [0,0,0,0,1,0|2,0,0]=3 1162 B9R0.7 C(N)(CCC(=O)[O-])C(=O)O MCULE-5359010340 [0,0,0,0,0,1|1,0,0]=2 1163 B9R0.7 C/C(=N/NC(=O)N)/C(=O)O MCULE-9321060192 [0,0,0,0,0,1|2,0,1]=4 1164 B9R0.7 C/C(=N\NC(=O)N)/C(=O)O MCULE-7459723879 [0,0,0,0,0,1|2,0,1]=4 1165 B9R0.7 C=C(CCC(=O)O)C(=O)O MCULE-3502029665 [0,0,0,0,0,1|2,0,1]=4 1166 B9R0.7 CC(=CCC(N)C(=O)O)C MCULE-9020150203 [0,0,0,0,0,1|2,0,0]=3 1167 B9R0.7 CC(=CC[C@@H](N)C(=O)O)C MCULE-7822845293 [0,0,0,0,0,1|2,0,0]=3 1168 B9R0.7 CC(=CC[C@H](N)C(=O)O)C MCULE-6208618845 [0,0,0,0,0,1|2,0,0]=3 1169 B9R0.7 CC(=NNC(=O)N)C(=O)O MCULE-9419629764 [0,0,0,0,0,1|2,0,1]=4 1170 B9R0.7 CC(=O)C(C)CCC(=O)O MCULE-9124111940 [0,0,0,0,0,1|3,0,0]=4 1171 B9R0.7 CC(=O)C(C)CCC(=O)[O-] MCULE-8051941482 [0,0,0,0,0,1|3,0,0]=4 1172 B9R0.7 CC(=O)OCC(N)C(=O)O MCULE-4063734192 [0,0,0,0,0,1|1,0,0]=2 1173 B9R0.7 CC(=O)OCC(N)C(=O)O MCULE-6252379108 [0,0,0,0,0,1|1,0,0]=2 1174 B9R0.7 CC(=O)OCC(N)C(=O)O MCULE-6448707862 [0,0,0,0,0,1|1,0,0]=2 1175 B9R0.7 CC(=O)OCC(N)C(=O)O MCULE-8255582994 [0,0,0,0,0,1|1,0,0]=2 1176 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O MCULE-2377153563 [0,0,0,0,0,1|1,0,0]=2 1177 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O MCULE-2469027462 [0,0,0,0,0,1|1,0,0]=2 1178 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O MCULE-4796013964 [0,0,0,0,0,1|1,0,0]=2 1179 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O MCULE-9408226443 [0,0,0,0,0,1|1,0,0]=2 1180 B9R0.7 CC(=O)OC[C@H](N)C(=O)O MCULE-1751945139 [0,0,0,0,0,1|1,0,0]=2 1181 B9R0.7 CC(=O)OC[C@H](N)C(=O)O MCULE-3822387628 [0,0,0,0,0,1|1,0,0]=2 1182 B9R0.7 CC(=O)OC[C@H](N)C(=O)O MCULE-6052634347 [0,0,0,0,0,1|1,0,0]=2 1183 B9R0.7 CC(=O)OC[C@H](N)C(=O)O MCULE-6909390355 [0,0,0,0,0,1|1,0,0]=2 1184 B9R0.7 CC(=O)SCC(C)C(=O)N MCULE-5520753765 [0,0,0,0,0,1|3,0,0]=4 1185 B9R0.7 CC(=O)SCC(C)C(=O)O MCULE-5116238206 [0,0,0,0,0,1|2,0,0]=3 1186 B9R0.7 CC(=O)SCC(N)C(=O)O MCULE-2891442308 [0,0,0,0,0,1|1,0,0]=2 1187 B9R0.7 CC(=O)SCC(N)C(=O)O MCULE-4623851451 [0,0,0,0,0,1|1,0,0]=2 1188 B9R0.7 CC(=O)SC[C@@H](C)C(=O)O MCULE-8028939364 [0,0,0,0,0,1|2,0,0]=3 1189 B9R0.7 CC(=O)SC[C@@H](C)C(=O)O MCULE-8973266419 [0,0,0,0,0,1|2,0,0]=3 1190 B9R0.7 CC(=O)SC[C@H](N)C(=O)O MCULE-1698125004 [0,0,0,0,0,1|1,0,0]=2 1191 B9R0.7 CC(=O)SC[C@H](N)C(=O)O MCULE-6046193594 [0,0,0,0,0,1|1,0,0]=2 1192 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-1719574078 [0,0,0,0,0,1|2,0,1]=4 1193 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-7494642848 [0,0,0,0,0,1|2,0,1]=4 1194 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-7934601656 [0,0,0,0,0,1|2,0,1]=4 1195 B9R0.7 CC(C)CC[C@@H](N)C(=O)O MCULE-3738071496 [0,0,0,0,0,1|2,0,1]=4 1196 B9R0.7 CC(C)CC[C@@H](N)C(=O)O MCULE-6646418122 [0,0,0,0,0,1|2,0,1]=4 1197 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-1152840736 [0,0,0,0,0,1|2,0,1]=4 1198 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-2931632246 [0,0,0,0,0,1|2,0,1]=4 1199 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-6463365282 [0,0,0,0,0,1|2,0,1]=4 1200 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-7649870164 [0,0,0,0,0,1|2,0,1]=4 1201 B9R0.7 CC(C)OC[C@H](N)C(=O)O MCULE-1578143302 [0,0,0,0,0,1|2,0,1]=4 1202 B9R0.7 CC(C)SCC(N)C(=O)O MCULE-2486867814 [0,0,0,0,0,1|2,0,1]=4 1203 B9R0.7 CC(CCC(=O)O)C(=O)O MCULE-1523371907 [0,0,0,0,0,1|2,0,0]=3 1204 B9R0.7 CC(CCC(=O)O)C(=O)O MCULE-1939523418 [0,0,0,0,0,1|2,0,0]=3 1205 B9R0.7 CC(CNC(=O)N)C(=O)O MCULE-6367938073 [0,0,0,0,0,1|1,0,0]=2 1206 B9R0.7 CC(NCC(=O)O)C(=O)O MCULE-1111290878 [0,0,0,0,0,1|2,0,0]=3 1207 B9R0.7 CC(NCC(=O)O)C(=O)O MCULE-6569987660 [0,0,0,0,0,1|2,0,0]=3 1208 B9R0.7 CC(SCC(=O)O)C(=O)O MCULE-8523268796 [0,0,0,0,0,1|2,0,0]=3 1209 B9R0.7 CN(C)CCC(N)C(=O)O MCULE-8874115334 [0,0,0,0,0,1|3,0,0]=4 1210 B9R0.7 CN(C)CC[C@H](N)C(=O)O MCULE-7859718042 [0,0,0,0,0,1|3,0,0]=4 1211 B9R0.7 CN(C)CC[C@H](N)C(=O)O MCULE-7883746105 [0,0,0,0,0,1|3,0,0]=4 1212 B9R0.7 CS(=O)CCC(N)C(=O)O MCULE-2810141962 [0,0,0,0,0,1|2,0,0]=3 1213 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O MCULE-3901672243 [0,0,0,0,0,1|2,0,0]=3 1214 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O MCULE-3967415982 [0,0,0,0,0,1|2,0,0]=3 1215 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O MCULE-6481206030 [0,0,0,0,0,1|2,0,0]=3 1216 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O MCULE-6787807393 [0,0,0,0,0,1|2,0,0]=3 1217 B9R0.7 CS(=O)CC[C@H](N)C(=O)O MCULE-1832499155 [0,0,0,0,0,1|2,0,0]=3 1218 B9R0.7 C[C@@H](CCC(=O)O)C(=O)O MCULE-7515023265 [0,0,0,0,0,1|2,0,0]=3 1219 B9R0.7 C[C@H](CCC(=O)O)C(=O)O MCULE-8441860655 [0,0,0,0,0,1|2,0,0]=3 1220 B9R0.7 C[C@H](CCC(=O)O)C(=O)O MCULE-9071150671 [0,0,0,0,0,1|2,0,0]=3 1221 B9R0.7 C[C@H](CC[N+](=O)[O-])C(=O)O MCULE-1884928652 [0,0,0,0,0,1|3,0,0]=4 1222 B9R0.7 C[C@H](NCC(=O)O)C(=O)O MCULE-1511229567 [0,0,0,0,0,1|2,0,0]=3 1223 B9R0.7 C[C@H](NCC(=O)O)C(=O)O MCULE-4530562082 [0,0,0,0,0,1|2,0,0]=3 1224 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-1226059178 [0,0,0,0,0,1|3,0,0]=4 1225 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-2190014040 [0,0,0,0,0,1|3,0,0]=4 1226 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-5712047901 [0,0,0,0,0,1|3,0,0]=4 1227 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-6819299220 [0,0,0,0,0,1|3,0,0]=4 1228 B9R0.7 C[S+](C)CCC(N)C(=O)O MCULE-9030836699 [0,0,0,0,0,1|3,0,0]=4 1229 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O MCULE-4590755313 [0,0,0,0,0,1|3,0,0]=4 1230 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O MCULE-5450461647 [0,0,0,0,0,1|3,0,0]=4 1231 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O MCULE-6366850762 [0,0,0,0,0,1|3,0,0]=4 1232 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-1022001641 [0,0,0,0,0,1|3,0,0]=4 1233 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-2164538601 [0,0,0,0,0,1|3,0,0]=4 1234 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-4494909498 [0,0,0,0,0,1|3,0,0]=4 1235 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-6858051266 [0,0,0,0,0,1|3,0,0]=4 1236 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-7758450855 [0,0,0,0,0,1|3,0,0]=4 1237 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O MCULE-8877605547 [0,0,0,0,0,1|3,0,0]=4 1238 B9R0.7 N=C(N)NCC(N)C(=O)O MCULE-1177262947 [0,0,0,0,0,1|1,0,0]=2 1239 B9R0.7 N=C(N)NCC(N)C(=O)O MCULE-2474644851 [0,0,0,0,0,1|1,0,0]=2 1240 B9R0.7 N=C(N)NCC(N)C(=O)O MCULE-5671557476 [0,0,0,0,0,1|1,0,0]=2 1241 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-3050097417 [0,0,0,0,0,1|1,0,0]=2 1242 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-3499032906 [0,0,0,0,0,1|1,0,0]=2 1243 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-4835798272 [0,0,0,0,0,1|1,0,0]=2 1244 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-8355456866 [0,0,0,0,0,1|1,0,0]=2 1245 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-8635327390 [0,0,0,0,0,1|1,0,0]=2 1246 B9R0.7 NC(=O)C(N)CCC(=O)O MCULE-7109792615 [0,0,0,0,0,1|2,0,0]=3 1247 B9R0.7 NC(=O)C(N)CCC(=O)O MCULE-8741984156 [0,0,0,0,0,1|2,0,0]=3 1248 B9R0.7 NC(=O)CCC(N)C(=O)O MCULE-1418655814 [0,0,0,0,0,1|0,0,0]=1 1249 B9R0.7 NC(=O)CC[C@@H](N)C(=O)N MCULE-3069717045 [0,0,0,0,0,1|1,0,0]=2 1250 B9R0.7 NC(=O)CC[C@@H](N)C(=O)N MCULE-3964283106 [0,0,0,0,0,1|1,0,0]=2 1251 B9R0.7 NC(=O)CC[C@@H](N)C(=O)N MCULE-8749190773 [0,0,0,0,0,1|1,0,0]=2 1252 B9R0.7 NC(=O)CC[C@@H](N)C(=O)N MCULE-8900435477 [0,0,0,0,0,1|1,0,0]=2 1253 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O MCULE-7870225738 [0,0,0,0,0,1|0,0,0]=1 1254 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O MCULE-9711806580 [0,0,0,0,0,1|0,0,0]=1 1255 B9R0.7 NC(=O)CC[C@H](N)C(=O)N MCULE-2293558876 [0,0,0,0,0,1|1,0,0]=2 1256 B9R0.7 NC(=O)CC[C@H](N)C(=O)N MCULE-5457304555 [0,0,0,0,0,1|1,0,0]=2 1257 B9R0.7 NC(=O)CC[C@H](N)C(=O)N MCULE-7482897734 [0,0,0,0,0,1|1,0,0]=2 1258 B9R0.7 NC(=O)CC[C@H](N)C(=O)N MCULE-9074108708 [0,0,0,0,0,1|1,0,0]=2 1259 B9R0.7 NC(=O)CC[C@H](N)C(=O)O MCULE-7234937947 [0,0,0,0,0,1|0,0,0]=1 1260 B9R0.7 NC(=O)CC[C@H](N)C(=O)O MCULE-8718820108 [0,0,0,0,0,1|0,0,0]=1 1261 B9R0.7 NC(=O)NCC(N)C(=O)O MCULE-4609961006 [0,0,0,0,0,1|0,0,0]=1 1262 B9R0.7 NC(=O)NC[C@@H](N)C(=O)O MCULE-7506737023 [0,0,0,0,0,1|0,0,0]=1 1263 B9R0.7 NC(=O)NC[C@H](N)C(=O)O MCULE-3123973606 [0,0,0,0,0,1|0,0,0]=1 1264 B9R0.7 NC(=O)NC[C@H]([NH3+])C(=O)[O-] MCULE-2674726108 [0,0,0,0,0,1|0,0,2]=3 1265 B9R0.7 NC(=O)SCC(N)C(=O)O MCULE-7865241343 [0,0,0,0,0,1|0,0,0]=1 1266 B9R0.7 NC(=O)SC[C@H](N)C(=O)O MCULE-6647567669 [0,0,0,0,0,1|0,0,0]=1 1267 B9R0.7 NC(=O)SC[C@H](N)C(=O)O MCULE-7995535877 [0,0,0,0,0,1|0,0,0]=1 1268 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O MCULE-7404893649 [0,0,0,0,0,1|2,0,0]=3 1269 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O MCULE-7580681383 [0,0,0,0,0,1|2,0,0]=3 1270 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-3142698040 [0,0,0,0,0,1|2,0,0]=3 1271 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-3865619229 [0,0,0,0,0,1|2,0,0]=3 1272 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-8184010011 [0,0,0,0,0,1|2,0,0]=3 1273 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-8981731652 [0,0,0,0,0,1|2,0,0]=3 1274 B9R0.7 NC(CCC(=O)O)C(=O)O MCULE-4203507491 [0,0,0,0,0,1|1,0,0]=2 1275 B9R0.7 NC(CCC(=O)O)C(=O)O MCULE-4600207704 [0,0,0,0,0,1|1,0,0]=2 1276 B9R0.7 NC(CCC(=O)O)C(=O)O MCULE-8107432729 [0,0,0,0,0,1|1,0,0]=2 1277 B9R0.7 NC(CCC(=O)[O-])C(=O)O MCULE-5012956158 [0,0,0,0,0,1|1,0,0]=2 1278 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-6077524166 [0,0,0,0,0,1|1,0,0]=2 1279 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-7201150413 [0,0,0,0,0,1|1,0,0]=2 1280 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-7328895736 [0,0,0,0,0,1|1,0,0]=2 1281 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-7782530856 [0,0,0,0,0,1|1,0,0]=2 1282 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-9447720868 [0,0,0,0,0,1|1,0,0]=2 1283 B9R0.7 N[C@@H](CCC(=O)O)C(=O)[O-] MCULE-3042990215 [0,0,0,0,0,1|1,0,1]=3 1284 B9R0.7 N[C@@H](CCC(=O)O)C(O)O MCULE-4882070910 [0,0,0,0,0,1|1,0,2]=4 1285 B9R0.7 N[C@@H](CCC(=O)[O-])C(=O)O MCULE-2315425063 [0,0,0,0,0,1|1,0,0]=2 1286 B9R0.7 N[C@@H](CCC(=O)[O-])C(=O)O MCULE-4367391999 [0,0,0,0,0,1|1,0,0]=2 1287 B9R0.7 N[C@H](CCC(=O)O)C(=O)O MCULE-5884691541 [0,0,0,0,0,1|1,0,0]=2 1288 B9R0.7 N[C@H](CCC(=O)O)C(=O)O MCULE-6647836957 [0,0,0,0,0,1|1,0,0]=2 1289 B9R0.7 O=C(O)CCC(=O)C(=O)O MCULE-5148157449 [0,0,0,0,0,1|2,0,1]=4 1290 B9R0.7 O=C(O)CCC(Cl)C(=O)O MCULE-8696439839 [0,0,0,0,0,1|2,0,0]=3 1291 B9R0.7 O=C(O)CCC(O)C(=O)O MCULE-5732806069 [0,0,0,0,0,1|2,0,0]=3 1292 B9R0.7 O=C(O)CC[C@@H](O)C(=O)O MCULE-2990674754 [0,0,0,0,0,1|2,0,0]=3 1293 B9R0.7 O=C(O)CC[C@@H](O)C(=O)O MCULE-9463608806 [0,0,0,0,0,1|2,0,0]=3 1294 B9R0.7 O=C(O)CC[C@H](Br)C(=O)O MCULE-3541564241 [0,0,0,0,0,1|2,0,0]=3 1295 B9R0.7 O=C(O)CC[C@H](Br)C(=O)O MCULE-5484001209 [0,0,0,0,0,1|2,0,0]=3 1296 B9R0.7 O=C(O)CC[C@H](Cl)C(=O)O MCULE-4338578978 [0,0,0,0,0,1|2,0,0]=3 1297 B9R0.7 O=C(O)CC[C@H](O)C(=O)O MCULE-4494756126 [0,0,0,0,0,1|2,0,0]=3 1298 B9R0.7 O=C(O)CNC(=O)C(=O)O MCULE-6181171802 [0,0,0,0,0,1|2,0,1]=4 1299 B9R0.7 O=C([O-])CCC(=O)C(=O)O MCULE-3931336643 [0,0,0,0,0,1|2,0,1]=4 1300 B9R0.7 O=C([O-])CCC(O)C(=O)[O-] MCULE-1880842258 [0,0,0,0,0,1|2,0,1]=4 1301 B9R0.7 O=C([O-])CCC(O)C(=O)[O-] MCULE-4254561979 [0,0,0,0,0,1|2,0,1]=4 1302 B9R0.7 O=C([O-])CCC(O)C(=O)[O-] MCULE-4348197971 [0,0,0,0,0,1|2,0,1]=4 1303 B9R0.7 O=C([O-])CC[C@@H](O)C(=O)[O-] MCULE-2376048296 [0,0,0,0,0,1|2,0,1]=4 1304 B9R0.7 O=C([O-])CC[C@@H](O)C(=O)[O-] MCULE-3046517186 [0,0,0,0,0,1|2,0,1]=4 1305 B9R0.7 O=C([O-])CC[C@H](O)C(=O)[O-] MCULE-2350068178 [0,0,0,0,0,1|2,0,1]=4 1306 B9R0.7 O=C([O-])CC[C@H](O)C(=O)[O-] MCULE-8971415546 [0,0,0,0,0,1|2,0,1]=4 1307 B9R0.7 P(=O)(O)CC[C@H](N)C(=O)O MCULE-2875179933 [0,0,0,0,0,1|2,0,0]=3 1308 B9R0.7 [C@H](N)(CCC(=O)O)C(=O)N MCULE-1881473683 [0,0,0,0,0,1|2,0,0]=3 1309 B9R0.7 [C@H](N)(CCC(=O)O)C(=O)O MCULE-8526087521 [0,0,0,0,0,1|1,0,0]=2 1310 B9R0.7 [C@H](N)(CCS(=O)C)C(=O)O MCULE-2995684872 [0,0,0,0,0,1|2,0,0]=3 1311 B9R0.7 [C@H](O)(CCC(=O)O)C(=O)O MCULE-8564542509 [0,0,0,0,0,1|2,0,0]=3 1312 B9R0.7 [NH3+][C@@H](CCC(=O)[O-])C(=O)[O-] MCULE-6350748495 [0,0,0,0,0,1|1,0,2]=4 1313 B9R0.53 C/C(=C\C(=O)O)/CC(=O)O MCULE-1345660635 [0,0,0,0,0,1|2,0,1]=4 1314 B9R0.53 CC(=CC(=O)O)CC(=O)O MCULE-8165055939 [0,0,0,0,0,1|2,0,1]=4 1315 B9R0.53 CC(=O)NC(C)CC(=O)O MCULE-8603148812 [0,0,0,0,0,1|3,0,0]=4 1316 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-3491123553 [0,0,0,0,0,1|2,0,1]=4 1317 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-4917004131 [0,0,0,0,0,1|2,0,1]=4 1318 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-9751191377 [0,0,0,0,0,1|2,0,1]=4 1319 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-1906257031 [0,0,0,0,0,1|2,0,1]=4 1320 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-5676550364 [0,0,0,0,0,1|2,0,1]=4 1321 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-8752852377 [0,0,0,0,0,1|2,0,1]=4 1322 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-9926372034 [0,0,0,0,0,1|2,0,1]=4 1323 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-5502640895 [0,0,0,0,0,1|2,0,1]=4 1324 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-5602246196 [0,0,0,0,0,1|2,0,1]=4 1325 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-6522397846 [0,0,0,0,0,1|2,0,1]=4 1326 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-8594791252 [0,0,0,0,0,1|2,0,1]=4 1327 B9R0.53 CC(CC(=O)N)CC(=O)N MCULE-8411499627 [0,0,0,0,0,1|2,0,0]=3 1328 B9R0.53 CC(CC(=O)O)CC(=O)O MCULE-7399673381 [0,0,0,0,0,1|2,0,0]=3 1329 B9R0.53 CC(CC(=O)O)NC(=O)N MCULE-2917505998 [0,0,0,0,0,1|2,0,0]=3 1330 B9R0.53 CN(CC(=O)O)CC(=O)O MCULE-6535937676 [0,0,0,0,0,1|3,0,0]=4 1331 B9R0.53 CN(CC(=O)O)CC(=O)O MCULE-9119313390 [0,0,0,0,0,1|3,0,0]=4 1332 B9R0.53 NC(CC(=O)O)CC(=O)O MCULE-4205352281 [0,0,0,0,0,1|1,0,0]=2 1333 B9R0.53 NC(CC(=O)O)CC(=O)O MCULE-5754399431 [0,0,0,0,0,1|1,0,0]=2 1334 B9R0.53 NN(CC(=O)O)CC(=O)O MCULE-6707699178 [0,0,0,0,0,1|2,0,0]=3 1335 B9R0.53 O=C(O)C=C(Cl)CC(=O)O MCULE-4643738898 [0,0,0,0,0,1|2,0,1]=4 1336 B9R0.53 O=C(O)CC(=O)CC(=O)O MCULE-7760127170 [0,0,0,0,0,1|2,0,1]=4 1337 B9R0.53 O=C(O)CC(O)CC(=O)O MCULE-7670149511 [0,0,0,0,0,1|2,0,0]=3 1338 B9R0.53 O=C(O)CS(=O)CC(=O)O MCULE-8117628584 [0,0,0,0,0,1|3,0,0]=4 1339 B6R0.1 C=CCC(C)C=O MCULE-3981206051 [2,0,0,0,0,0|2,0,0]=4 1340 B6R0.1 C=CCC(N)CO MCULE-3854217705 [2,0,0,0,0,0|1,0,1]=4 1341 B6R0.1 C=CCC(N)CO MCULE-6104194102 [2,0,0,0,0,0|1,0,1]=4 1342 B6R0.1 C=CCC(N)CO MCULE-6473126335 [2,0,0,0,0,0|1,0,1]=4 1343 B6R0.1 C=CCC(N)CO MCULE-8430673873 [2,0,0,0,0,0|1,0,1]=4 1344 B6R0.1 C=CC[C@@H](N)CO MCULE-1869015815 [2,0,0,0,0,0|1,0,1]=4 1345 B6R0.1 C=CC[C@@H](N)CO MCULE-2792980070 [2,0,0,0,0,0|1,0,1]=4 1346 B6R0.1 C=CC[C@@H](N)CO MCULE-3168704187 [2,0,0,0,0,0|1,0,1]=4 1347 B6R0.1 C=CC[C@@H](N)CO MCULE-4796522209 [2,0,0,0,0,0|1,0,1]=4 1348 B6R0.1 C=CC[C@H](C)C=O MCULE-6968117309 [2,0,0,0,0,0|2,0,0]=4 1349 B6R0.1 C=CC[C@H](N)CO MCULE-2427943513 [2,0,0,0,0,0|1,0,1]=4 1350 B6R0.1 C=CC[C@H](N)CO MCULE-4244461120 [2,0,0,0,0,0|1,0,1]=4 1351 B6R0.1 C=CC[C@H](N)CO MCULE-6760610212 [2,0,0,0,0,0|1,0,1]=4 1352 B6R0.1 C=CC[C@H](N)CO MCULE-7914934929 [2,0,0,0,0,0|1,0,1]=4 1353 B6R0.2 CC(=O)CC(=O)N MCULE-1618058771 [2,0,0,0,0,0|1,0,1]=4 1354 B6R0.2 CC(=O)CC(C)N MCULE-1028280795 [2,0,0,0,0,0|1,0,1]=4 1355 B6R0.2 CC(=O)CC(C)N MCULE-7911343070 [2,0,0,0,0,0|1,0,1]=4 1356 B6R0.2 CC(=O)CC(C)O MCULE-5175367575 [2,0,0,0,0,0|2,0,0]=4 1357 B6R0.2 CC(=O)C[C@@H](C)N MCULE-1260669737 [2,0,0,0,0,0|1,0,1]=4 1358 B6R0.2 CC(=O)C[C@@H](C)N MCULE-6556661125 [2,0,0,0,0,0|1,0,1]=4 1359 B6R0.2 CC(C)CC(=O)N MCULE-7790849976 [2,0,0,0,0,0|1,0,1]=4 1360 B6R0.2 CC(N)CC(=O)N MCULE-8604112274 [2,0,0,0,0,0|0,0,1]=3 1361 B6R0.2 CC(N)CC(=O)N MCULE-8651032460 [2,0,0,0,0,0|0,0,1]=3 1362 B6R0.2 CC(N)CC(=O)O MCULE-2960589915 [2,0,0,0,0,0|1,0,1]=4 1363 B6R0.2 CC(N)CC(=O)O MCULE-5772407106 [2,0,0,0,0,0|1,0,1]=4 1364 B6R0.2 CC(N)CC(=O)O MCULE-7818257350 [2,0,0,0,0,0|1,0,1]=4 1365 B6R0.2 CC(N)CC(=O)O MCULE-7847644131 [2,0,0,0,0,0|1,0,1]=4 1366 B6R0.2 CC(O)CC(=O)N MCULE-7442557911 [2,0,0,0,0,0|1,0,0]=3 1367 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [2,0,0,0,0,0|2,0,0]=4 1368 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [2,0,0,0,0,0|2,0,0]=4 1369 B6R0.2 CC(O)CC(=O)[O-] MCULE-1109368801 [2,0,0,0,0,0|2,0,0]=4 1370 B6R0.2 CC(O)CC(=O)[O-] MCULE-5681138302 [2,0,0,0,0,0|2,0,0]=4 1371 B6R0.2 C[C@@H](N)CC(=O)O MCULE-2652696372 [2,0,0,0,0,0|1,0,1]=4 1372 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7054489636 [2,0,0,0,0,0|1,0,1]=4 1373 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7621851215 [2,0,0,0,0,0|1,0,1]=4 1374 B6R0.2 C[C@@H](N)CC(=O)O MCULE-8671397640 [2,0,0,0,0,0|1,0,1]=4 1375 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [2,0,0,0,0,0|2,0,0]=4 1376 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [2,0,0,0,0,0|2,0,0]=4 1377 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7081161048 [2,0,0,0,0,0|2,0,0]=4 1378 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7886150665 [2,0,0,0,0,0|2,0,0]=4 1379 B6R0.2 C[C@H](N)CC(=O)O MCULE-2656839691 [2,0,0,0,0,0|1,0,1]=4 1380 B6R0.2 C[C@H](N)CC(=O)O MCULE-4695512293 [2,0,0,0,0,0|1,0,1]=4 1381 B6R0.2 C[C@H](N)CC(=O)O MCULE-5288044169 [2,0,0,0,0,0|1,0,1]=4 1382 B6R0.2 C[C@H](N)CC(=O)O MCULE-6641912058 [2,0,0,0,0,0|1,0,1]=4 1383 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [2,0,0,0,0,0|2,0,0]=4 1384 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [2,0,0,0,0,0|2,0,0]=4 1385 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-3624690550 [2,0,0,0,0,0|2,0,0]=4 1386 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-5550257128 [2,0,0,0,0,0|2,0,0]=4 1387 B6R0.2 N=C(N)CC(=O)N MCULE-9200673939 [2,0,0,0,0,0|1,0,1]=4 1388 B6R0.2 NC(=O)CC(=O)N MCULE-7675159766 [2,0,0,0,0,0|0,0,1]=3 1389 B6R0.2 NC(=O)CC(=O)O MCULE-1168254626 [2,0,0,0,0,0|1,0,1]=4 1390 B6R0.2 NC(=O)CC(=S)N MCULE-9383188328 [2,0,0,0,0,0|0,1,1]=4 1391 B6R0.2 NC(=O)CN(=O)=O MCULE-2051107739 [2,0,0,0,0,0|2,0,0]=4 1392 B6R0.2 NC(=O)CN(=O)=O MCULE-6284821429 [2,0,0,0,0,0|2,0,0]=4 1393 B6R0.2 NC(=O)NC(=O)N MCULE-4571627886 [2,0,0,0,0,0|1,0,1]=4 1394 B6R0.2 NC(F)CC(=O)O MCULE-1563194776 [2,0,0,0,0,0|2,0,0]=4 1395 B6R0.2 NC(F)CC(=O)O MCULE-1655564430 [2,0,0,0,0,0|2,0,0]=4 1396 B6R0.4 C#CCCC(=O)N MCULE-4490482235 [2,0,0,0,0,0|1,0,1]=4 1397 B6R0.4 C#CCCC(=O)O MCULE-6669146060 [2,0,0,0,0,0|1,0,1]=4 1398 B6R0.4 C/C=C/CC(=O)N MCULE-1942934157 [2,0,0,0,0,0|1,0,1]=4 1399 B6R0.4 C/C=C/CC(=O)O MCULE-4626577048 [2,0,0,0,0,0|1,0,1]=4 1400 B6R0.4 C=CCCC(=N)N MCULE-6900789687 [2,0,0,0,0,0|2,0,0]=4 1401 B6R0.4 C=CCCC(=N)N MCULE-8560021860 [2,0,0,0,0,0|2,0,0]=4 1402 B6R0.4 C=CCCC(=O)C MCULE-9598399930 [2,0,0,0,0,0|2,0,0]=4 1403 B6R0.4 C=CCCC(=O)Cl MCULE-7378353157 [2,0,0,0,0,0|2,0,0]=4 1404 B6R0.4 C=CCCC(=O)N MCULE-7202462484 [2,0,0,0,0,0|1,0,0]=3 1405 B6R0.4 C=CCCC(=O)O MCULE-6221951425 [2,0,0,0,0,0|1,0,0]=3 1406 B6R0.4 C=CCNC(=O)N MCULE-1210131291 [2,0,0,0,0,0|2,0,0]=4 1407 B6R0.4 C=CCOC(=O)N MCULE-4119124558 [2,0,0,0,0,0|2,0,0]=4 1408 B6R0.4 C=CNCC(=O)O MCULE-5142273921 [2,0,0,0,0,0|2,0,0]=4 1409 B6R0.4 CC(=O)CCC=O MCULE-4767690464 [2,0,0,0,0,0|1,0,0]=3 1410 B6R0.4 CC(=O)CCCO MCULE-1335342150 [2,0,0,0,0,0|1,0,1]=4 1411 B6R0.4 CC=CCC(=O)O MCULE-9174714653 [2,0,0,0,0,0|1,0,1]=4 1412 B6R0.4 CCCCC(=O)N MCULE-6419483436 [2,0,0,0,0,0|1,0,1]=4 1413 B6R0.4 CCCCC(=O)O MCULE-2333640078 [2,0,0,0,0,0|1,0,1]=4 1414 B6R0.4 CNCCC(=O)N MCULE-1118876220 [2,0,0,0,0,0|2,0,0]=4 1415 B6R0.4 CNCCC(=O)N MCULE-6679713144 [2,0,0,0,0,0|2,0,0]=4 1416 B6R0.4 CNCCC(=O)O MCULE-3627988097 [2,0,0,0,0,0|2,0,0]=4 1417 B6R0.4 CNCCC(=O)O MCULE-9858204248 [2,0,0,0,0,0|2,0,0]=4 1418 B6R0.4 COCCC(=O)N MCULE-7556483675 [2,0,0,0,0,0|2,0,0]=4 1419 B6R0.4 COCCC(=O)O MCULE-3436347115 [2,0,0,0,0,0|2,0,0]=4 1420 B6R0.4 CSCCC(=O)N MCULE-7105035733 [2,0,0,0,0,0|2,0,0]=4 1421 B6R0.4 CSCCC(=O)O MCULE-9550032941 [2,0,0,0,0,0|2,0,0]=4 1422 B6R0.4 N#CCCC(=O)O MCULE-3165189228 [2,0,0,0,0,0|0,0,2]=4 1423 B6R0.4 NC(=O)CCCCl MCULE-2774705212 [2,0,0,0,0,0|1,0,1]=4 1424 B6R0.4 NC(=O)CCCO MCULE-3779341561 [2,0,0,0,0,0|0,0,1]=3 1425 B6R0.4 NC(=O)NCCO MCULE-2353513655 [2,0,0,0,0,0|1,0,1]=4 1426 B6R0.4 NC(=O)OCCO MCULE-7565460845 [2,0,0,0,0,0|1,0,1]=4 1427 B6R0.4 NC(=S)CCCO MCULE-8951145487 [2,0,0,0,0,0|0,1,1]=4 1428 B6R0.4 NCCCC(=O)Cl MCULE-1312882775 [2,0,0,0,0,0|1,0,1]=4 1429 B6R0.4 NCCCC(=O)Cl MCULE-6405362906 [2,0,0,0,0,0|1,0,1]=4 1430 B6R0.4 NCCCC(=O)N MCULE-8039142092 [2,0,0,0,0,0|1,0,1]=4 1431 B6R0.4 NCCCC(=O)N MCULE-8262250872 [2,0,0,0,0,0|1,0,1]=4 1432 B6R0.4 NCCCC(=O)O MCULE-3615304273 [2,0,0,0,0,0|0,0,1]=3 1433 B6R0.4 NCCCC(=O)O MCULE-7613134021 [2,0,0,0,0,0|0,0,1]=3 1434 B6R0.4 NOCCC(=O)O MCULE-1529492904 [2,0,0,0,0,0|1,0,0]=3 1435 B6R0.4 NOCCC(=O)O MCULE-6297331357 [2,0,0,0,0,0|1,0,0]=3 1436 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [2,0,0,0,0,0|1,0,1]=4 1437 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [2,0,0,0,0,0|1,0,1]=4 1438 B6R0.4 O=C(O)CCCF MCULE-2415675768 [2,0,0,0,0,0|1,0,1]=4 1439 B6R0.4 O=C(O)CCCI MCULE-7794841553 [2,0,0,0,0,0|1,0,1]=4 1440 B6R0.4 O=C(O)CCCS MCULE-3352840152 [2,0,0,0,0,0|0,1,1]=4 1441 B6R0.4 O=CCCC(=O)O MCULE-7183864722 [2,0,0,0,0,0|0,0,0]=2 1442 B6R0.4 O=CCCN(=O)=O MCULE-3692892497 [2,0,0,0,0,0|1,0,1]=4 1443 B6R0.4 O=CNCC(=O)O MCULE-3251128290 [2,0,0,0,0,0|1,0,0]=3 1444 B6R0.3 C(N)(CO)C(=O)N MCULE-5512645571 [2,0,0,0,0,0|1,0,1]=4 1445 B6R0.3 C(N)(CO)C(=O)N MCULE-5852943337 [2,0,0,0,0,0|1,0,1]=4 1446 B6R0.3 C=CC(C)C(=O)O MCULE-7280145889 [2,0,0,0,0,0|1,0,1]=4 1447 B6R0.3 C=CC(N)C(=O)O MCULE-2000511750 [2,0,0,0,0,0|0,0,1]=3 1448 B6R0.3 C=CC(N)C(=O)O MCULE-7504415267 [2,0,0,0,0,0|0,0,1]=3 1449 B6R0.3 C=CC(N)C(=O)O MCULE-9012490000 [2,0,0,0,0,0|0,0,1]=3 1450 B6R0.3 C=CC(N)C(=O)O MCULE-9978294266 [2,0,0,0,0,0|0,0,1]=3 1451 B6R0.3 C=CC(O)C(=O)O MCULE-3847595710 [2,0,0,0,0,0|1,0,1]=4 1452 B6R0.3 C=C[C@@H](C)C(=O)O MCULE-9719548038 [2,0,0,0,0,0|1,0,1]=4 1453 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-3678761806 [2,0,0,0,0,0|0,0,1]=3 1454 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6682447306 [2,0,0,0,0,0|0,0,1]=3 1455 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6779191781 [2,0,0,0,0,0|0,0,1]=3 1456 B6R0.3 C=C[C@H](C)C(=O)O MCULE-1694697840 [2,0,0,0,0,0|1,0,1]=4 1457 B6R0.3 C=C[C@H](C)C(=O)O MCULE-2601438258 [2,0,0,0,0,0|1,0,1]=4 1458 B6R0.3 C=C[C@H](C)C(=O)O MCULE-6098133430 [2,0,0,0,0,0|1,0,1]=4 1459 B6R0.3 C=C[C@H](N)C(=O)O MCULE-2657488498 [2,0,0,0,0,0|0,0,1]=3 1460 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5103456570 [2,0,0,0,0,0|0,0,1]=3 1461 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5936124947 [2,0,0,0,0,0|0,0,1]=3 1462 B6R0.3 C=C[C@H](N)C(=O)O MCULE-9631686254 [2,0,0,0,0,0|0,0,1]=3 1463 B6R0.3 CC(=O)C(Br)C=O MCULE-6904531970 [2,0,0,0,0,0|2,0,0]=4 1464 B6R0.3 CC(=O)C(C)C=O MCULE-7133682970 [2,0,0,0,0,0|2,0,0]=4 1465 B6R0.3 CC(=O)C(N)CO MCULE-4063057020 [2,0,0,0,0,0|1,0,1]=4 1466 B6R0.3 CC(=O)[C@@H](N)CO MCULE-9046372356 [2,0,0,0,0,0|1,0,1]=4 1467 B6R0.3 CC(CBr)C(=O)O MCULE-1430003780 [2,0,0,0,0,0|2,0,0]=4 1468 B6R0.3 CC(CF)C(=O)O MCULE-7390028409 [2,0,0,0,0,0|2,0,0]=4 1469 B6R0.3 CC(CN)C(=O)O MCULE-5485986433 [2,0,0,0,0,0|1,0,0]=3 1470 B6R0.3 CC(CN)C(=O)O MCULE-5638884438 [2,0,0,0,0,0|1,0,0]=3 1471 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [2,0,0,0,0,0|1,0,1]=4 1472 B6R0.3 CC(CS)C(=O)O MCULE-9982386135 [2,0,0,0,0,0|1,1,0]=4 1473 B6R0.3 CC(O)C(N)CN MCULE-2787573482 [2,0,0,0,0,0|1,0,1]=4 1474 B6R0.3 CC(O)C(N)CN MCULE-5330950433 [2,0,0,0,0,0|1,0,1]=4 1475 B6R0.3 CC(ON)C(=O)O MCULE-1969235976 [2,0,0,0,0,0|2,0,0]=4 1476 B6R0.3 CC(ON)C(=O)O MCULE-4318537884 [2,0,0,0,0,0|2,0,0]=4 1477 B6R0.3 CC(ON)C(=O)O MCULE-4455753863 [2,0,0,0,0,0|2,0,0]=4 1478 B6R0.3 CC(ON)C(=O)O MCULE-8893009712 [2,0,0,0,0,0|2,0,0]=4 1479 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [2,0,0,0,0,0|1,0,1]=4 1480 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [2,0,0,0,0,0|1,0,1]=4 1481 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [2,0,0,0,0,0|1,0,1]=4 1482 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [2,0,0,0,0,0|1,0,1]=4 1483 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [2,0,0,0,0,0|1,0,1]=4 1484 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [2,0,0,0,0,0|1,0,1]=4 1485 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [2,0,0,0,0,0|1,0,1]=4 1486 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [2,0,0,0,0,0|1,0,1]=4 1487 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [2,0,0,0,0,0|1,0,1]=4 1488 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [2,0,0,0,0,0|0,0,1]=3 1489 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [2,0,0,0,0,0|0,0,1]=3 1490 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [2,0,0,0,0,0|0,0,1]=3 1491 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [2,0,0,0,0,0|0,0,1]=3 1492 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [2,0,0,0,0,0|1,0,1]=4 1493 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [2,0,0,0,0,0|1,0,1]=4 1494 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [2,0,0,0,0,0|1,0,1]=4 1495 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [2,0,0,0,0,0|1,0,1]=4 1496 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [2,0,0,0,0,0|1,0,1]=4 1497 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [2,0,0,0,0,0|1,0,1]=4 1498 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [2,0,0,0,0,0|1,0,1]=4 1499 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [2,0,0,0,0,0|1,0,1]=4 1500 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [2,0,0,0,0,0|1,0,1]=4 1501 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [2,0,0,0,0,0|1,0,1]=4 1502 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [2,0,0,0,0,0|1,0,1]=4 1503 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [2,0,0,0,0,0|1,0,1]=4 1504 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [2,0,0,0,0,0|1,0,1]=4 1505 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [2,0,0,0,0,0|0,0,1]=3 1506 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [2,0,0,0,0,0|0,0,1]=3 1507 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [2,0,0,0,0,0|0,0,1]=3 1508 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [2,0,0,0,0,0|0,0,1]=3 1509 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [2,0,0,0,0,0|1,0,1]=4 1510 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [2,0,0,0,0,0|1,0,1]=4 1511 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [2,0,0,0,0,0|1,0,1]=4 1512 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [2,0,0,0,0,0|1,0,1]=4 1513 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [2,0,0,0,0,0|1,0,1]=4 1514 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [2,0,0,0,0,0|1,0,1]=4 1515 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [2,0,0,0,0,0|1,0,1]=4 1516 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [2,0,0,0,0,0|1,0,1]=4 1517 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [2,0,0,0,0,0|1,0,1]=4 1518 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [2,0,0,0,0,0|1,0,1]=4 1519 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [2,0,0,0,0,0|1,0,1]=4 1520 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [2,0,0,0,0,0|0,0,1]=3 1521 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [2,0,0,0,0,0|0,0,1]=3 1522 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [2,0,0,0,0,0|0,0,1]=3 1523 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [2,0,0,0,0,0|0,0,1]=3 1524 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-2161876558 [2,0,0,0,0,0|0,1,1]=4 1525 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-6045953433 [2,0,0,0,0,0|0,1,1]=4 1526 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [2,0,0,0,0,0|1,0,1]=4 1527 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [2,0,0,0,0,0|1,0,1]=4 1528 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4438181090 [2,0,0,0,0,0|1,0,0]=3 1529 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4599481344 [2,0,0,0,0,0|1,0,0]=3 1530 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5826933618 [2,0,0,0,0,0|1,0,0]=3 1531 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5914856504 [2,0,0,0,0,0|1,0,0]=3 1532 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [2,0,0,0,0,0|1,0,1]=4 1533 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [2,0,0,0,0,0|1,0,1]=4 1534 B6R0.3 C[C@@H](ON)C(=O)O MCULE-1538722507 [2,0,0,0,0,0|2,0,0]=4 1535 B6R0.3 C[C@@H](ON)C(=O)O MCULE-3835402446 [2,0,0,0,0,0|2,0,0]=4 1536 B6R0.3 C[C@H](CN)C(=O)O MCULE-3703540023 [2,0,0,0,0,0|1,0,0]=3 1537 B6R0.3 C[C@H](CN)C(=O)O MCULE-5714771083 [2,0,0,0,0,0|1,0,0]=3 1538 B6R0.3 C[C@H](CN)C(=O)O MCULE-9009901306 [2,0,0,0,0,0|1,0,0]=3 1539 B6R0.3 C[C@H](CN)C(=O)O MCULE-9217365463 [2,0,0,0,0,0|1,0,0]=3 1540 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [2,0,0,0,0,0|1,0,1]=4 1541 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [2,0,0,0,0,0|1,0,1]=4 1542 B6R0.3 C[C@H](ON)C(=O)O MCULE-3327889540 [2,0,0,0,0,0|2,0,0]=4 1543 B6R0.3 C[C@H](ON)C(=O)O MCULE-4523264650 [2,0,0,0,0,0|2,0,0]=4 1544 B6R0.3 NC(=O)C(N)CO MCULE-4842751232 [2,0,0,0,0,0|1,0,1]=4 1545 B6R0.3 NC(=O)C(N)CO MCULE-6854366147 [2,0,0,0,0,0|1,0,1]=4 1546 B6R0.3 NC(=O)C(N)CS MCULE-3144051628 [2,0,0,0,0,0|1,1,0]=4 1547 B6R0.3 NC(=O)C(N)CS MCULE-7739536595 [2,0,0,0,0,0|1,1,0]=4 1548 B6R0.3 NC(=O)[C@@H](N)CO MCULE-2185844038 [2,0,0,0,0,0|1,0,1]=4 1549 B6R0.3 NC(=O)[C@@H](N)CO MCULE-3623516041 [2,0,0,0,0,0|1,0,1]=4 1550 B6R0.3 NC(=O)[C@@H](N)CO MCULE-6218638108 [2,0,0,0,0,0|1,0,1]=4 1551 B6R0.3 NC(=O)[C@@H](N)CS MCULE-9790378691 [2,0,0,0,0,0|1,1,0]=4 1552 B6R0.3 NC(=O)[C@H](N)CO MCULE-2061645482 [2,0,0,0,0,0|1,0,1]=4 1553 B6R0.3 NC(=O)[C@H](N)CO MCULE-5920366137 [2,0,0,0,0,0|1,0,1]=4 1554 B6R0.3 NC(=O)[C@H](N)CO MCULE-7612340519 [2,0,0,0,0,0|1,0,1]=4 1555 B6R0.3 NC(=O)[C@H](N)CO MCULE-7734326153 [2,0,0,0,0,0|1,0,1]=4 1556 B6R0.3 NC(CCl)C(=O)O MCULE-1601405489 [2,0,0,0,0,0|1,0,0]=3 1557 B6R0.3 NC(CCl)C(=O)O MCULE-3020306643 [2,0,0,0,0,0|1,0,0]=3 1558 B6R0.3 NC(CCl)C(=O)O MCULE-5440349631 [2,0,0,0,0,0|1,0,0]=3 1559 B6R0.3 NC(CF)C(=O)O MCULE-3274339636 [2,0,0,0,0,0|1,0,0]=3 1560 B6R0.3 NC(CO)C(=O)O MCULE-2425237422 [2,0,0,0,0,0|0,0,1]=3 1561 B6R0.3 NC(CO)C(=O)O MCULE-6460387318 [2,0,0,0,0,0|0,0,1]=3 1562 B6R0.3 NC(CS)C(=O)O MCULE-1666411258 [2,0,0,0,0,0|0,1,0]=3 1563 B6R0.3 NC(CS)C(=O)O MCULE-2938329352 [2,0,0,0,0,0|0,1,0]=3 1564 B6R0.3 NC(CS)C(=O)O MCULE-7203902929 [2,0,0,0,0,0|0,1,0]=3 1565 B6R0.3 NC(CS)C(=O)O MCULE-7790846545 [2,0,0,0,0,0|0,1,0]=3 1566 B6R0.3 NCC(Br)C(=O)O MCULE-2289205408 [2,0,0,0,0,0|1,0,0]=3 1567 B6R0.3 NCC(Br)C(=O)O MCULE-9361399143 [2,0,0,0,0,0|1,0,0]=3 1568 B6R0.3 NCC(F)C(=O)O MCULE-5666887061 [2,0,0,0,0,0|1,0,0]=3 1569 B6R0.3 NCC(F)C(=O)O MCULE-6134707533 [2,0,0,0,0,0|1,0,0]=3 1570 B6R0.3 NCC(N)C(=O)O MCULE-1867799207 [2,0,0,0,0,0|0,0,0]=2 1571 B6R0.3 NCC(N)C(=O)O MCULE-4853376364 [2,0,0,0,0,0|0,0,0]=2 1572 B6R0.3 NCC(N)C(=O)O MCULE-7636331821 [2,0,0,0,0,0|0,0,0]=2 1573 B6R0.3 NCC(N)C(=O)O MCULE-7735444546 [2,0,0,0,0,0|0,0,0]=2 1574 B6R0.3 NCC(N)C(=O)O MCULE-9197553017 [2,0,0,0,0,0|0,0,0]=2 1575 B6R0.3 NCC(O)C(=O)N MCULE-1543465850 [2,0,0,0,0,0|2,0,0]=4 1576 B6R0.3 NCC(O)C(=O)N MCULE-9574499203 [2,0,0,0,0,0|2,0,0]=4 1577 B6R0.3 NCC(O)C(=O)O MCULE-2137675488 [2,0,0,0,0,0|1,0,0]=3 1578 B6R0.3 NCC(O)C(=O)O MCULE-3348306437 [2,0,0,0,0,0|1,0,0]=3 1579 B6R0.3 NC[C@@H](F)C(=O)O MCULE-3544959183 [2,0,0,0,0,0|1,0,0]=3 1580 B6R0.3 NC[C@@H](F)C(=O)O MCULE-4122418685 [2,0,0,0,0,0|1,0,0]=3 1581 B6R0.3 NC[C@@H](F)C(=O)O MCULE-8592364466 [2,0,0,0,0,0|1,0,0]=3 1582 B6R0.3 NC[C@@H](F)C(=O)O MCULE-9106826144 [2,0,0,0,0,0|1,0,0]=3 1583 B6R0.3 NC[C@@H](N)C(=O)O MCULE-5363126654 [2,0,0,0,0,0|0,0,0]=2 1584 B6R0.3 NC[C@@H](N)C(=O)O MCULE-8998345978 [2,0,0,0,0,0|0,0,0]=2 1585 B6R0.3 NC[C@@H](N)C(=O)O MCULE-9125384126 [2,0,0,0,0,0|0,0,0]=2 1586 B6R0.3 NC[C@@H](O)C(=O)O MCULE-5922773276 [2,0,0,0,0,0|1,0,0]=3 1587 B6R0.3 NC[C@@H](O)C(=O)O MCULE-8921832932 [2,0,0,0,0,0|1,0,0]=3 1588 B6R0.3 NC[C@H](F)C(=O)O MCULE-2695037152 [2,0,0,0,0,0|1,0,0]=3 1589 B6R0.3 NC[C@H](F)C(=O)O MCULE-4323150722 [2,0,0,0,0,0|1,0,0]=3 1590 B6R0.3 NC[C@H](F)C(=O)O MCULE-6701791437 [2,0,0,0,0,0|1,0,0]=3 1591 B6R0.3 NC[C@H](F)C(=O)O MCULE-7674783008 [2,0,0,0,0,0|1,0,0]=3 1592 B6R0.3 NC[C@H](N)C(=O)O MCULE-1389567062 [2,0,0,0,0,0|0,0,0]=2 1593 B6R0.3 NC[C@H](N)C(=O)O MCULE-1833064192 [2,0,0,0,0,0|0,0,0]=2 1594 B6R0.3 NC[C@H](N)C(=O)O MCULE-2347369254 [2,0,0,0,0,0|0,0,0]=2 1595 B6R0.3 NC[C@H](N)C(=O)O MCULE-2781423323 [2,0,0,0,0,0|0,0,0]=2 1596 B6R0.3 NC[C@H](N)C(=O)O MCULE-6498458695 [2,0,0,0,0,0|0,0,0]=2 1597 B6R0.3 NC[C@H](N)C(=O)O MCULE-8313668715 [2,0,0,0,0,0|0,0,0]=2 1598 B6R0.3 NC[C@H](O)C(=O)O MCULE-5854124012 [2,0,0,0,0,0|1,0,0]=3 1599 B6R0.3 NC[C@H](O)C(=O)O MCULE-7536593166 [2,0,0,0,0,0|1,0,0]=3 1600 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-2896868744 [2,0,0,0,0,0|1,0,0]=3 1601 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-5799339909 [2,0,0,0,0,0|1,0,0]=3 1602 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-7445121230 [2,0,0,0,0,0|1,0,0]=3 1603 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-9137000163 [2,0,0,0,0,0|1,0,0]=3 1604 B6R0.3 N[C@@H](CO)C(=O)O MCULE-4580794842 [2,0,0,0,0,0|0,0,1]=3 1605 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5604658333 [2,0,0,0,0,0|0,0,1]=3 1606 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5884286841 [2,0,0,0,0,0|0,0,1]=3 1607 B6R0.3 N[C@@H](CO)C(=O)O MCULE-6118038121 [2,0,0,0,0,0|0,0,1]=3 1608 B6R0.3 N[C@@H](CS)C(=O)O MCULE-1896679526 [2,0,0,0,0,0|0,1,0]=3 1609 B6R0.3 N[C@@H](CS)C(=O)O MCULE-2206038012 [2,0,0,0,0,0|0,1,0]=3 1610 B6R0.3 N[C@@H](CS)C(=O)O MCULE-6337217524 [2,0,0,0,0,0|0,1,0]=3 1611 B6R0.3 N[C@@H](CS)C(=O)O MCULE-9685479191 [2,0,0,0,0,0|0,1,0]=3 1612 B6R0.3 N[C@H](CCl)C(=O)O MCULE-2647266636 [2,0,0,0,0,0|1,0,0]=3 1613 B6R0.3 N[C@H](CCl)C(=O)O MCULE-7797369596 [2,0,0,0,0,0|1,0,0]=3 1614 B6R0.3 N[C@H](CCl)C(=O)O MCULE-8133148482 [2,0,0,0,0,0|1,0,0]=3 1615 B6R0.3 N[C@H](CCl)C(=O)O MCULE-9324545858 [2,0,0,0,0,0|1,0,0]=3 1616 B6R0.3 N[C@H](CF)C(=O)O MCULE-4766495272 [2,0,0,0,0,0|1,0,0]=3 1617 B6R0.3 N[C@H](CF)C(=O)O MCULE-7679315401 [2,0,0,0,0,0|1,0,0]=3 1618 B6R0.3 N[C@H](CO)C(=O)O MCULE-3271603208 [2,0,0,0,0,0|0,0,1]=3 1619 B6R0.3 N[C@H](CO)C(=O)O MCULE-8560981570 [2,0,0,0,0,0|0,0,1]=3 1620 B6R0.3 N[C@H](CS)C(=O)O MCULE-2137827959 [2,0,0,0,0,0|0,1,0]=3 1621 B6R0.3 N[C@H](CS)C(=O)O MCULE-4521387126 [2,0,0,0,0,0|0,1,0]=3 1622 B6R0.3 N[C@H](CS)C(=O)O MCULE-7201506202 [2,0,0,0,0,0|0,1,0]=3 1623 B6R0.3 N[C@H](CS)C(=O)O MCULE-9147562606 [2,0,0,0,0,0|0,1,0]=3 1624 B6R0.3 O=C(O)C(Br)CBr MCULE-9991448725 [2,0,0,0,0,0|2,0,0]=4 1625 B6R0.3 O=C(O)C(Br)CF MCULE-6577995297 [2,0,0,0,0,0|2,0,0]=4 1626 B6R0.3 O=C(O)C(Br)CO MCULE-9060407295 [2,0,0,0,0,0|1,0,1]=4 1627 B6R0.3 O=C(O)C(Cl)CCl MCULE-4757238565 [2,0,0,0,0,0|2,0,0]=4 1628 B6R0.3 O=C(O)C(Cl)CO MCULE-3671026398 [2,0,0,0,0,0|1,0,1]=4 1629 B6R0.3 O=C(O)C(F)CF MCULE-4323199927 [2,0,0,0,0,0|2,0,0]=4 1630 B6R0.3 O=C(O)C(O)CBr MCULE-2600199692 [2,0,0,0,0,0|2,0,0]=4 1631 B6R0.3 O=C(O)C(O)CCl MCULE-6346810624 [2,0,0,0,0,0|2,0,0]=4 1632 B6R0.3 O=C(O)C(O)CO MCULE-3634533503 [2,0,0,0,0,0|1,0,1]=4 1633 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-4486884639 [2,0,0,0,0,0|1,0,1]=4 1634 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-8586594526 [2,0,0,0,0,0|1,0,1]=4 1635 B6R0.3 O=C(O)[C@@H](O)CCl MCULE-4927034524 [2,0,0,0,0,0|2,0,0]=4 1636 B6R0.3 O=C(O)[C@@H](O)CO MCULE-4917119993 [2,0,0,0,0,0|1,0,1]=4 1637 B6R0.3 O=C(O)[C@@H](O)CO MCULE-7996851129 [2,0,0,0,0,0|1,0,1]=4 1638 B6R0.3 O=C(O)[C@H](Br)CO MCULE-3770944978 [2,0,0,0,0,0|1,0,1]=4 1639 B6R0.3 O=C(O)[C@H](Br)CO MCULE-6926119866 [2,0,0,0,0,0|1,0,1]=4 1640 B6R0.3 O=C(O)[C@H](O)CF MCULE-4453713074 [2,0,0,0,0,0|2,0,0]=4 1641 B6R0.3 [C@@H](N)(C=C)C(=O)O MCULE-9406839633 [2,0,0,0,0,0|0,0,1]=3 1642 B6R0.3 [C@@H](N)(CN)C(=O)O MCULE-2844054083 [2,0,0,0,0,0|0,0,0]=2 1643 B6R0.3 [C@H](N)(CO)C(=O)N MCULE-2792784400 [2,0,0,0,0,0|1,0,1]=4 1644 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [2,0,0,0,0,0|1,0,1]=4 1645 B6R0.3 [SeH]C[C@H](N)C(=O)O MCULE-8205075370 [2,0,0,0,0,0|0,1,0]=3 1646 B8R0.5 C=CCC(N)CC(=O)O MCULE-1468461223 [1,1,0,0,0,0|2,0,0]=4 1647 B8R0.5 C=CCC(N)CC(=O)O MCULE-3288937491 [1,1,0,0,0,0|2,0,0]=4 1648 B8R0.5 C=CCC(N)CC(=O)O MCULE-4022730599 [1,1,0,0,0,0|2,0,0]=4 1649 B8R0.5 C=CCC(N)CC(=O)O MCULE-5843795649 [1,1,0,0,0,0|2,0,0]=4 1650 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-4754294062 [1,1,0,0,0,0|2,0,0]=4 1651 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-7831408077 [1,1,0,0,0,0|2,0,0]=4 1652 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-8503288377 [1,1,0,0,0,0|2,0,0]=4 1653 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-9398972010 [1,1,0,0,0,0|2,0,0]=4 1654 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-1784444892 [1,1,0,0,0,0|2,0,0]=4 1655 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-3247296447 [1,1,0,0,0,0|2,0,0]=4 1656 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-5484030094 [1,1,0,0,0,0|2,0,0]=4 1657 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-8982980423 [1,1,0,0,0,0|2,0,0]=4 1658 B8R0.16 NCC(CO)CC(=O)O MCULE-2939268634 [1,1,0,0,0,0|1,0,1]=4 1659 B8R0.19 COC(=O)CC(C)C=O MCULE-1183479071 [1,1,0,0,0,0|2,0,0]=4 1660 B8R0.19 COC(=O)CC(N)CO MCULE-4803123890 [1,1,0,0,0,0|1,0,1]=4 1661 B8R0.19 COC(=O)CC(N)CO MCULE-5372024399 [1,1,0,0,0,0|1,0,1]=4 1662 B8R0.34 C=CC(C)(N)CC(=O)O MCULE-6219975516 [1,1,0,0,0,0|2,0,0]=4 1663 B8R0.34 C=CC(C)(N)CC(=O)O MCULE-7181187393 [1,1,0,0,0,0|2,0,0]=4 1664 B8R0.3 C#CCC(N)C(=O)OC MCULE-2178950640 [1,1,0,0,0,0|1,0,1]=4 1665 B8R0.3 C#CCC(N)C(=O)OC MCULE-6758978147 [1,1,0,0,0,0|1,0,1]=4 1666 B8R0.3 C#CC[C@@H](N)C(=O)OC MCULE-1974908886 [1,1,0,0,0,0|1,0,1]=4 1667 B8R0.3 C#CC[C@@H](N)C(=O)OC MCULE-4511622416 [1,1,0,0,0,0|1,0,1]=4 1668 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-1519824425 [1,1,0,0,0,0|1,0,1]=4 1669 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-2744971317 [1,1,0,0,0,0|1,0,1]=4 1670 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-4813964115 [1,1,0,0,0,0|1,0,1]=4 1671 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-6433911913 [1,1,0,0,0,0|1,0,1]=4 1672 B8R0.3 C=CCC(Cl)C(=O)OC MCULE-6530091518 [1,1,0,0,0,0|2,0,0]=4 1673 B8R0.3 C=CCC(N)C(=O)OC MCULE-1390503391 [1,1,0,0,0,0|1,0,0]=3 1674 B8R0.3 C=CCC(N)C(=O)OC MCULE-6527008669 [1,1,0,0,0,0|1,0,0]=3 1675 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1188632168 [1,1,0,0,0,0|1,0,0]=3 1676 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1561172370 [1,1,0,0,0,0|1,0,0]=3 1677 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1592773442 [1,1,0,0,0,0|1,0,0]=3 1678 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-2928833845 [1,1,0,0,0,0|1,0,0]=3 1679 B8R0.3 C=CC[C@@H](O)C(=O)OC MCULE-5528424936 [1,1,0,0,0,0|2,0,0]=4 1680 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-1184647267 [1,1,0,0,0,0|1,0,0]=3 1681 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-6782970786 [1,1,0,0,0,0|1,0,0]=3 1682 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-7213365607 [1,1,0,0,0,0|1,0,0]=3 1683 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-9811834405 [1,1,0,0,0,0|1,0,0]=3 1684 B8R0.3 CCCC(N)C(=O)NO MCULE-2069838283 [1,1,0,0,0,0|1,0,1]=4 1685 B8R0.3 CCCC(N)C(=O)OC MCULE-1453218994 [1,1,0,0,0,0|1,0,1]=4 1686 B8R0.3 CCCC(N)C(=O)OC MCULE-4171872835 [1,1,0,0,0,0|1,0,1]=4 1687 B8R0.3 CCCC(N)C(=O)OC MCULE-4324009425 [1,1,0,0,0,0|1,0,1]=4 1688 B8R0.3 CCCC(N)C(=O)OC MCULE-9533158990 [1,1,0,0,0,0|1,0,1]=4 1689 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-1310673609 [1,1,0,0,0,0|1,0,1]=4 1690 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5850698619 [1,1,0,0,0,0|1,0,1]=4 1691 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5854286766 [1,1,0,0,0,0|1,0,1]=4 1692 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-9793822862 [1,1,0,0,0,0|1,0,1]=4 1693 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-2009036281 [1,1,0,0,0,0|1,0,1]=4 1694 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5609199650 [1,1,0,0,0,0|1,0,1]=4 1695 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5628439347 [1,1,0,0,0,0|1,0,1]=4 1696 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-8724830592 [1,1,0,0,0,0|1,0,1]=4 1697 B8R0.3 CNC[C@H](N)C(=O)OC MCULE-6377659413 [1,1,0,0,0,0|2,0,0]=4 1698 B8R0.3 CNC[C@H](N)C(=O)OC MCULE-9611469994 [1,1,0,0,0,0|2,0,0]=4 1699 B8R0.3 COC(=O)C(C)CCN MCULE-4788413403 [1,1,0,0,0,0|1,0,1]=4 1700 B8R0.3 COC(=O)C(C)CCN MCULE-6075427964 [1,1,0,0,0,0|1,0,1]=4 1701 B8R0.3 COC(=O)C(C)NC=O MCULE-7583002028 [1,1,0,0,0,0|2,0,0]=4 1702 B8R0.3 COC(=O)C(N)CCBr MCULE-5668145888 [1,1,0,0,0,0|1,0,1]=4 1703 B8R0.3 COC(=O)C(N)CCBr MCULE-5831054247 [1,1,0,0,0,0|1,0,1]=4 1704 B8R0.3 COC(=O)C(N)CCF MCULE-3356013030 [1,1,0,0,0,0|1,0,1]=4 1705 B8R0.3 COC(=O)C(N)CCF MCULE-6443244944 [1,1,0,0,0,0|1,0,1]=4 1706 B8R0.3 COC(=O)C(N)CCS MCULE-8178229832 [1,1,0,0,0,0|0,1,1]=4 1707 B8R0.3 COC(=O)C(N)CSC MCULE-6702025743 [1,1,0,0,0,0|2,0,0]=4 1708 B8R0.3 COC(=O)C(N)CSC MCULE-7180641175 [1,1,0,0,0,0|2,0,0]=4 1709 B8R0.3 COC(=O)C(O)CCN MCULE-7139144229 [1,1,0,0,0,0|1,0,1]=4 1710 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-1252477377 [1,1,0,0,0,0|1,0,1]=4 1711 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-6780159971 [1,1,0,0,0,0|1,0,1]=4 1712 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-8129635461 [1,1,0,0,0,0|1,0,1]=4 1713 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-9824385803 [1,1,0,0,0,0|1,0,1]=4 1714 B8R0.3 COC(=O)[C@@H](N)CCN MCULE-5345736899 [1,1,0,0,0,0|0,0,1]=3 1715 B8R0.3 COC(=O)[C@@H](N)CCN MCULE-8434362314 [1,1,0,0,0,0|0,0,1]=3 1716 B8R0.3 COC(=O)[C@@H](N)CCS MCULE-1895611205 [1,1,0,0,0,0|0,1,1]=4 1717 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-2532401863 [1,1,0,0,0,0|2,0,0]=4 1718 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-3321267517 [1,1,0,0,0,0|2,0,0]=4 1719 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-5693942065 [1,1,0,0,0,0|2,0,0]=4 1720 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-7597642447 [1,1,0,0,0,0|2,0,0]=4 1721 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-1204029497 [1,1,0,0,0,0|1,0,1]=4 1722 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-2464186416 [1,1,0,0,0,0|1,0,1]=4 1723 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-4887582087 [1,1,0,0,0,0|1,0,1]=4 1724 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-8785450046 [1,1,0,0,0,0|1,0,1]=4 1725 B8R0.3 COC(=O)[C@H](C)NC=O MCULE-3891029916 [1,1,0,0,0,0|2,0,0]=4 1726 B8R0.3 COC(=O)[C@H](C)NC=O MCULE-5938491065 [1,1,0,0,0,0|2,0,0]=4 1727 B8R0.3 COC(=O)[C@H](N)CCN MCULE-1821826306 [1,1,0,0,0,0|0,0,1]=3 1728 B8R0.3 COC(=O)[C@H](N)CCN MCULE-8161776969 [1,1,0,0,0,0|0,0,1]=3 1729 B8R0.3 COC(=O)[C@H](N)CCO MCULE-1194830786 [1,1,0,0,0,0|0,0,2]=4 1730 B8R0.3 COC(=O)[C@H](N)CCO MCULE-2532522705 [1,1,0,0,0,0|0,0,2]=4 1731 B8R0.3 COC(=O)[C@H](N)CCS MCULE-8558179208 [1,1,0,0,0,0|0,1,1]=4 1732 B8R0.3 COCC(N)C(=O)OC MCULE-1717271658 [1,1,0,0,0,0|2,0,0]=4 1733 B8R0.3 COCC(N)C(=O)OC MCULE-4567479747 [1,1,0,0,0,0|2,0,0]=4 1734 B8R0.3 COCC(N)C(=O)OC MCULE-4859095599 [1,1,0,0,0,0|2,0,0]=4 1735 B8R0.3 COCC(N)C(=O)OC MCULE-8125210840 [1,1,0,0,0,0|2,0,0]=4 1736 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-2867072950 [1,1,0,0,0,0|2,0,0]=4 1737 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-5445193744 [1,1,0,0,0,0|2,0,0]=4 1738 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8505505456 [1,1,0,0,0,0|2,0,0]=4 1739 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8525451378 [1,1,0,0,0,0|2,0,0]=4 1740 B8R0.8 C#CCCC(N)C(=O)O MCULE-2306841483 [1,1,0,0,0,0|1,0,1]=4 1741 B8R0.8 C#CCC[C@@H](N)C(=O)O MCULE-3328230047 [1,1,0,0,0,0|1,0,1]=4 1742 B8R0.8 C#CCC[C@@H](N)C(=O)O MCULE-8588363102 [1,1,0,0,0,0|1,0,1]=4 1743 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-3269292516 [1,1,0,0,0,0|1,0,1]=4 1744 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-6769399323 [1,1,0,0,0,0|1,0,1]=4 1745 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-6930343823 [1,1,0,0,0,0|1,0,1]=4 1746 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-9522590396 [1,1,0,0,0,0|1,0,1]=4 1747 B8R0.8 C=CCCC(C)C(=O)O MCULE-3089071984 [1,1,0,0,0,0|2,0,0]=4 1748 B8R0.8 C=CCCC(N)C(=O)N MCULE-3025865201 [1,1,0,0,0,0|2,0,0]=4 1749 B8R0.8 C=CCCC(N)C(=O)N MCULE-6477490851 [1,1,0,0,0,0|2,0,0]=4 1750 B8R0.8 C=CCCC(N)C(=O)O MCULE-1524160350 [1,1,0,0,0,0|1,0,0]=3 1751 B8R0.8 C=CCCC(N)C(=O)O MCULE-5522822192 [1,1,0,0,0,0|1,0,0]=3 1752 B8R0.8 C=CCCC(N)C(=O)O MCULE-7998584890 [1,1,0,0,0,0|1,0,0]=3 1753 B8R0.8 C=CCC[C@@H](N)C(=O)O MCULE-4571532321 [1,1,0,0,0,0|1,0,0]=3 1754 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-2235047291 [1,1,0,0,0,0|1,0,0]=3 1755 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-4644458098 [1,1,0,0,0,0|1,0,0]=3 1756 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-7821274952 [1,1,0,0,0,0|1,0,0]=3 1757 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-9807212949 [1,1,0,0,0,0|1,0,0]=3 1758 B8R0.8 C=CCOC(C)C(=O)O MCULE-4801958900 [1,1,0,0,0,0|2,0,0]=4 1759 B8R0.8 C=CCSC(C)C(=O)O MCULE-4683246165 [1,1,0,0,0,0|2,0,0]=4 1760 B8R0.8 CC#CCC(N)C(=O)O MCULE-2943446929 [1,1,0,0,0,0|1,0,1]=4 1761 B8R0.8 CC#CCC(N)C(=O)O MCULE-8126081664 [1,1,0,0,0,0|1,0,1]=4 1762 B8R0.8 CC#CC[C@@H](N)C(=O)O MCULE-5156383275 [1,1,0,0,0,0|1,0,1]=4 1763 B8R0.8 CC#CC[C@H](N)C(=O)O MCULE-4618959735 [1,1,0,0,0,0|1,0,1]=4 1764 B8R0.8 CC#CC[C@H](N)C(=O)O MCULE-7818390064 [1,1,0,0,0,0|1,0,1]=4 1765 B8R0.8 CC(OCCN)C(=O)O MCULE-4117277894 [1,1,0,0,0,0|1,0,1]=4 1766 B8R0.8 CC(OCCN)C(=O)O MCULE-6407651037 [1,1,0,0,0,0|1,0,1]=4 1767 B8R0.8 CCCCC(N)C(=O)O MCULE-4930484202 [1,1,0,0,0,0|1,0,1]=4 1768 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-3687527484 [1,1,0,0,0,0|1,0,1]=4 1769 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-9410581572 [1,1,0,0,0,0|1,0,1]=4 1770 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-3656145338 [1,1,0,0,0,0|1,0,1]=4 1771 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-7427914532 [1,1,0,0,0,0|1,0,1]=4 1772 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9199053225 [1,1,0,0,0,0|1,0,1]=4 1773 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9684903914 [1,1,0,0,0,0|1,0,1]=4 1774 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-6351196285 [1,1,0,0,0,0|1,0,1]=4 1775 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-7653589662 [1,1,0,0,0,0|1,0,1]=4 1776 B8R0.8 CCSCC(N)C(=O)O MCULE-9449250733 [1,1,0,0,0,0|1,0,1]=4 1777 B8R0.8 COCCC(N)C(=O)O MCULE-3018605108 [1,1,0,0,0,0|0,0,2]=4 1778 B8R0.8 COCC[C@H](N)C(=O)O MCULE-6748608543 [1,1,0,0,0,0|0,0,2]=4 1779 B8R0.8 COCC[C@H](N)C(=O)O MCULE-8586358852 [1,1,0,0,0,0|0,0,2]=4 1780 B8R0.8 CSCCC(N)C(=O)O MCULE-5626142345 [1,1,0,0,0,0|0,1,1]=4 1781 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-2209985195 [1,1,0,0,0,0|0,1,1]=4 1782 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-9944164883 [1,1,0,0,0,0|0,1,1]=4 1783 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-3383932641 [1,1,0,0,0,0|0,1,1]=4 1784 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-4603455639 [1,1,0,0,0,0|0,1,1]=4 1785 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-7228063662 [1,1,0,0,0,0|0,1,1]=4 1786 B8R0.8 C[Se]CCC(N)C(=O)O MCULE-9212969564 [1,1,0,0,0,0|0,1,1]=4 1787 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5333020269 [1,1,0,0,0,0|0,1,1]=4 1788 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5980340572 [1,1,0,0,0,0|0,1,1]=4 1789 B8R0.8 NC(CCCO)C(=O)O MCULE-5421732564 [1,1,0,0,0,0|0,0,2]=4 1790 B8R0.8 NCCCC(N)C(=O)O MCULE-1970642620 [1,1,0,0,0,0|0,0,1]=3 1791 B8R0.8 NCCCC(N)C(=O)O MCULE-4486209373 [1,1,0,0,0,0|0,0,1]=3 1792 B8R0.8 NCCCC(N)C(=O)O MCULE-8193724048 [1,1,0,0,0,0|0,0,1]=3 1793 B8R0.8 NCCCC(N)C(=O)O MCULE-9223414094 [1,1,0,0,0,0|0,0,1]=3 1794 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-1634156072 [1,1,0,0,0,0|0,0,1]=3 1795 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2602820298 [1,1,0,0,0,0|0,0,1]=3 1796 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2719848774 [1,1,0,0,0,0|0,0,1]=3 1797 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-8413545449 [1,1,0,0,0,0|0,0,1]=3 1798 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2588005079 [1,1,0,0,0,0|0,0,1]=3 1799 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2852667696 [1,1,0,0,0,0|0,0,1]=3 1800 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-3029872280 [1,1,0,0,0,0|0,0,1]=3 1801 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-4242810787 [1,1,0,0,0,0|0,0,1]=3 1802 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-6924538097 [1,1,0,0,0,0|0,0,1]=3 1803 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-8642266626 [1,1,0,0,0,0|0,0,1]=3 1804 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9352931710 [1,1,0,0,0,0|0,0,1]=3 1805 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9532999202 [1,1,0,0,0,0|0,0,1]=3 1806 B8R0.8 NOCCC(N)C(=O)O MCULE-1540658941 [1,1,0,0,0,0|0,0,1]=3 1807 B8R0.8 NOCCC(N)C(=O)O MCULE-3729513992 [1,1,0,0,0,0|0,0,1]=3 1808 B8R0.8 NOCC[C@@H](N)C(=O)O MCULE-3273727827 [1,1,0,0,0,0|0,0,1]=3 1809 B8R0.8 NOCC[C@H](N)C(=O)O MCULE-2315172974 [1,1,0,0,0,0|0,0,1]=3 1810 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-3220645027 [1,1,0,0,0,0|0,0,2]=4 1811 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-4608316868 [1,1,0,0,0,0|0,0,2]=4 1812 B8R0.8 [C@@H](N)(CCC=C)C(=O)O MCULE-9648209291 [1,1,0,0,0,0|1,0,0]=3 1813 B8R0.8 [C@H](N)(CCON)C(=O)O MCULE-1309966773 [1,1,0,0,0,0|0,0,1]=3 1814 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O MCULE-4562460888 [1,1,0,0,0,0|1,0,1]=4 1815 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O MCULE-4736712462 [1,1,0,0,0,0|1,0,1]=4 1816 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O MCULE-6764345986 [1,1,0,0,0,0|1,0,1]=4 1817 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O MCULE-1901194070 [1,1,0,0,0,0|1,0,1]=4 1818 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O MCULE-2129950967 [1,1,0,0,0,0|1,0,1]=4 1819 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O MCULE-4531641107 [1,1,0,0,0,0|1,0,1]=4 1820 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O MCULE-9554569949 [1,1,0,0,0,0|1,0,1]=4 1821 B8R0.12 C#CCC(C)(N)C(=O)O MCULE-8114982544 [1,1,0,0,0,0|1,0,1]=4 1822 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-2326062849 [1,1,0,0,0,0|1,0,1]=4 1823 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-2897598223 [1,1,0,0,0,0|1,0,1]=4 1824 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-6332359697 [1,1,0,0,0,0|1,0,1]=4 1825 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-9265618717 [1,1,0,0,0,0|1,0,1]=4 1826 B8R0.12 C#CC[C@](C)(N)C(=O)O MCULE-2976528694 [1,1,0,0,0,0|1,0,1]=4 1827 B8R0.12 C#CC[C@](C)(N)C(=O)O MCULE-7418052843 [1,1,0,0,0,0|1,0,1]=4 1828 B8R0.12 C=CCC(C)(C)C(=O)O MCULE-7428318853 [1,1,0,0,0,0|2,0,0]=4 1829 B8R0.12 C=CCC(C)(N)C(=O)O MCULE-7144199889 [1,1,0,0,0,0|1,0,0]=3 1830 B8R0.12 C=CCC(F)(F)C(=O)O MCULE-5503944687 [1,1,0,0,0,0|2,0,0]=4 1831 B8R0.12 C=CC[C@@](C)(N)C(=O)O MCULE-4753726738 [1,1,0,0,0,0|1,0,0]=3 1832 B8R0.12 C=CC[C@@](C)(N)C(=O)O MCULE-8270551752 [1,1,0,0,0,0|1,0,0]=3 1833 B8R0.12 C=CC[C@](C)(N)C(=O)O MCULE-2471413685 [1,1,0,0,0,0|1,0,0]=3 1834 B8R0.12 C=CC[C@](C)(N)C(=O)O MCULE-5595289174 [1,1,0,0,0,0|1,0,0]=3 1835 B8R0.12 CC(C)(CCN)C(=O)O MCULE-2948071531 [1,1,0,0,0,0|1,0,1]=4 1836 B8R0.12 CC(C)(CCN)C(=O)O MCULE-9113980340 [1,1,0,0,0,0|1,0,1]=4 1837 B8R0.12 CC(N)(CCF)C(=O)O MCULE-5797177130 [1,1,0,0,0,0|1,0,1]=4 1838 B8R0.12 CC(N)(CCF)C(=O)O MCULE-9911119608 [1,1,0,0,0,0|1,0,1]=4 1839 B8R0.12 CCCC(C)(N)C(=O)O MCULE-3079931045 [1,1,0,0,0,0|1,0,1]=4 1840 B8R0.12 CCC[C@](C)(N)C(=O)O MCULE-8569302783 [1,1,0,0,0,0|1,0,1]=4 1841 B8R0.12 NCCC(F)(F)C(=O)O MCULE-3814517866 [1,1,0,0,0,0|1,0,1]=4 1842 B8R0.15 C=CCC(CC)C(=O)O MCULE-8599414655 [1,1,0,0,0,0|2,0,0]=4 1843 B8R0.15 CCC(CCN)C(=O)O MCULE-3540595708 [1,1,0,0,0,0|1,0,1]=4 1844 B8R0.15 CCC(CCN)C(=O)O MCULE-6369668711 [1,1,0,0,0,0|1,0,1]=4 1845 B8R0.15 CCC(NC=O)C(=O)O MCULE-6163876154 [1,1,0,0,0,0|2,0,0]=4 1846 B8R0.15 CCCC(NC)C(=O)O MCULE-5292420123 [1,1,0,0,0,0|1,0,1]=4 1847 B8R0.15 CCCC(NC)C(=O)O MCULE-5734283547 [1,1,0,0,0,0|1,0,1]=4 1848 B8R0.15 CCCC(NC)C(=O)O MCULE-9559460593 [1,1,0,0,0,0|1,0,1]=4 1849 B8R0.15 CCCC(NO)C(=O)O MCULE-7484331195 [1,1,0,0,0,0|1,0,1]=4 1850 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-3394704356 [1,1,0,0,0,0|1,0,1]=4 1851 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-8140893147 [1,1,0,0,0,0|1,0,1]=4 1852 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-1028689544 [1,1,0,0,0,0|1,0,1]=4 1853 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-4848752673 [1,1,0,0,0,0|1,0,1]=4 1854 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-5585839502 [1,1,0,0,0,0|1,0,1]=4 1855 B8R0.15 CCC[C@H](NO)C(=O)O MCULE-7455558431 [1,1,0,0,0,0|1,0,1]=4 1856 B8R0.15 CNC(CCN)C(=O)N MCULE-4176706453 [1,1,0,0,0,0|1,0,1]=4 1857 B8R0.15 CNC(CCN)C(=O)O MCULE-6687313255 [1,1,0,0,0,0|0,0,1]=3 1858 B8R0.15 CNC(COC)C(=O)O MCULE-4091913769 [1,1,0,0,0,0|2,0,0]=4 1859 B8R0.15 CNC(COC)C(=O)O MCULE-6745647660 [1,1,0,0,0,0|2,0,0]=4 1860 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-4209872941 [1,1,0,0,0,0|0,0,2]=4 1861 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-7202916887 [1,1,0,0,0,0|0,0,2]=4 1862 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-1874728709 [1,1,0,0,0,0|0,0,2]=4 1863 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-3716592032 [1,1,0,0,0,0|0,0,2]=4 1864 B8R0.15 COC(CCN)C(=O)O MCULE-1510512790 [1,1,0,0,0,0|1,0,1]=4 1865 B8R0.15 COCC(ON)C(=O)O MCULE-4466158339 [1,1,0,0,0,0|2,0,0]=4 1866 B8R0.15 COCC(ON)C(=O)O MCULE-6084078663 [1,1,0,0,0,0|2,0,0]=4 1867 B8R0.15 O=CN[C@@H](CS)C(=O)O MCULE-9815114026 [1,1,0,0,0,0|2,0,0]=4 1868 B8R0.9 C(=CC(=O)NC)C(=O)O MCULE-6946307549 [1,1,0,0,0,0|0,0,2]=4 1869 B8R0.9 C=CC(=O)NCC(=O)N MCULE-4638561901 [1,1,0,0,0,0|2,0,0]=4 1870 B8R0.9 C=CC(=O)NCC(=O)O MCULE-6459513586 [1,1,0,0,0,0|2,0,0]=4 1871 B8R0.9 C=CC(N)CCC(=O)O MCULE-3453656580 [1,1,0,0,0,0|1,0,1]=4 1872 B8R0.9 C=CC(N)CCC(=O)O MCULE-4435406748 [1,1,0,0,0,0|1,0,1]=4 1873 B8R0.9 C=C[C@@H](N)CCC(=O)O MCULE-5470042954 [1,1,0,0,0,0|1,0,1]=4 1874 B8R0.9 C=C[C@@H](N)CCC(=O)O MCULE-9017090012 [1,1,0,0,0,0|1,0,1]=4 1875 B8R0.9 C=C[C@H](N)CCC(=O)O MCULE-4615585642 [1,1,0,0,0,0|1,0,1]=4 1876 B8R0.9 CC(=NO)CCC(=O)O MCULE-2481442220 [1,1,0,0,0,0|1,0,1]=4 1877 B8R0.9 CC(=O)NCC(=O)NN MCULE-1688027287 [1,1,0,0,0,0|2,0,0]=4 1878 B8R0.9 CC(O)CCC(=O)NN MCULE-3743680204 [1,1,0,0,0,0|1,0,1]=4 1879 B8R0.9 CCC(=O)CCC(=O)C MCULE-7923444653 [1,1,0,0,0,0|2,0,0]=4 1880 B8R0.9 CCC(=O)CCC(=O)O MCULE-4505750030 [1,1,0,0,0,0|1,0,0]=3 1881 B8R0.9 CCC(=O)NCC(=O)O MCULE-9173889437 [1,1,0,0,0,0|2,0,0]=4 1882 B8R0.9 CCC(N)CCC(=O)O MCULE-3116763773 [1,1,0,0,0,0|1,0,1]=4 1883 B8R0.9 CCC(N)CCC(=O)O MCULE-9126260921 [1,1,0,0,0,0|1,0,1]=4 1884 B8R0.9 CCS(=O)CCC(=O)O MCULE-4027618720 [1,1,0,0,0,0|2,0,0]=4 1885 B8R0.9 CNC(=O)/C=C\C(=O)O MCULE-9272095560 [1,1,0,0,0,0|0,0,2]=4 1886 B8R0.9 CNC(=O)CCC(=O)O MCULE-8340443315 [1,1,0,0,0,0|0,0,0]=2 1887 B8R0.9 CNC(=O)CNC(=O)C MCULE-3508245247 [1,1,0,0,0,0|2,0,0]=4 1888 B8R0.9 CNC(=O)NCC(=O)O MCULE-9575946804 [1,1,0,0,0,0|1,0,0]=3 1889 B8R0.9 COC(=O)/C=C/C(=O)N MCULE-9155646828 [1,1,0,0,0,0|0,0,2]=4 1890 B8R0.9 COC(=O)CCC(=O)C MCULE-6324755148 [1,1,0,0,0,0|1,0,0]=3 1891 B8R0.9 COC(=O)CCC(=O)Cl MCULE-2684320402 [1,1,0,0,0,0|1,0,0]=3 1892 B8R0.9 COC(=O)CCC(=O)N MCULE-1154081515 [1,1,0,0,0,0|0,0,0]=2 1893 B8R0.9 COC(=O)CCC(=O)O MCULE-4083173324 [1,1,0,0,0,0|1,0,0]=3 1894 B8R0.9 COC(=O)CCC(=S)N MCULE-4037707510 [1,1,0,0,0,0|0,1,0]=3 1895 B8R0.9 COC(=O)CCN(=O)=O MCULE-3836108700 [1,1,0,0,0,0|2,0,0]=4 1896 B8R0.9 COC(=O)CCS(=O)O MCULE-4935012562 [1,1,0,0,0,0|2,0,0]=4 1897 B8R0.9 COC(=O)CCS(=O)[O-] MCULE-5802411922 [1,1,0,0,0,0|2,0,0]=4 1898 B8R0.9 COC(=O)CNC(=O)C MCULE-3795072377 [1,1,0,0,0,0|2,0,0]=4 1899 B8R0.9 COC(=O)CSC(=N)N MCULE-5721573915 [1,1,0,0,0,0|2,0,0]=4 1900 B8R0.9 COC(=O)CSC(=N)N MCULE-8534299006 [1,1,0,0,0,0|2,0,0]=4 1901 B8R0.9 COC(=O)NCC(=O)C MCULE-1043877696 [1,1,0,0,0,0|2,0,0]=4 1902 B8R0.9 COC(=O)NCC(=O)O MCULE-3693365728 [1,1,0,0,0,0|2,0,0]=4 1903 B8R0.9 NCC(=O)CCC(=O)O MCULE-6371115085 [1,1,0,0,0,0|0,0,0]=2 1904 B8R0.9 NCC(=O)CCC(=O)O MCULE-8125179397 [1,1,0,0,0,0|0,0,0]=2 1905 B8R0.9 NCC(=O)CCC(=O)O MCULE-8676354165 [1,1,0,0,0,0|0,0,0]=2 1906 B8R0.9 NCC(=O)NCC(=O)N MCULE-8386571025 [1,1,0,0,0,0|2,0,0]=4 1907 B8R0.9 NCC(=O)NCC(=O)O MCULE-1239116894 [1,1,0,0,0,0|1,0,0]=3 1908 B8R0.9 NCC(=O)NCC(=O)O MCULE-2139302839 [1,1,0,0,0,0|1,0,0]=3 1909 B8R0.9 NCC(N)CCC(=O)O MCULE-1054409990 [1,1,0,0,0,0|1,0,1]=4 1910 B8R0.9 NC[C@@H](N)CCC(=O)O MCULE-2916881042 [1,1,0,0,0,0|1,0,1]=4 1911 B8R0.9 NC[C@@H](N)CCC(=O)O MCULE-7249154843 [1,1,0,0,0,0|1,0,1]=4 1912 B8R0.9 NNC(=O)CCC(=O)N MCULE-9710004878 [1,1,0,0,0,0|1,0,0]=3 1913 B8R0.9 NNC(=O)CCC(=O)O MCULE-7643180740 [1,1,0,0,0,0|0,0,0]=2 1914 B8R0.9 NNC(=O)CCC(=O)O MCULE-9888193887 [1,1,0,0,0,0|0,0,0]=2 1915 B8R0.9 NNC(=O)NCC(=O)O MCULE-6013763993 [1,1,0,0,0,0|1,0,0]=3 1916 B8R0.9 NNC(=O)NCC(=O)O MCULE-8104731063 [1,1,0,0,0,0|1,0,0]=3 1917 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-1233079264 [1,1,0,0,0,0|0,0,2]=4 1918 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-8091475267 [1,1,0,0,0,0|0,0,2]=4 1919 B8R0.9 O=C(O)CCC(=O)CBr MCULE-8373387398 [1,1,0,0,0,0|1,0,0]=3 1920 B8R0.9 O=C(O)CCC(=O)NO MCULE-2226202964 [1,1,0,0,0,0|0,0,0]=2 1921 B8R0.9 O=C(O)CCP(=O)CO MCULE-3163541128 [1,1,0,0,0,0|2,0,0]=4 1922 B8R0.9 O=C(O)CNC(=O)CCl MCULE-2917654196 [1,1,0,0,0,0|2,0,0]=4 1923 B8R0.9 O=C(O)COC(=O)CO MCULE-4022202206 [1,1,0,0,0,0|2,0,0]=4 1924 B8R0.29 CC(C)(N)CCC(=O)O MCULE-1195501366 [1,1,0,0,0,0|1,0,1]=4 1925 B8R0.29 CC(C)(N)CCC(=O)O MCULE-3901764815 [1,1,0,0,0,0|1,0,1]=4 1926 B8R0.29 CP(=O)(C)CCC(=O)O MCULE-4161237740 [1,1,0,0,0,0|2,0,0]=4 1927 B8R0.29 CP(=O)(O)CCC(=O)O MCULE-7722406670 [1,1,0,0,0,0|2,0,0]=4 1928 B8R0.29 CS(=O)(=O)CCC(=O)O MCULE-6100062469 [1,1,0,0,0,0|2,0,0]=4 1929 B8R0.29 NS(=O)(=O)CCC(=O)O MCULE-7062523969 [1,1,0,0,0,0|1,0,0]=3 1930 B8R0.29 O=C(O)CCP(=O)(O)O MCULE-5647723204 [1,1,0,0,0,0|2,0,0]=4 1931 B8R0.29 O=C(O)CCS(=O)(=O)O MCULE-8973025218 [1,1,0,0,0,0|2,0,0]=4 1932 B8R0.18 CCC(C(=O)O)C(=O)O MCULE-3288957588 [0,1,0,0,1,0|2,0,0]=4 1933 B8R0.27 CC(C(=O)O)S(=O)(=O)N MCULE-9865873949 [0,1,0,0,1,0|2,0,0]=4 1934 B8R0.37 CC(=O)C(C)(C)C(=O)O MCULE-5093326895 [0,1,0,0,1,0|2,0,0]=4 1935 B8R0.37 CC(C)(C(=O)N)C(=O)N MCULE-2181233977 [0,1,0,0,1,0|2,0,0]=4 1936 B8R0.37 CC(C)(C(=O)N)C(=O)O MCULE-2390691265 [0,1,0,0,1,0|1,0,0]=3 1937 B8R0.37 CC(C)(C(=O)O)C(=O)O MCULE-7318511088 [0,1,0,0,1,0|2,0,0]=4 1938 B8R0.37 NC(=O)C(Br)(Br)C(=O)N MCULE-6758740224 [0,1,0,0,1,0|2,0,0]=4 1939 B8R0.37 NC(=O)C(F)(F)C(=O)N MCULE-3505764072 [0,1,0,0,1,0|2,0,0]=4 1940 B8R0.37 O=C(O)C(F)(F)C(=O)O MCULE-4438516030 [0,1,0,0,1,0|2,0,0]=4 1941 B8R0.37 O=C(O)C(O)(O)C(=O)O MCULE-1610310703 [0,1,0,0,1,0|2,0,0]=4 1942 B10R0.13 CC(=O)OC(C)C(N)C(=O)O MCULE-2960070749 [0,1,0,0,0,1|1,0,0]=3 1943 B10R0.13 CC(=O)OC(C)C(N)C(=O)O MCULE-7223559986 [0,1,0,0,0,1|1,0,0]=3 1944 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 1945 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 1946 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 1947 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 1948 B10R0.13 C[C@@H](CC(=O)O)[C@@H](N)C(=O)O MCULE-3332620674 [0,1,0,0,0,1|1,0,0]=3 1949 B10R0.13 C[C@@H](CC(=O)O)[C@H](N)C(=O)O MCULE-1191810017 [0,1,0,0,0,1|1,0,0]=3 1950 B10R0.13 C[C@H](CC(=O)O)[C@@H](N)C(=O)O MCULE-6898866017 [0,1,0,0,0,1|1,0,0]=3 1951 B10R0.13 C[C@H](CC(=O)O)[C@H](N)C(=O)O MCULE-5584040869 [0,1,0,0,0,1|1,0,0]=3 1952 B10R0.13 N[C@@H](C(=O)O)[C@H](O)CC(=O)O MCULE-6540374220 [0,1,0,0,0,1|1,0,0]=3 1953 B10R0.13 N[C@H](C(=O)O)[C@@H](F)CC(=O)O MCULE-4546449636 [0,1,0,0,0,1|1,0,0]=3 1954 B10R0.43 CC(=O)CCC(C)(C)C(=O)O MCULE-7949244890 [0,1,0,0,0,1|2,0,0]=4 1955 B10R0.43 CC(=O)NCC(C)(C)C(=O)O MCULE-5666730658 [0,1,0,0,0,1|2,0,0]=4 1956 B10R0.43 CC(C)(CCC(=O)O)C(=O)O MCULE-3722680536 [0,1,0,0,0,1|2,0,0]=4 1957 B10R0.43 CC(C)(SCC(=O)O)C(=O)O MCULE-9761119610 [0,1,0,0,0,1|2,0,0]=4 1958 B10R0.43 CC(N)(CCC(=O)O)C(=O)O MCULE-3734637690 [0,1,0,0,0,1|1,0,0]=3 1959 B10R0.43 C[C@@](N)(CCC(=O)O)C(=O)O MCULE-5201150112 [0,1,0,0,0,1|1,0,0]=3 1960 B10R0.43 O=C(O)CCC(F)(F)C(=O)O MCULE-3909124499 [0,1,0,0,0,1|2,0,0]=4 1961 B10R0.57 C(N)(CCC(=O)O)C(=O)OC MCULE-6082605624 [0,1,0,0,0,1|1,0,0]=3 1962 B10R0.57 COC(=O)C(N)CCC(=O)N MCULE-3871381696 [0,1,0,0,0,1|0,0,0]=2 1963 B10R0.57 COC(=O)C(N)CCC(=O)N MCULE-6424537354 [0,1,0,0,0,1|0,0,0]=2 1964 B10R0.57 COC(=O)C(N)CCC(=O)O MCULE-3294558028 [0,1,0,0,0,1|1,0,0]=3 1965 B10R0.57 COC(=O)C(N)CCC(=O)O MCULE-4645787805 [0,1,0,0,0,1|1,0,0]=3 1966 B10R0.57 COC(=O)C(N)CCC(=O)O MCULE-8573479107 [0,1,0,0,0,1|1,0,0]=3 1967 B10R0.57 COC(=O)[C@@H](C)CSC(=O)C MCULE-1724066289 [0,1,0,0,0,1|2,0,0]=4 1968 B10R0.57 COC(=O)[C@@H](N)CCC(=O)N MCULE-2647128583 [0,1,0,0,0,1|0,0,0]=2 1969 B10R0.57 COC(=O)[C@@H](N)CCC(=O)N MCULE-3301910394 [0,1,0,0,0,1|0,0,0]=2 1970 B10R0.57 COC(=O)[C@@H](N)CCC(=O)N MCULE-6377888321 [0,1,0,0,0,1|0,0,0]=2 1971 B10R0.57 COC(=O)[C@@H](N)CCC(=O)N MCULE-8642069122 [0,1,0,0,0,1|0,0,0]=2 1972 B10R0.57 COC(=O)[C@@H](N)CCC(=O)O MCULE-3694424519 [0,1,0,0,0,1|1,0,0]=3 1973 B10R0.57 COC(=O)[C@@H](N)CCC(=O)O MCULE-3908913342 [0,1,0,0,0,1|1,0,0]=3 1974 B10R0.57 COC(=O)[C@H](N)CCC(=O)N MCULE-3332396919 [0,1,0,0,0,1|0,0,0]=2 1975 B10R0.57 COC(=O)[C@H](N)CCC(=O)N MCULE-4801234666 [0,1,0,0,0,1|0,0,0]=2 1976 B10R0.57 COC(=O)[C@H](N)CCC(=O)N MCULE-5791932848 [0,1,0,0,0,1|0,0,0]=2 1977 B10R0.57 COC(=O)[C@H](N)CCC(=O)N MCULE-7827323262 [0,1,0,0,0,1|0,0,0]=2 1978 B10R0.57 COC(=O)[C@H](N)CCC(=O)O MCULE-4899971591 [0,1,0,0,0,1|1,0,0]=3 1979 B10R0.57 COC(=O)[C@H](N)CCC(=O)O MCULE-5340713177 [0,1,0,0,0,1|1,0,0]=3 1980 B10R0.57 COC(=O)[C@H](N)CCC(=O)O MCULE-6573369964 [0,1,0,0,0,1|1,0,0]=3 1981 B10R0.57 COC(=O)[C@H](N)CCC(=O)O MCULE-9402335659 [0,1,0,0,0,1|1,0,0]=3 1982 B10R0.57 NCC(=O)C(N)CCC(=O)O MCULE-6909697909 [0,1,0,0,0,1|2,0,0]=4 1983 B10R0.82 CNC(=O)CCC(N)C(=O)O MCULE-2815144960 [0,1,0,0,0,1|0,0,0]=2 1984 B10R0.82 COC(=O)CCC(N)C(=O)N MCULE-2008488408 [0,1,0,0,0,1|2,0,0]=4 1985 B10R0.82 COC(=O)CCC(N)C(=O)N MCULE-4056733947 [0,1,0,0,0,1|2,0,0]=4 1986 B10R0.82 COC(=O)CCC(N)C(=O)O MCULE-1417445261 [0,1,0,0,0,1|1,0,0]=3 1987 B10R0.82 COC(=O)CCC(N)C(=O)O MCULE-1495018790 [0,1,0,0,0,1|1,0,0]=3 1988 B10R0.82 COC(=O)CC[C@@H](N)C(=O)O MCULE-3233905582 [0,1,0,0,0,1|1,0,0]=3 1989 B10R0.82 COC(=O)CC[C@@H](N)C(=O)O MCULE-4870656159 [0,1,0,0,0,1|1,0,0]=3 1990 B10R0.82 COC(=O)CC[C@H](N)C(=O)N MCULE-4563541396 [0,1,0,0,0,1|2,0,0]=4 1991 B10R0.82 COC(=O)CC[C@H](N)C(=O)N MCULE-5542631622 [0,1,0,0,0,1|2,0,0]=4 1992 B10R0.82 COC(=O)CC[C@H](N)C(=O)N MCULE-5671338567 [0,1,0,0,0,1|2,0,0]=4 1993 B10R0.82 COC(=O)CC[C@H](N)C(=O)N MCULE-7766792787 [0,1,0,0,0,1|2,0,0]=4 1994 B10R0.82 COC(=O)CC[C@H](N)C(=O)O MCULE-1607830290 [0,1,0,0,0,1|1,0,0]=3 1995 B10R0.82 COC(=O)CC[C@H](N)C(=O)O MCULE-7380350089 [0,1,0,0,0,1|1,0,0]=3 1996 B10R0.82 COC(=O)CC[C@H](N)C(=O)O MCULE-7654158848 [0,1,0,0,0,1|1,0,0]=3 1997 B10R0.82 COC(=O)CC[C@H](N)C(=O)O MCULE-8680968839 [0,1,0,0,0,1|1,0,0]=3 1998 B10R0.82 NC(CCC(=O)NO)C(=O)O MCULE-9353366308 [0,1,0,0,0,1|0,0,0]=2 1999 B10R0.82 NC(CCP(=O)CO)C(=O)O MCULE-2901685887 [0,1,0,0,0,1|2,0,0]=4 2000 B10R0.82 NC(CS/C(=C\Cl)/Cl)C(=O)O MCULE-9787799918 [0,1,0,0,0,1|2,0,0]=4 2001 B10R0.82 NC(CSC(=CCl)Cl)C(=O)O MCULE-3439601737 [0,1,0,0,0,1|2,0,0]=4 2002 B10R0.82 NCC(F)CCC(N)C(=O)O MCULE-5359725270 [0,1,0,0,0,1|1,0,1]=4 2003 B10R0.82 NCC(F)CCC(N)C(=O)O MCULE-7837362209 [0,1,0,0,0,1|1,0,1]=4 2004 B10R0.82 NCC(O)CCC(N)C(=O)O MCULE-6064290143 [0,1,0,0,0,1|0,0,2]=4 2005 B10R0.82 NCC(O)CCC(N)C(=O)O MCULE-6546706417 [0,1,0,0,0,1|0,0,2]=4 2006 B10R0.82 NCC(O)CC[C@H](N)C(=O)O MCULE-4925093695 [0,1,0,0,0,1|0,0,2]=4 2007 B10R0.82 NCC(O)CC[C@H](N)C(=O)O MCULE-7103430731 [0,1,0,0,0,1|0,0,2]=4 2008 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O MCULE-1390178110 [0,1,0,0,0,1|0,0,2]=4 2009 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O MCULE-7788161688 [0,1,0,0,0,1|0,0,2]=4 2010 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 2011 B10R0.82 N[C@@H](CSC(=CCl)Cl)C(=O)O MCULE-2279209273 [0,1,0,0,0,1|2,0,0]=4 2012 B10R0.82 N[C@@H](CSC(=CCl)Cl)C(=O)O MCULE-6627444633 [0,1,0,0,0,1|2,0,0]=4 2013 B10R0.84 CCC(CCC(=O)C)C(=O)O MCULE-2983781440 [0,1,0,0,0,1|2,0,0]=4 2014 B10R0.84 CNC(CCC(=O)O)C(=O)O MCULE-7159441787 [0,1,0,0,0,1|1,0,0]=3 2015 B10R0.84 CNC(CCC(=O)O)C(=O)O MCULE-9982940361 [0,1,0,0,0,1|1,0,0]=3 2016 B10R0.84 CN[C@@H](CCC(=O)N)C(=O)O MCULE-1463462281 [0,1,0,0,0,1|0,0,0]=2 2017 B10R0.84 CN[C@@H](CCC(=O)O)C(=O)O MCULE-1322979818 [0,1,0,0,0,1|1,0,0]=3 2018 B10R0.84 CN[C@@H](CCC(=O)O)C(=O)O MCULE-9405643691 [0,1,0,0,0,1|1,0,0]=3 2019 B10R0.84 CN[C@H](CCC(=O)N)C(=O)O MCULE-2123714471 [0,1,0,0,0,1|0,0,0]=2 2020 B10R0.84 CN[C@H](CCC(=O)O)C(=O)O MCULE-1735782000 [0,1,0,0,0,1|1,0,0]=3 2021 B10R0.84 NN=C(CCC(=O)O)C(=O)O MCULE-4661582416 [0,1,0,0,0,1|1,0,1]=4 2022 B10R0.92 CP(=O)(O)CCC(N)C(=O)O MCULE-1038057082 [0,1,0,0,0,1|2,0,0]=4 2023 B10R0.92 CP(=O)(O)CCC(N)C(=O)O MCULE-7761179555 [0,1,0,0,0,1|2,0,0]=4 2024 B10R0.92 CS(=N)(=O)CCC(N)C(=O)O MCULE-2268954465 [0,1,0,0,0,1|1,0,1]=4 2025 B10R0.92 CS(=N)(=O)CCC(N)C(=O)O MCULE-2804558075 [0,1,0,0,0,1|1,0,1]=4 2026 B10R0.92 CS(=N)(=O)CCC(N)C(=O)O MCULE-7485004955 [0,1,0,0,0,1|1,0,1]=4 2027 B10R0.92 CS(=N)(=O)CC[C@@H](N)C(=O)O MCULE-3997574746 [0,1,0,0,0,1|1,0,1]=4 2028 B10R0.92 CS(=N)(=O)CC[C@H](N)C(=O)O MCULE-1068341907 [0,1,0,0,0,1|1,0,1]=4 2029 B10R0.92 CS(=N)(=O)CC[C@H](N)C(=O)O MCULE-3093123817 [0,1,0,0,0,1|1,0,1]=4 2030 B10R0.92 CS(=O)(=O)CCC(N)C(=O)O MCULE-8107053430 [0,1,0,0,0,1|2,0,0]=4 2031 B10R0.92 CS(=O)(=O)CC[C@@H](N)C(=O)O MCULE-1126326759 [0,1,0,0,0,1|2,0,0]=4 2032 B10R0.92 CS(=O)(=O)CC[C@@H](N)C(=O)O MCULE-3558725435 [0,1,0,0,0,1|2,0,0]=4 2033 B10R0.92 CS(=O)(=O)CC[C@H](N)C(=O)O MCULE-2269540933 [0,1,0,0,0,1|2,0,0]=4 2034 B10R0.92 CS(=O)(=O)CC[C@H](N)C(=O)O MCULE-4203364916 [0,1,0,0,0,1|2,0,0]=4 2035 B10R0.92 CS(=O)(=O)SCC(N)C(=O)O MCULE-1061975394 [0,1,0,0,0,1|2,0,0]=4 2036 B10R0.92 NC(CCP(=O)(O)O)C(=O)O MCULE-2756478197 [0,1,0,0,0,1|2,0,0]=4 2037 B10R0.92 NC(CCS(=O)(=O)O)C(=O)O MCULE-7377602601 [0,1,0,0,0,1|2,0,0]=4 2038 B10R0.92 NC(COP(=O)(O)O)C(=O)O MCULE-1695816394 [0,1,0,0,0,1|2,0,0]=4 2039 B10R0.92 NC(COS(=O)(=O)O)C(=O)O MCULE-5049646882 [0,1,0,0,0,1|2,0,0]=4 2040 B10R0.92 N[C@@H](CCP(=O)(O)O)C(=O)O MCULE-3863533502 [0,1,0,0,0,1|2,0,0]=4 2041 B10R0.92 N[C@@H](CCP(=O)(O)O)C(=O)O MCULE-3988880216 [0,1,0,0,0,1|2,0,0]=4 2042 B10R0.92 N[C@@H](CCS(=O)(=O)O)C(=O)O MCULE-8204260402 [0,1,0,0,0,1|2,0,0]=4 2043 B10R0.92 N[C@@H](COP(=O)(O)O)C(=O)O MCULE-3199737084 [0,1,0,0,0,1|2,0,0]=4 2044 B10R0.92 N[C@@H](COP(=O)(O)O)C(=O)O MCULE-4907212979 [0,1,0,0,0,1|2,0,0]=4 2045 B10R0.92 N[C@@H](COS(=O)(=O)O)C(=O)O MCULE-3746813647 [0,1,0,0,0,1|2,0,0]=4 2046 B10R0.92 N[C@@H](COS(=O)(=O)O)C(=O)O MCULE-9474608832 [0,1,0,0,0,1|2,0,0]=4 2047 B10R0.92 N[C@@H](COS(=O)(=O)[O-])C(=O)O MCULE-9200207665 [0,1,0,0,0,1|2,0,0]=4 2048 B10R0.92 N[C@@H](CSS(=O)(=O)O)C(=O)O MCULE-5127296011 [0,1,0,0,0,1|2,0,0]=4 2049 B10R0.92 N[C@H](CCP(=O)(O)O)C(=O)O MCULE-4319868114 [0,1,0,0,0,1|2,0,0]=4 2050 B10R0.92 N[C@H](CCP(=O)([O-])O)C(=O)O MCULE-5292220353 [0,1,0,0,0,1|2,0,0]=4 2051 B10R0.92 N[C@H](COP(=O)(O)O)C(=O)O MCULE-4002733556 [0,1,0,0,0,1|2,0,0]=4 2052 B10R0.92 N[C@H](COP(=O)(O)O)C(=O)O MCULE-5554704102 [0,1,0,0,0,1|2,0,0]=4 2053 B10R0.92 [C@H](N)(CSS(=O)(=O)O)C(=O)O MCULE-9668444815 [0,1,0,0,0,1|2,0,0]=4 2054 B10R0.93 CC(CC(C)C(=O)O)C(=O)O MCULE-1153209267 [0,1,0,0,0,1|2,0,0]=4 2055 B10R0.93 CC(CC(N)C(=O)O)C(=O)O MCULE-4117547649 [0,1,0,0,0,1|1,0,0]=3 2056 B10R0.93 CC(N[C@@H](C)C(=O)O)C(=O)O MCULE-6318508526 [0,1,0,0,0,1|2,0,0]=4 2057 B10R0.93 C[C@H](C[C@H](N)C(=O)O)C(=O)O MCULE-2754578678 [0,1,0,0,0,1|1,0,0]=3 2058 B10R0.93 C[C@H](C[C@H](N)C(=O)O)C(=O)O MCULE-7169309772 [0,1,0,0,0,1|1,0,0]=3 2059 B10R0.93 NC(=O)[C@H](F)C[C@H](N)C(=O)O MCULE-6469307664 [0,1,0,0,0,1|0,0,0]=2 2060 B10R0.93 NC(=O)[C@H](F)C[C@H](N)C(=O)O MCULE-6602424535 [0,1,0,0,0,1|0,0,0]=2 2061 B10R0.93 NC(CC(F)C(=O)O)C(=O)O MCULE-9589470454 [0,1,0,0,0,1|1,0,0]=3 2062 B10R0.93 NC(CC(N)C(=O)O)C(=O)O MCULE-1335465688 [0,1,0,0,0,1|1,0,0]=3 2063 B10R0.93 NC(CC(N)C(=O)O)C(=O)O MCULE-4470732128 [0,1,0,0,0,1|1,0,0]=3 2064 B10R0.93 NC(CC(O)C(=O)O)C(=O)O MCULE-2122152001 [0,1,0,0,0,1|1,0,0]=3 2065 B10R0.93 N[C@@H](CC(F)C(=O)O)C(=O)O MCULE-2625841366 [0,1,0,0,0,1|1,0,0]=3 2066 B10R0.93 N[C@@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-5445779612 [0,1,0,0,0,1|1,0,0]=3 2067 B10R0.93 N[C@@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-9351036941 [0,1,0,0,0,1|1,0,0]=3 2068 B10R0.93 N[C@@H](C[C@@H](O)C(=O)O)C(=O)O MCULE-2660596864 [0,1,0,0,0,1|1,0,0]=3 2069 B10R0.93 N[C@@H](C[C@@H](O)C(=O)O)C(=O)O MCULE-6180379673 [0,1,0,0,0,1|1,0,0]=3 2070 B10R0.93 N[C@@H](C[C@H](F)C(=O)O)C(=O)O MCULE-5145554613 [0,1,0,0,0,1|1,0,0]=3 2071 B10R0.93 N[C@@H](C[C@H](F)C(=O)O)C(=O)O MCULE-9443069690 [0,1,0,0,0,1|1,0,0]=3 2072 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-2341577942 [0,1,0,0,0,1|1,0,0]=3 2073 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-4495746010 [0,1,0,0,0,1|1,0,0]=3 2074 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-6284302068 [0,1,0,0,0,1|1,0,0]=3 2075 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-6384488635 [0,1,0,0,0,1|1,0,0]=3 2076 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-6724681365 [0,1,0,0,0,1|1,0,0]=3 2077 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-8957870380 [0,1,0,0,0,1|1,0,0]=3 2078 B10R0.93 N[C@@H](C[C@H](O)C(=O)O)C(=O)O MCULE-2217204949 [0,1,0,0,0,1|1,0,0]=3 2079 B10R0.93 N[C@@H](C[C@H](O)C(=O)O)C(=O)O MCULE-8271752005 [0,1,0,0,0,1|1,0,0]=3 2080 B10R0.93 N[C@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-3848928339 [0,1,0,0,0,1|1,0,0]=3 2081 B10R0.93 N[C@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-4424451348 [0,1,0,0,0,1|1,0,0]=3 2082 B10R0.93 N[C@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-5729704628 [0,1,0,0,0,1|1,0,0]=3 2083 B10R0.93 N[C@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-8441844155 [0,1,0,0,0,1|1,0,0]=3 2084 B10R0.93 N[C@H](C[C@H](O)C(=O)O)C(=O)O MCULE-8040485498 [0,1,0,0,0,1|1,0,0]=3 2085 B10R0.93 O=C(O)C(Br)CC(Br)C(=O)O MCULE-2429859248 [0,1,0,0,0,1|2,0,0]=4 2086 B10R0.93 O=C(O)C(O)SC(O)C(=O)O MCULE-2925160633 [0,1,0,0,0,1|2,0,0]=4 2087 B10R0.44 COC(=O)CC(C)CC(=O)O MCULE-2040975724 [0,1,0,0,0,1|2,0,0]=4 2088 B10R0.44 COC(=O)CC(C)CC(=O)O MCULE-8664626816 [0,1,0,0,0,1|2,0,0]=4 2089 B10R0.44 COC(=O)C[C@H](C)CC(=O)O MCULE-3674114279 [0,1,0,0,0,1|2,0,0]=4 2090 B10R0.44 COC(=O)C[C@H](C)CC(=O)O MCULE-7834226828 [0,1,0,0,0,1|2,0,0]=4 2091 B10R0.165 CC(=O)CC(C)(C)CC(=O)O MCULE-4874610800 [0,1,0,0,0,1|2,0,0]=4 2092 B10R0.165 CC(C)(CC(=O)O)CC(=O)O MCULE-3688310273 [0,1,0,0,0,1|2,0,0]=4 2093 B10R0.165 CC(O)(CC(=O)O)CC(=O)O MCULE-9846508304 [0,1,0,0,0,1|2,0,0]=4 2094 B10R0.165 O=C(O)CC(F)(F)CC(=O)O MCULE-1340481205 [0,1,0,0,0,1|2,0,0]=4 2095 B10R0.47 COC(=O)CC(C)(C)C(=O)O MCULE-4222068236 [0,2,0,0,0,0|2,0,0]=4 2096 B10R0.117 CC(C)(C(N)C(=O)O)N(=O)=O MCULE-9002564501 [0,2,0,0,0,0|2,0,0]=4 2097 B10R0.117 CC(C)([C@H](N)C(=O)O)[N+](=O)[O-] MCULE-3869741264 [0,2,0,0,0,0|2,0,0]=4 2098 B10R0.117 O=C(O)C(F)C(F)(F)C(=O)O MCULE-7067726417 [0,2,0,0,0,0|2,0,0]=4 2099 B10R0.119 CC(CN)(CC(=O)O)C(=O)O MCULE-2103588985 [0,2,0,0,0,0|1,0,0]=3 2100 B10R0.119 CC(CN)(CC(=O)O)C(=O)O MCULE-8467010129 [0,2,0,0,0,0|1,0,0]=3 2101 B10R0.119 CCC(C)(CC(=O)O)C(=O)O MCULE-5857208842 [0,2,0,0,0,0|2,0,0]=4 2102 B10R0.141 COC(=O)C(C)(C)CC(=O)C MCULE-6735820439 [0,2,0,0,0,0|2,0,0]=4 2103 B10R0.141 COC(=O)C(C)(C)CC(=O)O MCULE-6122847743 [0,2,0,0,0,0|2,0,0]=4 2104 B10R0.163 CC(C)(CS(=O)(=O)N)C(=O)O MCULE-5940582557 [0,2,0,0,0,0|2,0,0]=4 2105 B10R0.32 C=C(C)CC(N)C(=O)OCC MCULE-8178008186 [0,2,0,0,0,0|2,0,0]=4 2106 B10R0.32 C=C(Cl)CC(N)C(=O)OCC MCULE-3973817457 [0,2,0,0,0,0|2,0,0]=4 2107 B10R0.32 CCOC(=O)C(C)CC(=O)C MCULE-5239572746 [0,2,0,0,0,0|2,0,0]=4 2108 B10R0.32 CCOC(=O)C(C)NC(=O)N MCULE-8566461140 [0,2,0,0,0,0|2,0,0]=4 2109 B10R0.32 CCOC(=O)C(N)CC(=O)C MCULE-5271354905 [0,2,0,0,0,0|1,0,0]=3 2110 B10R0.32 CCOC(=O)C(N)CC(=O)C MCULE-7720988971 [0,2,0,0,0,0|1,0,0]=3 2111 B10R0.32 CCOC(=O)C(N)CC(=O)N MCULE-2155920173 [0,2,0,0,0,0|0,0,0]=2 2112 B10R0.32 CCOC(=O)C(N)CC(=O)N MCULE-6061365230 [0,2,0,0,0,0|0,0,0]=2 2113 B10R0.32 CCOC(=O)[C@@H](N)CC(=O)O MCULE-8240292825 [0,2,0,0,0,0|1,0,0]=3 2114 B10R0.46 COC(=O)CC(Br)C(=O)OC MCULE-3739337867 [0,2,0,0,0,0|2,0,0]=4 2115 B10R0.46 COC(=O)CC(C)C(=O)OC MCULE-1613501642 [0,2,0,0,0,0|2,0,0]=4 2116 B10R0.46 COC(=O)CC(N)C(=O)OC MCULE-1114099871 [0,2,0,0,0,0|1,0,0]=3 2117 B10R0.46 COC(=O)CC(N)C(=O)OC MCULE-3051634308 [0,2,0,0,0,0|1,0,0]=3 2118 B10R0.46 COC(=O)CC(N)C(=O)OC MCULE-6777150813 [0,2,0,0,0,0|1,0,0]=3 2119 B10R0.46 COC(=O)CC(N)C(=O)OC MCULE-8623143776 [0,2,0,0,0,0|1,0,0]=3 2120 B10R0.46 COC(=O)CC(O)C(=O)OC MCULE-7469251782 [0,2,0,0,0,0|2,0,0]=4 2121 B10R0.46 COC(=O)C[C@@H](C)C(=O)OC MCULE-3416186452 [0,2,0,0,0,0|2,0,0]=4 2122 B10R0.46 COC(=O)C[C@@H](C)C(=O)OC MCULE-8307638859 [0,2,0,0,0,0|2,0,0]=4 2123 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC MCULE-1851128210 [0,2,0,0,0,0|1,0,0]=3 2124 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC MCULE-2435405009 [0,2,0,0,0,0|1,0,0]=3 2125 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC MCULE-5664472093 [0,2,0,0,0,0|1,0,0]=3 2126 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC MCULE-9555102277 [0,2,0,0,0,0|1,0,0]=3 2127 B10R0.46 COC(=O)C[C@@H](O)C(=O)OC MCULE-1517388811 [0,2,0,0,0,0|2,0,0]=4 2128 B10R0.46 COC(=O)C[C@@H](O)C(=O)OC MCULE-9934344103 [0,2,0,0,0,0|2,0,0]=4 2129 B10R0.46 COC(=O)C[C@H](C)C(=O)OC MCULE-6913107439 [0,2,0,0,0,0|2,0,0]=4 2130 B10R0.46 COC(=O)C[C@H](C)C(=O)OC MCULE-7249009101 [0,2,0,0,0,0|2,0,0]=4 2131 B10R0.46 COC(=O)C[C@H](N)C(=O)OC MCULE-1761054458 [0,2,0,0,0,0|1,0,0]=3 2132 B10R0.46 COC(=O)C[C@H](N)C(=O)OC MCULE-2463653671 [0,2,0,0,0,0|1,0,0]=3 2133 B10R0.46 COC(=O)C[C@H](N)C(=O)OC MCULE-8138790792 [0,2,0,0,0,0|1,0,0]=3 2134 B10R0.46 COC(=O)C[C@H](N)C(=O)OC MCULE-9097536857 [0,2,0,0,0,0|1,0,0]=3 2135 B10R0.46 COC(=O)C[C@H](O)C(=O)OC MCULE-5763222655 [0,2,0,0,0,0|2,0,0]=4 2136 B10R0.46 COC(=O)C[C@H](O)C(=O)OC MCULE-8038750949 [0,2,0,0,0,0|2,0,0]=4 2137 B10R0.46 COC(=O)C[C@H](S)C(=O)OC MCULE-7841191977 [0,2,0,0,0,0|2,0,0]=4 2138 B10R0.54 CN[C@@H](CC(=O)O)C(=O)OC MCULE-4180877161 [0,2,0,0,0,0|1,0,0]=3 2139 B10R0.54 CN[C@@H](CC(=O)O)C(=O)OC MCULE-8047613409 [0,2,0,0,0,0|1,0,0]=3 2140 B10R0.56 COC(=O)C(O)C(O)C(=O)O MCULE-5767592339 [0,2,0,0,0,0|2,0,0]=4 2141 B10R0.23 CCCC(CC(=O)C)C(=O)O MCULE-7988753662 [0,2,0,0,0,0|2,0,0]=4 2142 B10R0.23 CCCC(CC(=O)O)C(=O)O MCULE-5222720019 [0,2,0,0,0,0|2,0,0]=4 2143 B10R0.23 CCCC(NC(=O)N)C(=O)O MCULE-3451078854 [0,2,0,0,0,0|2,0,0]=4 2144 B10R0.23 CCC[C@@H](NC(=O)N)C(=O)O MCULE-4836272670 [0,2,0,0,0,0|2,0,0]=4 2145 B10R0.23 CNCC(NC(=O)C)C(=O)O MCULE-4047191308 [0,2,0,0,0,0|2,0,0]=4 2146 B10R0.23 CNC[C@H](NC(=O)C)C(=O)O MCULE-3833734431 [0,2,0,0,0,0|2,0,0]=4 2147 B10R0.23 COCC(CC(=O)O)C(=O)O MCULE-7211279043 [0,2,0,0,0,0|2,0,0]=4 2148 B10R0.23 O=CNC(CC(=O)O)C(=O)O MCULE-1319737382 [0,2,0,0,0,0|1,0,0]=3 2149 B10R0.53 CCC(NC(=O)CN)C(=O)O MCULE-2960630687 [0,2,0,0,0,0|2,0,0]=4 2150 B10R0.53 NCC(=O)NC(CO)C(=O)O MCULE-9704484705 [0,2,0,0,0,0|2,0,0]=4 2151 B10R0.53 NCC(=O)N[C@@H](CO)C(=O)O MCULE-4986689442 [0,2,0,0,0,0|2,0,0]=4 2152 B10R0.53 NCC(=O)N[C@@H](CS)C(=O)O MCULE-6900882033 [0,2,0,0,0,0|2,0,0]=4 2153 B10R0.53 [C@@H](CO)(NC(=O)CN)C(=O)O MCULE-7844760749 [0,2,0,0,0,0|2,0,0]=4 2154 B10R0.162 CC(C)C(CC(=O)O)C(=O)O MCULE-8647740549 [0,2,0,0,0,0|2,0,0]=4 2155 B10R0.162 CC(C)C(NC(=O)N)C(=O)O MCULE-8905457274 [0,2,0,0,0,0|2,0,0]=4 2156 B10R0.162 CC(C)[C@@H](NC(=O)N)C(=O)O MCULE-8034373559 [0,2,0,0,0,0|2,0,0]=4 2157 B10R0.162 CC(O)C(NC(=O)N)C(=O)O MCULE-3166365598 [0,2,0,0,0,0|2,0,0]=4 2158 B10R0.162 CN(C)[C@@H](CC(=O)O)C(=O)O MCULE-5975487097 [0,2,0,0,0,0|1,0,0]=3 2159 B10R0.162 CN(C)[C@H](CC(=O)N)C(=O)O MCULE-9653422208 [0,2,0,0,0,0|0,0,0]=2 2160 B10R0.162 CN(C)[C@H](CC(=O)O)C(=O)O MCULE-7438928757 [0,2,0,0,0,0|1,0,0]=3 2161 B10R0.162 [C@@H](NC(=O)N)(C(=O)O)C(C)C MCULE-1578246756 [0,2,0,0,0,0|2,0,0]=4 2162 B10R0.26 C=CCS(=O)CC(N)C(=O)O MCULE-1644221115 [0,2,0,0,0,0|2,0,0]=4 2163 B10R0.26 C=CCS(=O)C[C@H](N)C(=O)O MCULE-5403139844 [0,2,0,0,0,0|2,0,0]=4 2164 B10R0.26 C=CCS(=O)C[C@H](N)C(=O)O MCULE-6091538783 [0,2,0,0,0,0|2,0,0]=4 2165 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 2166 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 2167 B10R0.26 CC=CS(=O)C[C@H](N)C(=O)O MCULE-4397511090 [0,2,0,0,0,0|2,0,0]=4 2168 B10R0.26 CCCS(=O)CC(N)C(=O)O MCULE-8745806923 [0,2,0,0,0,0|2,0,0]=4 2169 B10R0.26 CCCS(=O)C[C@H](N)C(=O)O MCULE-6968745632 [0,2,0,0,0,0|2,0,0]=4 2170 B10R0.26 CCNC(=O)NC(C)C(=O)O MCULE-3484080527 [0,2,0,0,0,0|2,0,0]=4 2171 B10R0.26 CCOC(=O)CC(N)C(=O)O MCULE-1325477968 [0,2,0,0,0,0|1,0,0]=3 2172 B8R1.1 O=C1CC(CN1)CO MCULE-8619053563 [1,0,0,1,0,0|1,0,1]=4 2173 B8R1.1 O=C1C[C@@H](CN1)CO MCULE-5572559100 [1,0,0,1,0,0|1,0,1]=4 2174 B8R1.1 O=C1C[C@H](CN1)CO MCULE-4450345453 [1,0,0,1,0,0|1,0,1]=4 2175 B8R1.1 O=CC1COC(=O)C1 MCULE-7312168752 [1,0,0,1,0,0|2,0,0]=4 2176 B8R1.4 NC1CCNC(=O)C1 MCULE-2185303732 [1,0,0,1,0,0|1,0,1]=4 2177 B8R1.4 NC1CCNC(=O)C1 MCULE-4290135082 [1,0,0,1,0,0|1,0,1]=4 2178 B8R1.4 NC1CCNC(=O)C1 MCULE-6525283699 [1,0,0,1,0,0|1,0,1]=4 2179 B8R1.4 NC1CCNC(=O)C1 MCULE-8080194775 [1,0,0,1,0,0|1,0,1]=4 2180 B8R1.4 NC1COCC(=O)C1 MCULE-4958107203 [1,0,0,1,0,0|1,0,1]=4 2181 B8R1.4 NC1COCC(=O)C1 MCULE-9645630994 [1,0,0,1,0,0|1,0,1]=4 2182 B8R1.4 N[C@@H]1CCNC(=O)C1 MCULE-8276559925 [1,0,0,1,0,0|1,0,1]=4 2183 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-3299834957 [1,0,0,1,0,0|1,0,1]=4 2184 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-6683156371 [1,0,0,1,0,0|1,0,1]=4 2185 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-1641151984 [1,0,0,1,0,0|1,0,1]=4 2186 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-2042394403 [1,0,0,1,0,0|1,0,1]=4 2187 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-6400271298 [1,0,0,1,0,0|1,0,1]=4 2188 B8R1.18 CC1CC(=O)NC1=O MCULE-2962850802 [1,0,0,1,0,0|1,0,0]=3 2189 B8R1.18 CC1CC(=O)OC1=O MCULE-6043315810 [1,0,0,1,0,0|2,0,0]=4 2190 B8R1.18 CC1NC(=O)NC1=O MCULE-4619149186 [1,0,0,1,0,0|2,0,0]=4 2191 B8R1.18 CC1OC(=O)NC1=O MCULE-8191598152 [1,0,0,1,0,0|2,0,0]=4 2192 B8R1.18 CC1SC(=O)NC1=O MCULE-9249450232 [1,0,0,1,0,0|2,0,0]=4 2193 B8R1.18 CN1CC(=O)NC1=O MCULE-6246850639 [1,0,0,1,0,0|2,0,0]=4 2194 B8R1.18 C[C@@H]1CC(=O)NC1=O MCULE-9043552998 [1,0,0,1,0,0|1,0,0]=3 2195 B8R1.18 C[C@@H]1NC(=O)NC1=O MCULE-1126054848 [1,0,0,1,0,0|2,0,0]=4 2196 B8R1.18 C[C@H]1CC(=O)OC1=O MCULE-7764909201 [1,0,0,1,0,0|2,0,0]=4 2197 B8R1.18 C[C@H]1NC(=O)NC1=O MCULE-5443325319 [1,0,0,1,0,0|2,0,0]=4 2198 B8R1.18 NC1CC(=O)NC1=O MCULE-6692452440 [1,0,0,1,0,0|0,0,0]=2 2199 B8R1.18 NC1CC(=O)NC1=O MCULE-8447671567 [1,0,0,1,0,0|0,0,0]=2 2200 B8R1.18 NC1CC(=O)OC1=O MCULE-1406790351 [1,0,0,1,0,0|1,0,0]=3 2201 B8R1.18 NC1CC(=O)OC1=O MCULE-2807590870 [1,0,0,1,0,0|1,0,0]=3 2202 B8R1.18 NC1SC(=O)NC1=O MCULE-8460816262 [1,0,0,1,0,0|1,0,0]=3 2203 B8R1.18 NN1CC(=O)NC1=O MCULE-6319474334 [1,0,0,1,0,0|1,0,0]=3 2204 B8R1.18 NN1CC(=O)NC1=O MCULE-7370713803 [1,0,0,1,0,0|1,0,0]=3 2205 B8R1.18 N[C@@H]1CC(=O)NC1=O MCULE-1292090753 [1,0,0,1,0,0|0,0,0]=2 2206 B8R1.18 N[C@@H]1CC(=O)NC1=O MCULE-9676397018 [1,0,0,1,0,0|0,0,0]=2 2207 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-1937927503 [1,0,0,1,0,0|1,0,0]=3 2208 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-2080587685 [1,0,0,1,0,0|1,0,0]=3 2209 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-8793349665 [1,0,0,1,0,0|1,0,0]=3 2210 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-9640337170 [1,0,0,1,0,0|1,0,0]=3 2211 B8R1.18 N[C@H]1CC(=O)NC1=O MCULE-1052396743 [1,0,0,1,0,0|0,0,0]=2 2212 B8R1.18 N[C@H]1CC(=O)NC1=O MCULE-1965803095 [1,0,0,1,0,0|0,0,0]=2 2213 B8R1.18 N[C@H]1CC(=O)OC1=O MCULE-3191926438 [1,0,0,1,0,0|1,0,0]=3 2214 B8R1.18 N[C@H]1CC(=O)OC1=O MCULE-4503342222 [1,0,0,1,0,0|1,0,0]=3 2215 B8R1.18 O=C1NC(=O)C(N1)Br MCULE-9177153028 [1,0,0,1,0,0|2,0,0]=4 2216 B8R1.18 O=C1NC(=O)C(S1)Br MCULE-7635505691 [1,0,0,1,0,0|2,0,0]=4 2217 B8R1.43 NC(=O)C1CC1CO MCULE-3191620985 [1,0,0,1,0,0|1,0,1]=4 2218 B8R1.62 C=CC1(CC(=O)N1)C MCULE-1120869395 [1,0,0,1,0,0|2,0,0]=4 2219 B8R1.7 C1(CCNC1)C(=O)O MCULE-3210241958 [1,0,0,1,0,0|1,0,1]=4 2220 B8R1.7 C1(CCNC1)C(=O)O MCULE-6517290754 [1,0,0,1,0,0|1,0,1]=4 2221 B8R1.7 O=C(O)C1C=CCN1 MCULE-2141949922 [1,0,0,1,0,0|1,0,1]=4 2222 B8R1.7 O=C(O)C1C=CCN1 MCULE-3068035697 [1,0,0,1,0,0|1,0,1]=4 2223 B8R1.7 O=C(O)C1C=CCN1 MCULE-4825351403 [1,0,0,1,0,0|1,0,1]=4 2224 B8R1.7 O=C(O)C1C=CCN1 MCULE-9928071710 [1,0,0,1,0,0|1,0,1]=4 2225 B8R1.7 O=C(O)C1CC=CC1 MCULE-7876630177 [1,0,0,1,0,0|2,0,0]=4 2226 B8R1.7 O=C(O)C1CCCN1 MCULE-2229401513 [1,0,0,1,0,0|1,0,1]=4 2227 B8R1.7 O=C(O)C1CCCN1 MCULE-6305507014 [1,0,0,1,0,0|1,0,1]=4 2228 B8R1.7 O=C(O)C1CCCN1 MCULE-8387491590 [1,0,0,1,0,0|1,0,1]=4 2229 B8R1.7 O=C(O)C1CCCN1 MCULE-8611160929 [1,0,0,1,0,0|1,0,1]=4 2230 B8R1.7 O=C(O)C1CCNC1 MCULE-4976520029 [1,0,0,1,0,0|1,0,1]=4 2231 B8R1.7 O=C(O)C1CCNC1 MCULE-5937045785 [1,0,0,1,0,0|1,0,1]=4 2232 B8R1.7 O=C(O)C1CCNC1 MCULE-6983695276 [1,0,0,1,0,0|1,0,1]=4 2233 B8R1.7 O=C(O)C1COCN1 MCULE-4997392610 [1,0,0,1,0,0|2,0,0]=4 2234 B8R1.7 O=C(O)C1COCN1 MCULE-7001651226 [1,0,0,1,0,0|2,0,0]=4 2235 B8R1.7 O=C(O)C1CSCN1 MCULE-2391637686 [1,0,0,1,0,0|2,0,0]=4 2236 B8R1.7 O=C(O)C1CSCN1 MCULE-9622331370 [1,0,0,1,0,0|2,0,0]=4 2237 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-2515045579 [1,0,0,1,0,0|1,0,1]=4 2238 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-3589058117 [1,0,0,1,0,0|1,0,1]=4 2239 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-7995918745 [1,0,0,1,0,0|1,0,1]=4 2240 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-8155212892 [1,0,0,1,0,0|1,0,1]=4 2241 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-1020921088 [1,0,0,1,0,0|1,0,1]=4 2242 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6398060480 [1,0,0,1,0,0|1,0,1]=4 2243 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6772131264 [1,0,0,1,0,0|1,0,1]=4 2244 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-8415049837 [1,0,0,1,0,0|1,0,1]=4 2245 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-3068007507 [1,0,0,1,0,0|1,0,1]=4 2246 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4477578687 [1,0,0,1,0,0|1,0,1]=4 2247 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4524201006 [1,0,0,1,0,0|1,0,1]=4 2248 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4868292658 [1,0,0,1,0,0|1,0,1]=4 2249 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1547472283 [1,0,0,1,0,0|2,0,0]=4 2250 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1876089066 [1,0,0,1,0,0|2,0,0]=4 2251 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1926856350 [1,0,0,1,0,0|2,0,0]=4 2252 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-9876695932 [1,0,0,1,0,0|2,0,0]=4 2253 B8R1.7 O=C(O)[C@@H]1CSCN1 MCULE-4243406881 [1,0,0,1,0,0|2,0,0]=4 2254 B8R1.7 O=C(O)[C@@H]1CSCN1 MCULE-6343154165 [1,0,0,1,0,0|2,0,0]=4 2255 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-2145380755 [1,0,0,1,0,0|1,0,1]=4 2256 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-5768283844 [1,0,0,1,0,0|1,0,1]=4 2257 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-8522372891 [1,0,0,1,0,0|1,0,1]=4 2258 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-5856142508 [1,0,0,1,0,0|1,0,1]=4 2259 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-7748032436 [1,0,0,1,0,0|1,0,1]=4 2260 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2003400674 [1,0,0,1,0,0|1,0,1]=4 2261 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2851087395 [1,0,0,1,0,0|1,0,1]=4 2262 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7223432888 [1,0,0,1,0,0|1,0,1]=4 2263 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7610384670 [1,0,0,1,0,0|1,0,1]=4 2264 B8R1.7 O=C(O)[C@H]1CSCN1 MCULE-6095527710 [1,0,0,1,0,0|2,0,0]=4 2265 B8R1.7 O=C(O)[C@H]1CSCN1 MCULE-9117444908 [1,0,0,1,0,0|2,0,0]=4 2266 B8R1.23 C1(CC(=O)N1)C(=O)O MCULE-3416083471 [1,0,0,1,0,0|0,0,0]=2 2267 B8R1.23 C=C1CC(C1)C(=O)O MCULE-6435857280 [1,0,0,1,0,0|2,0,0]=4 2268 B8R1.23 CC1CC(N1)C(=O)O MCULE-2803934033 [1,0,0,1,0,0|1,0,1]=4 2269 B8R1.23 C[C@@H]1C[C@H](N1)C(=O)O MCULE-6318758002 [1,0,0,1,0,0|1,0,1]=4 2270 B8R1.23 C[C@H]1C[C@H](N1)C(=O)O MCULE-2969381793 [1,0,0,1,0,0|1,0,1]=4 2271 B8R1.23 NC1CC(C1)C(=O)O MCULE-8750839632 [1,0,0,1,0,0|1,0,1]=4 2272 B8R1.23 NC1CC(C1)C(=O)O MCULE-9051964103 [1,0,0,1,0,0|1,0,1]=4 2273 B8R1.23 N[C@H]1C[C@@H](C1)C(=O)O MCULE-1844060803 [1,0,0,1,0,0|1,0,1]=4 2274 B8R1.23 N[C@H]1C[C@@H](C1)C(=O)O MCULE-2707924504 [1,0,0,1,0,0|1,0,1]=4 2275 B8R1.23 N[C@H]1C[C@H](C1)C(=O)O MCULE-3847725342 [1,0,0,1,0,0|1,0,1]=4 2276 B8R1.23 N[C@H]1C[C@H](C1)C(=O)O MCULE-4578532365 [1,0,0,1,0,0|1,0,1]=4 2277 B8R1.23 O=C1CC(C1)C(=O)Cl MCULE-5261758509 [1,0,0,1,0,0|2,0,0]=4 2278 B8R1.23 O=C1CC(C1)C(=O)O MCULE-8672788982 [1,0,0,1,0,0|1,0,0]=3 2279 B8R1.23 O=C1CC(N1)C(=O)O MCULE-3167823583 [1,0,0,1,0,0|0,0,0]=2 2280 B8R1.23 O=C1CC(O1)C(=O)O MCULE-1791104685 [1,0,0,1,0,0|1,0,0]=3 2281 B8R1.23 O=C1C[C@@H](N1)C(=O)O MCULE-2118093307 [1,0,0,1,0,0|0,0,0]=2 2282 B8R1.23 O=C1C[C@@H](N1)C(=O)O MCULE-7784171286 [1,0,0,1,0,0|0,0,0]=2 2283 B8R1.23 O=C1C[C@H](N1)C(=O)O MCULE-1255798587 [1,0,0,1,0,0|0,0,0]=2 2284 B8R1.23 O=C1C[C@H](N1)C(=O)O MCULE-6947698869 [1,0,0,1,0,0|0,0,0]=2 2285 B8R1.54 C(N)(C(=O)O)C1CC1 MCULE-4833544032 [1,0,0,1,0,0|1,0,1]=4 2286 B8R1.54 NC(C(=O)O)C1CC1 MCULE-1974514713 [1,0,0,1,0,0|1,0,1]=4 2287 B8R1.54 NC(C(=O)O)C1CC1 MCULE-3126466096 [1,0,0,1,0,0|1,0,1]=4 2288 B8R1.54 N[C@@H](C(=O)O)C1CC1 MCULE-5662004537 [1,0,0,1,0,0|1,0,1]=4 2289 B8R1.54 N[C@@H](C(=O)O)C1CC1 MCULE-9004548949 [1,0,0,1,0,0|1,0,1]=4 2290 B8R1.54 N[C@H](C(=O)O)C1CC1 MCULE-4323013494 [1,0,0,1,0,0|1,0,1]=4 2291 B8R1.54 N[C@H](C(=O)O)C1CC1 MCULE-9475774396 [1,0,0,1,0,0|1,0,1]=4 2292 B8R1.78 NC1(CCC1)C(=O)O MCULE-7741753062 [1,0,0,1,0,0|1,0,1]=4 2293 B8R1.78 NC1(CCC1)C(=O)O MCULE-8986168461 [1,0,0,1,0,0|1,0,1]=4 2294 B8R1.78 NC1(CNC1)C(=O)O MCULE-1078717796 [1,0,0,1,0,0|2,0,0]=4 2295 B8R1.78 NC1(CNC1)C(=O)O MCULE-1597584418 [1,0,0,1,0,0|2,0,0]=4 2296 B8R1.78 NC1(COC1)C(=O)O MCULE-2048452241 [1,0,0,1,0,0|2,0,0]=4 2297 B8R1.78 NC1(CSC1)C(=O)O MCULE-3865165435 [1,0,0,1,0,0|2,0,0]=4 2298 B8R1.78 NC1(CSC1)C(=O)O MCULE-7335919130 [1,0,0,1,0,0|2,0,0]=4 2299 B8R1.3 CC1=NNC(=O)CC1 MCULE-3548202908 [1,0,0,1,0,0|2,0,0]=4 2300 B8R1.3 O=C1CCC(=O)CC1 MCULE-5432049567 [1,0,0,1,0,0|2,0,0]=4 2301 B8R1.3 O=C1CCC(=O)NC1 MCULE-8297515560 [1,0,0,1,0,0|1,0,0]=3 2302 B8R1.3 O=C1CCC(=O)NN1 MCULE-3404255918 [1,0,0,1,0,0|1,0,0]=3 2303 B8R1.3 O=C1CCC(=O)OC1 MCULE-5478039984 [1,0,0,1,0,0|1,0,0]=3 2304 B8R1.3 O=C1CCC(CN1)O MCULE-4501886280 [1,0,0,1,0,0|1,0,1]=4 2305 B8R1.3 O=C1CC[C@@H](CN1)O MCULE-3426407148 [1,0,0,1,0,0|1,0,1]=4 2306 B8R1.3 O=C1CC[C@@H](CN1)O MCULE-9592320749 [1,0,0,1,0,0|1,0,1]=4 2307 B8R1.3 O=C1CC[C@H](CN1)O MCULE-1500705916 [1,0,0,1,0,0|1,0,1]=4 2308 B8R1.3 O=C1CC[C@H](CN1)O MCULE-9578240246 [1,0,0,1,0,0|1,0,1]=4 2309 B8R1.3 O=C1CNC(=O)CN1 MCULE-7134033861 [1,0,0,1,0,0|2,0,0]=4 2310 B8R1.3 O=C1COC(=O)CN1 MCULE-4171313774 [1,0,0,1,0,0|2,0,0]=4 2311 B8R1.3 O=C1COC(=O)CO1 MCULE-8927291216 [1,0,0,1,0,0|2,0,0]=4 2312 B8R1.50 CC1C(=O)COC1=O MCULE-4188541096 [0,0,0,1,1,0|2,0,0]=4 2313 B8R1.50 NN1C(=O)CNC1=O MCULE-3172416594 [0,0,0,1,1,0|2,0,0]=4 2314 B8R1.50 NN1C(=O)NNC1=O MCULE-6234762498 [0,0,0,1,1,0|2,0,0]=4 2315 B8R1.50 N[C@@H]1C(=O)NC[C@H]1O MCULE-6840872048 [0,0,0,1,1,0|1,0,1]=4 2316 B8R1.50 O=C1COC(=O)C1Br MCULE-7458581655 [0,0,0,1,1,0|2,0,0]=4 2317 B8R1.50 O=C1COC(=O)C1Cl MCULE-1326411169 [0,0,0,1,1,0|2,0,0]=4 2318 B10R1.13 CC1=CCC(CN1)C(=O)O MCULE-6736360947 [0,0,0,1,0,1|2,0,0]=4 2319 B10R1.13 NC1=NCC(CN1)C(=O)O MCULE-5846461385 [0,0,0,1,0,1|2,0,0]=4 2320 B10R1.13 NC1=NCC(CN1)C(=O)O MCULE-7792293428 [0,0,0,1,0,1|2,0,0]=4 2321 B10R1.13 O=C1CCC(=NN1)C(=O)O MCULE-1818973372 [0,0,0,1,0,1|0,0,2]=4 2322 B10R1.13 O=C1CCC(CC1)C(=O)O MCULE-3268045048 [0,0,0,1,0,1|2,0,0]=4 2323 B10R1.13 O=C1CCC(CN1)C(=O)O MCULE-9788917215 [0,0,0,1,0,1|1,0,0]=3 2324 B10R1.13 O=C1CCC(NC1)C(=O)O MCULE-4067834062 [0,0,0,1,0,1|1,0,0]=3 2325 B10R1.13 O=C1CCC(NC1)C(=O)O MCULE-8147757527 [0,0,0,1,0,1|1,0,0]=3 2326 B10R1.13 O=C1CC[C@@H](CN1)C(=O)O MCULE-3191286949 [0,0,0,1,0,1|1,0,0]=3 2327 B10R1.13 O=C1CC[C@@H](CN1)C(=O)O MCULE-9692186311 [0,0,0,1,0,1|1,0,0]=3 2328 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-4350301488 [0,0,0,1,0,1|1,0,0]=3 2329 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-6122427477 [0,0,0,1,0,1|1,0,0]=3 2330 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-7864506900 [0,0,0,1,0,1|1,0,0]=3 2331 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-8690683788 [0,0,0,1,0,1|1,0,0]=3 2332 B10R1.13 O=C1CC[C@H](CN1)C(=O)O MCULE-6590332785 [0,0,0,1,0,1|1,0,0]=3 2333 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-2845724258 [0,0,0,1,0,1|1,0,0]=3 2334 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-4534690891 [0,0,0,1,0,1|1,0,0]=3 2335 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-5755683417 [0,0,0,1,0,1|1,0,0]=3 2336 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-6015971784 [0,0,0,1,0,1|1,0,0]=3 2337 B10R1.13 O=C1CNC(CN1)C(=O)O MCULE-1011618274 [0,0,0,1,0,1|1,0,0]=3 2338 B10R1.13 O=C1CNC(CN1)C(=O)O MCULE-9345081526 [0,0,0,1,0,1|1,0,0]=3 2339 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-1270509503 [0,0,0,1,0,1|1,0,0]=3 2340 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-5912128916 [0,0,0,1,0,1|1,0,0]=3 2341 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-6974754540 [0,0,0,1,0,1|1,0,0]=3 2342 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-9137341829 [0,0,0,1,0,1|1,0,0]=3 2343 B10R1.13 O=C1CN[C@H](CN1)C(=O)O MCULE-8928326150 [0,0,0,1,0,1|1,0,0]=3 2344 B10R1.349 CC(=O)N1CC(C1)C(=O)O MCULE-3908865552 [0,0,0,1,0,1|2,0,0]=4 2345 B10R1.349 NC(=O)N1CC(C1)C(=O)O MCULE-3854559032 [0,0,0,1,0,1|1,0,0]=3 2346 B10R1.349 O=C(O)C1CC(C1)C(=O)O MCULE-7515334695 [0,0,0,1,0,1|2,0,0]=4 2347 B10R1.349 O=C(O)C1CC(N1)C(=O)O MCULE-2441047831 [0,0,0,1,0,1|1,0,0]=3 2348 B10R1.349 O=C(O)[C@H]1C[C@@H](C1)C(=O)O MCULE-7021077384 [0,0,0,1,0,1|2,0,0]=4 2349 B10R1.349 O=C(O)[C@H]1C[C@H](C1)C(=O)O MCULE-2423808428 [0,0,0,1,0,1|2,0,0]=4 2350 B10R1.359 O=C(O)C1CCS(=O)(=O)N1 MCULE-5768819085 [0,0,0,1,0,1|2,0,0]=4 2351 B10R1.360 CC1(CC1C(=O)O)C(=O)O MCULE-1315514899 [0,0,0,1,0,1|2,0,0]=4 2352 B10R1.470 CC1(CCC(=O)C1)C(=O)O MCULE-8301527257 [0,0,0,1,0,1|2,0,0]=4 2353 B10R1.470 CC1(CCC(=O)N1)C(=O)O MCULE-6271364258 [0,0,0,1,0,1|1,0,0]=3 2354 B10R1.470 CC1(CCC(=O)O1)C(=O)O MCULE-2009596037 [0,0,0,1,0,1|2,0,0]=4 2355 B10R1.470 CC1(CNC(=O)C1)C(=O)O MCULE-2188595466 [0,0,0,1,0,1|2,0,0]=4 2356 B10R1.470 C[C@@]1(CCC(=O)N1)C(=O)O MCULE-6399167225 [0,0,0,1,0,1|1,0,0]=3 2357 B10R1.470 C[C@@]1(CCC(=O)N1)C(=O)O MCULE-7144294782 [0,0,0,1,0,1|1,0,0]=3 2358 B10R1.470 C[C@]1(CCC(=O)N1)C(=O)O MCULE-6153592913 [0,0,0,1,0,1|1,0,0]=3 2359 B10R1.470 C[C@]1(CCC(=O)N1)C(=O)O MCULE-6971506580 [0,0,0,1,0,1|1,0,0]=3 2360 B10R1.54 O=C(O)CC1=CC(=O)NN1 MCULE-5112159197 [0,0,0,1,0,1|0,0,2]=4 2361 B10R1.54 O=C(O)CC1CCC(=O)C1 MCULE-8065311815 [0,0,0,1,0,1|2,0,0]=4 2362 B10R1.54 O=C(O)CC1CNC(=O)C1 MCULE-1228415378 [0,0,0,1,0,1|1,0,0]=3 2363 B10R1.54 O=C(O)CC1COC(=O)C1 MCULE-9024324984 [0,0,0,1,0,1|2,0,0]=4 2364 B10R1.54 O=C(O)C[C@H]1CCC(=O)C1 MCULE-1700675888 [0,0,0,1,0,1|2,0,0]=4 2365 B10R1.54 O=C(O)C[C@H]1CCC(=O)C1 MCULE-3179723751 [0,0,0,1,0,1|2,0,0]=4 2366 B10R1.54 O=C(O)C[C@H]1COC(=O)N1 MCULE-1807368276 [0,0,0,1,0,1|2,0,0]=4 2367 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 2368 B10R1.59 CC1CC(=O)NC1C(=O)O MCULE-1142843058 [0,0,0,1,0,1|1,0,0]=3 2369 B10R1.59 CC1OC(=O)NC1C(=O)O MCULE-7595794618 [0,0,0,1,0,1|2,0,0]=4 2370 B10R1.59 C[C@@H]1CC(=O)N[C@@H]1C(=O)O MCULE-5687745727 [0,0,0,1,0,1|1,0,0]=3 2371 B10R1.59 C[C@@H]1CC(=O)N[C@H]1C(=O)O MCULE-3978079245 [0,0,0,1,0,1|1,0,0]=3 2372 B10R1.59 C[C@H]1CC(=O)N[C@@H]1C(=O)O MCULE-1352855018 [0,0,0,1,0,1|1,0,0]=3 2373 B10R1.59 C[C@H]1CC(=O)N[C@H]1C(=O)O MCULE-6205979547 [0,0,0,1,0,1|1,0,0]=3 2374 B10R1.282 CC1C(C1C(=O)O)C(=O)O MCULE-6282240195 [0,0,0,1,0,1|2,0,0]=4 2375 B10R1.442 NC(=O)NC1(CC1)C(=O)O MCULE-5553928485 [0,1,0,1,0,0|2,0,0]=4 2376 B10R1.442 O=C(O)CC1(CC1)C(=O)O MCULE-5389842845 [0,1,0,1,0,0|2,0,0]=4 2377 B10R1.566 NC1(CS(=O)(=O)C1)C(=O)O MCULE-6225932613 [0,1,0,1,0,0|2,0,0]=4 2378 B10R1.14 C1(CCC(=O)C1)C(=O)OC MCULE-8334918383 [0,1,0,1,0,0|2,0,0]=4 2379 B10R1.14 C=C1CNC(C1)C(=O)OC MCULE-4635683717 [0,1,0,1,0,0|2,0,0]=4 2380 B10R1.14 C=C1CNC(C1)C(=O)OC MCULE-9917502383 [0,1,0,1,0,0|2,0,0]=4 2381 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-2960661877 [0,1,0,1,0,0|2,0,0]=4 2382 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-3356870567 [0,1,0,1,0,0|2,0,0]=4 2383 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-5709460460 [0,1,0,1,0,0|2,0,0]=4 2384 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-5969395974 [0,1,0,1,0,0|2,0,0]=4 2385 B10R1.14 COC(=O)C1=NNC(=O)C1 MCULE-7707554064 [0,1,0,1,0,0|0,0,2]=4 2386 B10R1.14 COC(=O)C1C=CC(=O)C1 MCULE-4348671758 [0,1,0,1,0,0|2,0,0]=4 2387 B10R1.14 COC(=O)C1CC(=O)CO1 MCULE-2471814999 [0,1,0,1,0,0|2,0,0]=4 2388 B10R1.14 COC(=O)C1CCC(=O)C1 MCULE-5952382453 [0,1,0,1,0,0|2,0,0]=4 2389 B10R1.14 COC(=O)C1CNC(=O)C1 MCULE-5678646707 [0,1,0,1,0,0|1,0,0]=3 2390 B10R1.14 COC(=O)C1CNC(=O)O1 MCULE-2096777093 [0,1,0,1,0,0|2,0,0]=4 2391 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 MCULE-7952909342 [0,1,0,1,0,0|2,0,0]=4 2392 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 MCULE-8638772412 [0,1,0,1,0,0|2,0,0]=4 2393 B10R1.14 COC(=O)[C@@H]1CNC(=O)C1 MCULE-9225925550 [0,1,0,1,0,0|1,0,0]=3 2394 B10R1.14 COC(=O)[C@@H]1CNC(=O)N1 MCULE-4832270504 [0,1,0,1,0,0|2,0,0]=4 2395 B10R1.14 COC(=O)[C@@H]1CNC(=O)O1 MCULE-1667021734 [0,1,0,1,0,0|2,0,0]=4 2396 B10R1.14 COC(=O)[C@@H]1CNC(=O)O1 MCULE-9531113453 [0,1,0,1,0,0|2,0,0]=4 2397 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)N MCULE-5029881504 [0,1,0,1,0,0|1,0,1]=4 2398 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 MCULE-6859943891 [0,1,0,1,0,0|2,0,0]=4 2399 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 MCULE-7172592478 [0,1,0,1,0,0|2,0,0]=4 2400 B10R1.14 COC(=O)[C@H]1CNC(=O)C1 MCULE-9231955159 [0,1,0,1,0,0|1,0,0]=3 2401 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)N MCULE-2819941028 [0,1,0,1,0,0|1,0,1]=4 2402 B10R1.14 [C@@H]1(CNC(=O)C1)C(=O)OC MCULE-5277165389 [0,1,0,1,0,0|1,0,0]=3 2403 B10R1.14 [C@H]1(CNC(=O)C1)C(=O)OC MCULE-1672375650 [0,1,0,1,0,0|1,0,0]=3 2404 B10R1.194 CC1=C(NNC1=O)C(=O)O MCULE-2982850514 [0,1,0,1,0,0|0,0,2]=4 2405 B10R1.194 CC1C(=O)OCC1C(=O)O MCULE-8491867617 [0,1,0,1,0,0|2,0,0]=4 2406 B10R1.194 CN1C(=O)NCC1C(=O)O MCULE-2621049135 [0,1,0,1,0,0|2,0,0]=4 2407 B10R1.408 CNC(=O)C1CC1C(=O)N MCULE-3144651005 [0,1,0,1,0,0|2,0,0]=4 2408 B10R1.408 CNC(=O)C1CC1C(=O)O MCULE-5991575859 [0,1,0,1,0,0|1,0,0]=3 2409 B10R1.408 CNC(=O)[C@H]1C[C@@H]1C(=O)O MCULE-5485938531 [0,1,0,1,0,0|1,0,0]=3 2410 B10R1.408 COC(=O)C1CC1C(=O)C MCULE-9692510329 [0,1,0,1,0,0|2,0,0]=4 2411 B10R1.408 COC(=O)C1CC1C(=O)O MCULE-7866234212 [0,1,0,1,0,0|2,0,0]=4 2412 B10R1.408 COC(=O)[C@@H]1C[C@@H]1C(=O)O MCULE-3699835184 [0,1,0,1,0,0|2,0,0]=4 2413 B10R1.408 COC(=O)[C@@H]1C[C@@H]1C(=O)O MCULE-8154738068 [0,1,0,1,0,0|2,0,0]=4 2414 B10R1.408 COC(=O)[C@@H]1C[C@H]1C(=O)O MCULE-5512209759 [0,1,0,1,0,0|2,0,0]=4 2415 B10R1.408 COC(=O)[C@@H]1C[C@H]1C(=O)O MCULE-9728286418 [0,1,0,1,0,0|2,0,0]=4 2416 B10R1.408 COC(=O)[C@H]1C[C@@H]1C(=O)O MCULE-2394122729 [0,1,0,1,0,0|2,0,0]=4 2417 B10R1.408 COC(=O)[C@H]1C[C@H]1C(=O)O MCULE-9017164187 [0,1,0,1,0,0|2,0,0]=4 2418 B10R1.408 [C@H]1(C[C@H]1C(=O)OC)C(=O)O MCULE-5989838336 [0,1,0,1,0,0|2,0,0]=4 2419 B10R1.424 COC(=O)C1(CC(=O)C1)C MCULE-2114624885 [0,1,0,1,0,0|2,0,0]=4 2420 B10R1.424 COC(=O)C1(CC(=O)C1)F MCULE-3044103306 [0,1,0,1,0,0|2,0,0]=4 2421 B10R1.113 CC(=O)C1CCNC(=O)C1 MCULE-9774471516 [0,1,0,1,0,0|2,0,0]=4 2422 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-2725116552 [0,1,0,1,0,0|2,0,0]=4 2423 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-7493333189 [0,1,0,1,0,0|2,0,0]=4 2424 B10R1.113 O=C1C=CCC(C1)C(=O)O MCULE-3511234259 [0,1,0,1,0,0|2,0,0]=4 2425 B10R1.113 O=C1CC(CCN1)C(=O)O MCULE-8037650535 [0,1,0,1,0,0|1,0,0]=3 2426 B10R1.113 O=C1CC(CNN1)C(=O)O MCULE-4653652849 [0,1,0,1,0,0|0,0,0]=2 2427 B10R1.113 O=C1CC(CNN1)C(=O)O MCULE-5555795045 [0,1,0,1,0,0|0,0,0]=2 2428 B10R1.113 O=C1CCCC(C1)C(=O)O MCULE-6286773194 [0,1,0,1,0,0|2,0,0]=4 2429 B10R1.113 O=C1CCC[C@@H](C1)C(=O)O MCULE-5396925186 [0,1,0,1,0,0|2,0,0]=4 2430 B10R1.113 O=C1CCC[C@H](C1)C(=O)O MCULE-8936667281 [0,1,0,1,0,0|2,0,0]=4 2431 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-6916176336 [0,1,0,1,0,0|1,0,0]=3 2432 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-9262761817 [0,1,0,1,0,0|1,0,0]=3 2433 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-1115212106 [0,1,0,1,0,0|1,0,0]=3 2434 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5896394571 [0,1,0,1,0,0|1,0,0]=3 2435 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5937606037 [0,1,0,1,0,0|1,0,0]=3 2436 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-7073629862 [0,1,0,1,0,0|1,0,0]=3 2437 B10R1.113 O=C1CNCC(N1)C(=O)O MCULE-4117148380 [0,1,0,1,0,0|2,0,0]=4 2438 B10R1.113 O=C1CNC[C@@H](N1)C(=O)O MCULE-3006600193 [0,1,0,1,0,0|2,0,0]=4 2439 B10R1.113 O=C1CNC[C@H](N1)C(=O)O MCULE-4345470043 [0,1,0,1,0,0|2,0,0]=4 2440 B10R1.113 O=C1C[C@@H](CCN1)C(=O)O MCULE-5205458306 [0,1,0,1,0,0|1,0,0]=3 2441 B10R1.113 O=C1C[C@H](CCN1)C(=O)O MCULE-6254957663 [0,1,0,1,0,0|1,0,0]=3 2442 B10R1.113 O=C1C[C@H](CCN1)C(=O)O MCULE-9670666580 [0,1,0,1,0,0|1,0,0]=3 2443 B10R1.113 O=C1NCCC(N1)C(=O)O MCULE-6196729766 [0,1,0,1,0,0|2,0,0]=4 2444 B10R1.113 O=C1NCCC(O1)C(=O)O MCULE-1272116406 [0,1,0,1,0,0|2,0,0]=4 2445 B10R1.234 N#CC1(CC(=O)C1)C(=O)O MCULE-7934005669 [0,1,0,1,0,0|1,0,1]=4 2446 B10R1.361 NC(=O)C1CCC1C(=O)O MCULE-3903818494 [0,1,0,1,0,0|1,0,0]=3 2447 B10R1.361 NC(=O)[C@H]1CC[C@H]1C(=O)N MCULE-7732298882 [0,1,0,1,0,0|2,0,0]=4 2448 B10R1.361 O=C(O)C1CCC1C(=O)O MCULE-6136792366 [0,1,0,1,0,0|2,0,0]=4 2449 B10R1.361 O=C(O)[C@@H]1CC[C@H]1C(=O)O MCULE-2743190923 [0,1,0,1,0,0|2,0,0]=4 2450 B10R1.361 O=C(O)[C@@H]1CC[C@H]1C(=O)O MCULE-6841335407 [0,1,0,1,0,0|2,0,0]=4 2451 B10R1.361 O=C(O)[C@H]1CC[C@@H]1C(=O)O MCULE-3432000151 [0,1,0,1,0,0|2,0,0]=4 2452 B10R1.361 O=C(O)[C@H]1CC[C@@H]1C(=O)O MCULE-6937334278 [0,1,0,1,0,0|2,0,0]=4 2453 B10R1.361 O=C(O)[C@H]1CC[C@H]1C(=O)O MCULE-8609403409 [0,1,0,1,0,0|2,0,0]=4 2454 B10R1.361 [C@@H]1(CC[C@@H]1C(=O)O)C(=O)O MCULE-4637916300 [0,1,0,1,0,0|2,0,0]=4 2455 B10R1.31 NC[C@@H]1CN[C@@H](C1)C(=O)O MCULE-2543185174 [0,1,0,1,0,0|1,0,1]=4 2456 B10R1.31 NC[C@@H]1CN[C@@H](C1)C(=O)O MCULE-5699643655 [0,1,0,1,0,0|1,0,1]=4 2457 B8R0.28 C=C(Br)CCCC(=O)O MCULE-5394609034 [1,0,0,0,0,1|2,0,0]=4 2458 B8R0.28 C=C(C)CCCC(=O)O MCULE-1282031449 [1,0,0,0,0,1|2,0,0]=4 2459 B8R0.28 C=C(Cl)CCCC(=O)O MCULE-9525654231 [1,0,0,0,0,1|2,0,0]=4 2460 B8R0.28 CC(=CCCC(=O)O)C MCULE-5848388333 [1,0,0,0,0,1|2,0,0]=4 2461 B8R0.28 CC(=O)CC=CC(=O)O MCULE-9526483708 [1,0,0,0,0,1|1,0,1]=4 2462 B8R0.28 CC(=O)CCCC(=O)C MCULE-9250637004 [1,0,0,0,0,1|2,0,0]=4 2463 B8R0.28 CC(=O)CCCC(=O)N MCULE-8753142022 [1,0,0,0,0,1|1,0,0]=3 2464 B8R0.28 CC(=O)CCCC(=O)O MCULE-2498129200 [1,0,0,0,0,1|1,0,0]=3 2465 B8R0.28 CC(=O)CCOC(=O)C MCULE-5123903575 [1,0,0,0,0,1|2,0,0]=4 2466 B8R0.28 CC(=O)COCC(=O)C MCULE-1945925794 [1,0,0,0,0,1|2,0,0]=4 2467 B8R0.28 CC(=O)NCCC(=O)N MCULE-6090839432 [1,0,0,0,0,1|1,0,0]=3 2468 B8R0.28 CC(=O)NCCC(=O)O MCULE-8867286578 [1,0,0,0,0,1|1,0,0]=3 2469 B8R0.28 CC(=O)OCCC(=O)O MCULE-6617841906 [1,0,0,0,0,1|1,0,0]=3 2470 B8R0.28 CC(=O)SCCC(=O)Cl MCULE-7772328654 [1,0,0,0,0,1|2,0,0]=4 2471 B8R0.28 CC(=O)SCCC(=O)O MCULE-2263963171 [1,0,0,0,0,1|1,0,0]=3 2472 B8R0.28 N=C(N)NCCC(=O)O MCULE-6783592689 [1,0,0,0,0,1|1,0,0]=3 2473 B8R0.28 N=C(N)SCCC(=O)O MCULE-6820090813 [1,0,0,0,0,1|1,0,0]=3 2474 B8R0.28 N=C(N)SCCC(=O)O MCULE-9820250060 [1,0,0,0,0,1|1,0,0]=3 2475 B8R0.28 N=C(S)NCCC(=O)O MCULE-7149670288 [1,0,0,0,0,1|0,1,1]=4 2476 B8R0.28 NC(=O)CCCC(=O)N MCULE-8380308624 [1,0,0,0,0,1|1,0,0]=3 2477 B8R0.28 NC(=O)CCCC(=O)O MCULE-9714346244 [1,0,0,0,0,1|0,0,0]=2 2478 B8R0.28 NC(=O)CCCN(=O)=O MCULE-8220881093 [1,0,0,0,0,1|1,0,1]=4 2479 B8R0.28 NC(=O)CNCC(=O)N MCULE-7451569201 [1,0,0,0,0,1|1,0,0]=3 2480 B8R0.28 NC(=O)CNCC(=O)O MCULE-2816922286 [1,0,0,0,0,1|0,0,0]=2 2481 B8R0.28 NC(=O)COCC(=O)O MCULE-3868584388 [1,0,0,0,0,1|0,0,0]=2 2482 B8R0.28 NC(=O)CSCC(=O)N MCULE-1673116541 [1,0,0,0,0,1|1,0,0]=3 2483 B8R0.28 NC(=O)CSCC(=O)O MCULE-1419621262 [1,0,0,0,0,1|0,0,0]=2 2484 B8R0.28 NC(=O)NC=CC(=O)O MCULE-5004188805 [1,0,0,0,0,1|0,0,2]=4 2485 B8R0.28 NC(=O)NCCC(=O)O MCULE-3799706782 [1,0,0,0,0,1|0,0,0]=2 2486 B8R0.28 NC(=O)NCNC(=O)N MCULE-2324881355 [1,0,0,0,0,1|2,0,0]=4 2487 B8R0.28 NC(=O)NN=CC(=O)O MCULE-1954165276 [1,0,0,0,0,1|1,0,1]=4 2488 B8R0.28 NC(=S)SCCC(=O)O MCULE-1371836153 [1,0,0,0,0,1|0,1,0]=3 2489 B8R0.28 O=C(Cl)CCCC(=O)Cl MCULE-6157663188 [1,0,0,0,0,1|2,0,0]=4 2490 B8R0.28 O=C(Cl)COCC(=O)Cl MCULE-4828514058 [1,0,0,0,0,1|2,0,0]=4 2491 B8R0.28 O=C(O)/C=C/CC(=O)O MCULE-3754065542 [1,0,0,0,0,1|1,0,1]=4 2492 B8R0.28 O=C(O)C=CCC(=O)O MCULE-2034660220 [1,0,0,0,0,1|1,0,1]=4 2493 B8R0.28 O=C(O)CCCC(=O)O MCULE-4286022994 [1,0,0,0,0,1|1,0,0]=3 2494 B8R0.28 O=C(O)CCCN(=O)=O MCULE-2601801792 [1,0,0,0,0,1|2,0,0]=4 2495 B8R0.28 O=C(O)CNCC(=O)O MCULE-4131542591 [1,0,0,0,0,1|1,0,0]=3 2496 B8R0.28 O=C(O)COCC(=O)O MCULE-5687758679 [1,0,0,0,0,1|1,0,0]=3 2497 B8R0.28 O=C(O)CSCC(=O)O MCULE-8112166808 [1,0,0,0,0,1|1,0,0]=3 2498 B8R0.28 O=C([O-])CCCC(=O)[O-] MCULE-3809476672 [1,0,0,0,0,1|1,0,1]=4 2499 B8R0.28 O=C([O-])CNCC(=O)[O-] MCULE-1067264838 [1,0,0,0,0,1|1,0,1]=4 2500 B8R0.28 O=C([O-])COCC(=O)O MCULE-3773620396 [1,0,0,0,0,1|1,0,0]=3 2501 B8R0.28 O=C([O-])COCC(=O)O MCULE-5768077440 [1,0,0,0,0,1|1,0,0]=3 2502 B8R0.28 [NH2+](CC(=O)N)CC(=O)N MCULE-7548046822 [1,0,0,0,0,1|1,0,0]=3 2503 B10R0.96 CC(CCC(=O)O)CC(=O)O MCULE-7386549049 [0,0,0,0,0,2|2,0,0]=4 2504 B10R0.96 C[C@H](CCC(=O)O)CC(=O)O MCULE-1721699813 [0,0,0,0,0,2|2,0,0]=4 2505 B10R0.96 C[C@H](CCC(=O)O)CC(=O)O MCULE-7525360323 [0,0,0,0,0,2|2,0,0]=4 2506 B10R0.96 NC(=O)CCC(N)CC(=O)O MCULE-3003314518 [0,0,0,0,0,2|0,0,0]=2 2507 B10R0.96 NC(=O)CCC(N)CC(=O)O MCULE-7683510788 [0,0,0,0,0,2|0,0,0]=2 2508 B10R0.96 NC(=O)CC[C@@H](N)CC(=O)O MCULE-8316748928 [0,0,0,0,0,2|0,0,0]=2 2509 B10R0.96 NC(=O)CC[C@@H](N)CC(=O)O MCULE-8667775229 [0,0,0,0,0,2|0,0,0]=2 2510 B10R0.96 NC(=O)CC[C@H](N)CC(=O)O MCULE-2836546299 [0,0,0,0,0,2|0,0,0]=2 2511 B10R0.96 NC(=O)CC[C@H](N)CC(=O)O MCULE-4298371176 [0,0,0,0,0,2|0,0,0]=2 2512 B10R0.96 NC(=O)CC[C@H](N)CC(=O)O MCULE-4441176096 [0,0,0,0,0,2|0,0,0]=2 2513 B10R0.96 NC(=O)CC[C@H](N)CC(=O)O MCULE-5599562900 [0,0,0,0,0,2|0,0,0]=2 2514 B10R0.96 NC(CCC(=O)O)CC(=O)O MCULE-8155260586 [0,0,0,0,0,2|1,0,0]=3 2515 B10R0.96 NC(CCC(=O)O)CC(=O)O MCULE-8574900055 [0,0,0,0,0,2|1,0,0]=3 2516 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-5068946859 [0,0,0,0,0,2|1,0,0]=3 2517 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-8151605170 [0,0,0,0,0,2|1,0,0]=3 2518 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-8505675120 [0,0,0,0,0,2|1,0,0]=3 2519 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-9871725008 [0,0,0,0,0,2|1,0,0]=3 2520 B10R0.96 N[C@H](CCC(=O)O)CC(=O)O MCULE-3923729315 [0,0,0,0,0,2|1,0,0]=3 2521 B10R0.96 N[C@H](CCC(=O)O)CC(=O)O MCULE-6851763365 [0,0,0,0,0,2|1,0,0]=3 2522 B10R0.98 CC(=O)CCCC(C)C(=O)O MCULE-5760169093 [0,0,0,0,0,2|2,0,0]=4 2523 B10R0.98 CC(=O)NCC[C@H](N)C(=O)O MCULE-5384056558 [0,0,0,0,0,2|1,0,0]=3 2524 B10R0.98 CC(=O)NCC[C@H](N)C(=O)O MCULE-9151560319 [0,0,0,0,0,2|1,0,0]=3 2525 B10R0.98 CC(=O)OCCC(N)C(=O)O MCULE-7691334763 [0,0,0,0,0,2|1,0,0]=3 2526 B10R0.98 CC(=O)OCCC(N)C(=O)O MCULE-9993433450 [0,0,0,0,0,2|1,0,0]=3 2527 B10R0.98 CC(=O)OCC[C@H](N)C(=O)O MCULE-5425852779 [0,0,0,0,0,2|1,0,0]=3 2528 B10R0.98 CC(=O)OCC[C@H](N)C(=O)O MCULE-6909234177 [0,0,0,0,0,2|1,0,0]=3 2529 B10R0.98 N=C(N)NCCC(N)C(=O)O MCULE-2234773343 [0,0,0,0,0,2|1,0,0]=3 2530 B10R0.98 N=C(N)NCCC(N)C(=O)O MCULE-9635728361 [0,0,0,0,0,2|1,0,0]=3 2531 B10R0.98 N=C(N)NCC[C@H](N)C(=O)O MCULE-5360635274 [0,0,0,0,0,2|1,0,0]=3 2532 B10R0.98 N=C(N)NCC[C@H](N)C(=O)O MCULE-7633853490 [0,0,0,0,0,2|1,0,0]=3 2533 B10R0.98 NC(CCCC(=O)O)C(=O)O MCULE-3021567253 [0,0,0,0,0,2|1,0,0]=3 2534 B10R0.98 NC(CCCC(=O)O)C(=O)O MCULE-7434229402 [0,0,0,0,0,2|1,0,0]=3 2535 B10R0.98 NC(CCCC(=O)O)C(=O)O MCULE-8474963048 [0,0,0,0,0,2|1,0,0]=3 2536 B10R0.98 NC(CSCC(=O)O)C(=O)O MCULE-1997609241 [0,0,0,0,0,2|1,0,0]=3 2537 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O MCULE-1991686030 [0,0,0,0,0,2|1,0,0]=3 2538 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O MCULE-6053925503 [0,0,0,0,0,2|1,0,0]=3 2539 B10R0.98 N[C@@H](CSC=C(Cl)Cl)C(=O)O MCULE-5838139886 [0,0,0,0,0,2|2,0,0]=4 2540 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O MCULE-3291004829 [0,0,0,0,0,2|1,0,0]=3 2541 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O MCULE-3828091379 [0,0,0,0,0,2|1,0,0]=3 2542 B10R0.98 N[C@H](CCCC(=O)O)C(=O)O MCULE-3179500404 [0,0,0,0,0,2|1,0,0]=3 2543 B10R0.98 N[C@H](CCCC(=O)O)C(=O)O MCULE-9722366772 [0,0,0,0,0,2|1,0,0]=3 2544 B10R0.98 O=C(O)CCCC(O)C(=O)O MCULE-5970708862 [0,0,0,0,0,2|2,0,0]=4 2545 B10R0.98 O=C(O)CCC[C@H](O)C(=O)O MCULE-4157551693 [0,0,0,0,0,2|2,0,0]=4