0 B9R0.39 C#CC(NC(C)=O)C(=O)O Amb27411184 [0,0,0,0,0,0|1,0,1]=2 1 B9R0.39 C#C[C@@H](NC(C)=O)C(=O)O Amb27393972 [0,0,0,0,0,0|1,0,1]=2 2 B9R0.39 C=C(C)CC(C#N)C(=O)O Amb35741470 [0,0,0,0,0,0|3,0,1]=4 3 B9R0.39 C=C(C)CC(CC)C(C)=O Amb28060802 [0,0,0,0,0,0|4,0,0]=4 4 B9R0.39 C=C(C)CC(OC)C(=O)O Amb26386702 [0,0,0,0,0,0|4,0,0]=4 5 B9R0.39 C=C(C)C[C@@H](CC)C(=O)O Amb27785162 [0,0,0,0,0,0|3,0,0]=3 6 B9R0.39 C=C(C)\C=C(/CC)C(=O)O Amb28457972 [0,0,0,0,0,0|3,0,1]=4 7 B9R0.39 C=C(Cl)C(CCl)OC(C)=O Amb27798060 [0,0,0,0,0,0|4,0,0]=4 8 B9R0.39 C=C[C@@H](NC(C)=O)C(=O)O Amb28050121 [0,0,0,0,0,0|1,0,1]=2 9 B9R0.39 CC(=N)N[C@@H](CO)C(=O)O Amb27192588 [0,0,0,0,0,0|1,0,0]=1 10 B9R0.39 CC(=O)C(CCl)OC(=O)Cl Amb28118995 [0,0,0,0,0,0|4,0,0]=4 11 B9R0.39 CC(=O)CC(C=O)C(=O)O Amb28048038 [0,0,0,0,0,0|1,0,2]=3 12 B9R0.39 CC(=O)C\C(=N\O)C(C)=O Amb27256458 [0,0,0,0,0,0|3,0,1]=4 13 B9R0.39 CC(=O)NC(C#N)C(N)=O Amb1046298 [0,0,0,0,0,0|2,0,1]=3 14 B9R0.39 CC(=O)NC(C=O)C(N)=O Amb27240214 [0,0,0,0,0,0|1,0,2]=3 15 B9R0.39 CC(=O)NC(CBr)C(C)C Amb27162063 [0,0,0,0,0,0|3,0,1]=4 16 B9R0.39 CC(=O)NC(CCl)C(=O)O Amb27494110 [0,0,0,0,0,0|1,0,0]=1 17 B9R0.39 CC(=O)NC(CCl)C(C)C Amb27614887 [0,0,0,0,0,0|3,0,1]=4 18 B9R0.39 CC(=O)NC(CI)C(C)C Amb27803581 [0,0,0,0,0,0|3,0,1]=4 19 B9R0.39 CC(=O)NC(CN)C(=O)O Amb28128874 [0,0,0,0,0,0|1,0,0]=1 20 B9R0.39 CC(=O)NC(CO)C(=O)O Amb1115493 [0,0,0,0,0,0|0,0,0]=0 21 B9R0.39 CC(=O)NC(CO)C(C)C Amb17102545 [0,0,0,0,0,0|2,0,1]=3 22 B9R0.39 CC(=O)NC(CO)C(N)=O Amb4018749 [0,0,0,0,0,0|1,0,0]=1 23 B9R0.39 CC(=O)NC(CS)C(=O)O Amb1112748 [0,0,0,0,0,0|0,1,0]=1 24 B9R0.39 CC(=O)NC(CS)C(N)=O Amb24482241 [0,0,0,0,0,0|1,1,0]=2 25 B9R0.39 CC(=O)N[C@@H](CO)C(=O)O Amb22746917 [0,0,0,0,0,0|0,0,0]=0 26 B9R0.39 CC(=O)N[C@@H](CO)C(N)=O Amb28461160 [0,0,0,0,0,0|1,0,0]=1 27 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O Amb2684240 [0,0,0,0,0,0|0,1,0]=1 28 B9R0.39 CC(=O)N[C@@H](CS)C(N)=O Amb24183864 [0,0,0,0,0,0|1,1,0]=2 29 B9R0.39 CC(=O)N[C@H](CCl)C(=O)O Amb27171775 [0,0,0,0,0,0|1,0,0]=1 30 B9R0.39 CC(=O)N[C@H](CS)C(=O)O Amb25887589 [0,0,0,0,0,0|0,1,0]=1 31 B9R0.39 CC(=O)N[C@H](CS)C(N)=O Amb27232938 [0,0,0,0,0,0|1,1,0]=2 32 B9R0.39 CC(=O)N\C(=C\Br)C(=O)O Amb27451991 [0,0,0,0,0,0|1,0,2]=3 33 B9R0.39 CC(=O)N\C(=C\N)C(C)=O Amb28060035 [0,0,0,0,0,0|2,0,2]=4 34 B9R0.39 CC(=O)OC(C=O)C(C)=O Amb27798281 [0,0,0,0,0,0|2,0,2]=4 35 B9R0.39 CC(=O)OC(CCl)C(=O)O Amb27796012 [0,0,0,0,0,0|2,0,0]=2 36 B9R0.39 CC(=O)OC(CCl)C(C)O Amb27815074 [0,0,0,0,0,0|3,0,1]=4 37 B9R0.39 CC(=O)O[C@@H](CN)C(=O)O Amb27874054 [0,0,0,0,0,0|2,0,0]=2 38 B9R0.39 CC(=O)O\C(=C\O)C(C)=O Amb27493442 [0,0,0,0,0,0|2,0,2]=4 39 B9R0.39 CC(C)CC(CN)C(=O)O Amb19021764 [0,0,0,0,0,0|3,0,1]=4 40 B9R0.39 CC(C)CC(CN)C(=O)O Amb28555451 [0,0,0,0,0,0|3,0,1]=4 41 B9R0.39 CC(C)CC(CO)C(=O)O Amb18124780 [0,0,0,0,0,0|2,0,1]=3 42 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756732 [0,0,0,0,0,0|3,0,1]=4 43 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756740 [0,0,0,0,0,0|3,0,1]=4 44 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb26390781 [0,0,0,0,0,0|3,0,1]=4 45 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb32620226 [0,0,0,0,0,0|3,0,1]=4 46 B9R0.39 CC(C)NC(CN)C(=O)O Amb28291039 [0,0,0,0,0,0|2,0,1]=3 47 B9R0.39 CC(C)NC(CO)C(=O)O Amb26046487 [0,0,0,0,0,0|1,0,1]=2 48 B9R0.39 CC(C)NC(CO)C(N)=O Amb27838044 [0,0,0,0,0,0|2,0,1]=3 49 B9R0.39 CC(C)NC(CS)C(=O)O Amb27233014 [0,0,0,0,0,0|1,1,1]=3 50 B9R0.39 CC(C)N[C@@H](CS)C(=O)O Amb25299344 [0,0,0,0,0,0|1,1,1]=3 51 B9R0.39 CC(C)S[C@@H](CN)C(=O)O Amb27444140 [0,0,0,0,0,0|3,0,1]=4 52 B9R0.39 CC(Cl)CC(CN)C(=O)O Amb28396430 [0,0,0,0,0,0|3,0,1]=4 53 B9R0.39 CC(N)NC(CS)C(=O)O Amb27792112 [0,0,0,0,0,0|1,1,1]=3 54 B9R0.39 CCC(CC(=O)Cl)C(=O)Cl Amb26921552 [0,0,0,0,0,0|4,0,0]=4 55 B9R0.39 CCC(CC(=O)O)C(=O)O Amb10071696 [0,0,0,0,0,0|3,0,0]=3 56 B9R0.39 CCC(CC(C)=O)C(=O)O Amb18644109 [0,0,0,0,0,0|2,0,0]=2 57 B9R0.39 CCC(CC(C)=O)C(C)=O Amb27403023 [0,0,0,0,0,0|3,0,0]=3 58 B9R0.39 CCC(CC(C)C)C(=O)O Amb19014184 [0,0,0,0,0,0|3,0,1]=4 59 B9R0.39 CCC(CC(C)O)C(=O)O Amb27254121 [0,0,0,0,0,0|2,0,2]=4 60 B9R0.39 CCC(NC(C)=O)C(=O)O Amb2099651 [0,0,0,0,0,0|1,0,0]=1 61 B9R0.39 CCC(NC(C)=O)C(C)=O Amb28348733 [0,0,0,0,0,0|2,0,0]=2 62 B9R0.39 CCC(NC(C)C)C(=O)O Amb28555426 [0,0,0,0,0,0|2,0,1]=3 63 B9R0.39 CCC(NC(C)C)C(=O)O Amb9620437 [0,0,0,0,0,0|2,0,1]=3 64 B9R0.39 CCC(NC(N)=O)C(=N)N Amb27839111 [0,0,0,0,0,0|4,0,0]=4 65 B9R0.39 CCC(NC(N)=O)C(=O)O Amb435947 [0,0,0,0,0,0|2,0,0]=2 66 B9R0.39 CCC(NS(C)=O)C(C)O Amb27265997 [0,0,0,0,0,0|3,0,1]=4 67 B9R0.39 CCC(OC(C)=O)C(=O)Cl Amb28059233 [0,0,0,0,0,0|3,0,0]=3 68 B9R0.39 CCC(OC(C)=O)C(N)=O Amb25274332 [0,0,0,0,0,0|3,0,0]=3 69 B9R0.39 CCC(OC(N)=O)C(=O)O Amb28283574 [0,0,0,0,0,0|3,0,0]=3 70 B9R0.39 CCC(SC(C)C)C(=O)O Amb17501347 [0,0,0,0,0,0|3,0,1]=4 71 B9R0.39 CCN(NC(N)=O)C(C)=O Amb27229465 [0,0,0,0,0,0|4,0,0]=4 72 B9R0.39 CC[C@@H](CC(=O)O)C(=O)O Amb27830576 [0,0,0,0,0,0|3,0,0]=3 73 B9R0.39 CC[C@@H](CC(C)C)C(=O)O Amb28397993 [0,0,0,0,0,0|3,0,1]=4 74 B9R0.39 CC[C@@H](NC(C)=O)C(=O)O Amb3941467 [0,0,0,0,0,0|1,0,0]=1 75 B9R0.39 CC[C@H](CC(=O)O)C(=O)O Amb24643194 [0,0,0,0,0,0|3,0,0]=3 76 B9R0.39 CC[C@H](NC(C)=O)C(=O)O Amb3990111 [0,0,0,0,0,0|1,0,0]=1 77 B9R0.39 CC[C@H](OC(C)=O)C(=O)O Amb27948340 [0,0,0,0,0,0|2,0,0]=2 78 B9R0.39 CC\C(=C/C(=O)O)C(=O)O Amb27421975 [0,0,0,0,0,0|3,0,1]=4 79 B9R0.39 CC\C(=C/C(C)=O)C(C)=O Amb27878926 [0,0,0,0,0,0|3,0,1]=4 80 B9R0.39 CNC(CC(=O)O)C(=O)O Amb1905634 [0,0,0,0,0,0|4,0,0]=4 81 B9R0.39 CNC(CC(=O)O)C(=O)O Amb30867747 [0,0,0,0,0,0|4,0,0]=4 82 B9R0.39 CNC(CC(N)=O)C(=O)O Amb18644255 [0,0,0,0,0,0|4,0,0]=4 83 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O Amb3499450 [0,0,0,0,0,0|4,0,0]=4 84 B9R0.39 CN[C@H](CC(=O)O)C(=O)O Amb8515692 [0,0,0,0,0,0|4,0,0]=4 85 B9R0.39 CN[C@H](CC(N)=O)C(=O)O Amb28049962 [0,0,0,0,0,0|4,0,0]=4 86 B9R0.39 COC(C=C(C)C)C(=O)O Amb20621506 [0,0,0,0,0,0|4,0,0]=4 87 B9R0.39 CO[C@H](CC(=O)O)C(=O)O Amb27849552 [0,0,0,0,0,0|4,0,0]=4 88 B9R0.39 CS(=O)NC(CO)C(=O)O Amb28193924 [0,0,0,0,0,0|1,0,0]=1 89 B9R0.39 CSC(CC(=O)O)C(=O)O Amb18646024 [0,0,0,0,0,0|4,0,0]=4 90 B9R0.39 C[C@@H](O)[C@@H](CO)NS(C)=O Amb27251023 [0,0,0,0,0,0|2,0,1]=3 91 B9R0.39 C\C(Cl)=C/C(ON)C(=O)O Amb27252200 [0,0,0,0,0,0|4,0,0]=4 92 B9R0.39 C\C=C(/OC(C)=O)C(=O)O Amb27759731 [0,0,0,0,0,0|2,0,2]=4 93 B9R0.39 C\C=C(\NC(C)=O)C(=O)O Amb27781271 [0,0,0,0,0,0|1,0,2]=3 94 B9R0.39 N#CC(NC(N)=O)C(N)=O Amb17593581 [0,0,0,0,0,0|3,0,1]=4 95 B9R0.39 N=C(N)NC(CS)C(=O)O Amb24711320 [0,0,0,0,0,0|2,1,0]=3 96 B9R0.39 N=CC(CC(=O)O)C(=O)O Amb27653604 [0,0,0,0,0,0|3,0,1]=4 97 B9R0.39 NC(=O)CC(CO)C(=O)O Amb28411495 [0,0,0,0,0,0|2,0,0]=2 98 B9R0.39 NC(=O)CC(NO)C(=O)O Amb27168203 [0,0,0,0,0,0|3,0,0]=3 99 B9R0.39 NC(=O)C[C@H](NO)C(=O)O Amb28364297 [0,0,0,0,0,0|3,0,0]=3 100 B9R0.39 NC(=O)NC(CF)C(=O)O Amb28187932 [0,0,0,0,0,0|2,0,0]=2 101 B9R0.39 NC(=O)NC(CO)C(=O)O Amb1055147 [0,0,0,0,0,0|1,0,0]=1 102 B9R0.39 NC(=O)NC(CS)C(=O)O Amb1119403 [0,0,0,0,0,0|1,1,0]=2 103 B9R0.39 NC(=O)N[C@@H](CF)C(=O)O Amb26454171 [0,0,0,0,0,0|2,0,0]=2 104 B9R0.39 NC(=O)N[C@@H](CS)C(=O)O Amb17610484 [0,0,0,0,0,0|1,1,0]=2 105 B9R0.39 NC(N)=N[C@@H](CS)C(=O)O Amb26850870 [0,0,0,0,0,0|2,1,1]=4 106 B9R0.39 NCC(CC(=O)O)C(=O)O Amb22546423 [0,0,0,0,0,0|3,0,0]=3 107 B9R0.39 NCC(CC(=O)O)C(=O)O Amb24538047 [0,0,0,0,0,0|3,0,0]=3 108 B9R0.39 NNC(CC(=O)O)C(=O)O Amb28070991 [0,0,0,0,0,0|4,0,0]=4 109 B9R0.39 NN[C@@H](CC(=O)O)C(=O)O Amb24117193 [0,0,0,0,0,0|4,0,0]=4 110 B9R0.39 O=C(O)CC(CBr)C(=O)O Amb22752144 [0,0,0,0,0,0|3,0,0]=3 111 B9R0.39 O=C(O)CC(CF)C(=O)O Amb33379249 [0,0,0,0,0,0|3,0,0]=3 112 B9R0.39 O=C(O)CC(NCl)C(=O)O Amb27953217 [0,0,0,0,0,0|4,0,0]=4 113 B9R0.39 O=C(O)CC(NO)C(=O)O Amb24685872 [0,0,0,0,0,0|3,0,0]=3 114 B9R0.39 O=C(O)CC(NS)C(=O)O Amb25808901 [0,0,0,0,0,0|3,1,0]=4 115 B9R0.39 O=C(O)C[C@H](NCl)C(=O)O Amb27401859 [0,0,0,0,0,0|4,0,0]=4 116 B9R0.39 O=C(O)C[C@H](NO)C(=O)O Amb24117497 [0,0,0,0,0,0|3,0,0]=3 117 B9R0.39 O=C(O)C[C@H](NO)C(=O)O Amb24630025 [0,0,0,0,0,0|3,0,0]=3 118 B9R0.39 O=C(O)C\C(=N/O)C(=O)O Amb24117074 [0,0,0,0,0,0|3,0,1]=4 119 B9R0.39 O=C(O)C\C(=N\O)C(=O)O Amb27828721 [0,0,0,0,0,0|3,0,1]=4 120 B8R0.15 C=CC(\C=C\C)C(=O)O Amb27214636 [1,0,0,0,0,0|2,0,1]=4 121 B8R0.15 C=CCC(CC)C(=O)O Amb18642632 [1,0,0,0,0,0|2,0,1]=4 122 B8R0.15 C=CCC(NO)C(=O)O Amb27768789 [1,0,0,0,0,0|2,0,1]=4 123 B8R0.15 CC(C)[C@@H](CO)NC=O Amb27799099 [1,0,0,0,0,0|2,0,1]=4 124 B8R0.15 CC=C=C(CC)C(=O)O Amb28289600 [1,0,0,0,0,0|2,0,1]=4 125 B8R0.15 CCC(COC)C(=O)O Amb18124352 [1,0,0,0,0,0|3,0,0]=4 126 B8R0.15 CCC(CSC)C(=O)O Amb33272061 [1,0,0,0,0,0|3,0,0]=4 127 B8R0.15 CCC(N=C=O)C(=O)O Amb33471298 [1,0,0,0,0,0|1,0,2]=4 128 B8R0.15 CCC(NC#N)C(=O)O Amb35634498 [1,0,0,0,0,0|2,0,1]=4 129 B8R0.15 CCC(NC=O)C(=O)O Amb4016839 [1,0,0,0,0,0|1,0,0]=2 130 B8R0.15 CCC(OC=O)C(C)=O Amb27590416 [1,0,0,0,0,0|3,0,0]=4 131 B8R0.15 CCC(SSC)C(=O)O Amb27236075 [1,0,0,0,0,0|3,0,0]=4 132 B8R0.15 CCCC(CC)C(=O)O Amb19009626 [1,0,0,0,0,0|2,0,1]=4 133 B8R0.15 CCCC(CF)C(=O)O Amb27186472 [1,0,0,0,0,0|2,0,1]=4 134 B8R0.15 CCCC(CN)C(=O)O Amb19373497 [1,0,0,0,0,0|2,0,1]=4 135 B8R0.15 CCCC(CO)C(=O)O Amb25881510 [1,0,0,0,0,0|1,0,1]=3 136 B8R0.15 CCCC(NO)C(=O)O Amb22372057 [1,0,0,0,0,0|2,0,1]=4 137 B8R0.15 CCC[C@@H](CO)C(=O)O Amb24571859 [1,0,0,0,0,0|1,0,1]=3 138 B8R0.15 CCC[C@H](CN)C(=O)O Amb27460612 [1,0,0,0,0,0|2,0,1]=4 139 B8R0.15 CCC[C@H](CO)C(=O)O Amb25063310 [1,0,0,0,0,0|1,0,1]=3 140 B8R0.15 CCNC(CC)C(=O)O Amb33339265 [1,0,0,0,0,0|1,0,1]=3 141 B8R0.15 CCNC(CC)C(=O)O Amb9620054 [1,0,0,0,0,0|1,0,1]=3 142 B8R0.15 CCNC(CC)C(N)=O Amb19006590 [1,0,0,0,0,0|2,0,1]=4 143 B8R0.15 CCN[C@@H](CC)C(=O)O Amb26019582 [1,0,0,0,0,0|1,0,1]=3 144 B8R0.15 CCN[C@H](CC)C(=O)O Amb33347493 [1,0,0,0,0,0|1,0,1]=3 145 B8R0.15 CCOC(CC)C(=O)O Amb9675410 [1,0,0,0,0,0|2,0,1]=4 146 B8R0.15 CCOC(CS)C(=O)O Amb19037339 [1,0,0,0,0,0|1,1,1]=4 147 B8R0.15 CCSC(CC)C(=O)O Amb9675503 [1,0,0,0,0,0|2,0,1]=4 148 B8R0.15 CC[C@@H](N=C=O)C(=O)O Amb33471357 [1,0,0,0,0,0|1,0,2]=4 149 B8R0.15 CC[C@@H](NC#N)C(=O)O Amb35634501 [1,0,0,0,0,0|2,0,1]=4 150 B8R0.15 CC[C@H](NC#N)C(=O)O Amb35634500 [1,0,0,0,0,0|2,0,1]=4 151 B8R0.15 CNCC(CO)C(=O)O Amb26352745 [1,0,0,0,0,0|2,0,0]=3 152 B8R0.15 CNCC(CO)C(=O)O Amb32661056 [1,0,0,0,0,0|2,0,0]=3 153 B8R0.15 COCC(CN)C(=O)O Amb27219429 [1,0,0,0,0,0|3,0,0]=4 154 B8R0.15 COCC(NO)C(=O)O Amb27247213 [1,0,0,0,0,0|3,0,0]=4 155 B8R0.15 CSCC(CN)C(=O)O Amb33272062 [1,0,0,0,0,0|3,0,0]=4 156 B8R0.15 C\C=C\[C@@H](CC)C(=O)O Amb28388676 [1,0,0,0,0,0|2,0,0]=3 157 B8R0.15 C\C=N\[C@H](CO)C(=O)O Amb28423512 [1,0,0,0,0,0|0,0,1]=2 158 B8R0.15 N#CC(NC=O)C(=O)O Amb27444484 [1,0,0,0,0,0|1,0,1]=3 159 B8R0.15 N#CC(NC=O)C(N)=O Amb27201234 [1,0,0,0,0,0|2,0,1]=4 160 B8R0.15 N#CNC(CO)C(=O)O Amb35634506 [1,0,0,0,0,0|1,0,1]=3 161 B8R0.15 N#CN[C@@H](CO)C(=O)O Amb35634510 [1,0,0,0,0,0|1,0,1]=3 162 B8R0.15 N#CN[C@H](CO)C(=O)O Amb35634508 [1,0,0,0,0,0|1,0,1]=3 163 B8R0.15 O=C(O)C(CO)CCF Amb27876842 [1,0,0,0,0,0|2,0,1]=4 164 B8R0.15 O=C(O)[C@H](CS)NCO Amb27980938 [1,0,0,0,0,0|0,1,2]=4 165 B8R0.15 O=C=NC(CS)C(=O)O Amb33471296 [1,0,0,0,0,0|0,1,2]=4 166 B8R0.15 O=CNC(CO)C(=O)O Amb18290435 [1,0,0,0,0,0|0,0,0]=1 167 B8R0.15 O=CNC(CS)C(=O)O Amb20093366 [1,0,0,0,0,0|0,1,0]=2 168 B8R0.15 O=CN[C@H](CO)C(=O)O Amb28248397 [1,0,0,0,0,0|0,0,0]=1 169 B8R0.15 [N-]=[N+]=N[C@@H](CO)C(=O)O Amb27956143 [1,0,0,0,0,0|2,0,1]=4 170 B8R0.15 [N-]=[N+]=N[C@@H](CO)C(=O)O Amb32620210 [1,0,0,0,0,0|2,0,1]=4 171 B8R0.15 [N-]=[N+]=N[C@H](CO)C(=O)O Amb32620243 [1,0,0,0,0,0|2,0,1]=4 172 B8R0.16 C#CC(CO)NC(C)=O Amb28052706 [1,0,0,0,0,0|1,0,1]=3 173 B8R0.16 C=CC(C=C(C)C)CO Amb28049116 [1,0,0,0,0,0|3,0,0]=4 174 B8R0.16 C=CC(CC)OC(C)=O Amb24325174 [1,0,0,0,0,0|3,0,0]=4 175 B8R0.16 C=C\C(=N/O)NC(C)=O Amb25249213 [1,0,0,0,0,0|2,0,1]=4 176 B8R0.16 CC(=O)CC(C=O)C=O Amb25767018 [1,0,0,0,0,0|1,0,2]=4 177 B8R0.16 CC(=O)NC(C=O)CO Amb27816982 [1,0,0,0,0,0|0,0,0]=1 178 B8R0.16 CC(=O)NC(CO)CO Amb25127062 [1,0,0,0,0,0|0,0,1]=2 179 B8R0.16 CC(=O)N[C@@H](CO)CS Amb27393209 [1,0,0,0,0,0|0,1,1]=3 180 B8R0.16 CC(=O)N\C(C=O)=C/N Amb28287330 [1,0,0,0,0,0|1,0,2]=4 181 B8R0.16 CC(=O)OC(C=O)C=O Amb28184717 [1,0,0,0,0,0|1,0,2]=4 182 B8R0.16 CC(=O)OC(CO)CBr Amb28286806 [1,0,0,0,0,0|2,0,1]=4 183 B8R0.16 CC(=O)O[C@H](CO)CCl Amb27945582 [1,0,0,0,0,0|2,0,1]=4 184 B8R0.16 CC(=S)NC(CO)CO Amb27489764 [1,0,0,0,0,0|0,1,1]=3 185 B8R0.16 CC(C)NC(CO)CO Amb24636514 [1,0,0,0,0,0|1,0,2]=4 186 B8R0.16 CCC(C#N)NC(C)=O Amb27837460 [1,0,0,0,0,0|2,0,1]=4 187 B8R0.16 CCC(C=O)CC(C)=O Amb18642641 [1,0,0,0,0,0|2,0,0]=3 188 B8R0.16 CCC(CC)NC(C)=O Amb3886548 [1,0,0,0,0,0|2,0,1]=4 189 B8R0.16 CCC(CN)NC(C)=O Amb18112590 [1,0,0,0,0,0|2,0,1]=4 190 B8R0.16 CCC(CO)NS(C)=O Amb27862014 [1,0,0,0,0,0|2,0,1]=4 191 B8R0.16 CC[C@@H](C#N)NC(C)=O Amb27450708 [1,0,0,0,0,0|2,0,1]=4 192 B8R0.16 CC[C@@H](CO)NC(C)=O Amb27251985 [1,0,0,0,0,0|1,0,1]=3 193 B8R0.16 CC[C@@H](CO)NS(C)=O Amb27227790 [1,0,0,0,0,0|2,0,1]=4 194 B8R0.16 CC[C@@H](CO)OC(C)=O Amb27879395 [1,0,0,0,0,0|2,0,1]=4 195 B8R0.16 CC[C@H](C=O)CC(=O)[O-] Amb28198369 [1,0,0,0,0,0|3,0,0]=4 196 B8R0.16 C\C=C(/CC)NC(C)=O Amb28208259 [1,0,0,0,0,0|2,0,1]=4 197 B8R0.16 NC(=O)NC(CO)CO Amb27814601 [1,0,0,0,0,0|1,0,1]=3 198 B8R0.23 BC(CC(=O)O)C(=O)O Amb28287358 [1,0,0,0,0,0|3,0,0]=4 199 B8R0.23 C=C(C)C(C)CC(C)=O Amb27607290 [1,0,0,0,0,0|3,0,0]=4 200 B8R0.23 C=C(C)C(O)CC(C)=O Amb27605750 [1,0,0,0,0,0|3,0,0]=4 201 B8R0.23 C=C(C)CC(C)C(=O)O Amb24471924 [1,0,0,0,0,0|2,0,0]=3 202 B8R0.23 C=C(C)CC(C)C(C)=O Amb28203090 [1,0,0,0,0,0|3,0,0]=4 203 B8R0.23 C=C(C)CC(N)C(=O)O Amb6280366 [1,0,0,0,0,0|3,0,0]=4 204 B8R0.23 C=C(C)CC(O)C(=O)O Amb24534477 [1,0,0,0,0,0|2,0,0]=3 205 B8R0.23 C=C(C)C[C@@H](C)C(=O)O Amb24340253 [1,0,0,0,0,0|2,0,0]=3 206 B8R0.23 C=C(C)C[C@@H](N)C(=O)O Amb22801689 [1,0,0,0,0,0|3,0,0]=4 207 B8R0.23 C=C(C)C[C@H](C)C(=O)O Amb10843988 [1,0,0,0,0,0|2,0,0]=3 208 B8R0.23 C=C(C)C[C@H](N)C(=O)O Amb25757900 [1,0,0,0,0,0|3,0,0]=4 209 B8R0.23 C=C(C)OC(C)C(C)=O Amb27838756 [1,0,0,0,0,0|3,0,0]=4 210 B8R0.23 C=C(C)[C@@H](O)CC(C)=O Amb26477424 [1,0,0,0,0,0|3,0,0]=4 211 B8R0.23 C=C(C)[C@H](O)CC(C)=O Amb27409964 [1,0,0,0,0,0|3,0,0]=4 212 B8R0.23 C=C(F)CC(C)C(=O)O Amb27975781 [1,0,0,0,0,0|2,0,1]=4 213 B8R0.23 C=C(NC(C)=O)C(=O)O Amb8513049 [1,0,0,0,0,0|0,0,2]=3 214 B8R0.23 C=C(NC(C)=O)C(N)=O Amb27984135 [1,0,0,0,0,0|1,0,2]=4 215 B8R0.23 CC(=N)NC(C)C(N)=O Amb27412520 [1,0,0,0,0,0|2,0,0]=3 216 B8R0.23 CC(=O)C(C)CC(=O)O Amb18292788 [1,0,0,0,0,0|3,0,0]=4 217 B8R0.23 CC(=O)C(C)NC(N)=O Amb27778024 [1,0,0,0,0,0|2,0,0]=3 218 B8R0.23 CC(=O)C(C)SC(=O)Cl Amb32679654 [1,0,0,0,0,0|3,0,0]=4 219 B8R0.23 CC(=O)C(O)CC(=O)O Amb25341886 [1,0,0,0,0,0|3,0,0]=4 220 B8R0.23 CC(=O)CC(=O)C(=O)O Amb18642736 [1,0,0,0,0,0|1,0,2]=4 221 B8R0.23 CC(=O)CC(C)C(=O)O Amb3939893 [1,0,0,0,0,0|1,0,0]=2 222 B8R0.23 CC(=O)CC(C)C(C)=O Amb26490545 [1,0,0,0,0,0|2,0,0]=3 223 B8R0.23 CC(=O)CC(C)[N+](=O)[O-] Amb27210764 [1,0,0,0,0,0|2,0,1]=4 224 B8R0.23 CC(=O)CC(N)C(=O)O Amb18832532 [1,0,0,0,0,0|2,0,0]=3 225 B8R0.23 CC(=O)CC(N)C(=O)O Amb22546289 [1,0,0,0,0,0|2,0,0]=3 226 B8R0.23 CC(=O)CC(N)C(N)=O Amb27485103 [1,0,0,0,0,0|3,0,0]=4 227 B8R0.23 CC(=O)CC(O)C(=O)O Amb22500917 [1,0,0,0,0,0|1,0,0]=2 228 B8R0.23 CC(=O)CN(C)C(C)=O Amb27267241 [1,0,0,0,0,0|3,0,0]=4 229 B8R0.23 CC(=O)C[C@@H](N)C(=O)O Amb22745939 [1,0,0,0,0,0|2,0,0]=3 230 B8R0.23 CC(=O)C[C@@H](O)C(=O)O Amb26845481 [1,0,0,0,0,0|1,0,0]=2 231 B8R0.23 CC(=O)C[C@H](C)C(=O)O Amb26318005 [1,0,0,0,0,0|1,0,0]=2 232 B8R0.23 CC(=O)C[C@H](C)C(C)=O Amb28051038 [1,0,0,0,0,0|2,0,0]=3 233 B8R0.23 CC(=O)C[C@H](N)C(=O)O Amb27832342 [1,0,0,0,0,0|2,0,0]=3 234 B8R0.23 CC(=O)C[C@H](O)C(=O)O Amb24358758 [1,0,0,0,0,0|1,0,0]=2 235 B8R0.23 CC(=O)NC(=O)C(C)=O Amb28245557 [1,0,0,0,0,0|1,0,2]=4 236 B8R0.23 CC(=O)NC(Br)C(C)=O Amb28285135 [1,0,0,0,0,0|2,0,0]=3 237 B8R0.23 CC(=O)NC(C)B(O)O Amb25125858 [1,0,0,0,0,0|1,0,1]=3 238 B8R0.23 CC(=O)NC(C)C(=O)O Amb9745652 [1,0,0,0,0,0|0,0,0]=1 239 B8R0.23 CC(=O)NC(C)C(C)=O Amb3093787 [1,0,0,0,0,0|1,0,0]=2 240 B8R0.23 CC(=O)NC(C)C(F)F Amb27634551 [1,0,0,0,0,0|2,0,1]=4 241 B8R0.23 CC(=O)NC(C)C(N)=O Amb4018750 [1,0,0,0,0,0|1,0,0]=2 242 B8R0.23 CC(=O)NC(O)C(Cl)Cl Amb3978808 [1,0,0,0,0,0|2,0,1]=4 243 B8R0.23 CC(=O)NN(C)C(N)=S Amb28126743 [1,0,0,0,0,0|2,1,0]=4 244 B8R0.23 CC(=O)N[C@@H](C)B(O)O Amb28397356 [1,0,0,0,0,0|1,0,1]=3 245 B8R0.23 CC(=O)N[C@@H](C)C(=O)O Amb8390375 [1,0,0,0,0,0|0,0,0]=1 246 B8R0.23 CC(=O)N[C@@H](C)C(N)=O Amb22168264 [1,0,0,0,0,0|1,0,0]=2 247 B8R0.23 CC(=O)N[C@H](C)C(=O)O Amb19944277 [1,0,0,0,0,0|0,0,0]=1 248 B8R0.23 CC(=O)N\C(C)=C(\C)[S-] Amb28285580 [1,0,0,0,0,0|1,1,1]=4 249 B8R0.23 CC(=O)OC(C)C(=O)Cl Amb25920188 [1,0,0,0,0,0|2,0,0]=3 250 B8R0.23 CC(=O)OC(C)C(=O)O Amb22360672 [1,0,0,0,0,0|1,0,0]=2 251 B8R0.23 CC(=O)OC(C)C(C)=O Amb4021650 [1,0,0,0,0,0|2,0,0]=3 252 B8R0.23 CC(=O)OC(C)C(C)O Amb28366888 [1,0,0,0,0,0|2,0,1]=4 253 B8R0.23 CC(=O)OC(C)C(N)=O Amb27179906 [1,0,0,0,0,0|2,0,0]=3 254 B8R0.23 CC(=O)ON(C)C(C)=O Amb4017292 [1,0,0,0,0,0|3,0,0]=4 255 B8R0.23 CC(=O)O[C@@H](C)C(=O)Cl Amb3939242 [1,0,0,0,0,0|2,0,0]=3 256 B8R0.23 CC(=O)O[C@@H](C)C(=O)O Amb3938984 [1,0,0,0,0,0|1,0,0]=2 257 B8R0.23 CC(=O)O[C@@H](C)C(C)=O Amb26074254 [1,0,0,0,0,0|2,0,0]=3 258 B8R0.23 CC(=O)O[C@@H](C)C(N)=S Amb28067714 [1,0,0,0,0,0|2,1,0]=4 259 B8R0.23 CC(=O)O[C@@H](C)[C@H](C)O Amb28321279 [1,0,0,0,0,0|2,0,1]=4 260 B8R0.23 CC(=O)O[C@H](C)C(=O)Cl Amb27411067 [1,0,0,0,0,0|2,0,0]=3 261 B8R0.23 CC(=O)O[C@H](C)C(=O)O Amb26458759 [1,0,0,0,0,0|1,0,0]=2 262 B8R0.23 CC(=O)O[C@H](C)C(C)O Amb27192959 [1,0,0,0,0,0|2,0,1]=4 263 B8R0.23 CC(=O)O[C@H](C)C(N)=O Amb27227531 [1,0,0,0,0,0|2,0,0]=3 264 B8R0.23 CC(=O)S[C@@H](C)C(=O)O Amb26639910 [1,0,0,0,0,0|1,0,0]=2 265 B8R0.23 CC(=O)S[C@H](C)C(=O)O Amb28118658 [1,0,0,0,0,0|1,0,0]=2 266 B8R0.23 CC(=O)[C@@H](O)CC(=O)O Amb28398474 [1,0,0,0,0,0|3,0,0]=4 267 B8R0.23 CC(=O)[C@H](C)CC(=O)O Amb25360184 [1,0,0,0,0,0|3,0,0]=4 268 B8R0.23 CC(=O)\C=C(/C)C(=O)O Amb18642577 [1,0,0,0,0,0|1,0,1]=3 269 B8R0.23 CC(=O)\C=C(/C)[PH](=O)O Amb27838812 [1,0,0,0,0,0|2,0,1]=4 270 B8R0.23 CC(=O)\C=C(/N)C(=O)O Amb28206217 [1,0,0,0,0,0|2,0,1]=4 271 B8R0.23 CC(=O)\C=C(/O)C(=O)O Amb28122229 [1,0,0,0,0,0|1,0,1]=3 272 B8R0.23 CC(=O)\C=C(\Br)C(=O)O Amb27419942 [1,0,0,0,0,0|2,0,1]=4 273 B8R0.23 CC(=O)\C=C(\C)[PH](=O)O Amb28248338 [1,0,0,0,0,0|2,0,1]=4 274 B8R0.23 CC(=O)\C=C(\O)C(=O)O Amb25856143 [1,0,0,0,0,0|1,0,1]=3 275 B8R0.23 CC(=O)\N=C(/C)C(C)=O Amb26476592 [1,0,0,0,0,0|1,0,2]=4 276 B8R0.23 CC(=S)NC(C)C(=O)O Amb27876447 [1,0,0,0,0,0|0,1,0]=2 277 B8R0.23 CC(Br)CC(C)C(=O)O Amb27760411 [1,0,0,0,0,0|2,0,1]=4 278 B8R0.23 CC(C)=CC(O)C(=O)O Amb28346343 [1,0,0,0,0,0|2,0,0]=3 279 B8R0.23 CC(C)=C[C@@H](O)C(=O)O Amb27228179 [1,0,0,0,0,0|2,0,0]=3 280 B8R0.23 CC(C)=C[C@H](O)C(=O)O Amb27473652 [1,0,0,0,0,0|2,0,0]=3 281 B8R0.23 CC(C)CC(C)C(=O)O Amb18975244 [1,0,0,0,0,0|2,0,1]=4 282 B8R0.23 CC(C)CC(O)C(=O)O Amb2694726 [1,0,0,0,0,0|2,0,1]=4 283 B8R0.23 CC(C)C[C@@H](C)C(=O)O Amb10844070 [1,0,0,0,0,0|2,0,1]=4 284 B8R0.23 CC(C)C[C@@H](O)C(=O)O Amb8630052 [1,0,0,0,0,0|2,0,1]=4 285 B8R0.23 CC(C)C[C@H](C)C(=O)O Amb10844071 [1,0,0,0,0,0|2,0,1]=4 286 B8R0.23 CC(C)C[C@H](O)C(=O)O Amb16232074 [1,0,0,0,0,0|2,0,1]=4 287 B8R0.23 CC(C)NC(C)C(=O)O Amb10199874 [1,0,0,0,0,0|1,0,1]=3 288 B8R0.23 CC(C)NC(C)C(=O)O Amb1110769 [1,0,0,0,0,0|1,0,1]=3 289 B8R0.23 CC(C)N[C@H](C)C(=O)O Amb26409390 [1,0,0,0,0,0|1,0,1]=3 290 B8R0.23 CC(C)OC(C)C(=O)O Amb10607866 [1,0,0,0,0,0|2,0,1]=4 291 B8R0.23 CC(C)SC(C)C(=O)O Amb6263656 [1,0,0,0,0,0|2,0,1]=4 292 B8R0.23 CC(C)S[C@H](C)C(=O)O Amb27771567 [1,0,0,0,0,0|2,0,1]=4 293 B8R0.23 CC(CC(=O)Cl)C(=O)Cl Amb22167294 [1,0,0,0,0,0|3,0,0]=4 294 B8R0.23 CC(CC(=O)O)C(=O)O Amb1935053 [1,0,0,0,0,0|2,0,0]=3 295 B8R0.23 CC(CC(=O)O)C(N)=O Amb25737942 [1,0,0,0,0,0|3,0,0]=4 296 B8R0.23 CC(CC(N)=O)C(=O)O Amb27596628 [1,0,0,0,0,0|2,0,0]=3 297 B8R0.23 CC(CC(N)=O)C(N)=O Amb2720769 [1,0,0,0,0,0|3,0,0]=4 298 B8R0.23 CC(CN(C)C)C(=O)O Amb8428203 [1,0,0,0,0,0|3,0,0]=4 299 B8R0.23 CC(CN(C)C)C(=O)O Amb9173365 [1,0,0,0,0,0|3,0,0]=4 300 B8R0.23 CC(CN(C)N)C(=O)O Amb28145156 [1,0,0,0,0,0|3,0,0]=4 301 B8R0.23 CC(CS(=O)O)C(=O)O Amb28118949 [1,0,0,0,0,0|3,0,0]=4 302 B8R0.23 CC(CS(C)=O)C(=O)O Amb18974546 [1,0,0,0,0,0|2,0,0]=3 303 B8R0.23 CC(CS(C)=O)C(N)=O Amb27981416 [1,0,0,0,0,0|3,0,0]=4 304 B8R0.23 CC(C[PH](=O)O)C(=O)O Amb27477749 [1,0,0,0,0,0|3,0,0]=4 305 B8R0.23 CC(N)CC(O)C(=O)O Amb27975686 [1,0,0,0,0,0|2,0,1]=4 306 B8R0.23 CC(NC(=N)N)C(=O)Cl Amb27960711 [1,0,0,0,0,0|3,0,0]=4 307 B8R0.23 CC(NC(=N)N)C(=O)O Amb22522920 [1,0,0,0,0,0|2,0,0]=3 308 B8R0.23 CC(NC(=S)S)C(=O)O Amb25336384 [1,0,0,0,0,0|1,1,0]=3 309 B8R0.23 CC(NC(N)=O)C(=O)O Amb9745673 [1,0,0,0,0,0|1,0,0]=2 310 B8R0.23 CC(N[N+](=O)[O-])C(=O)O Amb27873513 [1,0,0,0,0,0|2,0,0]=3 311 B8R0.23 CC(O)C(C)NC(N)=O Amb27254184 [1,0,0,0,0,0|2,0,1]=4 312 B8R0.23 CC(OC(=O)Cl)C(=O)O Amb27241520 [1,0,0,0,0,0|2,0,0]=3 313 B8R0.23 CC(O[N+](=O)[O-])C(=O)O Amb27947983 [1,0,0,0,0,0|3,0,0]=4 314 B8R0.23 CC(\N=C(/N)S)C(=O)O Amb22229340 [1,0,0,0,0,0|1,1,1]=4 315 B8R0.23 CN(C)CC(O)C(=O)O Amb27856754 [1,0,0,0,0,0|3,0,0]=4 316 B8R0.23 CN(C)C[C@H](O)C(=O)O Amb24372674 [1,0,0,0,0,0|3,0,0]=4 317 B8R0.23 CS(=O)CC(N)C(=O)O Amb18125279 [1,0,0,0,0,0|3,0,0]=4 318 B8R0.23 CS(=O)C[C@@H](N)C(=O)O Amb22745418 [1,0,0,0,0,0|3,0,0]=4 319 B8R0.23 CS(=O)C[C@H](N)C(=O)O Amb16232229 [1,0,0,0,0,0|3,0,0]=4 320 B8R0.23 C[C@@H](CC(=O)O)C(=O)O Amb22226742 [1,0,0,0,0,0|2,0,0]=3 321 B8R0.23 C[C@@H](NC(=N)N)C(N)=O Amb28121974 [1,0,0,0,0,0|3,0,0]=4 322 B8R0.23 C[C@@H](NC(N)=O)C(=O)O Amb27242972 [1,0,0,0,0,0|1,0,0]=2 323 B8R0.23 C[C@@H](NC(N)=O)C(N)=O Amb27394390 [1,0,0,0,0,0|2,0,0]=3 324 B8R0.23 C[C@@H](OC(N)=O)C(=O)O Amb35655773 [1,0,0,0,0,0|2,0,0]=3 325 B8R0.23 C[C@H](CC(=O)O)C(=O)O Amb22225399 [1,0,0,0,0,0|2,0,0]=3 326 B8R0.23 C[C@H](CC(=O)O)C(N)=O Amb28133461 [1,0,0,0,0,0|3,0,0]=4 327 B8R0.23 C[C@H](N)C[C@@H](O)C(=O)O Amb27231129 [1,0,0,0,0,0|2,0,1]=4 328 B8R0.23 C[C@H](N)C[C@H](O)C(=O)O Amb27180466 [1,0,0,0,0,0|2,0,1]=4 329 B8R0.23 C[C@H](NC(=N)N)C(=O)O Amb24388432 [1,0,0,0,0,0|2,0,0]=3 330 B8R0.23 C[C@H](NC(=N)N)C(N)=O Amb27484450 [1,0,0,0,0,0|3,0,0]=4 331 B8R0.23 C[C@H](NC(=O)Cl)C(=O)Cl Amb28292733 [1,0,0,0,0,0|2,0,0]=3 332 B8R0.23 C[C@H](NC(N)=O)C(=O)O Amb545023 [1,0,0,0,0,0|1,0,0]=2 333 B8R0.23 C[C@H](NS(C)=O)C(=O)O Amb27212723 [1,0,0,0,0,0|1,0,0]=2 334 B8R0.23 C[S@@](=O)C[C@H](N)C(=O)O Amb35789128 [1,0,0,0,0,0|3,0,0]=4 335 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb33756818 [1,0,0,0,0,0|3,0,0]=4 336 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb35788678 [1,0,0,0,0,0|3,0,0]=4 337 B8R0.23 C\C(=C/C(=O)O)C(=O)O Amb9703112 [1,0,0,0,0,0|2,0,1]=4 338 B8R0.23 C\C(=C/C(N)=O)C(=O)O Amb28060883 [1,0,0,0,0,0|2,0,1]=4 339 B8R0.23 C\C(=C\C(=O)O)C(=O)O Amb8391132 [1,0,0,0,0,0|2,0,1]=4 340 B8R0.23 C\C(Cl)=C/C(C)C(=O)O Amb28285105 [1,0,0,0,0,0|2,0,0]=3 341 B8R0.23 C\C(Cl)=C/C(Cl)C(=O)O Amb28128482 [1,0,0,0,0,0|3,0,0]=4 342 B8R0.23 C\C(N)=N/[C@H](C)C(N)=O Amb28049817 [1,0,0,0,0,0|2,0,1]=4 343 B8R0.23 NC(=O)C(O)CC(=O)[O-] Amb33068981 [1,0,0,0,0,0|3,0,0]=4 344 B8R0.23 NC(=O)CC(Br)C(=O)O Amb26012685 [1,0,0,0,0,0|3,0,0]=4 345 B8R0.23 NC(=O)CC(Cl)C(=O)O Amb27478086 [1,0,0,0,0,0|3,0,0]=4 346 B8R0.23 NC(=O)CC(N)C(=O)O Amb2725509 [1,0,0,0,0,0|3,0,0]=4 347 B8R0.23 NC(=O)CC(N)C(=O)O Amb3940878 [1,0,0,0,0,0|3,0,0]=4 348 B8R0.23 NC(=O)CC(O)C(=O)O Amb27807542 [1,0,0,0,0,0|2,0,0]=3 349 B8R0.23 NC(=O)CC(O)C(N)=O Amb27961515 [1,0,0,0,0,0|3,0,0]=4 350 B8R0.23 NC(=O)CC(S)C(=O)O Amb27494183 [1,0,0,0,0,0|2,1,0]=4 351 B8R0.23 NC(=O)C[C@@H](Br)C(=O)O Amb27858620 [1,0,0,0,0,0|3,0,0]=4 352 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb10071271 [1,0,0,0,0,0|3,0,0]=4 353 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb17749060 [1,0,0,0,0,0|3,0,0]=4 354 B8R0.23 NC(=O)C[C@@H](O)C(=O)O Amb24681022 [1,0,0,0,0,0|2,0,0]=3 355 B8R0.23 NC(=O)C[C@@H](O)C(N)=O Amb27258074 [1,0,0,0,0,0|3,0,0]=4 356 B8R0.23 NC(=O)C[C@@H](S)C(=O)O Amb27234637 [1,0,0,0,0,0|2,1,0]=4 357 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb3940760 [1,0,0,0,0,0|3,0,0]=4 358 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb8513755 [1,0,0,0,0,0|3,0,0]=4 359 B8R0.23 NC(=O)C[C@H](S)C(=O)O Amb27253643 [1,0,0,0,0,0|2,1,0]=4 360 B8R0.23 NC(=O)NC(=O)C(=O)O Amb18124345 [1,0,0,0,0,0|1,0,2]=4 361 B8R0.23 NC(=O)NC(O)C(=O)O Amb24592607 [1,0,0,0,0,0|1,0,0]=2 362 B8R0.23 NC(=O)N[C@@H](O)C(=O)O Amb28287313 [1,0,0,0,0,0|1,0,0]=2 363 B8R0.23 NC(CC(=O)O)C(=O)O Amb9702780 [1,0,0,0,0,0|3,0,0]=4 364 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb34163080 [1,0,0,0,0,0|3,0,0]=4 365 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb3940320 [1,0,0,0,0,0|3,0,0]=4 366 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb20240565 [1,0,0,0,0,0|3,0,0]=4 367 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb22748769 [1,0,0,0,0,0|3,0,0]=4 368 B8R0.23 N[C@H](CC(=O)O)C(=O)O Amb6599992 [1,0,0,0,0,0|3,0,0]=4 369 B8R0.23 O=C(O)C(O)C[N+](=O)[O-] Amb6883775 [1,0,0,0,0,0|3,0,0]=4 370 B8R0.23 O=C(O)CC(Br)C(=O)O Amb3941503 [1,0,0,0,0,0|3,0,0]=4 371 B8R0.23 O=C(O)CC(Cl)C(=O)O Amb9825869 [1,0,0,0,0,0|3,0,0]=4 372 B8R0.23 O=C(O)CC(O)C(=O)O Amb8513238 [1,0,0,0,0,0|2,0,0]=3 373 B8R0.23 O=C(O)CC(S)C(=O)O Amb2779994 [1,0,0,0,0,0|2,1,0]=4 374 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O Amb22504149 [1,0,0,0,0,0|3,0,0]=4 375 B8R0.23 O=C(O)C[C@@H](Cl)C(=O)O Amb20242424 [1,0,0,0,0,0|3,0,0]=4 376 B8R0.23 O=C(O)C[C@@H](F)C(=O)O Amb27173500 [1,0,0,0,0,0|3,0,0]=4 377 B8R0.23 O=C(O)C[C@@H](O)C(=O)O Amb4166311 [1,0,0,0,0,0|2,0,0]=3 378 B8R0.23 O=C(O)C[C@H](Br)C(=O)O Amb8629197 [1,0,0,0,0,0|3,0,0]=4 379 B8R0.23 O=C(O)C[C@H](Cl)C(=O)O Amb20242425 [1,0,0,0,0,0|3,0,0]=4 380 B8R0.23 O=C(O)C[C@H](F)C(=O)O Amb27167819 [1,0,0,0,0,0|3,0,0]=4 381 B8R0.23 O=C(O)C[C@H](O)C(=O)O Amb6599993 [1,0,0,0,0,0|2,0,0]=3 382 B8R0.23 O=C([O-])CC(O)C(=O)[O-] Amb30876864 [1,0,0,0,0,0|2,0,1]=4 383 B8R0.23 O=C([O-])C[C@H](O)C(=O)[O-] Amb22351833 [1,0,0,0,0,0|2,0,1]=4 384 B10R0.23 C#CCC(NC(C)=O)C(=O)O Amb19929448 [0,1,0,0,0,0|1,0,0]=2 385 B10R0.23 C#CCC(NC(C)C)C(=O)O Amb27986652 [0,1,0,0,0,0|2,0,1]=4 386 B10R0.23 C#CCC(NS(C)=O)C(=O)O Amb27272514 [0,1,0,0,0,0|2,0,0]=3 387 B10R0.23 C#CC[C@H](NC(C)=O)C(=O)O Amb27495396 [0,1,0,0,0,0|1,0,0]=2 388 B10R0.23 C=CCC(NC(C)=O)C(=O)O Amb4013580 [0,1,0,0,0,0|1,0,0]=2 389 B10R0.23 C=CCC(NC(N)=O)C(=O)O Amb27990271 [0,1,0,0,0,0|2,0,0]=3 390 B10R0.23 C=CC[C@@H](NC(C)=O)C(=O)O Amb16182994 [0,1,0,0,0,0|1,0,0]=2 391 B10R0.23 C=CC[C@H](NC(C)=O)C(=O)O Amb24270992 [0,1,0,0,0,0|1,0,0]=2 392 B10R0.23 CC#CC(NC(C)=O)C(=O)O Amb27985934 [0,1,0,0,0,0|1,0,1]=3 393 B10R0.23 CC(=O)CC(NC=O)C(=O)O Amb26998851 [0,1,0,0,0,0|1,0,2]=4 394 B10R0.23 CC(=O)NC(CC#N)C(=O)O Amb33127537 [0,1,0,0,0,0|1,0,0]=2 395 B10R0.23 CC(=O)NC(CCF)C(=O)O Amb26651079 [0,1,0,0,0,0|1,0,0]=2 396 B10R0.23 CC(=O)NC(CCO)C(=O)O Amb8631250 [0,1,0,0,0,0|0,0,0]=1 397 B10R0.23 CC(=O)NC(CCS)C(=O)O Amb18127932 [0,1,0,0,0,0|0,1,0]=2 398 B10R0.23 CC(=O)NN(CCO)C(C)=O Amb27989600 [0,1,0,0,0,0|2,0,0]=3 399 B10R0.23 CC(=O)N[C@@H](CCS)C(=O)O Amb27990115 [0,1,0,0,0,0|0,1,0]=2 400 B10R0.23 CCCC(CC(=O)O)C(=O)O Amb18645267 [0,1,0,0,0,0|3,0,0]=4 401 B10R0.23 CCCC(CC(C)=O)C(=O)O Amb533160 [0,1,0,0,0,0|2,0,0]=3 402 B10R0.23 CCCC(NC(C)=O)C(=O)Cl Amb27673640 [0,1,0,0,0,0|2,0,0]=3 403 B10R0.23 CCCC(NC(C)=O)C(=O)O Amb4013563 [0,1,0,0,0,0|1,0,0]=2 404 B10R0.23 CCCC(NC(C)=O)C(N)=O Amb27988366 [0,1,0,0,0,0|2,0,0]=3 405 B10R0.23 CCCC(NC(C)C)C(=O)O Amb28960316 [0,1,0,0,0,0|2,0,1]=4 406 B10R0.23 CCCC(NC(C)C)C(=O)O Amb9496296 [0,1,0,0,0,0|2,0,1]=4 407 B10R0.23 CCCC(NC(N)=O)C(=O)O Amb9495809 [0,1,0,0,0,0|2,0,0]=3 408 B10R0.23 CCCC(NC(N)=O)C(N)=O Amb26990652 [0,1,0,0,0,0|3,0,0]=4 409 B10R0.23 CCC[C@@H](NC(C)=O)C(=O)O Amb3941420 [0,1,0,0,0,0|1,0,0]=2 410 B10R0.23 CCC[C@@H](NC(N)=O)C(=O)O Amb27000197 [0,1,0,0,0,0|2,0,0]=3 411 B10R0.23 CCC[C@H](NC(C)=O)C(=O)O Amb3941421 [0,1,0,0,0,0|1,0,0]=2 412 B10R0.23 CCC[C@H](NC(C)=O)C(N)=O Amb27671257 [0,1,0,0,0,0|2,0,0]=3 413 B10R0.23 CCSC(NC(C)=O)C(=O)O Amb27989933 [0,1,0,0,0,0|1,0,0]=2 414 B10R0.23 CC\C=C(\CC(C)=O)C(=O)O Amb27001155 [0,1,0,0,0,0|2,0,1]=4 415 B10R0.23 CC\C=C(\NC(C)=O)C(=O)O Amb27789885 [0,1,0,0,0,0|1,0,1]=3 416 B10R0.23 CC\C=C(\OC(C)=O)C(=O)O Amb26659894 [0,1,0,0,0,0|2,0,1]=4 417 B10R0.23 CNCC(NC(C)=O)C(=O)O Amb27269521 [0,1,0,0,0,0|1,0,0]=2 418 B10R0.23 CNC[C@H](NC(C)=O)C(=O)O Amb25383164 [0,1,0,0,0,0|1,0,0]=2 419 B10R0.23 COCC(CC(=O)O)C(=O)O Amb4007524 [0,1,0,0,0,0|2,0,0]=3 420 B10R0.23 COCC(NC(=O)Cl)C(=O)O Amb27673662 [0,1,0,0,0,0|1,0,0]=2 421 B10R0.23 COCC(NC(C)=O)C(=O)O Amb8385373 [0,1,0,0,0,0|0,0,0]=1 422 B10R0.23 COCC(NC(C)=O)C(C)C Amb28386771 [0,1,0,0,0,0|2,0,1]=4 423 B10R0.23 COC[C@@H](NC(C)=O)C(=O)O Amb27990008 [0,1,0,0,0,0|0,0,0]=1 424 B10R0.23 COC[C@H](NC(C)=O)C(=O)O Amb26999845 [0,1,0,0,0,0|0,0,0]=1 425 B10R0.23 CSCC(CC(=O)O)C(=O)O Amb32953699 [0,1,0,0,0,0|2,1,0]=4 426 B10R0.23 CSCC(NC(C)=O)C(=O)O Amb4013561 [0,1,0,0,0,0|0,1,0]=2 427 B10R0.23 CSC[C@H](NC(C)=O)C(=O)O Amb17607605 [0,1,0,0,0,0|0,1,0]=2 428 B10R0.23 CSC[C@H](NC(C)=O)C(N)=O Amb27989966 [0,1,0,0,0,0|1,1,0]=3 429 B10R0.23 NC(=O)NC(CCS)C(=O)O Amb27271753 [0,1,0,0,0,0|1,1,0]=3 430 B10R0.23 NC(=O)N[C@@H](CCO)C(=O)O Amb26993170 [0,1,0,0,0,0|1,0,0]=2 431 B10R0.23 NCCC(NC(=O)O)C(=O)O Amb24091186 [0,1,0,0,0,0|2,0,0]=3 432 B10R0.23 O=C(O)CC(CCF)C(=O)O Amb33196068 [0,1,0,0,0,0|3,0,0]=4 433 B10R0.53 C#CC(C)NC(CC)C(=O)O Amb27988094 [0,1,0,0,0,0|2,0,1]=4 434 B10R0.53 C=CC(=O)N[C@@H](CC)C(=O)O Amb27672241 [0,1,0,0,0,0|1,0,1]=3 435 B10R0.53 C=CC(=O)N[C@H](CO)[C@@H](C)O Amb27674181 [0,1,0,0,0,0|1,0,2]=4 436 B10R0.53 CC(C)C(CO)NC(=O)CBr Amb27271087 [0,1,0,0,0,0|2,0,1]=4 437 B10R0.53 CC(C)C(CO)NC(=O)CCl Amb27271086 [0,1,0,0,0,0|2,0,1]=4 438 B10R0.53 CC(C)C(CO)NC(=O)CN Amb27271372 [0,1,0,0,0,0|2,0,1]=4 439 B10R0.53 CC(C)C(CO)NC(=O)CS Amb27271085 [0,1,0,0,0,0|2,0,1]=4 440 B10R0.53 CC(C)[C@@H](CO)NC(=O)CBr Amb27271090 [0,1,0,0,0,0|2,0,1]=4 441 B10R0.53 CC(C)[C@@H](CO)NC(=O)CN Amb27271080 [0,1,0,0,0,0|2,0,1]=4 442 B10R0.53 CCC(=O)NC(C#N)C(N)=O Amb25135978 [0,1,0,0,0,0|2,0,1]=4 443 B10R0.53 CCC(=O)NC(CC)C(=O)O Amb5741741 [0,1,0,0,0,0|1,0,0]=2 444 B10R0.53 CCC(=O)NC(CO)C(C)C Amb17102546 [0,1,0,0,0,0|2,0,1]=4 445 B10R0.53 CCC(=O)N[C@@H](CC)C(=O)O Amb27672238 [0,1,0,0,0,0|1,0,0]=2 446 B10R0.53 CCC(=O)N[C@@H](CS)C(=O)O Amb17619566 [0,1,0,0,0,0|0,1,0]=2 447 B10R0.53 CCC(=O)N[C@H](CO)[C@@H](C)O Amb27674183 [0,1,0,0,0,0|1,0,1]=3 448 B10R0.53 CCC(=O)N[C@H](CS)C(=O)O Amb27989798 [0,1,0,0,0,0|0,1,0]=2 449 B10R0.53 CCC(C\C(C)=C\Cl)C(=O)O Amb27492519 [0,1,0,0,0,0|3,0,0]=4 450 B10R0.53 CCC(NC(=O)CCl)C(=O)O Amb22343239 [0,1,0,0,0,0|1,0,0]=2 451 B10R0.53 CCC(NC(=O)CN)C(=O)O Amb19009859 [0,1,0,0,0,0|1,0,0]=2 452 B10R0.53 CCC(NC(=O)CO)C(N)=O Amb27986906 [0,1,0,0,0,0|2,0,0]=3 453 B10R0.53 CCC(NC(=O)OC)C(=N)N Amb27987102 [0,1,0,0,0,0|3,0,0]=4 454 B10R0.53 CCC(NC(=O)OC)C(=O)O Amb9329787 [0,1,0,0,0,0|1,0,0]=2 455 B10R0.53 CCC(NC(=O)OC)C(N)=O Amb27986907 [0,1,0,0,0,0|2,0,0]=3 456 B10R0.53 CCC(NC(=S)NC)C(N)=O Amb28201926 [0,1,0,0,0,0|2,1,0]=4 457 B10R0.53 CC[C@@H](NC(=O)CN)C(=O)O Amb24755319 [0,1,0,0,0,0|1,0,0]=2 458 B10R0.53 CC[C@@H](NC(=O)NC)C(N)=O Amb27660108 [0,1,0,0,0,0|2,0,0]=3 459 B10R0.53 CC[C@@H](NC(=O)OC)C(=O)O Amb25386298 [0,1,0,0,0,0|1,0,0]=2 460 B10R0.53 CC[C@H](NC(=O)CCl)C(=O)O Amb27272568 [0,1,0,0,0,0|1,0,0]=2 461 B10R0.53 CC[C@H](NC(=O)CN)C(=O)O Amb27272566 [0,1,0,0,0,0|1,0,0]=2 462 B10R0.53 CNC(=O)NC(CO)C(=O)O Amb18290471 [0,1,0,0,0,0|0,0,0]=1 463 B10R0.53 CNC(=O)N[C@H](CO)C(C)C Amb27632541 [0,1,0,0,0,0|2,0,1]=4 464 B10R0.53 CNC(=O)N[C@H](CO)[C@@H](C)O Amb28455877 [0,1,0,0,0,0|1,0,1]=3 465 B10R0.53 CNC(=S)N[C@@H](CO)C(=O)O Amb27983756 [0,1,0,0,0,0|0,1,0]=2 466 B10R0.53 COC(=O)NC(CO)C(C)C Amb27271084 [0,1,0,0,0,0|2,0,1]=4 467 B10R0.53 COC(=O)NC(OC)C(N)=O Amb24764691 [0,1,0,0,0,0|3,0,0]=4 468 B10R0.53 COC(=O)N[C@@H](CO)C(N)=O Amb27271972 [0,1,0,0,0,0|1,0,0]=2 469 B10R0.53 COC(=O)N[C@H](CO)C(C)C Amb27271088 [0,1,0,0,0,0|2,0,1]=4 470 B10R0.53 COC(=O)N[C@H](CO)[C@@H](C)O Amb27674164 [0,1,0,0,0,0|1,0,1]=3 471 B10R0.53 C[C@@H](O)[C@@H](CO)NC(=O)CBr Amb27674205 [0,1,0,0,0,0|1,0,1]=3 472 B10R0.53 C[C@@H](O)[C@@H](CO)NC(=O)CCl Amb27674204 [0,1,0,0,0,0|1,0,1]=3 473 B10R0.53 C[C@@H](O)[C@@H](CO)NC(=O)CN Amb27674194 [0,1,0,0,0,0|1,0,1]=3 474 B10R0.53 C\C=C(/C)CC(CO)C(C)=O Amb28080254 [0,1,0,0,0,0|3,0,0]=4 475 B10R0.53 C\C=C(/NC(=O)CCl)C(=O)O Amb27650549 [0,1,0,0,0,0|1,0,2]=4 476 B10R0.53 C\C=C(\C)CC(CO)C(C)=O Amb27673559 [0,1,0,0,0,0|3,0,0]=4 477 B10R0.53 C\C=C(\NC(=O)CN)C(=O)O Amb28411010 [0,1,0,0,0,0|1,0,2]=4 478 B10R0.53 NC(=O)[C@H](CO)NC(=O)CO Amb27271882 [0,1,0,0,0,0|1,0,0]=2 479 B10R0.53 NCC(=O)NC(CO)C(=O)O Amb557297 [0,1,0,0,0,0|0,0,0]=1 480 B10R0.53 NCC(=O)N[C@@H](CO)C(=O)O Amb18180042 [0,1,0,0,0,0|0,0,0]=1 481 B10R0.53 NCC(=O)N[C@@H](CS)C(=O)O Amb26660629 [0,1,0,0,0,0|0,1,0]=2 482 B10R0.53 NCC(=O)N[C@H](CO)C(=O)O Amb22230741 [0,1,0,0,0,0|0,0,0]=1 483 B10R0.53 O=C(CCl)NC(CO)C(=O)O Amb3940605 [0,1,0,0,0,0|0,0,0]=1 484 B10R0.53 O=C(CCl)N[C@@H](CO)C(=O)O Amb27990067 [0,1,0,0,0,0|0,0,0]=1 485 B10R0.53 O=C(CCl)N[C@@H](CS)C(=O)O Amb27990119 [0,1,0,0,0,0|0,1,0]=2 486 B10R0.54 CC(=O)N[C@@H](CO)C(=O)NN Amb27849007 [0,1,0,0,0,0|1,0,0]=2 487 B10R0.54 CCC(=O)C(CC)NC(C)=O Amb27673452 [0,1,0,0,0,0|2,0,0]=3 488 B10R0.54 CCC(C)C(CO)NC(C)=O Amb27673613 [0,1,0,0,0,0|2,0,1]=4 489 B10R0.54 CCC(NC(=N)N)C(=O)OC Amb27266641 [0,1,0,0,0,0|3,0,0]=4 490 B10R0.54 CCC(NC(C)=N)C(=O)NC Amb35612379 [0,1,0,0,0,0|3,0,0]=4 491 B10R0.54 CCC(NC(C)=O)C(=O)OC Amb18399905 [0,1,0,0,0,0|1,0,0]=2 492 B10R0.54 CCC(NC(C)=O)\C(N)=N\O Amb18179883 [0,1,0,0,0,0|2,0,0]=3 493 B10R0.54 CCC(NC(C)C)C(=O)OC Amb18792083 [0,1,0,0,0,0|2,0,1]=4 494 B10R0.54 CCC(NC(N)=O)C(=O)NC Amb27211432 [0,1,0,0,0,0|3,0,0]=4 495 B10R0.54 CCC(NC(N)=O)C(=O)NN Amb27840348 [0,1,0,0,0,0|3,0,0]=4 496 B10R0.54 CCC(NC(N)=O)C(=O)OC Amb27266627 [0,1,0,0,0,0|2,0,0]=3 497 B10R0.54 CCC(NC(N)=S)C(=O)OC Amb27266637 [0,1,0,0,0,0|2,1,0]=4 498 B10R0.54 CC[C@@H](NC(C)C)C(=O)OC Amb33872281 [0,1,0,0,0,0|2,0,1]=4 499 B10R0.54 CC[C@H](NC(C)=O)C(=O)NC Amb28388659 [0,1,0,0,0,0|2,0,0]=3 500 B10R0.54 CNC(=O)C(CO)NC(C)=O Amb25338076 [0,1,0,0,0,0|1,0,0]=2 501 B10R0.54 CNC(=O)[C@@H](CO)NC(C)=O Amb27827792 [0,1,0,0,0,0|1,0,0]=2 502 B10R0.54 CNC(=O)[C@H](CO)NC(C)=O Amb27230605 [0,1,0,0,0,0|1,0,0]=2 503 B10R0.54 CNC(=O)[C@H](CS)NC(C)=O Amb28122561 [0,1,0,0,0,0|1,1,0]=3 504 B10R0.54 COC(=O)C(C#N)CC(C)=O Amb18125822 [0,1,0,0,0,0|2,0,1]=4 505 B10R0.54 COC(=O)C(C#N)NC(C)=O Amb23437078 [0,1,0,0,0,0|1,0,1]=3 506 B10R0.54 COC(=O)C(CCl)NC(C)=O Amb16234128 [0,1,0,0,0,0|1,0,0]=2 507 B10R0.54 COC(=O)C(CF)NC(C)=O Amb27988861 [0,1,0,0,0,0|1,0,0]=2 508 B10R0.54 COC(=O)C(CO)CC(C)C Amb33036222 [0,1,0,0,0,0|2,0,1]=4 509 B10R0.54 COC(=O)C(CO)NC(C)=O Amb9263032 [0,1,0,0,0,0|0,0,0]=1 510 B10R0.54 COC(=O)C(CS)NC(C)=O Amb9786610 [0,1,0,0,0,0|0,1,0]=2 511 B10R0.54 COC(=O)[C@@H](CCl)NC(C)=O Amb27990110 [0,1,0,0,0,0|1,0,0]=2 512 B10R0.54 COC(=O)[C@H](CCl)NC(C)=O Amb17607478 [0,1,0,0,0,0|1,0,0]=2 513 B10R0.54 COC(=O)[C@H](CN)NC(C)=O Amb26999942 [0,1,0,0,0,0|1,0,0]=2 514 B10R0.54 COC(=O)[C@H](CO)NC(C)=S Amb27818746 [0,1,0,0,0,0|0,1,0]=2 515 B10R0.54 COC(=O)[C@H](CO)NC(N)=O Amb27266620 [0,1,0,0,0,0|1,0,0]=2 516 B10R0.54 COC(=O)[C@H](CS)NC(C)=O Amb22349444 [0,1,0,0,0,0|0,1,0]=2 517 B10R0.54 COC(=O)\C(=C/O)CC(C)=O Amb27672601 [0,1,0,0,0,0|1,0,2]=4 518 B10R0.54 COC(=O)\C(=C/O)NC(C)=O Amb27245352 [0,1,0,0,0,0|0,0,2]=3 519 B10R0.54 COC(=O)\C(=C\Cl)NC(C)=O Amb27658890 [0,1,0,0,0,0|1,0,2]=4 520 B10R0.54 C\C=C(\NC(C)=O)C(=O)OC Amb24117094 [0,1,0,0,0,0|1,0,2]=4 521 B10R0.54 [C-]#[N+]C(CC(C)=O)C(=O)OC Amb19928639 [0,1,0,0,0,0|3,0,0]=4 522 B10R0.76 CC(=O)N(C)C(CO)C(=O)O Amb28386887 [0,1,0,0,0,0|0,0,0]=1 523 B10R0.76 CC(=O)N(C)[C@@H](CO)C(=O)O Amb26083314 [0,1,0,0,0,0|0,0,0]=1 524 B10R0.76 CC(C(=O)O)C(NO)C(=O)O Amb27673476 [0,1,0,0,0,0|3,0,0]=4 525 B10R0.76 CCC(C(=O)O)C(O)C(=O)O Amb25386294 [0,1,0,0,0,0|3,0,0]=4 526 B10R0.76 CCC(C(=O)O)N(C)C(N)=O Amb18983108 [0,1,0,0,0,0|2,0,0]=3 527 B10R0.76 CCC(C(=O)O)N(C)S(C)=O Amb27272524 [0,1,0,0,0,0|2,0,0]=3 528 B10R0.76 CCC(C(=O)O)N(N)C(C)C Amb27990223 [0,1,0,0,0,0|2,0,1]=4 529 B10R0.76 CCC(C(N)=O)N(C)C(C)=O Amb27989955 [0,1,0,0,0,0|2,0,0]=3 530 B10R0.76 CC[C@@H](C(=O)O)[C@@H](O)C(=O)O Amb27990177 [0,1,0,0,0,0|3,0,0]=4 531 B10R0.76 CC[C@@H](C(N)=O)N(C)C(C)=O Amb25383114 [0,1,0,0,0,0|2,0,0]=3 532 B10R0.76 CC[C@H](C(=O)O)[C@@H](C)C(=O)O Amb27269197 [0,1,0,0,0,0|3,0,0]=4 533 B10R0.76 CC[C@H](C(=O)O)[C@H](C)C(=O)O Amb27990007 [0,1,0,0,0,0|3,0,0]=4 534 B10R0.76 CC\C(C(=O)O)=C(/C)C(C)=O Amb32682079 [0,1,0,0,0,0|2,0,1]=4 535 B10R0.76 NC(C(=O)O)C(CO)C(=O)O Amb27988471 [0,1,0,0,0,0|2,0,0]=3 536 B10R0.76 NCC(C(=O)O)[C@H](N)C(=O)O Amb25384089 [0,1,0,0,0,0|3,0,0]=4 537 B10R0.76 N[C@H](C(=O)O)C(CO)C(=O)O Amb25384088 [0,1,0,0,0,0|2,0,0]=3 538 B10R0.95 CC(C)(C)CC(CO)C(=O)O Amb27272417 [0,1,0,0,0,0|2,0,1]=4 539 B10R0.95 CC(C)(C)N[C@H](CS)C(=O)O Amb27272307 [0,1,0,0,0,0|1,1,1]=4 540 B10R0.95 CCC(CS(C)(=O)=O)C(=O)O Amb33056370 [0,1,0,0,0,0|3,0,0]=4 541 B10R0.95 CCC(NS(C)(=O)=O)C(=O)Cl Amb5742262 [0,1,0,0,0,0|3,0,0]=4 542 B10R0.95 CCC(NS(C)(=O)=O)C(=O)O Amb5741781 [0,1,0,0,0,0|2,0,0]=3 543 B10R0.95 CCC(NS(C)(=O)=O)C(N)=O Amb27270621 [0,1,0,0,0,0|3,0,0]=4 544 B10R0.95 CCC(NS(N)(=O)=O)C(=O)O Amb27987773 [0,1,0,0,0,0|3,0,0]=4 545 B10R0.95 CC[C@@H](NS(C)(=O)=O)C(N)=O Amb28080502 [0,1,0,0,0,0|3,0,0]=4 546 B10R0.95 CC[C@@H](NS(N)(=O)=O)C(=O)O Amb27987781 [0,1,0,0,0,0|3,0,0]=4 547 B10R0.95 CC[C@H](NS(C)(=O)=O)C(=O)Cl Amb27671492 [0,1,0,0,0,0|3,0,0]=4 548 B10R0.95 CC[C@H](NS(C)(=O)=O)C(=O)O Amb27672237 [0,1,0,0,0,0|2,0,0]=3 549 B10R0.95 CC[C@H](NS(N)(=O)=O)C(=O)O Amb27987785 [0,1,0,0,0,0|3,0,0]=4 550 B10R0.95 CS(=O)(=O)CC(CN)C(=O)O Amb33055761 [0,1,0,0,0,0|3,0,0]=4 551 B10R0.95 CS(=O)(=O)NC(CO)C(=O)O Amb1119737 [0,1,0,0,0,0|1,0,0]=2 552 B10R0.95 CS(=O)(=O)N[C@@H](CO)C(=O)O Amb18321716 [0,1,0,0,0,0|1,0,0]=2 553 B10R0.95 CS(=O)(=O)N[C@@H](CO)C(N)=O Amb27988925 [0,1,0,0,0,0|2,0,0]=3 554 B10R0.95 CS(=O)(=O)N[C@@H](CS)C(=O)O Amb27988495 [0,1,0,0,0,0|1,1,0]=3 555 B10R0.95 C[C@@H](O)[C@@H](CO)NS(C)(=O)=O Amb27674161 [0,1,0,0,0,0|2,0,1]=4 556 B10R0.95 NS(=O)(=O)NC(CO)C(=O)O Amb6256631 [0,1,0,0,0,0|2,0,0]=3 557 B10R0.95 NS(=O)(=O)N[C@@H](CO)C(=O)O Amb27987776 [0,1,0,0,0,0|2,0,0]=3 558 B10R0.95 NS(=O)(=O)N[C@H](CO)C(=O)O Amb27987784 [0,1,0,0,0,0|2,0,0]=3 559 B10R0.95 O=C(O)C(CO)NS(=O)(=O)O Amb17594775 [0,1,0,0,0,0|2,0,0]=3 560 B10R0.95 O=C(O)C(CO)OP(=O)(O)O Amb27000108 [0,1,0,0,0,0|3,0,0]=4 561 B10R0.95 O=C(O)C(CS)NS(=O)(O)=S Amb27673660 [0,1,0,0,0,0|2,1,0]=4 562 B10R0.95 O=C(O)[C@H](CO)NP(=O)(O)O Amb22233132 [0,1,0,0,0,0|2,0,0]=3 563 B10R0.119 C=C(C)CC(C)(CC)C(=O)O Amb27670914 [0,1,0,0,0,0|3,0,0]=4 564 B10R0.119 CC(=O)NC(C)(C#N)C(=O)O Amb27408979 [0,1,0,0,0,0|1,0,1]=3 565 B10R0.119 CC(=O)NC(C)(CO)C(C)=O Amb27810894 [0,1,0,0,0,0|1,0,0]=2 566 B10R0.119 CC(=O)NC(N)(CCl)C(=O)O Amb26361163 [0,1,0,0,0,0|1,0,0]=2 567 B10R0.119 CC(=O)N[C@](C)(CO)C(=O)O Amb27758605 [0,1,0,0,0,0|0,0,0]=1 568 B10R0.119 CC(C)C[C@@](N)(CO)C(=O)O Amb26659554 [0,1,0,0,0,0|2,0,1]=4 569 B10R0.119 CC(C)NC(C)(CO)C(=O)O Amb27269507 [0,1,0,0,0,0|1,0,1]=3 570 B10R0.119 CC(C)NC(C)(CO)C(N)=O Amb27269503 [0,1,0,0,0,0|2,0,1]=4 571 B10R0.119 CC(CN)(CC(=O)O)C(=O)O Amb22546424 [0,1,0,0,0,0|3,0,0]=4 572 B10R0.119 CC(CN)(CC(=O)O)C(=O)O Amb26999762 [0,1,0,0,0,0|3,0,0]=4 573 B10R0.119 CC(CO)(NC(N)=O)C(=O)O Amb28385975 [0,1,0,0,0,0|1,0,0]=2 574 B10R0.119 CCC(C)(CC(=O)O)C(=O)O Amb17776967 [0,1,0,0,0,0|3,0,0]=4 575 B10R0.119 CCC(C)(CC(C)=O)C(C)=O Amb28080255 [0,1,0,0,0,0|3,0,0]=4 576 B10R0.119 CCC(C)(NC(C)=O)C(C)=O Amb27852112 [0,1,0,0,0,0|2,0,0]=3 577 B10R0.119 CCC(C)(NS(C)=O)C(=O)O Amb27272528 [0,1,0,0,0,0|2,0,0]=3 578 B10R0.119 CCC(Cl)(OC(C)=O)C(C)=O Amb27673730 [0,1,0,0,0,0|3,0,0]=4 579 B10R0.119 CCC(N)(CC(=O)O)C(=O)O Amb27673263 [0,1,0,0,0,0|3,0,0]=4 580 B10R0.119 COC(C)(NC(C)=O)C(C)=O Amb28397955 [0,1,0,0,0,0|3,0,0]=4 581 B10R0.119 CSC(C)(NC(C)=O)C(N)=O Amb27212702 [0,1,0,0,0,0|3,0,0]=4 582 B10R0.119 N[C@@](CO)(CC(=O)O)C(=O)O Amb27001406 [0,1,0,0,0,0|2,0,0]=3 583 B10R0.119 N[C@](CO)(CC(=O)O)C(=O)O Amb26659195 [0,1,0,0,0,0|2,0,0]=3 584 B10R0.119 O=C(O)CC(Cl)(CO)C(=O)O Amb27271127 [0,1,0,0,0,0|2,0,0]=3 585 B10R0.138 CC(=O)N[C@H](CO)C(C)(C)C Amb4009174 [0,1,0,0,0,0|2,0,1]=4 586 B10R0.162 C=C(C)C(OC(C)=O)C(C)O Amb27673918 [0,1,0,0,0,0|3,0,0]=4 587 B10R0.162 CC(=N)C(NC(C)=O)C(C)=O Amb27176329 [0,1,0,0,0,0|2,0,1]=4 588 B10R0.162 CC(=O)NC(B(O)O)C(C)C Amb28074069 [0,1,0,0,0,0|2,0,1]=4 589 B10R0.162 CC(=O)NC(C(=N)N)C(N)=O Amb27429339 [0,1,0,0,0,0|2,0,1]=4 590 B10R0.162 CC(=O)NC(C(=O)Cl)C(C)C Amb5742285 [0,1,0,0,0,0|2,0,0]=3 591 B10R0.162 CC(=O)NC(C(=O)O)=C(C)C Amb24309192 [0,1,0,0,0,0|1,0,2]=4 592 B10R0.162 CC(=O)NC(C(=O)O)=C(Cl)Cl Amb1148794 [0,1,0,0,0,0|1,0,2]=4 593 B10R0.162 CC(=O)NC(C(=O)O)C(=O)O Amb27471757 [0,1,0,0,0,0|0,0,1]=2 594 B10R0.162 CC(=O)NC(C(=O)O)C(C)C Amb9702849 [0,1,0,0,0,0|1,0,0]=2 595 B10R0.162 CC(=O)NC(C(=O)O)C(C)O Amb1119285 [0,1,0,0,0,0|0,0,0]=1 596 B10R0.162 CC(=O)NC(C(=O)O)C(C)S Amb27409022 [0,1,0,0,0,0|0,1,0]=2 597 B10R0.162 CC(=O)NC(C(=O)[O-])C(=O)[O-] Amb32405594 [0,1,0,0,0,0|0,0,3]=4 598 B10R0.162 CC(=O)NC(C(C)=O)C(C)=O Amb20620188 [0,1,0,0,0,0|1,0,2]=4 599 B10R0.162 CC(=O)NC(C(N)=O)C(C)C Amb6739910 [0,1,0,0,0,0|2,0,0]=3 600 B10R0.162 CC(=O)NC(C(N)=O)C(C)S Amb27176594 [0,1,0,0,0,0|1,1,0]=3 601 B10R0.162 CC(=O)NC(C(N)=O)C(N)=O Amb27590289 [0,1,0,0,0,0|1,0,2]=4 602 B10R0.162 CC(=O)NC(C(N)=O)C(N)=S Amb27632485 [0,1,0,0,0,0|1,1,1]=4 603 B10R0.162 CC(=O)N[C@@H](C(=O)O)C(C)C Amb533286 [0,1,0,0,0,0|1,0,0]=2 604 B10R0.162 CC(=O)N[C@@H](C(=O)O)[C@H](C)O Amb24388953 [0,1,0,0,0,0|0,0,0]=1 605 B10R0.162 CC(=O)N[C@H](C(=O)O)C(C)C Amb1152997 [0,1,0,0,0,0|1,0,0]=2 606 B10R0.162 CC(=O)N[C@H](C(=O)O)[C@@H](C)O Amb4606017 [0,1,0,0,0,0|0,0,0]=1 607 B10R0.162 CC(=O)N[C@H](C(=O)O)[C@H](C)O Amb27165719 [0,1,0,0,0,0|0,0,0]=1 608 B10R0.162 CC(=O)N[C@H](C(N)=O)C(C)C Amb16182991 [0,1,0,0,0,0|2,0,0]=3 609 B10R0.162 CC(=O)N[C@H](C(N)=O)[C@@H](C)O Amb27955806 [0,1,0,0,0,0|1,0,0]=2 610 B10R0.162 CC(=O)OC(C(=O)O)C(C)C Amb8390137 [0,1,0,0,0,0|2,0,0]=3 611 B10R0.162 CC(=O)OC(C(C)=O)C(C)C Amb28080157 [0,1,0,0,0,0|3,0,0]=4 612 B10R0.162 CC(=O)O[C@@H](C(=O)O)C(C)C Amb22225167 [0,1,0,0,0,0|2,0,0]=3 613 B10R0.162 CC(=O)O[C@H](C(=O)O)C(C)C Amb22232253 [0,1,0,0,0,0|2,0,0]=3 614 B10R0.162 CC(=O)O[C@H](C(C)=O)C(C)C Amb27672448 [0,1,0,0,0,0|3,0,0]=4 615 B10R0.162 CC(C)=NC(C(=O)O)C(C)C Amb27176584 [0,1,0,0,0,0|2,0,1]=4 616 B10R0.162 CC(C)C(CC(=O)O)C(=O)O Amb18645268 [0,1,0,0,0,0|3,0,0]=4 617 B10R0.162 CC(C)C(NC(=N)N)C(=O)O Amb27409796 [0,1,0,0,0,0|3,0,0]=4 618 B10R0.162 CC(C)C(NC(=O)S)C(=O)O Amb27760476 [0,1,0,0,0,0|2,0,0]=3 619 B10R0.162 CC(C)C(NC(N)=O)C(=O)O Amb6718279 [0,1,0,0,0,0|2,0,0]=3 620 B10R0.162 CC(C)C(NS(C)=O)C(=O)O Amb27272525 [0,1,0,0,0,0|2,0,0]=3 621 B10R0.162 CC(C)CC(C(=O)O)C(C)O Amb27990208 [0,1,0,0,0,0|2,0,1]=4 622 B10R0.162 CC(C)NC(C(=O)O)C(=O)O Amb27670980 [0,1,0,0,0,0|1,0,2]=4 623 B10R0.162 CC(C)NC(C(=O)O)C(C)C Amb10199872 [0,1,0,0,0,0|2,0,1]=4 624 B10R0.162 CC(C)NC(C(=O)O)C(C)C Amb1110617 [0,1,0,0,0,0|2,0,1]=4 625 B10R0.162 CC(C)NC(C(=O)O)C(C)O Amb28079679 [0,1,0,0,0,0|1,0,1]=3 626 B10R0.162 CC(C)[C@@H](NC(N)=O)C(=O)O Amb18179952 [0,1,0,0,0,0|2,0,0]=3 627 B10R0.162 CC(C)[C@@H](NS(C)=O)C(=O)O Amb27272521 [0,1,0,0,0,0|2,0,0]=3 628 B10R0.162 CC(C)[C@H](NC(N)=O)C(=O)O Amb544737 [0,1,0,0,0,0|2,0,0]=3 629 B10R0.162 CC(C)[C@H](NS(C)=O)C(=O)O Amb27272519 [0,1,0,0,0,0|2,0,0]=3 630 B10R0.162 CC(O)C(NC(=S)S)C(=O)O Amb27863740 [0,1,0,0,0,0|1,1,0]=3 631 B10R0.162 CC(O)C(NC(N)=O)C(=O)O Amb9706401 [0,1,0,0,0,0|1,0,0]=2 632 B10R0.162 CC(O)C(NS(C)=O)C(=O)O Amb27272532 [0,1,0,0,0,0|1,0,0]=2 633 B10R0.162 CS(=O)NC(C(=O)O)C(=O)O Amb27272529 [0,1,0,0,0,0|1,0,1]=3 634 B10R0.162 C[C@@H](O)[C@H](NC(=N)N)C(=O)O Amb28365477 [0,1,0,0,0,0|2,0,0]=3 635 B10R0.162 C[C@@H](O)[C@H](NC(=S)S)C(=O)O Amb28396492 [0,1,0,0,0,0|1,1,0]=3 636 B10R0.162 C[C@@H](O)[C@H](NC(N)=O)C(=O)O Amb24651146 [0,1,0,0,0,0|1,0,0]=2 637 B10R0.162 C[C@@H](O)[C@H](NS(C)=O)C(=O)O Amb27272531 [0,1,0,0,0,0|1,0,0]=2 638 B10R0.162 O=C(O)CC(C(=O)O)C(=O)O Amb4035259 [0,1,0,0,0,0|2,0,1]=4 639 B10R0.162 O=C(O)CC(C(=O)O)C(F)F Amb32811600 [0,1,0,0,0,0|3,0,0]=4 640 B10R1.30 CC1=C(CO)NC(=O)CO1 Amb24738088 [0,0,0,1,0,0|1,0,1]=3 641 B10R1.30 CCC1NC(=O)CNC1=O Amb22496698 [0,0,0,1,0,0|2,0,0]=3 642 B10R1.30 CC[C@@H]1NC(=O)CNC1=O Amb24426869 [0,0,0,1,0,0|2,0,0]=3 643 B10R1.30 CC[C@H]1NC(=O)CNC1=O Amb26960974 [0,0,0,1,0,0|2,0,0]=3 644 B10R1.30 NC[C@@H]1NC(=O)CNC1=O Amb28068613 [0,0,0,1,0,0|2,0,0]=3 645 B10R1.30 O=C1CCC(O)C(CO)O1 Amb27651090 [0,0,0,1,0,0|2,0,1]=4 646 B10R1.30 O=C1CC[C@H](O)[C@H](CO)N1 Amb27814661 [0,0,0,1,0,0|1,0,1]=3 647 B10R1.30 O=C1CNC(=O)C(CO)N1 Amb26601815 [0,0,0,1,0,0|1,0,0]=2 648 B10R1.30 O=C1CNC(=O)C(CS)N1 Amb24666680 [0,0,0,1,0,0|1,1,0]=3 649 B10R1.30 O=C1CNC(=O)[C@@H](CO)N1 Amb26069201 [0,0,0,1,0,0|1,0,0]=2 650 B10R1.30 O=C1CNC(=O)[C@H](CO)N1 Amb22757086 [0,0,0,1,0,0|1,0,0]=2 651 B10R1.30 O=C1COC(=O)C(CS)N1 Amb28421720 [0,0,0,1,0,0|0,1,0]=2 652 B10R1.30 O=C1COC(=O)[C@@H](CS)N1 Amb27250743 [0,0,0,1,0,0|0,1,0]=2 653 B10R1.30 O=C1COC(=O)[C@H](CO)N1 Amb24648743 [0,0,0,1,0,0|0,0,0]=1 654 B10R1.30 O=C1NCC(O)C(CO)N1 Amb28077599 [0,0,0,1,0,0|2,0,1]=4 655 B10R1.30 O=CC1NC(=O)CNC1=O Amb26980805 [0,0,0,1,0,0|1,0,2]=4 656 B10R1.52 CCC1C(=O)NC1C(C)=O Amb26034436 [0,0,0,1,0,0|3,0,0]=4 657 B10R1.52 CC[C@@H]1C(=O)N[C@@H]1C(C)=O Amb25175090 [0,0,0,1,0,0|3,0,0]=4 658 B10R1.52 CC[C@H]1C(=O)N[C@@H]1C(C)=O Amb27446522 [0,0,0,1,0,0|3,0,0]=4 659 B10R1.52 CC[C@H]1C(=O)N[C@H]1C(C)=O Amb25292232 [0,0,0,1,0,0|3,0,0]=4 660 B10R1.59 C=C1CC(N)C(C(=O)O)C1 Amb27779891 [0,0,0,1,0,0|3,0,0]=4 661 B10R1.59 C=C1C[C@H](N)[C@@H](C(=O)O)C1 Amb10071928 [0,0,0,1,0,0|3,0,0]=4 662 B10R1.59 C=C1C[C@H](N)[C@H](C(=O)O)C1 Amb17938168 [0,0,0,1,0,0|3,0,0]=4 663 B10R1.59 CC(=O)[C@@H]1CC(=O)C[C@@H]1C Amb27844197 [0,0,0,1,0,0|3,0,0]=4 664 B10R1.59 CC(=O)[C@@H]1OC(=O)C[C@@H]1C Amb25319949 [0,0,0,1,0,0|3,0,0]=4 665 B10R1.59 CC(C)C1NC(=O)CC1O Amb27605833 [0,0,0,1,0,0|2,0,1]=4 666 B10R1.59 CC(C)[C@@H]1NC(=O)C[C@H]1O Amb27780062 [0,0,0,1,0,0|2,0,1]=4 667 B10R1.59 CC(C)[C@H]1NC(=O)C[C@H]1O Amb27493519 [0,0,0,1,0,0|2,0,1]=4 668 B10R1.59 CC1=CC(C(=O)O)C(N)C1 Amb27838089 [0,0,0,1,0,0|3,0,0]=4 669 B10R1.59 CC1=CC(N)C(C(=O)O)C1 Amb27408423 [0,0,0,1,0,0|3,0,0]=4 670 B10R1.59 CC1=C[C@@H](C(=O)O)[C@@H](N)C1 Amb27629270 [0,0,0,1,0,0|3,0,0]=4 671 B10R1.59 CC1=C[C@@H](N)[C@@H](C(=O)O)C1 Amb27956118 [0,0,0,1,0,0|3,0,0]=4 672 B10R1.59 CC1=C[C@@H](N)[C@H](C(=O)O)C1 Amb27882639 [0,0,0,1,0,0|3,0,0]=4 673 B10R1.59 CC1=C[C@H](C(=O)O)[C@@H](N)C1 Amb27975743 [0,0,0,1,0,0|3,0,0]=4 674 B10R1.59 CC1=C[C@H](N)[C@H](C(=O)O)C1 Amb25174958 [0,0,0,1,0,0|3,0,0]=4 675 B10R1.59 CC1=NC(C(=O)O)C(C)S1 Amb28143410 [0,0,0,1,0,0|1,1,1]=4 676 B10R1.59 CC1CC(=O)NC1C(=O)O Amb25063723 [0,0,0,1,0,0|1,0,0]=2 677 B10R1.59 CC1CC(=O)NC1C(N)=O Amb28435298 [0,0,0,1,0,0|2,0,0]=3 678 B10R1.59 CC1CC(=O)NN1C(=O)Cl Amb26633004 [0,0,0,1,0,0|3,0,0]=4 679 B10R1.59 CC1C[C@@H](O)[C@@H](C(=O)O)N1 Amb27818206 [0,0,0,1,0,0|1,0,1]=3 680 B10R1.59 CC1NC(=O)OC1C(=O)O Amb25046075 [0,0,0,1,0,0|3,0,0]=4 681 B10R1.59 CC1OC(=O)NC1C(=O)O Amb18644184 [0,0,0,1,0,0|2,0,0]=3 682 B10R1.59 CC1OC(=O)NC1C(N)=O Amb27792961 [0,0,0,1,0,0|3,0,0]=4 683 B10R1.59 CC1SC(=O)NC1C(=O)O Amb28208417 [0,0,0,1,0,0|2,0,0]=3 684 B10R1.59 CC1SC(=O)NC1C(N)=O Amb28141991 [0,0,0,1,0,0|3,0,0]=4 685 B10R1.59 CC1SC(=O)SC1C(=O)O Amb23504453 [0,0,0,1,0,0|3,0,0]=4 686 B10R1.59 C[C@@H]1CC(=O)C[C@H]1C(=O)O Amb26891990 [0,0,0,1,0,0|2,0,0]=3 687 B10R1.59 C[C@@H]1CC(=O)N[C@@H]1C(=O)O Amb27188183 [0,0,0,1,0,0|1,0,0]=2 688 B10R1.59 C[C@@H]1CC(=O)O[C@@H]1C(=O)O Amb28428901 [0,0,0,1,0,0|2,0,0]=3 689 B10R1.59 C[C@@H]1C[C@@H](O)[C@@H](C(=O)O)N1 Amb25966968 [0,0,0,1,0,0|1,0,1]=3 690 B10R1.59 C[C@@H]1C[C@@H](O)[C@H](C(=O)O)N1 Amb27204031 [0,0,0,1,0,0|1,0,1]=3 691 B10R1.59 C[C@@H]1C[C@H](O)[C@@H](C(=O)O)N1 Amb27249841 [0,0,0,1,0,0|1,0,1]=3 692 B10R1.59 C[C@@H]1NC(=O)C[C@H]1C(=O)O Amb18202489 [0,0,0,1,0,0|3,0,0]=4 693 B10R1.59 C[C@@H]1NC(=O)O[C@@H]1C(=O)O Amb28057719 [0,0,0,1,0,0|3,0,0]=4 694 B10R1.59 C[C@@H]1NC(=O)O[C@H]1C(=O)O Amb27630658 [0,0,0,1,0,0|3,0,0]=4 695 B10R1.59 C[C@@H]1OC(=O)C[C@@H]1C(=O)O Amb27810863 [0,0,0,1,0,0|3,0,0]=4 696 B10R1.59 C[C@@H]1OC(=O)N[C@H]1C(=O)O Amb25243703 [0,0,0,1,0,0|2,0,0]=3 697 B10R1.59 C[C@@H]1SC(=O)S[C@H]1C(=O)O Amb28384455 [0,0,0,1,0,0|3,0,0]=4 698 B10R1.59 C[C@H](O)C1OC(=O)C[C@@H]1O Amb28345319 [0,0,0,1,0,0|2,0,1]=4 699 B10R1.59 C[C@H](O)[C@@H]1OC(=O)C[C@H]1O Amb28350193 [0,0,0,1,0,0|2,0,1]=4 700 B10R1.59 C[C@H]1CC(=O)N[C@@H]1C(=O)O Amb28429784 [0,0,0,1,0,0|1,0,0]=2 701 B10R1.59 C[C@H]1CC(=O)O[C@@H]1C(=O)O Amb27230560 [0,0,0,1,0,0|2,0,0]=3 702 B10R1.59 C[C@H]1C[C@@H](O)[C@H](C(=O)O)N1 Amb27420162 [0,0,0,1,0,0|1,0,1]=3 703 B10R1.59 C[C@H]1C[C@H](O)[C@@H](C(=O)O)N1 Amb26930084 [0,0,0,1,0,0|1,0,1]=3 704 B10R1.59 C[C@H]1NC(=O)O[C@@H]1C(=O)O Amb28346276 [0,0,0,1,0,0|3,0,0]=4 705 B10R1.59 C[C@H]1OC(=O)N[C@@H]1C(N)=O Amb27420143 [0,0,0,1,0,0|3,0,0]=4 706 B10R1.59 C[C@H]1OC(=O)O[C@@H]1C(=O)O Amb27446650 [0,0,0,1,0,0|3,0,0]=4 707 B10R1.59 NC1CC(=O)CC1C(=O)O Amb24523031 [0,0,0,1,0,0|2,0,0]=3 708 B10R1.59 N[C@H]1CC(=O)C[C@H]1C(=O)O Amb27658876 [0,0,0,1,0,0|2,0,0]=3 709 B10R1.59 O=C(O)[C@H]1O[C@@H](O)C[C@@H]1O Amb27961459 [0,0,0,1,0,0|1,0,2]=4 710 B10R1.59 O=C(O)[C@H]1O[C@H](O)C[C@@H]1O Amb27422050 [0,0,0,1,0,0|1,0,2]=4 711 B10R1.59 O=C1CC(O)C(C(=O)O)N1 Amb27175349 [0,0,0,1,0,0|0,0,0]=1 712 B10R1.59 O=C1CC(O)C(C(=O)O)O1 Amb27815003 [0,0,0,1,0,0|1,0,0]=2 713 B10R1.59 O=C1C[C@@H](O)[C@H](C(=O)O)O1 Amb27254163 [0,0,0,1,0,0|1,0,0]=2 714 B10R1.59 O=C1C[C@H](O)[C@@H](C(=O)O)N1 Amb27803055 [0,0,0,1,0,0|0,0,0]=1 715 B10R1.64 C=C1COCC1CC(C)=O Amb25146719 [0,0,0,1,0,0|3,0,0]=4 716 B10R1.64 CC(=N)NC1CCNC1=O Amb35686004 [0,0,0,1,0,0|3,0,0]=4 717 B10R1.64 CC(=O)CC1CCCC1=O Amb22363747 [0,0,0,1,0,0|3,0,0]=4 718 B10R1.64 CC(=O)CC1COCC1O Amb27217997 [0,0,0,1,0,0|2,0,1]=4 719 B10R1.64 CC(=O)NC1CCCC1O Amb27638264 [0,0,0,1,0,0|2,0,1]=4 720 B10R1.64 CC(=O)NC1CCOC1=O Amb28423436 [0,0,0,1,0,0|1,0,0]=2 721 B10R1.64 CC(=O)NC1CCSC1=O Amb2974659 [0,0,0,1,0,0|1,1,0]=3 722 B10R1.64 CC(=O)NC1COCC1C Amb32697723 [0,0,0,1,0,0|2,0,1]=4 723 B10R1.64 CC(=O)NC1COCC1O Amb26043956 [0,0,0,1,0,0|1,0,1]=3 724 B10R1.64 CC(=O)NN1CCCC1=O Amb27956361 [0,0,0,1,0,0|3,0,0]=4 725 B10R1.64 CC(=O)N[C@@H]1CCC[C@H]1O Amb28368826 [0,0,0,1,0,0|2,0,1]=4 726 B10R1.64 CC(=O)N[C@@H]1CNC[C@@H]1O Amb35665581 [0,0,0,1,0,0|2,0,1]=4 727 B10R1.64 CC(=O)N[C@@H]1CNC[C@H]1O Amb35663522 [0,0,0,1,0,0|2,0,1]=4 728 B10R1.64 CC(=O)N[C@@H]1COC[C@@H]1O Amb32671843 [0,0,0,1,0,0|1,0,1]=3 729 B10R1.64 CC(=O)N[C@@H]1COC[C@H]1O Amb23580686 [0,0,0,1,0,0|1,0,1]=3 730 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O Amb27801087 [0,0,0,1,0,0|2,0,1]=4 731 B10R1.64 CC(=O)OC1CCC=C1O Amb26319180 [0,0,0,1,0,0|3,0,0]=4 732 B10R1.64 CC(=O)OC1CCCC1=O Amb17593587 [0,0,0,1,0,0|3,0,0]=4 733 B10R1.64 CC(=O)OC1CCNC1=O Amb22372252 [0,0,0,1,0,0|3,0,0]=4 734 B10R1.64 CC(=O)OC1CCOC1=O Amb27240972 [0,0,0,1,0,0|2,0,0]=3 735 B10R1.64 CC(=O)OC1COCC1=O Amb22755135 [0,0,0,1,0,0|2,0,0]=3 736 B10R1.64 CC(=O)OC1COC[C@H]1O Amb28321331 [0,0,0,1,0,0|2,0,1]=4 737 B10R1.64 CC(=O)O[C@@H]1COC[C@H]1O Amb27440029 [0,0,0,1,0,0|2,0,1]=4 738 B10R1.64 CC(=O)SC1CCOC1=O Amb27668944 [0,0,0,1,0,0|2,0,0]=3 739 B10R1.64 CC(=O)S[C@H]1COC[C@@H]1O Amb27849606 [0,0,0,1,0,0|2,0,1]=4 740 B10R1.64 CC(=O)\C=C1\CCOC1=O Amb24480570 [0,0,0,1,0,0|2,0,1]=4 741 B10R1.64 CC(C)NC1CONC1=O Amb28385818 [0,0,0,1,0,0|2,0,1]=4 742 B10R1.64 CC(C)N[C@H]1CCOC1=O Amb28188550 [0,0,0,1,0,0|2,0,1]=4 743 B10R1.64 CS(=O)NC1CCNC1=O Amb35599685 [0,0,0,1,0,0|3,0,0]=4 744 B10R1.64 CS(=O)N[C@H]1CCNC1=O Amb35599678 [0,0,0,1,0,0|3,0,0]=4 745 B10R1.64 NC(=O)NC1CCNC1=O Amb27800694 [0,0,0,1,0,0|3,0,0]=4 746 B10R1.64 NC(=O)NC1COCC1O Amb28185557 [0,0,0,1,0,0|2,0,1]=4 747 B10R1.64 NC(=O)N[C@@H]1COC[C@H]1O Amb27471071 [0,0,0,1,0,0|2,0,1]=4 748 B10R1.64 NC(=O)N[C@@H]1CONC1=O Amb28313778 [0,0,0,1,0,0|2,0,0]=3 749 B10R1.64 NC(=O)N[C@H]1CCNC1=O Amb27590725 [0,0,0,1,0,0|3,0,0]=4 750 B10R1.64 NC(=S)NC1CCOC1=O Amb24113636 [0,0,0,1,0,0|2,1,0]=4 751 B10R1.64 NC(=S)NC1CONC1=O Amb28129012 [0,0,0,1,0,0|2,1,0]=4 752 B10R1.64 O=C(Cl)NC1CCSC1=O Amb27424822 [0,0,0,1,0,0|2,1,0]=4 753 B10R1.64 O=C(O)CC1CCOC1=O Amb18644064 [0,0,0,1,0,0|3,0,0]=4 754 B10R1.107 CC(=O)O[C@@H]1C(=O)N[C@H]1C Amb27450689 [0,0,0,1,0,0|3,0,0]=4 755 B10R1.113 C=C(C)C1CCCC(=O)N1 Amb27427373 [0,0,0,1,0,0|3,0,0]=4 756 B10R1.113 CC(=O)C1CCCC(=O)O1 Amb24662042 [0,0,0,1,0,0|3,0,0]=4 757 B10R1.113 CC(=O)[C@@H]1CCCC(=O)C1 Amb27974638 [0,0,0,1,0,0|3,0,0]=4 758 B10R1.113 CC(C)C1COCC(=O)N1 Amb21864801 [0,0,0,1,0,0|2,0,1]=4 759 B10R1.113 CC1=CC(C(=O)O)CCC1 Amb27252115 [0,0,0,1,0,0|3,0,0]=4 760 B10R1.113 CC1=NC(C(=O)O)CCN1 Amb16193456 [0,0,0,1,0,0|2,0,1]=4 761 B10R1.113 CC1=N[C@H](C(=O)O)CCN1 Amb22348409 [0,0,0,1,0,0|2,0,1]=4 762 B10R1.113 CC1CCCC(C(=O)O)N1 Amb19959953 [0,0,0,1,0,0|2,0,1]=4 763 B10R1.113 CC1CCCC(C(=O)O)N1 Amb4314386 [0,0,0,1,0,0|2,0,1]=4 764 B10R1.113 CC1CCC[C@H](C(=O)O)N1 Amb540211 [0,0,0,1,0,0|2,0,1]=4 765 B10R1.113 CC1CNCC(C(=O)O)N1 Amb32716215 [0,0,0,1,0,0|2,0,1]=4 766 B10R1.113 CC1COCC(C(=O)O)N1 Amb23585511 [0,0,0,1,0,0|1,0,1]=3 767 B10R1.113 CC1COCC(C(=O)O)N1 Amb28555605 [0,0,0,1,0,0|1,0,1]=3 768 B10R1.113 CC1CSCC(C(=O)O)N1 Amb18645533 [0,0,0,1,0,0|1,1,1]=4 769 B10R1.113 CC1CSCC(C(=O)O)N1 Amb33456372 [0,0,0,1,0,0|1,1,1]=4 770 B10R1.113 CC1CSC[C@@H](C(=O)O)N1 Amb27223064 [0,0,0,1,0,0|1,1,1]=4 771 B10R1.113 CC1NC(C(=O)O)CCS1 Amb18278331 [0,0,0,1,0,0|1,1,1]=4 772 B10R1.113 C[C@@H]1CCC[C@H](C(=O)O)N1 Amb25168905 [0,0,0,1,0,0|2,0,1]=4 773 B10R1.113 C[C@@H]1CCC[C@H](C(=O)O)N1 Amb32666562 [0,0,0,1,0,0|2,0,1]=4 774 B10R1.113 C[C@@H]1COC[C@H](C(=O)O)N1 Amb25102766 [0,0,0,1,0,0|1,0,1]=3 775 B10R1.113 C[C@@H]1COC[C@H](C(=O)O)N1 Amb32796271 [0,0,0,1,0,0|1,0,1]=3 776 B10R1.113 C[C@H]1CCC[C@@H](C(=O)O)N1 Amb28145011 [0,0,0,1,0,0|2,0,1]=4 777 B10R1.113 C[C@H]1CCC[C@@H](C(=O)O)N1 Amb35746778 [0,0,0,1,0,0|2,0,1]=4 778 B10R1.113 C[C@H]1COC[C@@H](C(=O)O)N1 Amb26528283 [0,0,0,1,0,0|1,0,1]=3 779 B10R1.113 C[C@H]1COC[C@@H](C(=O)O)N1 Amb35746779 [0,0,0,1,0,0|1,0,1]=3 780 B10R1.113 C[C@H]1COC[C@@H](C(N)=O)N1 Amb27867896 [0,0,0,1,0,0|2,0,1]=4 781 B10R1.113 N=C1NCC[C@H](C(=O)O)N1 Amb27203442 [0,0,0,1,0,0|3,0,0]=4 782 B10R1.113 NC(=O)C1CCCC(=O)C1 Amb24470598 [0,0,0,1,0,0|3,0,0]=4 783 B10R1.113 NC(=O)C1CNCC(=O)N1 Amb27843743 [0,0,0,1,0,0|2,0,0]=3 784 B10R1.113 NC(=O)[C@@H]1CCCC(=O)N1 Amb24753146 [0,0,0,1,0,0|2,0,0]=3 785 B10R1.113 NC1=NCCC(C(=O)O)N1 Amb27202937 [0,0,0,1,0,0|3,0,0]=4 786 B10R1.113 NC1=N[C@H](C(=O)O)CSC1 Amb28384073 [0,0,0,1,0,0|1,1,1]=4 787 B10R1.113 NC1COCC(C(=O)O)C1 Amb25088866 [0,0,0,1,0,0|2,0,1]=4 788 B10R1.113 O=C(O)C1COCC(O)C1 Amb27810785 [0,0,0,1,0,0|1,0,2]=4 789 B10R1.113 O=C1C=C(C(=O)O)CCC1 Amb10789564 [0,0,0,1,0,0|2,0,1]=4 790 B10R1.113 O=C1C=CCC(C(=O)O)C1 Amb18643491 [0,0,0,1,0,0|2,0,1]=4 791 B10R1.113 O=C1C=CC[C@@H](C(=O)O)N1 Amb26347336 [0,0,0,1,0,0|1,0,1]=3 792 B10R1.113 O=C1CC(C(=O)O)CCN1 Amb33531218 [0,0,0,1,0,0|3,0,0]=4 793 B10R1.113 O=C1CC(C(=O)O)CNN1 Amb22546429 [0,0,0,1,0,0|3,0,0]=4 794 B10R1.113 O=C1CC(C(=O)O)CNN1 Amb28144294 [0,0,0,1,0,0|3,0,0]=4 795 B10R1.113 O=C1CC=CC(C(=O)O)N1 Amb27785978 [0,0,0,1,0,0|1,0,1]=3 796 B10R1.113 O=C1CCCC(C(=O)O)C1 Amb6305244 [0,0,0,1,0,0|2,0,0]=3 797 B10R1.113 O=C1CCCC(C(=O)O)N1 Amb2697230 [0,0,0,1,0,0|1,0,0]=2 798 B10R1.113 O=C1CCCC(C(=O)O)O1 Amb27969173 [0,0,0,1,0,0|2,0,0]=3 799 B10R1.113 O=C1CCC[C@@H](C(=O)O)C1 Amb28050152 [0,0,0,1,0,0|2,0,0]=3 800 B10R1.113 O=C1CCC[C@@H](C(=O)O)N1 Amb10576327 [0,0,0,1,0,0|1,0,0]=2 801 B10R1.113 O=C1CCC[C@H](C(=O)O)N1 Amb8631220 [0,0,0,1,0,0|1,0,0]=2 802 B10R1.113 O=C1CCNC(C(=O)O)C1 Amb13889088 [0,0,0,1,0,0|3,0,0]=4 803 B10R1.113 O=C1CCNC(C(=O)O)C1 Amb13889089 [0,0,0,1,0,0|3,0,0]=4 804 B10R1.113 O=C1CCN[C@@H](C(=O)O)C1 Amb27977165 [0,0,0,1,0,0|3,0,0]=4 805 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 Amb13889084 [0,0,0,1,0,0|3,0,0]=4 806 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 Amb2699956 [0,0,0,1,0,0|3,0,0]=4 807 B10R1.113 O=C1CCOC(C(=O)O)C1 Amb22496784 [0,0,0,1,0,0|3,0,0]=4 808 B10R1.113 O=C1CNCC(C(=O)O)C1 Amb27244770 [0,0,0,1,0,0|2,0,0]=3 809 B10R1.113 O=C1CNC[C@H](C(=O)O)N1 Amb27398104 [0,0,0,1,0,0|1,0,0]=2 810 B10R1.113 O=C1COCC(C(=O)O)N1 Amb18862478 [0,0,0,1,0,0|0,0,0]=1 811 B10R1.113 O=C1COCC(C(=O)O)O1 Amb27209316 [0,0,0,1,0,0|1,0,0]=2 812 B10R1.113 O=C1COC[C@@H](C(=O)O)N1 Amb27164013 [0,0,0,1,0,0|0,0,0]=1 813 B10R1.113 O=C1CSCC(C(=O)O)N1 Amb2693036 [0,0,0,1,0,0|0,1,0]=2 814 B10R1.113 O=C1CSC[C@@H](C(=O)O)N1 Amb26516534 [0,0,0,1,0,0|0,1,0]=2 815 B10R1.113 O=C1CSC[C@H](C(=O)O)N1 Amb27667984 [0,0,0,1,0,0|0,1,0]=2 816 B10R1.113 O=C1NC(C(=O)O)CCO1 Amb28121893 [0,0,0,1,0,0|2,0,0]=3 817 B10R1.113 O=C1NC(C(=O)O)CCS1 Amb28342373 [0,0,0,1,0,0|2,0,0]=3 818 B10R1.234 C=C1CC(CC)(C(=O)O)C1 Amb27760034 [0,0,0,1,0,0|3,0,0]=4 819 B10R1.234 CC1CC(CO)(C(=O)O)C1 Amb23453486 [0,0,0,1,0,0|2,0,1]=4 820 B10R1.234 CCC1(C(=O)O)CC(=O)C1 Amb33204270 [0,0,0,1,0,0|2,0,0]=3 821 B10R1.234 CSC1(C(=O)O)CC(=O)C1 Amb27754200 [0,0,0,1,0,0|3,0,0]=4 822 B10R1.234 N#CC1(C(=O)O)CC(=O)C1 Amb27838979 [0,0,0,1,0,0|2,0,1]=4 823 B10R1.234 NCC1(C(=O)O)CC(=O)C1 Amb26392240 [0,0,0,1,0,0|2,0,0]=3 824 B10R1.234 O=C(O)C1(CO)CC(F)C1 Amb32946224 [0,0,0,1,0,0|2,0,1]=4 825 B10R1.234 O=C1CC(CCl)(C(=O)O)O1 Amb27185492 [0,0,0,1,0,0|2,0,0]=3 826 B10R1.234 O=C1CC(CF)(C(=O)O)C1 Amb33378697 [0,0,0,1,0,0|2,0,0]=3 827 B10R1.242 CC1(C)CC1(CO)C(=O)O Amb28368752 [0,0,0,1,0,0|2,0,1]=4 828 B10R1.282 CC(=O)C1C(C)C1C(=O)O Amb27794780 [0,0,0,1,0,0|2,0,0]=3 829 B10R1.282 CC(=O)[C@@H]1[C@@H](C)[C@H]1C(=O)O Amb27489158 [0,0,0,1,0,0|2,0,0]=3 830 B10R1.282 CC1C(C(=O)O)C1C(=O)O Amb25113473 [0,0,0,1,0,0|3,0,0]=4 831 B10R1.282 CC1C(C(N)=O)C1C(=O)O Amb27816551 [0,0,0,1,0,0|3,0,0]=4 832 B10R1.282 CC1[C@@H](C(=O)O)[C@@H]1C(=O)O Amb27422045 [0,0,0,1,0,0|3,0,0]=4 833 B10R1.282 CC1[C@H](C(=O)O)[C@H]1C(=O)O Amb25956733 [0,0,0,1,0,0|3,0,0]=4 834 B10R1.282 N[C@@H]1[C@@H](C(=O)O)[C@H]1C(=O)O Amb27472114 [0,0,0,1,0,0|3,0,0]=4 835 B10R1.359 CC1(C)CC(C(=O)O)CO1 Amb24312661 [0,0,0,1,0,0|2,0,1]=4 836 B10R1.359 CC1(C)CCC(C(=O)O)N1 Amb17593611 [0,0,0,1,0,0|2,0,1]=4 837 B10R1.359 CC1(C)CCC(C(=O)O)N1 Amb22755806 [0,0,0,1,0,0|2,0,1]=4 838 B10R1.359 CC1(C)NC(C(=O)O)CS1 Amb1155998 [0,0,0,1,0,0|1,1,1]=4 839 B10R1.359 CC1(C)NC(C(=O)O)CS1 Amb9749517 [0,0,0,1,0,0|1,1,1]=4 840 B10R1.359 CC1(C)N[C@H](C(=O)O)CO1 Amb27483148 [0,0,0,1,0,0|1,0,1]=3 841 B10R1.359 CC1(C)N[C@H](C(=O)O)CS1 Amb2719501 [0,0,0,1,0,0|1,1,1]=4 842 B10R1.359 CC1(C)N[C@H](C(=O)O)CS1 Amb29838195 [0,0,0,1,0,0|1,1,1]=4 843 B10R1.359 CC1(C)OCC(C(=O)O)O1 Amb10603493 [0,0,0,1,0,0|2,0,1]=4 844 B10R1.359 CC1(C)OCC(C(=O)O)O1 Amb33719324 [0,0,0,1,0,0|2,0,1]=4 845 B10R1.359 CC1(C)OC[C@@H](C(=O)O)O1 Amb24411495 [0,0,0,1,0,0|2,0,1]=4 846 B10R1.359 CC1(C)OC[C@H](C(=O)O)O1 Amb22745866 [0,0,0,1,0,0|2,0,1]=4 847 B10R1.359 CP1(=O)CCC(C(=O)O)N1 Amb28436164 [0,0,0,1,0,0|2,0,0]=3 848 B10R1.359 O=C(O)C1CCS(=O)(=O)N1 Amb19888363 [0,0,0,1,0,0|3,0,0]=4 849 B10R1.359 O=C(O)C1COS(=O)(=O)N1 Amb27837946 [0,0,0,1,0,0|2,0,0]=3 850 B10R1.359 O=C(O)[C@@H]1CCS(=O)(=O)N1 Amb27272810 [0,0,0,1,0,0|3,0,0]=4 851 B10R1.359 O=C(O)[C@H]1CCS(=O)(=O)N1 Amb27600587 [0,0,0,1,0,0|3,0,0]=4 852 B10R1.361 CC(=O)C1CCC1C(N)=O Amb26003688 [0,0,0,1,0,0|3,0,0]=4 853 B10R1.361 CC(=O)N1CCC1C(=O)O Amb24077473 [0,0,0,1,0,0|1,0,0]=2 854 B10R1.361 CC(=O)N1CCC1C(N)=O Amb33251169 [0,0,0,1,0,0|2,0,0]=3 855 B10R1.361 CC(=O)[C@H]1CC[C@@H]1C(=O)O Amb28252580 [0,0,0,1,0,0|2,0,0]=3 856 B10R1.361 CC(=O)[C@H]1CC[C@@H]1C(N)=O Amb27436143 [0,0,0,1,0,0|3,0,0]=4 857 B10R1.361 CC(=O)[C@H]1CC[C@H]1C(C)=O Amb28461217 [0,0,0,1,0,0|3,0,0]=4 858 B10R1.361 CC(C)N1CC[C@@H]1C(=O)O Amb23399601 [0,0,0,1,0,0|2,0,1]=4 859 B10R1.361 CC(C)N1CC[C@H]1C(=O)O Amb25113865 [0,0,0,1,0,0|2,0,1]=4 860 B10R1.361 N=C(N)N1CCC1C(=O)O Amb27162049 [0,0,0,1,0,0|3,0,0]=4 861 B10R1.361 NC(=O)C1CCC1C(=O)O Amb26027341 [0,0,0,1,0,0|3,0,0]=4 862 B10R1.361 NC(=O)C1CCN1C(N)=O Amb33251995 [0,0,0,1,0,0|3,0,0]=4 863 B10R1.361 NC(=O)[C@@H]1CC[C@@H]1C(=O)O Amb27216173 [0,0,0,1,0,0|3,0,0]=4 864 B10R1.361 NC(=O)[C@@H]1CC[C@H]1C(=O)O Amb24366239 [0,0,0,1,0,0|3,0,0]=4 865 B10R1.361 O=C(O)C1CCC1C(=O)Cl Amb24753887 [0,0,0,1,0,0|3,0,0]=4 866 B10R1.361 O=C(O)C1CCC1C(=O)O Amb19373431 [0,0,0,1,0,0|3,0,0]=4 867 B10R1.361 O=C(O)[C@@H]1CC[C@H]1C(=O)O Amb2609028 [0,0,0,1,0,0|3,0,0]=4 868 B10R1.361 O=C(O)[C@@H]1CN[C@H]1C(=O)O Amb25956288 [0,0,0,1,0,0|3,0,0]=4 869 B10R1.361 O=C(O)[C@H]1CC[C@@H]1C(=O)O Amb25267014 [0,0,0,1,0,0|3,0,0]=4 870 B10R1.361 O=C(O)[C@H]1CC[C@H]1C(=O)O Amb16230761 [0,0,0,1,0,0|3,0,0]=4 871 B10R1.361 O=C(O)[C@H]1CN[C@@H]1C(=O)O Amb25225066 [0,0,0,1,0,0|3,0,0]=4 872 B10R1.361 O=C(O)[C@H]1NC[C@H]1C(=O)O Amb26967619 [0,0,0,1,0,0|3,0,0]=4 873 B10R1.442 C=C(C)CC1(C(=O)O)CC1 Amb24393332 [0,0,0,1,0,0|3,0,0]=4 874 B10R1.442 CC(=O)CC1(C(=O)O)CC1 Amb35789256 [0,0,0,1,0,0|2,0,0]=3 875 B10R1.442 CC(=O)NC1(C(=O)O)CC1 Amb25342880 [0,0,0,1,0,0|1,0,0]=2 876 B10R1.442 CC(=O)NC1(C(N)=S)CC1 Amb35669692 [0,0,0,1,0,0|2,1,0]=4 877 B10R1.442 CC(=O)OC1(C(=O)O)CC1 Amb22264528 [0,0,0,1,0,0|2,0,0]=3 878 B10R1.442 CC(=O)OC1(C(N)=O)CC1 Amb25104699 [0,0,0,1,0,0|3,0,0]=4 879 B10R1.442 CC(C)NC1(C(=O)O)CC1 Amb27866279 [0,0,0,1,0,0|2,0,1]=4 880 B10R1.442 NC(=O)C1(CC(=O)O)CO1 Amb27617834 [0,0,0,1,0,0|3,0,0]=4 881 B10R1.442 NC(=O)NC1(C(=O)O)CC1 Amb26026787 [0,0,0,1,0,0|2,0,0]=3 882 B10R1.442 O=C(O)CC1(C(=O)O)CC1 Amb27410590 [0,0,0,1,0,0|3,0,0]=4 883 B10R1.444 CC1(C)CC(=O)NC1CO Amb27188929 [0,0,0,1,0,0|2,0,1]=4 884 B10R1.444 CCC1NC(=O)CC1(C)O Amb28385665 [0,0,0,1,0,0|2,0,1]=4 885 B10R1.444 CC[C@@H]1NC(=O)C[C@]1(C)O Amb27440838 [0,0,0,1,0,0|2,0,1]=4 886 B10R1.444 C[C@@]1(O)CC(=O)O[C@@H]1CO Amb27443423 [0,0,0,1,0,0|2,0,1]=4 887 B10R1.444 C[C@@]1(O)CC(=O)O[C@H]1CO Amb27197547 [0,0,0,1,0,0|2,0,1]=4 888 B10R1.469 NC(=O)C(CO)NC1CC1 Amb27760575 [0,0,0,1,0,0|2,0,1]=4 889 B10R1.469 O=C(O)C(CO)NC1CC1 Amb27266189 [0,0,0,1,0,0|1,0,1]=3 890 B8R0.18 C#CC(C(=O)O)C(=O)O Amb27493331 [0,0,0,0,1,0|2,0,1]=4 891 B8R0.18 C=C(C)C(CC)C(=O)O Amb18642606 [0,0,0,0,1,0|2,0,0]=3 892 B8R0.18 C=C(C)C(CN)C(=O)O Amb33199955 [0,0,0,0,1,0|2,0,0]=3 893 B8R0.18 C=C(C)C(OC)C(=O)O Amb27219440 [0,0,0,0,1,0|3,0,0]=4 894 B8R0.18 C=CC(C(=O)O)C(=O)O Amb27655691 [0,0,0,0,1,0|2,0,1]=4 895 B8R0.18 C=CC(C(C)=O)C(C)=O Amb28132041 [0,0,0,0,1,0|2,0,1]=4 896 B8R0.18 CC(=O)C(=NO)C(C)=O Amb1145803 [0,0,0,0,1,0|2,0,1]=4 897 B8R0.18 CC(=O)C(C#N)C(N)=O Amb25265556 [0,0,0,0,1,0|2,0,1]=4 898 B8R0.18 CC(=O)C(C=O)C(C)=O Amb27234408 [0,0,0,0,1,0|1,0,2]=4 899 B8R0.18 CC(=O)C(CN)C(C)=O Amb28411438 [0,0,0,0,1,0|2,0,0]=3 900 B8R0.18 CC(=O)\C(=N\O)C(N)=O Amb27484394 [0,0,0,0,1,0|2,0,1]=4 901 B8R0.18 CC(C)=C(CN)C(=O)O Amb28368080 [0,0,0,0,1,0|2,0,1]=4 902 B8R0.18 CC(C)C(CF)C(=O)O Amb26965957 [0,0,0,0,1,0|2,0,1]=4 903 B8R0.18 CC(C)C(CN)C(=O)O Amb18987935 [0,0,0,0,1,0|2,0,1]=4 904 B8R0.18 CC(C)C(CN)C(=O)O Amb19375052 [0,0,0,0,1,0|2,0,1]=4 905 B8R0.18 CC(C)C(CO)C(=O)O Amb24116921 [0,0,0,0,1,0|1,0,1]=3 906 B8R0.18 CC(C)C(CO)C(=O)[O-] Amb32655908 [0,0,0,0,1,0|1,0,2]=4 907 B8R0.18 CC(C)C(CS)C(=O)O Amb17593703 [0,0,0,0,1,0|1,1,1]=4 908 B8R0.18 CC(C)C(NO)C(=O)O Amb28429830 [0,0,0,0,1,0|2,0,1]=4 909 B8R0.18 CC(C)[C@@H](CN)C(=O)O Amb22756745 [0,0,0,0,1,0|2,0,1]=4 910 B8R0.18 CC(C)[C@@H](CN)C(=O)O Amb22756747 [0,0,0,0,1,0|2,0,1]=4 911 B8R0.18 CC(C)[C@H](CN)C(=O)O Amb25283442 [0,0,0,0,1,0|2,0,1]=4 912 B8R0.18 CC(C)[C@H](CN)C(=O)O Amb32620230 [0,0,0,0,1,0|2,0,1]=4 913 B8R0.18 CC(C)[C@H](CO)C(=O)O Amb27249807 [0,0,0,0,1,0|1,0,1]=3 914 B8R0.18 CC(C)[C@H](NO)C(=O)O Amb27859675 [0,0,0,0,1,0|2,0,1]=4 915 B8R0.18 CCC(C(=O)Cl)C(=O)Cl Amb17942975 [0,0,0,0,1,0|3,0,0]=4 916 B8R0.18 CCC(C(=O)O)C(=O)O Amb6297197 [0,0,0,0,1,0|2,0,0]=3 917 B8R0.18 CCC(C(=O)O)C(C)C Amb18972345 [0,0,0,0,1,0|2,0,1]=4 918 B8R0.18 CCC(C(=O)O)C(C)O Amb18990651 [0,0,0,0,1,0|1,0,2]=4 919 B8R0.18 CCC(C(=O)O)N(C)C Amb33551144 [0,0,0,0,1,0|3,0,0]=4 920 B8R0.18 CCC(C(=O)O)N(C)C Amb8455277 [0,0,0,0,1,0|3,0,0]=4 921 B8R0.18 CCC(C(=O)O)N(C)N Amb25145584 [0,0,0,0,1,0|3,0,0]=4 922 B8R0.18 CCC(C(=O)O)S(C)=O Amb18290930 [0,0,0,0,1,0|2,0,0]=3 923 B8R0.18 CCC(C(C)=O)C(C)=O Amb2371444 [0,0,0,0,1,0|2,0,0]=3 924 B8R0.18 CCC(C(N)=O)C(=O)O Amb28410332 [0,0,0,0,1,0|2,0,0]=3 925 B8R0.18 CCC(C(N)=O)C(N)=O Amb25848912 [0,0,0,0,1,0|3,0,0]=4 926 B8R0.18 CC[C@@H](C(=O)O)N(C)C Amb25823446 [0,0,0,0,1,0|3,0,0]=4 927 B8R0.18 CC[C@@H](C(=O)O)[C@@H](C)O Amb28410568 [0,0,0,0,1,0|1,0,2]=4 928 B8R0.18 CC[C@@H](C(C)=O)[C@H](C)O Amb27164629 [0,0,0,0,1,0|2,0,1]=4 929 B8R0.18 CC[C@H](C(=O)O)N(C)C Amb32668789 [0,0,0,0,1,0|3,0,0]=4 930 B8R0.18 CC[C@H](C(=O)O)[C@H](C)O Amb27655638 [0,0,0,0,1,0|1,0,2]=4 931 B8R0.18 CN(C)C(CN)C(=O)O Amb26350112 [0,0,0,0,1,0|3,0,0]=4 932 B8R0.18 CN(C)C(CO)C(=O)O Amb24407402 [0,0,0,0,1,0|2,0,0]=3 933 B8R0.18 CN(C)[C@@H](CO)C(=O)O Amb27397686 [0,0,0,0,1,0|2,0,0]=3 934 B8R0.18 CN(C)[C@@H](CO)C(N)=O Amb25114181 [0,0,0,0,1,0|3,0,0]=4 935 B8R0.18 CN(C)[C@H](CO)C(N)=O Amb27757984 [0,0,0,0,1,0|3,0,0]=4 936 B8R0.18 COC(C(=O)O)C(=O)O Amb27396318 [0,0,0,0,1,0|3,0,0]=4 937 B8R0.18 COC(C(C)=O)C(C)=O Amb25913550 [0,0,0,0,1,0|3,0,0]=4 938 B8R0.18 CSC(C(=O)O)C(=O)O Amb27407760 [0,0,0,0,1,0|3,0,0]=4 939 B8R0.18 N#CC(C(N)=O)C(=O)O Amb28121468 [0,0,0,0,1,0|2,0,1]=4 940 B8R0.18 NCC(C(=O)O)C(=O)O Amb27408219 [0,0,0,0,1,0|2,0,0]=3 941 B8R0.18 O=C(O)C(CO)C(=O)O Amb27849072 [0,0,0,0,1,0|1,0,0]=2 942 B10R0.70 CC(=O)NC(CO)CC(C)C Amb17138489 [0,0,0,0,0,1|2,0,1]=4 943 B10R0.70 CC(=O)NC(CO)CC(F)F Amb27270356 [0,0,0,0,0,1|2,0,1]=4 944 B10R0.70 CC(C)=CC(CN)CC(=O)O Amb22054874 [0,0,0,0,0,1|3,0,0]=4 945 B10R0.70 CCC(CC(=O)O)CC(=O)O Amb33172175 [0,0,0,0,0,1|3,0,0]=4 946 B10R0.70 CCC(CC(=O)O)NC(C)=O Amb25384609 [0,0,0,0,0,1|1,0,0]=2 947 B10R0.70 CCC(NC(N)=O)NC(N)=O Amb27249079 [0,0,0,0,0,1|3,0,0]=4 948 B10R0.70 CC[C@H](CC(=O)O)NC(C)=O Amb27272274 [0,0,0,0,0,1|1,0,0]=2 949 B10R0.70 O=C(O)CC(CF)CC(=O)O Amb33379251 [0,0,0,0,0,1|3,0,0]=4 950 B10R0.84 CCC(NNC(C)=O)C(N)=O Amb27270619 [0,0,0,0,0,1|2,0,0]=3 951 B10R0.84 CCC(ON=C(C)C)C(=O)O Amb4015509 [0,0,0,0,0,1|2,0,1]=4 952 B10R0.84 CCC(ONC(C)=O)C(N)=O Amb28352081 [0,0,0,0,0,1|2,0,0]=3 953 B10R0.84 CCC(ONC(N)=O)C(N)=O Amb28352082 [0,0,0,0,0,1|3,0,0]=4 954 B10R0.84 CCC(SCC(=O)O)C(=O)O Amb17501325 [0,0,0,0,0,1|3,0,0]=4 955 B10R0.84 CCC(SCC(N)=O)C(=O)O Amb17501319 [0,0,0,0,0,1|3,0,0]=4 956 B10R0.84 CC\C(=N/NC(C)=O)C(C)=O Amb28253810 [0,0,0,0,0,1|2,0,1]=4 957 B10R0.84 CC\C(=N/NC(N)=O)C(=O)O Amb27858671 [0,0,0,0,0,1|2,0,1]=4 958 B10R0.84 CC\C(=N\NC(C)=O)C(C)=O Amb27972935 [0,0,0,0,0,1|2,0,1]=4 959 B10R0.84 COC(CNC(C)=O)C(=O)O Amb27269110 [0,0,0,0,0,1|2,0,0]=3 960 B10R0.84 COC(CNC(N)=O)C(=O)O Amb27269111 [0,0,0,0,0,1|3,0,0]=4 961 B7R0.5 C=C(O)C(O)\C=C\C Amb28140639 [2,0,0,0,0,0|2,0,0]=4 962 B7R0.5 C=CCC(C)C(=O)O Amb33545044 [2,0,0,0,0,0|1,0,1]=4 963 B7R0.5 CC#CC(C)C(=O)O Amb22748425 [2,0,0,0,0,0|1,0,1]=4 964 B7R0.5 CC#CC(O)C(=O)O Amb27451308 [2,0,0,0,0,0|1,0,1]=4 965 B7R0.5 CC(=O)C(C)NC=O Amb23442778 [2,0,0,0,0,0|1,0,0]=3 966 B7R0.5 CC(=O)C(C)OC=O Amb26492625 [2,0,0,0,0,0|2,0,0]=4 967 B7R0.5 CC(=O)[C@H](O)CC=O Amb27446551 [2,0,0,0,0,0|2,0,0]=4 968 B7R0.5 CC(CC=O)C(=O)O Amb27952476 [2,0,0,0,0,0|1,0,0]=3 969 B7R0.5 CC(N=C=O)C(=O)O Amb33471295 [2,0,0,0,0,0|0,0,2]=4 970 B7R0.5 CC(NC=O)C(=O)O Amb1144629 [2,0,0,0,0,0|0,0,0]=2 971 B7R0.5 CC(NCO)C(=O)O Amb27468253 [2,0,0,0,0,0|0,0,2]=4 972 B7R0.5 CC(OC=O)C(=O)O Amb27872094 [2,0,0,0,0,0|1,0,0]=3 973 B7R0.5 CCCC(C)C(=O)O Amb3938958 [2,0,0,0,0,0|1,0,1]=4 974 B7R0.5 CCCC(O)C(=O)O Amb2818222 [2,0,0,0,0,0|1,0,1]=4 975 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [2,0,0,0,0,0|1,0,1]=4 976 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [2,0,0,0,0,0|1,0,1]=4 977 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [2,0,0,0,0,0|1,0,1]=4 978 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [2,0,0,0,0,0|1,0,1]=4 979 B7R0.5 CCNC(C)C(=O)O Amb33527634 [2,0,0,0,0,0|0,0,1]=3 980 B7R0.5 CCNC(C)C(=O)O Amb9326962 [2,0,0,0,0,0|0,0,1]=3 981 B7R0.5 CCNC(C)C(N)=O Amb21959648 [2,0,0,0,0,0|1,0,1]=4 982 B7R0.5 CCNC(C)C(N)=O Amb7758139 [2,0,0,0,0,0|1,0,1]=4 983 B7R0.5 CCNC(O)C(=O)O Amb27259098 [2,0,0,0,0,0|0,0,1]=3 984 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [2,0,0,0,0,0|0,0,1]=3 985 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [2,0,0,0,0,0|0,0,1]=3 986 B7R0.5 CCOC(C)C(=O)O Amb9725271 [2,0,0,0,0,0|1,0,1]=4 987 B7R0.5 CCSC(C)C(=O)O Amb9721554 [2,0,0,0,0,0|1,0,1]=4 988 B7R0.5 CNCC(C)C(=O)O Amb13952364 [2,0,0,0,0,0|2,0,0]=4 989 B7R0.5 CNCC(C)C(=O)O Amb9400281 [2,0,0,0,0,0|2,0,0]=4 990 B7R0.5 CNCC(O)C(=O)O Amb26894610 [2,0,0,0,0,0|2,0,0]=4 991 B7R0.5 COCC(C)C(=O)O Amb33545090 [2,0,0,0,0,0|2,0,0]=4 992 B7R0.5 COCC(O)C(=O)O Amb18124273 [2,0,0,0,0,0|2,0,0]=4 993 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [2,0,0,0,0,0|2,0,0]=4 994 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [2,0,0,0,0,0|2,0,0]=4 995 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [2,0,0,0,0,0|2,0,0]=4 996 B7R0.5 CONC(C)C(N)=O Amb27657313 [2,0,0,0,0,0|2,0,0]=4 997 B7R0.5 CON[C@@H](C)C(=O)O Amb27862116 [2,0,0,0,0,0|1,0,0]=3 998 B7R0.5 CSCC(C)C(=O)O Amb18967825 [2,0,0,0,0,0|2,0,0]=4 999 B7R0.5 CSCC(O)C(=O)O Amb25131873 [2,0,0,0,0,0|2,0,0]=4 1000 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [2,0,0,0,0,0|2,0,0]=4 1001 B7R0.5 C[C@@H](N=C=O)C(=O)O Amb33189209 [2,0,0,0,0,0|0,0,2]=4 1002 B7R0.5 C[C@@H](NC#N)C(=O)O Amb35634494 [2,0,0,0,0,0|1,0,1]=4 1003 B7R0.5 C[C@@H](NC=O)C(N)=O Amb27837549 [2,0,0,0,0,0|1,0,0]=3 1004 B7R0.5 C[C@H](N=C=O)C(=O)O Amb33471333 [2,0,0,0,0,0|0,0,2]=4 1005 B7R0.5 C[C@H](NC#N)C(=O)O Amb30031667 [2,0,0,0,0,0|1,0,1]=4 1006 B7R0.5 C[C@H](NC=O)C(=O)O Amb28323701 [2,0,0,0,0,0|0,0,0]=2 1007 B7R0.5 C[C@H](NCO)C(=O)O Amb24401217 [2,0,0,0,0,0|0,0,2]=4 1008 B7R0.5 C\C(=C/C=O)C(=O)O Amb27165186 [2,0,0,0,0,0|1,0,1]=4 1009 B7R0.5 C\C=C\C(Br)C(=O)O Amb27451575 [2,0,0,0,0,0|2,0,0]=4 1010 B7R0.5 C\C=C\C(C)C(C)=O Amb26585088 [2,0,0,0,0,0|2,0,0]=4 1011 B7R0.5 C\C=C\C(O)C(=O)O Amb30585115 [2,0,0,0,0,0|1,0,0]=3 1012 B7R0.5 C\C=C\C(O)C(C)=O Amb25912951 [2,0,0,0,0,0|2,0,0]=4 1013 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [2,0,0,0,0,0|2,0,0]=4 1014 B7R0.5 C\C=C\[C@@H](O)C(=O)O Amb28368832 [2,0,0,0,0,0|1,0,0]=3 1015 B7R0.5 C\C=C\[C@H](O)C(=O)O Amb27162651 [2,0,0,0,0,0|1,0,0]=3 1016 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [2,0,0,0,0,0|2,0,0]=4 1017 B7R0.12 CCNC(CO)CO Amb27196216 [2,0,0,0,0,0|0,0,2]=4 1018 B7R0.12 CCOC(C=O)CO Amb27164613 [2,0,0,0,0,0|1,0,1]=4 1019 B7R0.12 CC[C@H](CO)NC=O Amb27838419 [2,0,0,0,0,0|1,0,1]=4 1020 B7R0.12 O=CNC(CO)CO Amb27806540 [2,0,0,0,0,0|0,0,1]=3 1021 B7R0.12 O=CN\C(C=O)=C\O Amb26015019 [2,0,0,0,0,0|0,0,2]=4 1022 B7R0.15 C=CC(CC)C(=O)O Amb28119400 [2,0,0,0,0,0|1,0,1]=4 1023 B7R0.15 CCC(C=O)C(=O)O Amb28410235 [2,0,0,0,0,0|1,0,0]=3 1024 B7R0.15 CCC(CC)C(=O)O Amb4605826 [2,0,0,0,0,0|1,0,1]=4 1025 B7R0.15 CCC(CCl)C(=O)O Amb27424156 [2,0,0,0,0,0|1,0,1]=4 1026 B7R0.15 CCC(CF)C(=O)O Amb27625346 [2,0,0,0,0,0|1,0,1]=4 1027 B7R0.15 CCC(CN)C(=O)O Amb18987934 [2,0,0,0,0,0|1,0,1]=4 1028 B7R0.15 CCC(CN)C(=O)O Amb19514932 [2,0,0,0,0,0|1,0,1]=4 1029 B7R0.15 CCC(CO)C(=O)O Amb18641947 [2,0,0,0,0,0|0,0,1]=3 1030 B7R0.15 CCC(CO)C(=O)[O-] Amb28934895 [2,0,0,0,0,0|0,0,2]=4 1031 B7R0.15 CCC(CO)C(N)=O Amb28314312 [2,0,0,0,0,0|1,0,1]=4 1032 B7R0.15 CCC(NC)C(=O)O Amb10610245 [2,0,0,0,0,0|1,0,0]=3 1033 B7R0.15 CCC(NC)C(=O)O Amb9619833 [2,0,0,0,0,0|1,0,0]=3 1034 B7R0.15 CCC(NC)C(C)=O Amb28049011 [2,0,0,0,0,0|2,0,0]=4 1035 B7R0.15 CCC(NC)C(N)=O Amb15701261 [2,0,0,0,0,0|2,0,0]=4 1036 B7R0.15 CCC(NCl)C(=O)O Amb28387574 [2,0,0,0,0,0|2,0,0]=4 1037 B7R0.15 CCC(NN)C(=O)O Amb18641955 [2,0,0,0,0,0|2,0,0]=4 1038 B7R0.15 CCC(NO)C(=O)O Amb4019788 [2,0,0,0,0,0|1,0,1]=4 1039 B7R0.15 CCC(OC)C(=O)O Amb8472685 [2,0,0,0,0,0|2,0,0]=4 1040 B7R0.15 CCC(SC)C(=O)O Amb17501348 [2,0,0,0,0,0|2,0,0]=4 1041 B7R0.15 CC[C@@H](CN)C(=O)O Amb27838297 [2,0,0,0,0,0|1,0,1]=4 1042 B7R0.15 CC[C@@H](CO)C(=O)O Amb22745321 [2,0,0,0,0,0|0,0,1]=3 1043 B7R0.15 CC[C@@H](NC)C(=O)O Amb28315876 [2,0,0,0,0,0|1,0,0]=3 1044 B7R0.15 CC[C@H](CN)C(=O)O Amb25790771 [2,0,0,0,0,0|1,0,1]=4 1045 B7R0.15 CC[C@H](CO)C(=O)O Amb16232065 [2,0,0,0,0,0|0,0,1]=3 1046 B7R0.15 CC[C@H](NC)C(=O)O Amb24505225 [2,0,0,0,0,0|1,0,0]=3 1047 B7R0.15 CC[C@H](NCl)C(=O)O Amb28193501 [2,0,0,0,0,0|2,0,0]=4 1048 B7R0.15 CC[C@H](NN)C(=O)O Amb28289412 [2,0,0,0,0,0|2,0,0]=4 1049 B7R0.15 CNC(CN)C(=O)O Amb23515020 [2,0,0,0,0,0|1,0,0]=3 1050 B7R0.15 CNC(CN)C(=O)O Amb28934876 [2,0,0,0,0,0|1,0,0]=3 1051 B7R0.15 CNC(CO)C(=O)O Amb26068513 [2,0,0,0,0,0|0,0,0]=2 1052 B7R0.15 CNC(CO)C(C)O Amb27794828 [2,0,0,0,0,0|1,0,1]=4 1053 B7R0.15 CNC(CO)C(N)=O Amb18641957 [2,0,0,0,0,0|1,0,0]=3 1054 B7R0.15 CNC(CS)C(=O)O Amb2781760 [2,0,0,0,0,0|0,1,0]=3 1055 B7R0.15 CN[C@@H](CO)C(=O)O Amb16183860 [2,0,0,0,0,0|0,0,0]=2 1056 B7R0.15 CN[C@@H](CO)C(C)=O Amb26476298 [2,0,0,0,0,0|1,0,0]=3 1057 B7R0.15 CN[C@@H](CS)C(=O)O Amb27630049 [2,0,0,0,0,0|0,1,0]=3 1058 B7R0.15 CN[C@@H](CS)C(=O)O Amb33875997 [2,0,0,0,0,0|0,1,0]=3 1059 B7R0.15 CN[C@H](CO)C(=O)O Amb26948665 [2,0,0,0,0,0|0,0,0]=2 1060 B7R0.15 CN[C@H](CO)[C@@H](C)O Amb27239292 [2,0,0,0,0,0|1,0,1]=4 1061 B7R0.15 CN\C(CO)=C(\C)O Amb25210013 [2,0,0,0,0,0|1,0,1]=4 1062 B7R0.15 COC(CN)C(=O)O Amb22059584 [2,0,0,0,0,0|2,0,0]=4 1063 B7R0.15 COC(CN)C(=O)O Amb24271092 [2,0,0,0,0,0|2,0,0]=4 1064 B7R0.15 CO[C@@H](CN)C(=O)O Amb32679591 [2,0,0,0,0,0|2,0,0]=4 1065 B7R0.15 CO[C@@H](CN)C(=O)O Amb32679853 [2,0,0,0,0,0|2,0,0]=4 1066 B7R0.15 CO[C@@H](CO)C(=O)O Amb27409917 [2,0,0,0,0,0|1,0,0]=3 1067 B7R0.15 CSC(C=O)C(=O)O Amb27399075 [2,0,0,0,0,0|2,0,0]=4 1068 B7R0.15 CSC(CCl)C(=O)O Amb24526774 [2,0,0,0,0,0|2,0,0]=4 1069 B7R0.15 CSC(CN)C(=O)O Amb28346880 [2,0,0,0,0,0|2,0,0]=4 1070 B7R0.15 C\C=C(/CBr)C(=O)O Amb18128301 [2,0,0,0,0,0|1,0,1]=4 1071 B7R0.15 C\C=C(/CC)C(=O)O Amb18641780 [2,0,0,0,0,0|1,0,1]=4 1072 B7R0.15 C\C=C(\CO)C(=O)O Amb25306747 [2,0,0,0,0,0|0,0,1]=3 1073 B7R0.15 N#CC(CO)C(=O)O Amb27246245 [2,0,0,0,0,0|1,0,1]=4 1074 B7R0.15 NC[C@H](CO)C(=O)O Amb26873333 [2,0,0,0,0,0|1,0,1]=4 1075 B7R0.15 NNC(CO)C(=O)O Amb27595622 [2,0,0,0,0,0|1,0,0]=3 1076 B7R0.15 NNC(CS)C(=O)O Amb24117863 [2,0,0,0,0,0|1,1,0]=4 1077 B7R0.15 NNC(CS)C(=O)O Amb27834344 [2,0,0,0,0,0|1,1,0]=4 1078 B7R0.15 NOC(CO)C(=O)O Amb27173883 [2,0,0,0,0,0|2,0,0]=4 1079 B7R0.15 O=C(O)C(CO)NCl Amb28120918 [2,0,0,0,0,0|1,0,0]=3 1080 B7R0.15 O=C(O)[C@H](CS)NS Amb27750416 [2,0,0,0,0,0|0,2,0]=4 1081 B7R0.2 C=C(C)CC(C)C=O Amb18641711 [2,0,0,0,0,0|2,0,0]=4 1082 B7R0.2 C=CC(C)CC(C)=O Amb27759897 [2,0,0,0,0,0|2,0,0]=4 1083 B7R0.2 C=CC(C)NC(C)=O Amb27236925 [2,0,0,0,0,0|1,0,0]=3 1084 B7R0.2 C=CC(C)NC(C)=S Amb28042545 [2,0,0,0,0,0|1,1,0]=4 1085 B7R0.2 C=CC(C)OC(C)=O Amb4016456 [2,0,0,0,0,0|2,0,0]=4 1086 B7R0.2 CC(=O)CC(=O)CO Amb28316150 [2,0,0,0,0,0|1,0,1]=4 1087 B7R0.2 CC(=O)CC(N)CO Amb27240210 [2,0,0,0,0,0|2,0,0]=4 1088 B7R0.2 CC(=O)CC(O)CCl Amb27827457 [2,0,0,0,0,0|2,0,0]=4 1089 B7R0.2 CC(=O)C[C@@H](C)C=O Amb27470883 [2,0,0,0,0,0|1,0,0]=3 1090 B7R0.2 CC(=O)C[C@@H](O)CCl Amb27817734 [2,0,0,0,0,0|2,0,0]=4 1091 B7R0.2 CC(=O)C[C@H](C)C=O Amb24379584 [2,0,0,0,0,0|1,0,0]=3 1092 B7R0.2 CC(=O)C[C@H](O)CO Amb28316148 [2,0,0,0,0,0|1,0,0]=3 1093 B7R0.2 CC(=O)NC(=O)CBr Amb33541733 [2,0,0,0,0,0|1,0,1]=4 1094 B7R0.2 CC(=O)NC(=O)CCl Amb1105796 [2,0,0,0,0,0|1,0,1]=4 1095 B7R0.2 CC(=O)NC(=O)CN Amb24117061 [2,0,0,0,0,0|1,0,1]=4 1096 B7R0.2 CC(=O)NC(C)C#N Amb17399792 [2,0,0,0,0,0|1,0,1]=4 1097 B7R0.2 CC(=O)NC(C)CCl Amb33542146 [2,0,0,0,0,0|1,0,1]=4 1098 B7R0.2 CC(=O)NC(C)CO Amb9276356 [2,0,0,0,0,0|0,0,1]=3 1099 B7R0.2 CC(=O)N[C@@H](C)CN Amb27768700 [2,0,0,0,0,0|1,0,1]=4 1100 B7R0.2 CC(=O)N[C@@H](C)CO Amb26515722 [2,0,0,0,0,0|0,0,1]=3 1101 B7R0.2 CC(=O)N[C@H](C)C=O Amb27838347 [2,0,0,0,0,0|0,0,0]=2 1102 B7R0.2 CC(=O)N[C@H](C)CO Amb24426644 [2,0,0,0,0,0|0,0,1]=3 1103 B7R0.2 CC(=O)N\C(C)=C/S Amb27437872 [2,0,0,0,0,0|0,1,1]=4 1104 B7R0.2 CC(=O)N\C(C)=C\S Amb28384532 [2,0,0,0,0,0|0,1,1]=4 1105 B7R0.2 CC(=O)OC(C)C=O Amb18641863 [2,0,0,0,0,0|1,0,0]=3 1106 B7R0.2 CC(=O)OC(O)CN Amb27839430 [2,0,0,0,0,0|2,0,0]=4 1107 B7R0.2 CC(=O)O[C@H](C)C=O Amb28422009 [2,0,0,0,0,0|1,0,0]=3 1108 B7R0.2 CC(=O)\C=C(/C)C=O Amb27607120 [2,0,0,0,0,0|1,0,1]=4 1109 B7R0.2 CC(=O)\C=C(\C)C=O Amb18641689 [2,0,0,0,0,0|1,0,1]=4 1110 B7R0.2 CC(CO)NS(C)=O Amb28286003 [2,0,0,0,0,0|1,0,1]=4 1111 B7R0.2 CCC(=O)NC(C)=O Amb27800787 [2,0,0,0,0,0|1,0,1]=4 1112 B7R0.2 CCC(C)NC(C)=O Amb3358085 [2,0,0,0,0,0|1,0,1]=4 1113 B7R0.2 CCC(O)CC(C)=O Amb25065181 [2,0,0,0,0,0|2,0,0]=4 1114 B7R0.2 CCC(O)OC(C)=O Amb28256771 [2,0,0,0,0,0|2,0,0]=4 1115 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [2,0,0,0,0,0|2,0,0]=4 1116 B7R0.2 CC[C@H](O)CC(C)=O Amb26980782 [2,0,0,0,0,0|2,0,0]=4 1117 B7R0.2 COC(C)NC(C)=O Amb27839138 [2,0,0,0,0,0|2,0,0]=4 1118 B7R0.2 C[C@H](CO)NS(C)=O Amb27226913 [2,0,0,0,0,0|1,0,1]=4 1119 B7R0.2 C\C=C(\C)NC(C)=O Amb24468210 [2,0,0,0,0,0|1,0,1]=4 1120 B7R0.2 NC(=O)CC(O)CO Amb25662216 [2,0,0,0,0,0|2,0,0]=4 1121 B7R0.2 NC(=O)C[C@H](O)CO Amb8388588 [2,0,0,0,0,0|2,0,0]=4 1122 B7R0.2 O=C(O)CC(O)CO Amb28120003 [2,0,0,0,0,0|2,0,0]=4 1123 B7R0.2 O=C(O)C[C@H](O)CO Amb26353423 [2,0,0,0,0,0|2,0,0]=4 1124 B7R0.2 O=C([O-])CC(O)CO Amb24117078 [2,0,0,0,0,0|2,0,0]=4 1125 B7R0.6 C=C(C)CCC(=O)O Amb18641793 [2,0,0,0,0,0|2,0,0]=4 1126 B7R0.6 C=C(C)NCC(=O)O Amb9173757 [2,0,0,0,0,0|1,0,0]=3 1127 B7R0.6 CC(=N)NCC(N)=O Amb27601983 [2,0,0,0,0,0|2,0,0]=4 1128 B7R0.6 CC(=O)CCC(=O)O Amb534169 [2,0,0,0,0,0|1,0,0]=3 1129 B7R0.6 CC(=O)CCC(C)=O Amb2793010 [2,0,0,0,0,0|2,0,0]=4 1130 B7R0.6 CC(=O)CCC(N)=O Amb17142854 [2,0,0,0,0,0|2,0,0]=4 1131 B7R0.6 CC(=O)CCC(O)=S Amb27267983 [2,0,0,0,0,0|1,1,0]=4 1132 B7R0.6 CC(=O)CNC(C)=O Amb6297294 [2,0,0,0,0,0|1,0,0]=3 1133 B7R0.6 CC(=O)CNS(C)=O Amb27243778 [2,0,0,0,0,0|2,0,0]=4 1134 B7R0.6 CC(=O)COC(C)=O Amb8517567 [2,0,0,0,0,0|2,0,0]=4 1135 B7R0.6 CC(=O)NCB(O)O Amb8392097 [2,0,0,0,0,0|1,0,1]=4 1136 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [2,0,0,0,0,0|0,0,0]=2 1137 B7R0.6 CC(=O)NCC(C)O Amb9276316 [2,0,0,0,0,0|1,0,1]=4 1138 B7R0.6 CC(=O)NCC(N)=O Amb17231824 [2,0,0,0,0,0|1,0,0]=3 1139 B7R0.6 CC(=O)NCC(N)=S Amb17231879 [2,0,0,0,0,0|1,1,0]=4 1140 B7R0.6 CC(=O)NNC(C)=O Amb8516143 [2,0,0,0,0,0|2,0,0]=4 1141 B7R0.6 CC(=O)OCC(=O)Cl Amb3939160 [2,0,0,0,0,0|2,0,0]=4 1142 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [2,0,0,0,0,0|1,0,0]=3 1143 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [2,0,0,0,0,0|2,0,0]=4 1144 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [2,0,0,0,0,0|2,0,0]=4 1145 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [2,0,0,0,0,0|2,0,0]=4 1146 B7R0.6 CC(=O)\C=C\C(=O)O Amb2722867 [2,0,0,0,0,0|1,0,1]=4 1147 B7R0.6 CC(=O)\N=C\C(=O)O Amb27262053 [2,0,0,0,0,0|0,0,2]=4 1148 B7R0.6 CC(=S)NCC(=O)O Amb24325138 [2,0,0,0,0,0|0,1,0]=3 1149 B7R0.6 CC(=S)SCC(=O)O Amb25963237 [2,0,0,0,0,0|1,1,0]=4 1150 B7R0.6 CC(C)=CCC(=O)O Amb6274419 [2,0,0,0,0,0|2,0,0]=4 1151 B7R0.6 CC(C)NCC(=O)O Amb2372347 [2,0,0,0,0,0|1,0,1]=4 1152 B7R0.6 CC(C)NCC(=O)O Amb6892753 [2,0,0,0,0,0|1,0,1]=4 1153 B7R0.6 CS(=O)CCC(=O)O Amb18523762 [2,0,0,0,0,0|2,0,0]=4 1154 B7R0.6 CS(=O)NCC(=O)O Amb25237322 [2,0,0,0,0,0|1,0,0]=3 1155 B7R0.6 C\C(Cl)=C\CC(=O)O Amb27975492 [2,0,0,0,0,0|2,0,0]=4 1156 B7R0.6 N=C(N)NCC(=O)O Amb16231404 [2,0,0,0,0,0|2,0,0]=4 1157 B7R0.6 N=C(N)NCC(=O)O Amb2781642 [2,0,0,0,0,0|2,0,0]=4 1158 B7R0.6 NC(=O)CCC(=O)O Amb2967294 [2,0,0,0,0,0|2,0,0]=4 1159 B7R0.6 NC(=O)NCC(=O)O Amb6366364 [2,0,0,0,0,0|1,0,0]=3 1160 B7R0.6 NC(=S)NCC(=O)O Amb9786290 [2,0,0,0,0,0|1,1,0]=4 1161 B7R0.6 O=C(O)CCC(=O)O Amb22168124 [2,0,0,0,0,0|2,0,0]=4 1162 B7R0.6 O=C(O)CCC(=O)O Amb2792874 [2,0,0,0,0,0|2,0,0]=4 1163 B7R0.6 O=C(O)CNC(=O)S Amb27424662 [2,0,0,0,0,0|1,0,0]=3 1164 B7R0.6 O=C(O)CN[N+](=O)[O-] Amb26397226 [2,0,0,0,0,0|2,0,0]=4 1165 B7R0.6 O=C(O)COC(=O)Cl Amb27199161 [2,0,0,0,0,0|2,0,0]=4 1166 B7R0.6 [BH3-]C(=O)NCC(=O)O Amb27478291 [2,0,0,0,0,0|1,0,0]=3 1167 B9R0.12 CCC(NC=O)C(=O)NC Amb29872163 [1,1,0,0,0,0|2,0,0]=4 1168 B9R0.12 CCNC(CC)C(=O)OC Amb25324244 [1,1,0,0,0,0|1,0,1]=4 1169 B9R0.12 CCNC(CC)C(=O)OC Amb32753847 [1,1,0,0,0,0|1,0,1]=4 1170 B9R0.12 CCNC(CN)C(=O)OC Amb27830264 [1,1,0,0,0,0|1,0,1]=4 1171 B9R0.12 CCNC(CO)C(=O)OC Amb27407880 [1,1,0,0,0,0|0,0,1]=3 1172 B9R0.12 CCN[C@@H](CO)C(=O)OC Amb27468731 [1,1,0,0,0,0|0,0,1]=3 1173 B9R0.12 COC(=O)C(C=O)NC=O Amb28252686 [1,1,0,0,0,0|0,0,2]=4 1174 B9R0.12 COC(=O)C(CO)NC#N Amb27245714 [1,1,0,0,0,0|1,0,1]=4 1175 B9R0.12 COC(=O)[C@@H](CO)NC=O Amb27970262 [1,1,0,0,0,0|0,0,0]=2 1176 B9R0.12 C\C=N\[C@@H](CO)C(=O)OC Amb27481118 [1,1,0,0,0,0|0,0,1]=3 1177 B9R0.13 C=CCNC(CS)C(=O)O Amb28382320 [1,1,0,0,0,0|0,1,1]=4 1178 B9R0.13 CCC(CCC=O)C(=O)O Amb27216961 [1,1,0,0,0,0|2,0,0]=4 1179 B9R0.13 CCC(NCCF)C(=O)O Amb27427562 [1,1,0,0,0,0|1,0,1]=4 1180 B9R0.13 CCC(NCCN)C(=O)O Amb28061779 [1,1,0,0,0,0|1,0,1]=4 1181 B9R0.13 CCC(NCCO)C(=O)O Amb18115226 [1,1,0,0,0,0|1,0,1]=4 1182 B9R0.13 CCCCC(CO)C(=O)O Amb27834958 [1,1,0,0,0,0|1,0,1]=4 1183 B9R0.13 CCCC[C@H](CO)C(=O)O Amb16232529 [1,1,0,0,0,0|1,0,1]=4 1184 B9R0.13 CCCN[C@@H](CS)C(=O)O Amb27645159 [1,1,0,0,0,0|0,1,1]=4 1185 B9R0.13 CCCN[C@H](CO)C(=O)O Amb28125350 [1,1,0,0,0,0|0,0,1]=3 1186 B9R0.13 CCCSC(CO)C(=O)O Amb27629095 [1,1,0,0,0,0|1,0,1]=4 1187 B9R0.13 CC\C=C\C(CC)C(=O)O Amb33080288 [1,1,0,0,0,0|2,0,0]=4 1188 B9R0.13 CC\C=C\C(CN)C(=O)O Amb33268709 [1,1,0,0,0,0|2,0,0]=4 1189 B9R0.13 C\C=C\CC(CC)C(=O)O Amb18643880 [1,1,0,0,0,0|2,0,0]=4 1190 B9R0.13 NCC(NCCF)C(=O)O Amb27246937 [1,1,0,0,0,0|1,0,1]=4 1191 B9R0.13 NCCNC(CN)C(=O)O Amb28454232 [1,1,0,0,0,0|1,0,1]=4 1192 B9R0.13 NCCN[C@@H](CS)C(=O)O Amb27407766 [1,1,0,0,0,0|0,1,1]=4 1193 B9R0.13 O=C(O)C(CO)SCCO Amb28196797 [1,1,0,0,0,0|1,0,1]=4 1194 B9R0.13 O=C(O)C(CS)NCCO Amb27454918 [1,1,0,0,0,0|0,1,1]=4 1195 B9R0.13 O=C(O)[C@H](CS)NCCCl Amb27592190 [1,1,0,0,0,0|0,1,1]=4 1196 B9R0.13 O=C(O)[C@H](CS)NCCO Amb27617120 [1,1,0,0,0,0|0,1,1]=4 1197 B9R0.15 C#CCC(NC=O)C(=O)O Amb25069360 [1,1,0,0,0,0|1,0,0]=3 1198 B9R0.15 C=CCC(COC)C(=O)O Amb18644105 [1,1,0,0,0,0|1,0,1]=4 1199 B9R0.15 C=CCC(NC=O)C(=O)O Amb24641210 [1,1,0,0,0,0|1,0,0]=3 1200 B9R0.15 CCCC(CC=O)C(=O)O Amb27786319 [1,1,0,0,0,0|2,0,0]=4 1201 B9R0.15 CCCC(NC=O)C(=O)O Amb9871545 [1,1,0,0,0,0|1,0,0]=3 1202 B9R0.15 CCCC(NCC)C(=O)O Amb9496319 [1,1,0,0,0,0|1,0,1]=4 1203 B9R0.15 CCC[C@@H](NC=O)C(=O)O Amb27831939 [1,1,0,0,0,0|1,0,0]=3 1204 B9R0.15 CCC[C@@H](NCC)C(=O)O Amb33347491 [1,1,0,0,0,0|1,0,1]=4 1205 B9R0.15 CCC[C@H](NCC)C(=O)O Amb33347483 [1,1,0,0,0,0|1,0,1]=4 1206 B9R0.15 CCNC(CCN)C(=O)O Amb27830036 [1,1,0,0,0,0|1,0,1]=4 1207 B9R0.15 CCN[C@H](COC)C(=O)O Amb33347499 [1,1,0,0,0,0|0,0,1]=3 1208 B9R0.15 CCOC(COC)C(=O)O Amb28348050 [1,1,0,0,0,0|1,0,1]=4 1209 B9R0.15 COCC(N=C=O)C(=O)O Amb33471318 [1,1,0,0,0,0|0,0,2]=4 1210 B9R0.15 COCC(NC=O)C(=O)O Amb25378764 [1,1,0,0,0,0|0,0,0]=2 1211 B9R0.15 COC[C@H](N=C=O)C(=O)O Amb33471381 [1,1,0,0,0,0|0,0,2]=4 1212 B9R0.15 COC[C@H](NC=O)C(=O)O Amb27390202 [1,1,0,0,0,0|0,0,0]=2 1213 B9R0.15 CSCC(NCO)C(=O)O Amb28137810 [1,1,0,0,0,0|2,0,0]=4 1214 B9R0.15 C\C=C\C(CCC)C(=O)O Amb18643916 [1,1,0,0,0,0|2,0,0]=4 1215 B9R0.15 N#CCC(NC=O)C(=O)O Amb33066274 [1,1,0,0,0,0|1,0,0]=3 1216 B9R0.15 O=CNC(CCF)C(=O)O Amb26995646 [1,1,0,0,0,0|1,0,0]=3 1217 B9R0.15 O=CNC(CCO)C(=O)O Amb18305692 [1,1,0,0,0,0|0,0,0]=2 1218 B9R0.15 O=CN[C@H](CCO)C(=O)O Amb27238455 [1,1,0,0,0,0|0,0,0]=2 1219 B9R0.29 CCC(C(=O)O)N(C)CC Amb9675598 [1,1,0,0,0,0|1,0,1]=4 1220 B9R0.29 CCC(C(=O)O)N(O)C=O Amb27253538 [1,1,0,0,0,0|1,0,0]=3 1221 B9R0.29 CCN(N)[C@@H](CS)C(=O)O Amb27657394 [1,1,0,0,0,0|0,1,1]=4 1222 B9R0.29 CN(C=O)C(CO)C(=O)O Amb28325160 [1,1,0,0,0,0|0,0,0]=2 1223 B9R0.29 C\C=C(/C)C(CC)C(=O)O Amb27440494 [1,1,0,0,0,0|2,0,0]=4 1224 B9R0.33 CC(C)C(NC=O)C(=O)O Amb4018743 [1,1,0,0,0,0|1,0,0]=3 1225 B9R0.33 CC(C)C(NN=O)C(=O)O Amb28198835 [1,1,0,0,0,0|2,0,0]=4 1226 B9R0.33 CC(C)[C@@H](NC=O)C(=O)O Amb22745192 [1,1,0,0,0,0|1,0,0]=3 1227 B9R0.33 CC(C)[C@H](NC=O)C(=O)O Amb4018781 [1,1,0,0,0,0|1,0,0]=3 1228 B9R0.33 CC(C)[C@H](NN=O)C(=O)O Amb27810805 [1,1,0,0,0,0|2,0,0]=4 1229 B9R0.33 CC(O)C(NC#N)C(=O)O Amb30031280 [1,1,0,0,0,0|1,0,1]=4 1230 B9R0.33 CCCC(C(=O)O)C(C)O Amb26422276 [1,1,0,0,0,0|1,0,1]=4 1231 B9R0.33 CCC[C@H](C(=O)O)[C@H](C)O Amb27221692 [1,1,0,0,0,0|1,0,1]=4 1232 B9R0.33 CCNC(C(=O)O)C(C)C Amb19514760 [1,1,0,0,0,0|1,0,1]=4 1233 B9R0.33 CCNC(C(=O)O)C(C)C Amb9327924 [1,1,0,0,0,0|1,0,1]=4 1234 B9R0.33 CCN[C@@H](C(=O)O)C(C)C Amb33347482 [1,1,0,0,0,0|1,0,1]=4 1235 B9R0.33 CCN[C@H](C(=O)O)C(C)C Amb25230589 [1,1,0,0,0,0|1,0,1]=4 1236 B9R0.33 CCN[C@H](C(=O)O)C(C)O Amb27629796 [1,1,0,0,0,0|0,0,1]=3 1237 B9R0.33 C[C@@H](O)[C@H](NC#N)C(=O)O Amb30031230 [1,1,0,0,0,0|1,0,1]=4 1238 B9R0.33 C\C=C\C(C(=O)O)C(C)C Amb18643944 [1,1,0,0,0,0|2,0,0]=4 1239 B9R0.33 C\C=N\[C@H](C(=O)O)C(C)C Amb27831817 [1,1,0,0,0,0|1,0,1]=4 1240 B9R0.74 C=CCC(O)(CO)C(=O)O Amb27635848 [1,1,0,0,0,0|1,0,1]=4 1241 B9R0.74 CC(C#N)(NC=O)C(=O)O Amb27839466 [1,1,0,0,0,0|1,0,1]=4 1242 B9R0.74 CC(CO)(NC#N)C(=O)O Amb35593376 [1,1,0,0,0,0|1,0,1]=4 1243 B9R0.74 CC(CO)(NC=O)C(=O)O Amb27652605 [1,1,0,0,0,0|0,0,0]=2 1244 B9R0.74 CCC(C)(NC=O)C(=O)O Amb27833208 [1,1,0,0,0,0|1,0,0]=3 1245 B9R0.74 CCC(C)(NC=O)C(N)=O Amb27613694 [1,1,0,0,0,0|2,0,0]=4 1246 B9R0.74 CCCC(N)(CO)C(=O)O Amb27668101 [1,1,0,0,0,0|1,0,1]=4 1247 B9R0.74 CCNC(C)(CO)C(=O)O Amb28067321 [1,1,0,0,0,0|0,0,1]=3 1248 B9R0.74 CC[C@@](C)(NC=O)C(=O)O Amb27461335 [1,1,0,0,0,0|1,0,0]=3 1249 B9R0.74 CC[C@](C)(NC=O)C(=O)O Amb28410541 [1,1,0,0,0,0|1,0,0]=3 1250 B9R0.74 COCC(O)(CO)C(=O)O Amb27465024 [1,1,0,0,0,0|2,0,0]=4 1251 B9R0.74 C\C=C\[C@](N)(CC)C(=O)O Amb27799654 [1,1,0,0,0,0|2,0,0]=4 1252 B9R0.14 C#CC(COC)NC(C)=O Amb28315914 [1,1,0,0,0,0|1,0,1]=4 1253 B9R0.14 C=CCC(CC)NC(C)=O Amb27858141 [1,1,0,0,0,0|2,0,0]=4 1254 B9R0.14 C=CCC(CO)NC(C)=O Amb27838085 [1,1,0,0,0,0|1,0,0]=3 1255 B9R0.14 C=CCC(CO)NC(N)=O Amb28318590 [1,1,0,0,0,0|2,0,0]=4 1256 B9R0.14 CC(=O)NC(C=O)CC=O Amb27424810 [1,1,0,0,0,0|0,0,1]=3 1257 B9R0.14 CC(=O)NC(CO)CCO Amb26855329 [1,1,0,0,0,0|0,0,1]=3 1258 B9R0.14 CC(=O)N[C@@H](C=O)CC=O Amb27950711 [1,1,0,0,0,0|0,0,1]=3 1259 B9R0.14 CC(=O)N[C@H](CO)CCO Amb28043105 [1,1,0,0,0,0|0,0,1]=3 1260 B9R0.14 CCC(CC=O)CC(C)=O Amb26587505 [1,1,0,0,0,0|2,0,0]=4 1261 B9R0.14 CCC(CC=O)NC(C)=O Amb27237530 [1,1,0,0,0,0|1,0,0]=3 1262 B9R0.14 CCCC(C=O)OC(C)=O Amb18644107 [1,1,0,0,0,0|2,0,0]=4 1263 B9R0.14 CC[C@H](CC=O)NC(C)=O Amb28050247 [1,1,0,0,0,0|1,0,0]=3 1264 B9R0.14 COCC(CCl)NC(C)=O Amb27766500 [1,1,0,0,0,0|1,0,1]=4 1265 B9R0.14 COCC(CO)NC(N)=O Amb28118310 [1,1,0,0,0,0|1,0,1]=4 1266 B9R0.14 COC[C@H](CO)NC(C)=O Amb28342322 [1,1,0,0,0,0|0,0,1]=3 1267 B9R0.14 COC[C@H](CO)NC(N)=O Amb28453946 [1,1,0,0,0,0|1,0,1]=4 1268 B9R0.14 C\C=C\C(CO)NC(C)=O Amb27838102 [1,1,0,0,0,0|1,0,0]=3 1269 B9R0.14 NC(=O)N[C@H](CO)CCO Amb28043702 [1,1,0,0,0,0|1,0,1]=4 1270 B9R0.26 C=CC(=O)NC(CO)CO Amb27950467 [1,1,0,0,0,0|0,0,2]=4 1271 B9R0.26 C=CC(CO)CC(=O)OC Amb28050688 [1,1,0,0,0,0|2,0,0]=4 1272 B9R0.26 C=CC(CO)NC(=O)CC Amb27615115 [1,1,0,0,0,0|1,0,0]=3 1273 B9R0.26 C=CC(CO)NC(=O)CO Amb28062081 [1,1,0,0,0,0|1,0,0]=3 1274 B9R0.26 C=CC(CO)NC(=O)OC Amb27837968 [1,1,0,0,0,0|1,0,0]=3 1275 B9R0.26 CCC(=O)N[C@@H](CC)CO Amb27466160 [1,1,0,0,0,0|1,0,1]=4 1276 B9R0.26 CCC(CO)NC(=O)CBr Amb17329184 [1,1,0,0,0,0|1,0,1]=4 1277 B9R0.26 CCC(CO)NC(=O)NC Amb27852633 [1,1,0,0,0,0|1,0,1]=4 1278 B9R0.26 CC[C@@H](C=O)CC(=O)OC Amb28250907 [1,1,0,0,0,0|2,0,0]=4 1279 B9R0.26 CC[C@@H](CO)NC(=O)NC Amb28189018 [1,1,0,0,0,0|1,0,1]=4 1280 B9R0.26 CC[C@H](CO)NC(=O)CBr Amb27989179 [1,1,0,0,0,0|1,0,1]=4 1281 B9R0.26 CC[C@H](CO)NC(=O)CO Amb27836654 [1,1,0,0,0,0|1,0,1]=4 1282 B9R0.26 CNC(=O)CC(CO)CO Amb27770361 [1,1,0,0,0,0|1,0,1]=4 1283 B9R0.26 COC(=O)CN(C=O)CO Amb28044780 [1,1,0,0,0,0|2,0,0]=4 1284 B9R0.26 O=C(CO)NC(CO)CO Amb28049820 [1,1,0,0,0,0|0,0,1]=3 1285 B9R0.26 O=C(CS)NC(CO)CO Amb27966396 [1,1,0,0,0,0|0,0,1]=3 1286 B9R0.41 CCC(CO)N(C)C(C)=O Amb28144695 [1,1,0,0,0,0|1,0,1]=4 1287 B9R0.41 CN(C(N)=O)C(CO)CO Amb27823244 [1,1,0,0,0,0|1,0,1]=4 1288 B9R0.52 CS(=O)(=O)NC(CO)CO Amb26610337 [1,1,0,0,0,0|1,0,1]=4 1289 B9R0.10 CC(=O)NC(C)P(=O)(O)O Amb27229951 [1,1,0,0,0,0|1,0,0]=3 1290 B9R0.11 C=C(C)CC(C)(C)C(=O)O Amb27619182 [1,1,0,0,0,0|2,0,0]=4 1291 B9R0.11 C=C(C)CC(C)(N)C(=O)O Amb27838051 [1,1,0,0,0,0|2,0,0]=4 1292 B9R0.11 C=C(C)CC(C)(O)C(=O)O Amb24763776 [1,1,0,0,0,0|2,0,0]=4 1293 B9R0.11 C=C(C)C[C@](C)(O)C(=O)O Amb27618953 [1,1,0,0,0,0|2,0,0]=4 1294 B9R0.11 CC(=N)NC(C)(C)C(N)=O Amb27260683 [1,1,0,0,0,0|2,0,0]=4 1295 B9R0.11 CC(=O)CC(C)(C)C(=O)O Amb18644092 [1,1,0,0,0,0|1,0,0]=3 1296 B9R0.11 CC(=O)CC(C)(C)C(=O)S Amb28201149 [1,1,0,0,0,0|1,1,0]=4 1297 B9R0.11 CC(=O)CC(C)(S)C(=O)O Amb27984551 [1,1,0,0,0,0|1,0,0]=3 1298 B9R0.11 CC(=O)C[C@](C)(O)C(=O)O Amb27170683 [1,1,0,0,0,0|1,0,0]=3 1299 B9R0.11 CC(=O)NC(C)(C)C(=O)O Amb13952726 [1,1,0,0,0,0|0,0,0]=2 1300 B9R0.11 CC(=O)NC(C)(C)C(C)=O Amb27798335 [1,1,0,0,0,0|1,0,0]=3 1301 B9R0.11 CC(=O)NC(C)(N)C(=O)O Amb27881127 [1,1,0,0,0,0|0,0,0]=2 1302 B9R0.11 CC(=O)OC(C)(C)C(=O)Br Amb8384982 [1,1,0,0,0,0|2,0,0]=4 1303 B9R0.11 CC(=O)OC(C)(C)C(=O)Cl Amb3939171 [1,1,0,0,0,0|2,0,0]=4 1304 B9R0.11 CC(=O)OC(C)(C)C(=O)O Amb18644243 [1,1,0,0,0,0|1,0,0]=3 1305 B9R0.11 CC(=O)OC(C)(C)C(C)=O Amb8394371 [1,1,0,0,0,0|2,0,0]=4 1306 B9R0.11 CC(=O)SC(C)(C)C(=O)O Amb17607677 [1,1,0,0,0,0|1,0,0]=3 1307 B9R0.11 CC(=O)SC(F)(F)C(=O)O Amb27252817 [1,1,0,0,0,0|2,0,0]=4 1308 B9R0.11 CC(C)(CC(=O)O)C(=O)O Amb9787793 [1,1,0,0,0,0|2,0,0]=4 1309 B9R0.11 CC(C)(NC(N)=O)C(=O)O Amb9825347 [1,1,0,0,0,0|1,0,0]=3 1310 B9R0.11 CC(C)=CC(C)(C)C(=O)O Amb27162610 [1,1,0,0,0,0|2,0,0]=4 1311 B9R0.11 CC(C)NC(C)(C)C(=O)O Amb3978636 [1,1,0,0,0,0|1,0,1]=4 1312 B9R0.11 CC(Cl)(CC(=O)O)C(=O)O Amb18126463 [1,1,0,0,0,0|2,0,0]=4 1313 B9R0.11 CC(N)(CC(=O)O)C(=O)O Amb10807406 [1,1,0,0,0,0|2,0,0]=4 1314 B9R0.11 CC(N)(CC(N)=O)C(=O)O Amb28131361 [1,1,0,0,0,0|2,0,0]=4 1315 B9R0.11 CC(O)(CC(=O)O)C(=O)O Amb6366309 [1,1,0,0,0,0|2,0,0]=4 1316 B9R0.11 CS(=O)CC(C)(C)C(=O)O Amb28049647 [1,1,0,0,0,0|2,0,0]=4 1317 B9R0.11 CS(=O)CC(C)(O)C(=O)O Amb27984742 [1,1,0,0,0,0|2,0,0]=4 1318 B9R0.11 C[C@@](N)(CC(N)=O)C(=O)O Amb22225025 [1,1,0,0,0,0|2,0,0]=4 1319 B9R0.11 C[C@](N)(CC(=O)O)C(=O)O Amb10601663 [1,1,0,0,0,0|2,0,0]=4 1320 B9R0.11 C[C@](N)(CC(N)=O)C(=O)O Amb27195940 [1,1,0,0,0,0|2,0,0]=4 1321 B9R0.11 C[C@](O)(CC(=O)O)C(=O)O Amb26398856 [1,1,0,0,0,0|2,0,0]=4 1322 B9R0.11 NC(=O)CC(N)(O)C(=O)O Amb27794741 [1,1,0,0,0,0|2,0,0]=4 1323 B9R0.11 NC(=O)C[C@@](N)(O)C(=O)O Amb28348701 [1,1,0,0,0,0|2,0,0]=4 1324 B9R0.23 C=C(C)CC(C)C(=O)OC Amb27857780 [1,1,0,0,0,0|2,0,0]=4 1325 B9R0.23 C=C(C)CC(O)C(=O)OC Amb24464009 [1,1,0,0,0,0|2,0,0]=4 1326 B9R0.23 C=C(C)C[C@@H](O)C(=O)OC Amb27219810 [1,1,0,0,0,0|2,0,0]=4 1327 B9R0.23 C=C(NC(C)=O)C(=O)OC Amb10807388 [1,1,0,0,0,0|0,0,2]=4 1328 B9R0.23 CC(=O)NC(C)C(=O)NN Amb8998040 [1,1,0,0,0,0|1,0,0]=3 1329 B9R0.23 CC(=O)NC(C)C(O)CO Amb35660314 [1,1,0,0,0,0|0,0,2]=4 1330 B9R0.23 CC(=O)NC(C)\C(N)=N\O Amb28126933 [1,1,0,0,0,0|1,0,0]=3 1331 B9R0.23 CC(=O)OC(C)C(=O)C=O Amb27852090 [1,1,0,0,0,0|1,0,1]=4 1332 B9R0.23 CC(=O)OC(C)C(=O)NN Amb27769604 [1,1,0,0,0,0|2,0,0]=4 1333 B9R0.23 CC(=O)O[C@@H](C)[C@H](O)C=O Amb27194323 [1,1,0,0,0,0|1,0,1]=4 1334 B9R0.23 CCC(=O)C(C)NC(N)=O Amb28350530 [1,1,0,0,0,0|2,0,0]=4 1335 B9R0.23 CCC(=O)C(C)NS(C)=O Amb28195270 [1,1,0,0,0,0|2,0,0]=4 1336 B9R0.23 CCC(=O)C(C)OC(C)=O Amb25909694 [1,1,0,0,0,0|2,0,0]=4 1337 B9R0.23 CCC(=O)[C@H](C)NC(C)=O Amb27468250 [1,1,0,0,0,0|1,0,0]=3 1338 B9R0.23 CNC(=O)C(C)NC(N)=O Amb27806674 [1,1,0,0,0,0|2,0,0]=4 1339 B9R0.23 CNC(=O)C(C)OC(C)=O Amb27168697 [1,1,0,0,0,0|2,0,0]=4 1340 B9R0.23 CNC(=O)[C@@H](C)NC(N)=O Amb35660536 [1,1,0,0,0,0|2,0,0]=4 1341 B9R0.23 CNC(=O)[C@@H](C)OC(C)=O Amb27253659 [1,1,0,0,0,0|2,0,0]=4 1342 B9R0.23 CNC(=O)[C@H](C)NC(C)=O Amb22800074 [1,1,0,0,0,0|1,0,0]=3 1343 B9R0.23 CNC(=S)[C@H](C)NC(C)=O Amb27597544 [1,1,0,0,0,0|1,1,0]=4 1344 B9R0.23 COC(=O)C(C)CC(=O)O Amb18644248 [1,1,0,0,0,0|2,0,0]=4 1345 B9R0.23 COC(=O)C(C)CC(C)=O Amb27465860 [1,1,0,0,0,0|1,0,0]=3 1346 B9R0.23 COC(=O)C(C)NC(=N)N Amb27780112 [1,1,0,0,0,0|2,0,0]=4 1347 B9R0.23 COC(=O)C(C)NC(C)=O Amb24650565 [1,1,0,0,0,0|0,0,0]=2 1348 B9R0.23 COC(=O)C(C)NC(C)=S Amb27838032 [1,1,0,0,0,0|0,1,0]=3 1349 B9R0.23 COC(=O)C(C)NC(C)C Amb19003119 [1,1,0,0,0,0|1,0,1]=4 1350 B9R0.23 COC(=O)C(C)NC(N)=O Amb20407420 [1,1,0,0,0,0|1,0,0]=3 1351 B9R0.23 COC(=O)C(C)NN(C)C Amb27985422 [1,1,0,0,0,0|2,0,0]=4 1352 B9R0.23 COC(=O)C(C)NS(C)=O Amb27431923 [1,1,0,0,0,0|1,0,0]=3 1353 B9R0.23 COC(=O)C(Cl)NC(C)=O Amb28193243 [1,1,0,0,0,0|1,0,0]=3 1354 B9R0.23 COC(=O)C(N)CC(C)=O Amb25367296 [1,1,0,0,0,0|2,0,0]=4 1355 B9R0.23 COC(=O)C(O)CC(=O)O Amb17615865 [1,1,0,0,0,0|2,0,0]=4 1356 B9R0.23 COC(=O)C(O)CC(N)=O Amb27655536 [1,1,0,0,0,0|2,0,0]=4 1357 B9R0.23 COC(=O)[C@@H](C)NC(C)=O Amb17621817 [1,1,0,0,0,0|0,0,0]=2 1358 B9R0.23 COC(=O)[C@@H](C)OC(C)=O Amb28314265 [1,1,0,0,0,0|1,0,0]=3 1359 B9R0.23 COC(=O)[C@@H](O)CC(=O)O Amb17615867 [1,1,0,0,0,0|2,0,0]=4 1360 B9R0.23 COC(=O)[C@H](C)CC(=O)Cl Amb28050543 [1,1,0,0,0,0|2,0,0]=4 1361 B9R0.23 COC(=O)[C@H](C)CC(=O)O Amb24561954 [1,1,0,0,0,0|2,0,0]=4 1362 B9R0.23 COC(=O)[C@H](C)NC(C)=O Amb4034849 [1,1,0,0,0,0|0,0,0]=2 1363 B9R0.23 COC(=O)[C@H](C)NC(C)=S Amb26907443 [1,1,0,0,0,0|0,1,0]=3 1364 B9R0.23 COC(=O)[C@H](C)NC(C)C Amb9228611 [1,1,0,0,0,0|1,0,1]=4 1365 B9R0.23 COC(=O)[C@H](C)NC(N)=O Amb27948545 [1,1,0,0,0,0|1,0,0]=3 1366 B9R0.23 COC(=O)[C@H](O)C=C(C)C Amb27432220 [1,1,0,0,0,0|2,0,0]=4 1367 B9R0.23 COC(=O)[C@H](O)CC(=O)O Amb17615866 [1,1,0,0,0,0|2,0,0]=4 1368 B9R0.23 COC(=O)[C@H](O)CC(N)=O Amb27623997 [1,1,0,0,0,0|2,0,0]=4 1369 B9R0.23 COC(=O)\C(C)=C\C(C)=O Amb27164598 [1,1,0,0,0,0|1,0,1]=4 1370 B9R0.23 COC(=O)\C(O)=C\C(C)=O Amb1981446 [1,1,0,0,0,0|1,0,1]=4 1371 B9R0.23 COC(C)[C@@H](C)NC(C)=O Amb27197797 [1,1,0,0,0,0|1,0,1]=4 1372 B9R0.23 COC(C)[C@H](C)NC(C)=O Amb28063340 [1,1,0,0,0,0|1,0,1]=4 1373 B9R0.42 C#CC(=O)N[C@@H](C)C(=O)O Amb28060769 [1,1,0,0,0,0|0,0,1]=3 1374 B9R0.42 C=C(NC(=O)CCl)C(=O)O Amb1951911 [1,1,0,0,0,0|0,0,2]=4 1375 B9R0.42 C=C(NC(=O)CN)C(=O)O Amb25845451 [1,1,0,0,0,0|0,0,2]=4 1376 B9R0.42 C=CC(=O)NC(O)C(=O)O Amb3940875 [1,1,0,0,0,0|0,0,1]=3 1377 B9R0.42 C=CC(=O)NC(O)C(=O)O Amb9790819 [1,1,0,0,0,0|0,0,1]=3 1378 B9R0.42 C=CC(=O)NC(O)C(=O)[O-] Amb33512922 [1,1,0,0,0,0|0,0,2]=4 1379 B9R0.42 C=CC(=O)N[C@H](C)C(N)=O Amb27770556 [1,1,0,0,0,0|1,0,1]=4 1380 B9R0.42 C=CC(=O)OC(C)C(=O)O Amb27592472 [1,1,0,0,0,0|1,0,1]=4 1381 B9R0.42 CC(=O)C(C)\C=C(/C)C=O Amb27753996 [1,1,0,0,0,0|2,0,0]=4 1382 B9R0.42 CC(CC(=O)CCl)C(=O)O Amb24585160 [1,1,0,0,0,0|1,0,0]=3 1383 B9R0.42 CC(NC(=O)C=O)C(=O)O Amb27830810 [1,1,0,0,0,0|0,0,1]=3 1384 B9R0.42 CC(NC(=O)C=O)C(N)=O Amb27469201 [1,1,0,0,0,0|1,0,1]=4 1385 B9R0.42 CC(NC(=O)CBr)C(N)=O Amb27470048 [1,1,0,0,0,0|1,0,0]=3 1386 B9R0.42 CC(NC(=O)CCl)C(=O)Cl Amb27201426 [1,1,0,0,0,0|1,0,0]=3 1387 B9R0.42 CC(NC(=O)CCl)C(=O)O Amb3940604 [1,1,0,0,0,0|0,0,0]=2 1388 B9R0.42 CC(NC(=O)CN)C(=O)O Amb533807 [1,1,0,0,0,0|0,0,0]=2 1389 B9R0.42 CC(O)C(C)NC(=O)CN Amb27424140 [1,1,0,0,0,0|1,0,1]=4 1390 B9R0.42 CC(OC(=O)CCl)C(=O)O Amb28042677 [1,1,0,0,0,0|1,0,0]=3 1391 B9R0.42 CC(OC(=O)CN)C(N)=O Amb27596266 [1,1,0,0,0,0|2,0,0]=4 1392 B9R0.42 CC(OC(=O)CO)C(N)=O Amb28126899 [1,1,0,0,0,0|2,0,0]=4 1393 B9R0.42 CCC(=O)CC(N)C(=O)O Amb22546324 [1,1,0,0,0,0|2,0,0]=4 1394 B9R0.42 CCC(=O)CC(N)C(=O)O Amb24479073 [1,1,0,0,0,0|2,0,0]=4 1395 B9R0.42 CCC(=O)CC(O)C(=O)O Amb27655574 [1,1,0,0,0,0|1,0,0]=3 1396 B9R0.42 CCC(=O)C[C@@H](N)C(=O)O Amb26061186 [1,1,0,0,0,0|2,0,0]=4 1397 B9R0.42 CCC(=O)C[C@H](N)C(=O)O Amb24479266 [1,1,0,0,0,0|2,0,0]=4 1398 B9R0.42 CCC(=O)NC(C)C(=O)O Amb1116933 [1,1,0,0,0,0|0,0,0]=2 1399 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O Amb22901053 [1,1,0,0,0,0|0,0,0]=2 1400 B9R0.42 CCC(=O)OC(C)C(C)=O Amb26063123 [1,1,0,0,0,0|2,0,0]=4 1401 B9R0.42 CCC(=O)\C=C(/C)C(=O)O Amb27613306 [1,1,0,0,0,0|1,0,1]=4 1402 B9R0.42 CCC(C)N[C@@H](C)C(=O)O Amb25691180 [1,1,0,0,0,0|1,0,1]=4 1403 B9R0.42 CCS(=O)CC(C)C(=O)O Amb19012076 [1,1,0,0,0,0|2,0,0]=4 1404 B9R0.42 CCS(=O)CC(O)C(=O)O Amb28342085 [1,1,0,0,0,0|2,0,0]=4 1405 B9R0.42 CCS(=O)NC(C)C(=O)O Amb28319239 [1,1,0,0,0,0|1,0,0]=3 1406 B9R0.42 CCS(=O)N[C@@H](C)C(=O)O Amb27243800 [1,1,0,0,0,0|1,0,0]=3 1407 B9R0.42 CNC(=O)CC(C)C(N)=O Amb17334219 [1,1,0,0,0,0|2,0,0]=4 1408 B9R0.42 CNC(=O)CC(N)C(=O)O Amb27839034 [1,1,0,0,0,0|2,0,0]=4 1409 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O Amb20240891 [1,1,0,0,0,0|2,0,0]=4 1410 B9R0.42 CNC(=O)NC(C)C(=O)O Amb1130316 [1,1,0,0,0,0|0,0,0]=2 1411 B9R0.42 CNC(=O)NC(C)C(N)=O Amb27255879 [1,1,0,0,0,0|1,0,0]=3 1412 B9R0.42 CNC(=O)NN(C)C(C)=O Amb28289344 [1,1,0,0,0,0|2,0,0]=4 1413 B9R0.42 CNC(=O)N[C@@H](C)C(=O)O Amb24478025 [1,1,0,0,0,0|0,0,0]=2 1414 B9R0.42 CNC(=O)N[C@H](C)C(=O)O Amb24558529 [1,1,0,0,0,0|0,0,0]=2 1415 B9R0.42 CNC(=O)OC(C)C(=O)O Amb35655772 [1,1,0,0,0,0|1,0,0]=3 1416 B9R0.42 CNC(=O)O[C@@H](C)C(=O)O Amb35647450 [1,1,0,0,0,0|1,0,0]=3 1417 B9R0.42 CNC(=O)O[C@H](C)C(=O)O Amb29866286 [1,1,0,0,0,0|1,0,0]=3 1418 B9R0.42 COC(=O)CC(Br)C(=O)O Amb18656998 [1,1,0,0,0,0|2,0,0]=4 1419 B9R0.42 COC(=O)CC(C)C(=O)Cl Amb27972299 [1,1,0,0,0,0|2,0,0]=4 1420 B9R0.42 COC(=O)CC(C)C(=O)O Amb18644239 [1,1,0,0,0,0|1,0,0]=3 1421 B9R0.42 COC(=O)CC(C)C(=O)[O-] Amb34915052 [1,1,0,0,0,0|1,0,1]=4 1422 B9R0.42 COC(=O)CC(Cl)C(=O)O Amb32941126 [1,1,0,0,0,0|2,0,0]=4 1423 B9R0.42 COC(=O)CC(N)C(=O)O Amb22489498 [1,1,0,0,0,0|2,0,0]=4 1424 B9R0.42 COC(=O)CC(N)C(=O)O Amb7172558 [1,1,0,0,0,0|2,0,0]=4 1425 B9R0.42 COC(=O)CC(N)C(=O)O Amb8390391 [1,1,0,0,0,0|2,0,0]=4 1426 B9R0.42 COC(=O)CC(O)C(=O)O Amb25786182 [1,1,0,0,0,0|1,0,0]=3 1427 B9R0.42 COC(=O)CC(O)C(N)=O Amb27830345 [1,1,0,0,0,0|2,0,0]=4 1428 B9R0.42 COC(=O)C[C@@H](C)C(=O)O Amb3939892 [1,1,0,0,0,0|1,0,0]=3 1429 B9R0.42 COC(=O)C[C@@H](C)C(C)=O Amb26846867 [1,1,0,0,0,0|2,0,0]=4 1430 B9R0.42 COC(=O)C[C@@H](C)C(N)=O Amb27169355 [1,1,0,0,0,0|2,0,0]=4 1431 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb22745861 [1,1,0,0,0,0|2,0,0]=4 1432 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb8385327 [1,1,0,0,0,0|2,0,0]=4 1433 B9R0.42 COC(=O)C[C@@H](O)C(=O)O Amb23603858 [1,1,0,0,0,0|1,0,0]=3 1434 B9R0.42 COC(=O)C[C@H](Br)C(=O)O Amb26619839 [1,1,0,0,0,0|2,0,0]=4 1435 B9R0.42 COC(=O)C[C@H](C)C(=O)O Amb26967622 [1,1,0,0,0,0|1,0,0]=3 1436 B9R0.42 COC(=O)C[C@H](C)C(C)=O Amb26873807 [1,1,0,0,0,0|2,0,0]=4 1437 B9R0.42 COC(=O)C[C@H](N)C(=O)O Amb8629121 [1,1,0,0,0,0|2,0,0]=4 1438 B9R0.42 COC(=O)C[C@H](O)C(=O)O Amb25367304 [1,1,0,0,0,0|1,0,0]=3 1439 B9R0.42 COC(=O)C[C@H](O)C(N)=O Amb28120921 [1,1,0,0,0,0|2,0,0]=4 1440 B9R0.42 COC(=O)NC(C)C(=N)N Amb27789549 [1,1,0,0,0,0|2,0,0]=4 1441 B9R0.42 COC(=O)NC(C)C(=O)O Amb6668789 [1,1,0,0,0,0|0,0,0]=2 1442 B9R0.42 COC(=O)N[C@@H](C)C(=O)O Amb24477985 [1,1,0,0,0,0|0,0,0]=2 1443 B9R0.42 COC(=O)N[C@H](C)C(=O)O Amb24381066 [1,1,0,0,0,0|0,0,0]=2 1444 B9R0.42 COC(=O)N[C@H](C)C(N)=O Amb27428453 [1,1,0,0,0,0|1,0,0]=3 1445 B9R0.42 COC(=O)SC(C)C(C)=O Amb27243977 [1,1,0,0,0,0|2,0,0]=4 1446 B9R0.42 COC(=O)\C=C(/C)C(=O)O Amb18644070 [1,1,0,0,0,0|1,0,1]=4 1447 B9R0.42 COC(=S)SC(C)C(=O)O Amb28458571 [1,1,0,0,0,0|1,1,0]=4 1448 B9R0.42 C[C@@H](NC(=O)CCl)C(=O)O Amb10842258 [1,1,0,0,0,0|0,0,0]=2 1449 B9R0.42 C[C@@H](NC(=O)CN)C(N)=O Amb27865946 [1,1,0,0,0,0|1,0,0]=3 1450 B9R0.42 C[C@H](NC(=O)CCl)C(=O)O Amb2781694 [1,1,0,0,0,0|0,0,0]=2 1451 B9R0.42 C[C@H](NC(=O)CN)C(=O)O Amb537542 [1,1,0,0,0,0|0,0,0]=2 1452 B9R0.42 C[C@H](NC(=O)CS)C(=O)O Amb27780474 [1,1,0,0,0,0|0,0,0]=2 1453 B9R0.42 C[C@H](OC(=O)CBr)C(N)=O Amb27985898 [1,1,0,0,0,0|2,0,0]=4 1454 B9R0.42 C\C(=N/C(=O)CO)C(=O)O Amb27426561 [1,1,0,0,0,0|0,0,2]=4 1455 B9R0.42 NC(CC(=O)CI)C(=O)O Amb27803464 [1,1,0,0,0,0|2,0,0]=4 1456 B9R0.42 NC(CC(=O)CO)C(=O)O Amb18644310 [1,1,0,0,0,0|2,0,0]=4 1457 B9R0.42 N[C@@H](CC(=O)CCl)C(=O)O Amb27168692 [1,1,0,0,0,0|2,0,0]=4 1458 B9R0.42 N[C@@H](CC(=O)CI)C(=O)O Amb27248631 [1,1,0,0,0,0|2,0,0]=4 1459 B9R0.42 N[C@@H](CC(=O)CO)C(=O)O Amb28050099 [1,1,0,0,0,0|2,0,0]=4 1460 B9R0.42 O=C(CBr)C[C@H](O)C(=O)O Amb27876238 [1,1,0,0,0,0|1,0,0]=3 1461 B9R0.42 O=C(CCl)NC(O)C(=O)O Amb27598875 [1,1,0,0,0,0|0,0,0]=2 1462 B9R0.57 CC(CP(C)(C)=O)C(=O)O Amb28050894 [1,1,0,0,0,0|2,0,0]=4 1463 B9R0.57 CC(CS(C)(=O)=O)C(=O)O Amb18971622 [1,1,0,0,0,0|2,0,0]=4 1464 B9R0.57 CC(NC(C)(C)C)C(=O)O Amb17399895 [1,1,0,0,0,0|1,0,1]=4 1465 B9R0.57 CC(NC(C)(C)C)C(=O)O Amb28991327 [1,1,0,0,0,0|1,0,1]=4 1466 B9R0.57 CC(NS(C)(=N)=O)C(=O)O Amb35680388 [1,1,0,0,0,0|1,0,0]=3 1467 B9R0.57 CC(NS(C)(=N)=O)C(N)=O Amb35710906 [1,1,0,0,0,0|2,0,0]=4 1468 B9R0.57 CC(NS(C)(=O)=O)C(=O)Cl Amb5742178 [1,1,0,0,0,0|2,0,0]=4 1469 B9R0.57 CC(NS(C)(=O)=O)C(=O)O Amb9705402 [1,1,0,0,0,0|1,0,0]=3 1470 B9R0.57 CC(NS(C)(=O)=O)C(N)=O Amb27424752 [1,1,0,0,0,0|2,0,0]=4 1471 B9R0.57 CC(NS(N)(=O)=O)C(=O)O Amb6281498 [1,1,0,0,0,0|2,0,0]=4 1472 B9R0.57 CC(N[Si](C)(C)C)C(=O)O Amb27984746 [1,1,0,0,0,0|1,1,0]=4 1473 B9R0.57 CS(=O)(=O)CC(O)C(=O)O Amb24398186 [1,1,0,0,0,0|2,0,0]=4 1474 B9R0.57 C[C@@H](NS(C)(=N)=O)C(=O)O Amb35680524 [1,1,0,0,0,0|1,0,0]=3 1475 B9R0.57 C[C@@H](NS(C)(=N)=O)C(N)=O Amb35680543 [1,1,0,0,0,0|2,0,0]=4 1476 B9R0.57 C[C@@H](NS(N)(=O)=O)C(=O)O Amb28323679 [1,1,0,0,0,0|2,0,0]=4 1477 B9R0.57 C[C@H](NS(C)(=N)=O)C(=O)O Amb29867468 [1,1,0,0,0,0|1,0,0]=3 1478 B9R0.57 C[C@H](NS(C)(=N)=O)C(N)=O Amb35725162 [1,1,0,0,0,0|2,0,0]=4 1479 B9R0.57 C[C@H](NS(C)(=O)=O)C(=O)O Amb27649688 [1,1,0,0,0,0|1,0,0]=3 1480 B9R0.57 C[C@H](OS(C)(=O)=O)C(=O)O Amb25701707 [1,1,0,0,0,0|2,0,0]=4 1481 B9R0.79 C=C(C)C(C)C(C)C(=O)O Amb28042819 [1,1,0,0,0,0|2,0,0]=4 1482 B9R0.79 C=C(C)C(N)C(C)C(=O)O Amb33036349 [1,1,0,0,0,0|2,0,0]=4 1483 B9R0.79 C=C(C)C(O)C(C)C(=O)O Amb18644101 [1,1,0,0,0,0|2,0,0]=4 1484 B9R0.79 C=C(C)[C@@H](C)[C@@H](C)C(=O)O Amb28050111 [1,1,0,0,0,0|2,0,0]=4 1485 B9R0.79 C=C(C)[C@@H](O)[C@@H](C)C(=O)O Amb28283987 [1,1,0,0,0,0|2,0,0]=4 1486 B9R0.79 CC(=O)C(=O)C(O)C(C)=O Amb25910745 [1,1,0,0,0,0|2,0,0]=4 1487 B9R0.79 CC(=O)C(C)C(C)C(C)=O Amb4016940 [1,1,0,0,0,0|2,0,0]=4 1488 B9R0.79 CC(=O)C(C)C(N)C(=O)O Amb18202116 [1,1,0,0,0,0|2,0,0]=4 1489 B9R0.79 CC(=O)C(O)C(O)C(=O)O Amb25292189 [1,1,0,0,0,0|1,0,0]=3 1490 B9R0.79 CC(=O)C(O)C(O)C(C)=O Amb17593650 [1,1,0,0,0,0|2,0,0]=4 1491 B9R0.79 CC(=O)N(C)C(C)C(N)=S Amb18800424 [1,1,0,0,0,0|1,1,0]=4 1492 B9R0.79 CC(=O)N(Cl)[C@@H](C)C(=O)O Amb28458454 [1,1,0,0,0,0|0,0,0]=2 1493 B9R0.79 CC(=O)[C@@H](C)[C@@H](O)C(=O)O Amb27661780 [1,1,0,0,0,0|1,0,0]=3 1494 B9R0.79 CC(=O)[C@@H](C)[C@H](O)C(=O)O Amb28050113 [1,1,0,0,0,0|1,0,0]=3 1495 B9R0.79 CC(=O)[C@H](C)[C@@H](C)C(C)=O Amb28202186 [1,1,0,0,0,0|2,0,0]=4 1496 B9R0.79 CC(=O)[C@H](C)[C@H](N)C(=O)O Amb27424983 [1,1,0,0,0,0|2,0,0]=4 1497 B9R0.79 CC(C(=O)O)C(Br)C(=O)O Amb2612973 [1,1,0,0,0,0|2,0,0]=4 1498 B9R0.79 CC(C(=O)O)C(C)C(=O)O Amb8513150 [1,1,0,0,0,0|2,0,0]=4 1499 B9R0.79 CC(C(=O)O)C(N)C(=O)O Amb2099482 [1,1,0,0,0,0|2,0,0]=4 1500 B9R0.79 CC(C(=O)O)C(O)C(=O)O Amb17593680 [1,1,0,0,0,0|2,0,0]=4 1501 B9R0.79 CC(C)N(N)C(C)C(=O)O Amb27850417 [1,1,0,0,0,0|1,0,1]=4 1502 B9R0.79 C[C@@H](C(=O)O)C(N)C(=O)O Amb27877897 [1,1,0,0,0,0|2,0,0]=4 1503 B9R0.79 C[C@@H](C(=O)O)[C@@H](N)C(=O)O Amb27170727 [1,1,0,0,0,0|2,0,0]=4 1504 B9R0.79 C[C@@H](C(=O)O)[C@H](N)C(=O)O Amb25324829 [1,1,0,0,0,0|2,0,0]=4 1505 B9R0.79 C[C@@H](C(=O)O)[C@H](O)C(=O)O Amb27243908 [1,1,0,0,0,0|2,0,0]=4 1506 B9R0.79 C[C@H](C(=O)O)[C@@H](C)C(=O)O Amb22801175 [1,1,0,0,0,0|2,0,0]=4 1507 B9R0.79 C[C@H](C(=O)O)[C@@H](C)C(N)=O Amb27771245 [1,1,0,0,0,0|2,0,0]=4 1508 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O Amb27783086 [1,1,0,0,0,0|2,0,0]=4 1509 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O Amb31031234 [1,1,0,0,0,0|2,0,0]=4 1510 B9R0.79 C[C@H](C(=O)O)[C@H](Br)C(=O)O Amb27463297 [1,1,0,0,0,0|2,0,0]=4 1511 B9R0.79 C[C@H](C(=O)O)[C@H](C)C(=O)O Amb27460990 [1,1,0,0,0,0|2,0,0]=4 1512 B9R0.79 C[C@H](C(=O)O)[C@H](Cl)C(=O)O Amb27955233 [1,1,0,0,0,0|2,0,0]=4 1513 B9R0.79 NC(=O)C(O)C(O)C(=O)O Amb24112928 [1,1,0,0,0,0|2,0,0]=4 1514 B9R0.79 NC(=O)[C@H](O)[C@@H](O)C(=O)O Amb28341817 [1,1,0,0,0,0|2,0,0]=4 1515 B9R0.79 NC(C(=O)O)C(O)C(=O)O Amb9871461 [1,1,0,0,0,0|2,0,0]=4 1516 B9R0.79 N[C@@H](C(=O)O)[C@@H](O)C(=O)O Amb17942870 [1,1,0,0,0,0|2,0,0]=4 1517 B9R0.79 N[C@@H](C(=O)O)[C@H](O)C(=O)O Amb27470435 [1,1,0,0,0,0|2,0,0]=4 1518 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(=O)O Amb24087715 [1,1,0,0,0,0|2,0,0]=4 1519 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(=O)O Amb24117974 [1,1,0,0,0,0|2,0,0]=4 1520 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O Amb17615140 [1,1,0,0,0,0|2,0,0]=4 1521 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O Amb33714683 [1,1,0,0,0,0|2,0,0]=4 1522 B9R0.79 O=C(O)C(O)C(Cl)C(=O)O Amb17594225 [1,1,0,0,0,0|2,0,0]=4 1523 B9R0.79 O=C(O)C(O)C(F)C(=O)O Amb24479232 [1,1,0,0,0,0|2,0,0]=4 1524 B9R0.79 O=C(O)C(O)C(O)C(=O)O Amb24668916 [1,1,0,0,0,0|2,0,0]=4 1525 B9R0.79 O=C(O)C(O)C(O)C(=O)O Amb6608787 [1,1,0,0,0,0|2,0,0]=4 1526 B9R0.79 O=C(O)C(O)C(O)C(=O)S Amb28050895 [1,1,0,0,0,0|2,0,0]=4 1527 B9R0.79 O=C(O)[C@@H](Cl)[C@H](O)C(=O)O Amb27845392 [1,1,0,0,0,0|2,0,0]=4 1528 B9R0.79 O=C(O)[C@@H](O)[C@@H](O)C(=O)O Amb22230832 [1,1,0,0,0,0|2,0,0]=4 1529 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb17616192 [1,1,0,0,0,0|2,0,0]=4 1530 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb19884028 [1,1,0,0,0,0|2,0,0]=4 1531 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb22750609 [1,1,0,0,0,0|2,0,0]=4 1532 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb22756774 [1,1,0,0,0,0|2,0,0]=4 1533 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb34915014 [1,1,0,0,0,0|2,0,0]=4 1534 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb5722339 [1,1,0,0,0,0|2,0,0]=4 1535 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb19884026 [1,1,0,0,0,0|2,0,0]=4 1536 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb20240604 [1,1,0,0,0,0|2,0,0]=4 1537 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb20670711 [1,1,0,0,0,0|2,0,0]=4 1538 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb34915016 [1,1,0,0,0,0|2,0,0]=4 1539 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb8628435 [1,1,0,0,0,0|2,0,0]=4 1540 B9R0.79 O=C(O)[C@H](O)[C@H](Br)C(=O)O Amb28252354 [1,1,0,0,0,0|2,0,0]=4 1541 B9R0.79 O=C(O)[C@H](O)[C@H](Cl)C(=O)O Amb27477747 [1,1,0,0,0,0|2,0,0]=4 1542 B9R0.79 O=C([O-])C(O)C(O)C(=O)O Amb20246422 [1,1,0,0,0,0|2,0,0]=4 1543 B9R0.79 O=C([O-])C(O)C(O)C(=O)O Amb8517447 [1,1,0,0,0,0|2,0,0]=4 1544 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)O Amb34915846 [1,1,0,0,0,0|2,0,0]=4 1545 B9R0.54 C=C(C)C(C(=O)O)C(C)C Amb18643917 [0,1,0,0,1,0|2,0,0]=4 1546 B9R0.54 C=C(C)[C@H](C(=O)O)C(C)C Amb27222321 [0,1,0,0,1,0|2,0,0]=4 1547 B9R0.54 CC(=O)C(C(C)=O)C(C)C Amb17689200 [0,1,0,0,1,0|2,0,0]=4 1548 B9R0.54 CC(=O)C(C(N)=O)C(C)C Amb27618094 [0,1,0,0,1,0|2,0,0]=4 1549 B9R0.54 CC(C)C(C(=O)O)C(=O)O Amb2689019 [0,1,0,0,1,0|2,0,0]=4 1550 B9R0.54 CC(C)C(C(=O)O)C(C)O Amb18990640 [0,1,0,0,1,0|1,0,1]=4 1551 B9R0.54 CC(C)C(C(N)=O)C(=O)O Amb28050146 [0,1,0,0,1,0|2,0,0]=4 1552 B9R0.54 CC(N)C(C(=O)O)C(C)O Amb27201636 [0,1,0,0,1,0|1,0,1]=4 1553 B9R0.54 C[C@@H](O)[C@@H](C(=O)O)N(C)C Amb27493848 [0,1,0,0,1,0|2,0,0]=4 1554 B9R0.54 O=C(O)C(C(=O)O)C(=O)O Amb8393825 [0,1,0,0,1,0|1,0,1]=4 1555 B9R0.72 CC(C)(C)C(CO)C(=O)O Amb28050066 [0,1,0,0,1,0|1,0,1]=4 1556 B9R0.72 CC(C)(C)[C@H](CO)C(=O)O Amb27787642 [0,1,0,0,1,0|1,0,1]=4 1557 B9R0.72 CCC(C(=O)O)S(C)(=O)=O Amb17501412 [0,1,0,0,1,0|2,0,0]=4 1558 B9R0.72 CS(=O)(=O)C(CN)C(=O)O Amb27754418 [0,1,0,0,1,0|2,0,0]=4 1559 B9R0.76 C=C(C)C(C)(CC)C(=O)O Amb18643949 [0,1,0,0,1,0|2,0,0]=4 1560 B9R0.76 C=C(C)[C@@](O)(CC)C(=O)O Amb28397858 [0,1,0,0,1,0|2,0,0]=4 1561 B9R0.76 CC(=O)C(C)(CBr)C(C)=O Amb27817626 [0,1,0,0,1,0|2,0,0]=4 1562 B9R0.76 CC(=O)C(O)(CO)C(C)=O Amb27973085 [0,1,0,0,1,0|1,0,0]=3 1563 B9R0.76 CC(=O)C(O)(CO)C(C)O Amb28324374 [0,1,0,0,1,0|1,0,1]=4 1564 B9R0.76 CC(=O)[C@@](O)(CO)[C@H](C)O Amb28382432 [0,1,0,0,1,0|1,0,1]=4 1565 B9R0.76 CC(C)C(C)(CO)C(=O)O Amb27849972 [0,1,0,0,1,0|1,0,1]=4 1566 B9R0.76 CC(C)C(N)(CO)C(=O)O Amb8515984 [0,1,0,0,1,0|1,0,1]=4 1567 B9R0.76 CC(C)C(O)(CO)C(=O)O Amb27461352 [0,1,0,0,1,0|1,0,1]=4 1568 B9R0.76 CC(C)[C@](N)(CO)C(=O)O Amb25103828 [0,1,0,0,1,0|1,0,1]=4 1569 B9R0.76 CC(CBr)(C(=O)O)C(=O)O Amb27226060 [0,1,0,0,1,0|2,0,0]=4 1570 B9R0.76 CCC(C)(C(=O)O)C(=O)O Amb18644240 [0,1,0,0,1,0|2,0,0]=4 1571 B9R0.76 CCC(C)(C(C)=O)C(N)=O Amb25889035 [0,1,0,0,1,0|2,0,0]=4 1572 B9R0.76 CCC(F)(C(N)=O)C(=O)O Amb27413804 [0,1,0,0,1,0|2,0,0]=4 1573 B9R0.76 CN(C)C(C)(CO)C(=O)O Amb27829392 [0,1,0,0,1,0|2,0,0]=4 1574 B9R0.76 NC(=O)C(N)(CO)C(=O)O Amb27240199 [0,1,0,0,1,0|1,0,0]=3 1575 B11R0.32 CC(=O)CC(NC(C)=O)C(=O)O Amb32679425 [0,1,0,0,0,1|1,0,1]=4 1576 B11R0.32 CC(=O)NC(CC(=O)O)C(=O)O Amb3499381 [0,1,0,0,0,1|0,0,1]=3 1577 B11R0.32 CC(=O)NC(CC(=O)O)C(C)C Amb33042693 [0,1,0,0,0,1|1,0,0]=3 1578 B11R0.32 CC(=O)NC(CC(=O)O)C(N)=O Amb21811914 [0,1,0,0,0,1|0,0,2]=4 1579 B11R0.32 CC(=O)NC(CC(N)=O)C(=O)O Amb1118662 [0,1,0,0,0,1|1,0,1]=4 1580 B11R0.32 CC(=O)NC(NC(C)=O)C(C)C Amb27949633 [0,1,0,0,0,1|2,0,0]=4 1581 B11R0.32 CC(=O)N[C@@H](CC(=O)O)C(=O)O Amb8628593 [0,1,0,0,0,1|0,0,1]=3 1582 B11R0.32 CC(=O)N[C@@H](CC(=O)O)C(C)C Amb33253810 [0,1,0,0,0,1|1,0,0]=3 1583 B11R0.32 CC(=O)N[C@@H](CC(=O)O)C(N)=O Amb19374681 [0,1,0,0,0,1|0,0,2]=4 1584 B11R0.32 CC(=O)N[C@@H](CC(N)=O)C(=O)O Amb2755870 [0,1,0,0,0,1|1,0,1]=4 1585 B11R0.32 CC(=O)N[C@H](CC(=O)O)C(C)C Amb33308358 [0,1,0,0,0,1|1,0,0]=3 1586 B11R0.32 CC(=O)N[C@H](CC(N)=O)C(=O)O Amb2732381 [0,1,0,0,0,1|1,0,1]=4 1587 B11R0.32 NC(=O)NC(CC(=O)O)C(=O)O Amb2222280 [0,1,0,0,0,1|1,0,1]=4 1588 B11R0.32 NC(=O)N[C@@H](CC(=O)O)C(=O)O Amb6600046 [0,1,0,0,0,1|1,0,1]=4 1589 B11R0.35 CCCC(CC(=O)O)NC(C)=O Amb33042695 [0,1,0,0,0,1|1,0,0]=3 1590 B11R0.35 COCC(CC(=O)O)CC(=O)O Amb33079739 [0,1,0,0,0,1|2,0,0]=4 1591 B11R0.35 COCC(CC(=O)O)NC(C)=O Amb33253848 [0,1,0,0,0,1|0,0,0]=2 1592 B11R0.91 CCC(CC(=O)O)CC(=O)OC Amb33474984 [0,1,0,0,0,1|2,0,0]=4 1593 B11R0.91 CC\C(=C/C(=O)OC)NC(C)=O Amb27264919 [0,1,0,0,0,1|1,0,1]=4 1594 B11R0.91 COC(=O)CC(CF)CC(=O)O Amb33474631 [0,1,0,0,0,1|2,0,0]=4 1595 B11R0.210 CC(=O)NC(C)(CN)CC(=O)O Amb33255160 [0,1,0,0,0,1|1,0,0]=3 1596 B11R0.210 CCC(C)(CC(=O)O)NC(C)=O Amb33255323 [0,1,0,0,0,1|1,0,0]=3 1597 B11R0.28 CC(=O)CCC(C(=O)O)C(C)C Amb533059 [0,1,0,0,0,1|2,0,0]=4 1598 B11R0.90 CCC(SCC(=O)NC)C(=O)O Amb17501361 [0,1,0,0,0,1|2,0,0]=4 1599 B11R0.146 CCCC(CCC(C)=O)C(=O)O Amb533087 [0,1,0,0,0,1|2,0,0]=4 1600 B11R0.275 CC(C)C(=O)NC(CO)C(=O)O Amb1116776 [0,1,0,0,0,1|1,0,1]=4 1601 B11R0.275 CC(C)C(=O)N[C@@H](CO)C(=O)O Amb18795553 [0,1,0,0,0,1|1,0,1]=4 1602 B11R0.275 CC(N)C(=O)NC(CO)C(=O)O Amb542792 [0,1,0,0,0,1|1,0,1]=4 1603 B11R0.275 C[C@@H](N)C(=O)N[C@H](CO)C(=O)O Amb18795767 [0,1,0,0,0,1|1,0,1]=4 1604 B11R0.275 C[C@H](N)C(=O)N[C@@H](CO)C(=O)O Amb33802995 [0,1,0,0,0,1|1,0,1]=4 1605 B11R0.282 CCC(C(=O)O)N(C)NC(C)=O Amb32430166 [0,1,0,0,0,1|1,0,0]=3 1606 B11R0.16 CCCC(NS(C)(=O)=O)C(=O)O Amb9495872 [0,2,0,0,0,0|2,0,0]=4 1607 B11R0.39 CC(=O)NC(CCS)C(=O)NN Amb22735120 [0,2,0,0,0,0|1,1,0]=4 1608 B11R0.39 COC(=O)C(CCBr)OC(C)=O Amb30588583 [0,2,0,0,0,0|2,0,0]=4 1609 B11R0.39 COC(=O)C(CCBr)SC(C)=O Amb32412857 [0,2,0,0,0,0|2,0,0]=4 1610 B11R0.115 C#CC(C)C(NC(C)=O)C(=O)O Amb27816267 [0,2,0,0,0,0|1,0,0]=3 1611 B11R0.115 C=CC(C)C(NC(C)=O)C(=O)O Amb33308641 [0,2,0,0,0,0|1,0,0]=3 1612 B11R0.115 CC(=O)NC(C(=O)NO)C(C)C Amb26331390 [0,2,0,0,0,0|1,0,0]=3 1613 B11R0.115 CC(=O)NC(C(=O)O)C(C)C#N Amb33065636 [0,2,0,0,0,0|1,0,0]=3 1614 B11R0.115 CC(=O)NC(C(=O)O)C(C)CO Amb33065442 [0,2,0,0,0,0|0,0,0]=2 1615 B11R0.115 CC(C)[C@H](NC(N)=O)C(=O)NO Amb27982487 [0,2,0,0,0,0|2,0,0]=4 1616 B11R0.115 CCC(C)C(NC(C)=O)C(=O)O Amb9706300 [0,2,0,0,0,0|1,0,0]=3 1617 B11R0.115 CCC(C)C(NC(N)=O)C(=O)O Amb9745677 [0,2,0,0,0,0|2,0,0]=4 1618 B11R0.115 CCC(C)[C@H](NC(C)=O)C(=O)O Amb33523725 [0,2,0,0,0,0|1,0,0]=3 1619 B11R0.115 CC[C@H](C)[C@@H](NC(C)=O)C(=O)O Amb22230215 [0,2,0,0,0,0|1,0,0]=3 1620 B11R0.115 CC[C@H](C)[C@H](NC(C)=O)C(=O)O Amb3939886 [0,2,0,0,0,0|1,0,0]=3 1621 B11R0.115 CC[C@H](C)[C@H](NC(C)=O)C(N)=O Amb31291748 [0,2,0,0,0,0|2,0,0]=4 1622 B11R0.115 CC\C(C)=C(/NC(C)=O)C(=O)O Amb27634857 [0,2,0,0,0,0|1,0,1]=4 1623 B11R0.115 CNC(=O)C(NC(C)=O)C(C)C Amb8343968 [0,2,0,0,0,0|2,0,0]=4 1624 B11R0.115 CNC(=O)[C@@H](NC(C)=O)C(C)C Amb22800075 [0,2,0,0,0,0|2,0,0]=4 1625 B11R0.115 CNC(=O)[C@@H](NC(C)=O)[C@@H](C)O Amb25325006 [0,2,0,0,0,0|1,0,0]=3 1626 B11R0.115 CNC(=O)[C@@H](NC(C)=O)[C@H](C)O Amb27646531 [0,2,0,0,0,0|1,0,0]=3 1627 B11R0.115 CNC(=O)[C@H](NC(C)=O)C(C)C Amb27949558 [0,2,0,0,0,0|2,0,0]=4 1628 B11R0.115 COC(=O)C(NC(C)=O)C(C)C Amb6825630 [0,2,0,0,0,0|1,0,0]=3 1629 B11R0.115 COC(=O)C(NC(C)=O)C(C)O Amb33513124 [0,2,0,0,0,0|0,0,0]=2 1630 B11R0.115 COC(=O)C(NC(N)=O)C(C)C Amb9239118 [0,2,0,0,0,0|2,0,0]=4 1631 B11R0.115 COC(=O)[C@@H](NC(C)=O)C(C)C Amb16182992 [0,2,0,0,0,0|1,0,0]=3 1632 B11R0.115 COC(=O)[C@@H](NC(C)=O)C(O)Cl Amb22745981 [0,2,0,0,0,0|0,0,0]=2 1633 B11R0.115 COC(=O)[C@@H](NC(C)=O)[C@@H](C)O Amb15690769 [0,2,0,0,0,0|0,0,0]=2 1634 B11R0.115 COC(C)C(NC(C)=O)C(=O)O Amb33036550 [0,2,0,0,0,0|0,0,0]=2 1635 B11R0.160 C#CCCC(NC(C)=O)C(=O)O Amb33042801 [0,2,0,0,0,0|1,0,0]=3 1636 B11R0.160 C=CCCC(NC(C)=O)C(=O)O Amb33042697 [0,2,0,0,0,0|1,0,0]=3 1637 B11R0.160 CC#CCC(NC(C)=O)C(=O)O Amb25949940 [0,2,0,0,0,0|1,0,0]=3 1638 B11R0.160 CC#CCC(NC(N)=O)C(=O)O Amb27864120 [0,2,0,0,0,0|2,0,0]=4 1639 B11R0.160 CC(=O)NC(CCC#N)C(=O)O Amb33308987 [0,2,0,0,0,0|1,0,0]=3 1640 B11R0.160 CC(=O)NC(CCCF)C(=O)O Amb33308610 [0,2,0,0,0,0|1,0,0]=3 1641 B11R0.160 CC(=O)NC(CCCO)C(=O)O Amb33036789 [0,2,0,0,0,0|0,0,0]=2 1642 B11R0.160 CC(=O)NC(C\C=C\Cl)C(=O)O Amb33037024 [0,2,0,0,0,0|1,0,0]=3 1643 B11R0.160 CCCCC(NC(C)=O)C(=O)O Amb2732387 [0,2,0,0,0,0|1,0,0]=3 1644 B11R0.160 CCCCC(NC(N)=O)C(=O)O Amb9329824 [0,2,0,0,0,0|2,0,0]=4 1645 B11R0.160 CCCC[C@H](NC(C)=O)C(=O)O Amb2732388 [0,2,0,0,0,0|1,0,0]=3 1646 B11R0.160 CCOCC(NC(C)=O)C(=O)O Amb33308943 [0,2,0,0,0,0|0,0,0]=2 1647 B11R0.160 COCCC(CC(=O)O)C(=O)O Amb33377343 [0,2,0,0,0,0|2,0,0]=4 1648 B11R0.160 COCCC(NC(C)=O)C(=O)O Amb13952178 [0,2,0,0,0,0|0,0,0]=2 1649 B11R0.160 CSCCC(NC(C)=O)C(=O)O Amb9706349 [0,2,0,0,0,0|0,1,0]=3 1650 B11R0.160 CSCCC(NC(C)=O)C(=O)[O-] Amb33513247 [0,2,0,0,0,0|0,1,1]=4 1651 B11R0.160 CSCCC(NC(N)=O)C(=O)O Amb1107591 [0,2,0,0,0,0|1,1,0]=4 1652 B11R0.160 CSCC[C@@H](NC(C)=O)C(=O)O Amb8629159 [0,2,0,0,0,0|0,1,0]=3 1653 B11R0.160 CSCC[C@H](NC(C)=O)C(=O)O Amb2720580 [0,2,0,0,0,0|0,1,0]=3 1654 B11R0.160 CSCC[C@H](NC(C)=O)C(N)=O Amb22800241 [0,2,0,0,0,0|1,1,0]=4 1655 B11R0.160 CSCC[C@H](NC(N)=O)C(=O)O Amb32668794 [0,2,0,0,0,0|1,1,0]=4 1656 B11R0.160 CSC\C=C(/NC(C)=O)C(=O)O Amb27233575 [0,2,0,0,0,0|0,1,1]=4 1657 B11R0.160 C\C=C\CC(NC(C)=O)C(=O)O Amb33065773 [0,2,0,0,0,0|1,0,0]=3 1658 B11R0.160 O=C(O)CC(C#CCO)C(=O)O Amb27408434 [0,2,0,0,0,0|2,0,0]=4 1659 B11R0.236 C#CCC(NC(=O)C#C)C(=O)O Amb27606102 [0,2,0,0,0,0|1,0,1]=4 1660 B11R0.236 C#CCC(NC(=O)NC)C(=O)O Amb27202159 [0,2,0,0,0,0|1,0,0]=3 1661 B11R0.236 CCCC(NC(=O)CC)C(=O)O Amb9494928 [0,2,0,0,0,0|1,0,0]=3 1662 B11R0.236 CCC[C@@H](NC(=O)CC)C(=O)O Amb32757138 [0,2,0,0,0,0|1,0,0]=3 1663 B11R0.236 CCC[C@H](NC(=O)CC)C(=O)O Amb32757125 [0,2,0,0,0,0|1,0,0]=3 1664 B11R0.236 CCC[C@H](NC(=O)CCl)C(=O)O Amb2781696 [0,2,0,0,0,0|1,0,0]=3 1665 B11R0.55 CC#CC(=O)N[C@H](CC)C(N)=O Amb28201927 [0,2,0,0,0,0|2,0,0]=4 1666 B11R0.55 CC#CC(=O)N[C@H](CO)C(=O)O Amb27953442 [0,2,0,0,0,0|0,0,0]=2 1667 B11R0.55 NC(=O)[C@H](CO)NC(=O)C#CBr Amb27187595 [0,2,0,0,0,0|1,0,1]=4 1668 B11R0.88 CCC(=O)NC(OC)C(=O)OC Amb24096209 [0,2,0,0,0,0|2,0,0]=4 1669 B11R0.88 CCC(NC(=O)NC)C(=O)NC Amb29882555 [0,2,0,0,0,0|2,0,0]=4 1670 B11R0.88 COC(=O)CC(CN)C(=O)OC Amb24103412 [0,2,0,0,0,0|2,0,0]=4 1671 B11R0.108 C#CC(=O)N[C@H](C(=O)O)C(C)C Amb27626397 [0,2,0,0,0,0|1,0,1]=4 1672 B11R0.108 CC(=O)C(NC(=O)CCl)C(C)C Amb499303 [0,2,0,0,0,0|2,0,0]=4 1673 B11R0.108 CC(C)C(NC(=O)CCl)C(=O)O Amb1152499 [0,2,0,0,0,0|1,0,0]=3 1674 B11R0.108 CC(C)C(NC(=O)CN)C(=O)O Amb4016467 [0,2,0,0,0,0|1,0,0]=3 1675 B11R0.108 CC(C)[C@@H](NC(=O)CCl)C(=O)O Amb10842261 [0,2,0,0,0,0|1,0,0]=3 1676 B11R0.108 CC(C)[C@@H](NC(=O)CN)C(=O)O Amb18795251 [0,2,0,0,0,0|1,0,0]=3 1677 B11R0.108 CC(C)[C@H](NC(=O)CN)C(=O)O Amb8515022 [0,2,0,0,0,0|1,0,0]=3 1678 B11R0.108 CC(O)C(NC(=O)CN)C(=O)O Amb18305295 [0,2,0,0,0,0|0,0,0]=2 1679 B11R0.108 CCC(=O)NC(C(=O)O)C(C)C Amb1117002 [0,2,0,0,0,0|1,0,0]=3 1680 B11R0.108 CCC(=O)N[C@@H](C(=O)O)C(C)C Amb18794783 [0,2,0,0,0,0|1,0,0]=3 1681 B11R0.108 CCC(=O)N[C@H](C(=O)O)C(C)C Amb32757150 [0,2,0,0,0,0|1,0,0]=3 1682 B11R0.108 CNC(=O)NC(C(N)=O)C(C)C Amb27233150 [0,2,0,0,0,0|2,0,0]=4 1683 B11R0.108 CNC(=O)N[C@@H](C(=O)O)C(C)C Amb18795254 [0,2,0,0,0,0|1,0,0]=3 1684 B11R0.108 CNC(=S)NC(C(=O)O)C(C)C Amb28397387 [0,2,0,0,0,0|1,1,0]=4 1685 B11R0.108 CNC(=S)N[C@H](C(=O)O)C(C)C Amb27392296 [0,2,0,0,0,0|1,1,0]=4 1686 B11R0.108 COC(=O)NC(C(=O)O)C(C)C Amb9735812 [0,2,0,0,0,0|1,0,0]=3 1687 B11R0.108 COC(=O)N[C@@H](C(=O)O)C(C)C Amb18795552 [0,2,0,0,0,0|1,0,0]=3 1688 B11R0.108 COC(=O)N[C@H](C(=O)O)C(C)C Amb28555706 [0,2,0,0,0,0|1,0,0]=3 1689 B11R0.263 C#CC(=O)NC(C)(CC)C(=O)O Amb28189685 [0,2,0,0,0,0|1,0,1]=4 1690 B11R0.263 CNC(=O)NC(C)(CO)C(=O)O Amb28182705 [0,2,0,0,0,0|0,0,0]=2 1691 B11R0.56 CCOC(=O)C(C#N)NC(C)=O Amb8393625 [0,2,0,0,0,0|1,0,1]=4 1692 B11R0.56 CCOC(=O)[C@@H](C#N)NC(C)=O Amb33872516 [0,2,0,0,0,0|1,0,1]=4 1693 B11R0.56 CCOC(=O)[C@H](CS)NC(C)=O Amb16232483 [0,2,0,0,0,0|0,1,0]=3 1694 B11R0.286 CCC(C)(NC(C)=O)\C(N)=N\O Amb18794829 [0,2,0,0,0,0|2,0,0]=4 1695 B11R0.286 CNC(=O)[C@](C)(CO)NC(C)=O Amb28251248 [0,2,0,0,0,0|1,0,0]=3 1696 B11R0.317 CC(=O)N(C)C(C(=O)O)C(C)C Amb31101079 [0,2,0,0,0,0|1,0,0]=3 1697 B11R0.426 CC(C)C(NS(C)(=O)=O)C(=O)O Amb1116836 [0,2,0,0,0,0|2,0,0]=4 1698 B11R0.426 CC(C)[C@H](NS(C)(=O)=O)C(=O)O Amb34203563 [0,2,0,0,0,0|2,0,0]=4 1699 B11R0.25 CCC(CC)(NC(C)=O)C(=O)O Amb24105938 [0,2,0,0,0,0|1,0,0]=3 1700 B11R0.427 CC(=O)NC(C)(C(=O)O)C(C)C Amb26506231 [0,2,0,0,0,0|1,0,0]=3 1701 B11R0.427 CC(=O)NC(C)(C(=O)O)C(F)F Amb29890233 [0,2,0,0,0,0|1,0,0]=3 1702 B11R0.427 CC(=O)NC(O)(C(=O)O)C(=O)O Amb26929642 [0,2,0,0,0,0|0,0,1]=3 1703 B11R0.427 CC(=O)N[C@](C)(C(=O)O)C(C)C Amb27400409 [0,2,0,0,0,0|1,0,0]=3 1704 B11R0.234 CC(=O)NC(C(=O)O)C(C)(C)C Amb1106296 [0,2,0,0,0,0|1,0,0]=3 1705 B11R0.234 CC(=O)NC(C(=O)O)C(C)(C)Cl Amb28290478 [0,2,0,0,0,0|1,0,0]=3 1706 B11R0.234 CC(=O)NC(C(=O)O)C(C)(C)S Amb1112910 [0,2,0,0,0,0|0,1,0]=3 1707 B11R0.234 CC(=O)NC(C(N)=O)C(C)(C)S Amb25059234 [0,2,0,0,0,0|1,1,0]=4 1708 B11R0.234 CC(=O)N[C@@H](C(=O)O)C(C)(C)C Amb18794784 [0,2,0,0,0,0|1,0,0]=3 1709 B11R0.234 CC(=O)N[C@H](C(=O)O)C(C)(C)C Amb24401767 [0,2,0,0,0,0|1,0,0]=3 1710 B11R0.234 CC(=O)N[C@H](C(=O)O)C(C)(C)S Amb28138068 [0,2,0,0,0,0|0,1,0]=3 1711 B11R0.234 CC(=O)OC(C(=O)O)C(F)(F)F Amb33109860 [0,2,0,0,0,0|2,0,0]=4 1712 B11R0.234 CC(C)(C)C(NC(N)=O)C(=O)O Amb9327782 [0,2,0,0,0,0|2,0,0]=4 1713 B11R0.234 CC(C)NC(C(=O)O)C(C)(C)O Amb31378617 [0,2,0,0,0,0|1,0,1]=4 1714 B9R1.6 CC(=O)C1COCCN1 Amb24761214 [1,0,0,1,0,0|1,0,1]=4 1715 B9R1.6 NC(=O)C1COCCN1 Amb22059486 [1,0,0,1,0,0|1,0,1]=4 1716 B9R1.6 NC(=O)C1COCCN1 Amb31308018 [1,0,0,1,0,0|1,0,1]=4 1717 B9R1.6 NC(=O)[C@H]1COCCN1 Amb27591943 [1,0,0,1,0,0|1,0,1]=4 1718 B9R1.6 NC(=O)[C@H]1COCCN1 Amb27838503 [1,0,0,1,0,0|1,0,1]=4 1719 B9R1.6 O=C(O)C1C=CCCC1 Amb18642396 [1,0,0,1,0,0|2,0,0]=4 1720 B9R1.6 O=C(O)C1C=CCNC1 Amb18642497 [1,0,0,1,0,0|2,0,0]=4 1721 B9R1.6 O=C(O)C1C=CCNC1 Amb35747468 [1,0,0,1,0,0|2,0,0]=4 1722 B9R1.6 O=C(O)C1CCCCN1 Amb6754083 [1,0,0,1,0,0|1,0,1]=4 1723 B9R1.6 O=C(O)C1CCCCN1 Amb9703161 [1,0,0,1,0,0|1,0,1]=4 1724 B9R1.6 O=C(O)C1CCCOC1 Amb1102367 [1,0,0,1,0,0|1,0,1]=4 1725 B9R1.6 O=C(O)C1CNCCN1 Amb22490977 [1,0,0,1,0,0|1,0,1]=4 1726 B9R1.6 O=C(O)C1CNCCN1 Amb2690349 [1,0,0,1,0,0|1,0,1]=4 1727 B9R1.6 O=C(O)C1CNCCN1 Amb2720318 [1,0,0,1,0,0|1,0,1]=4 1728 B9R1.6 O=C(O)C1COCCN1 Amb10607157 [1,0,0,1,0,0|0,0,1]=3 1729 B9R1.6 O=C(O)C1COCCN1 Amb2694767 [1,0,0,1,0,0|0,0,1]=3 1730 B9R1.6 O=C(O)C1COCCO1 Amb5399760 [1,0,0,1,0,0|1,0,1]=4 1731 B9R1.6 O=C(O)C1CSCC=N1 Amb25887246 [1,0,0,1,0,0|0,1,1]=4 1732 B9R1.6 O=C(O)C1CSCCN1 Amb19888398 [1,0,0,1,0,0|0,1,1]=4 1733 B9R1.6 O=C(O)C1CSCCN1 Amb2695006 [1,0,0,1,0,0|0,1,1]=4 1734 B9R1.6 O=C(O)[C@@H]1CCC=CN1 Amb19888332 [1,0,0,1,0,0|1,0,1]=4 1735 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb2690345 [1,0,0,1,0,0|1,0,1]=4 1736 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb8384272 [1,0,0,1,0,0|1,0,1]=4 1737 B9R1.6 O=C(O)[C@@H]1CCCNN1 Amb30666630 [1,0,0,1,0,0|2,0,0]=4 1738 B9R1.6 O=C(O)[C@@H]1CCCOC1 Amb26885613 [1,0,0,1,0,0|1,0,1]=4 1739 B9R1.6 O=C(O)[C@@H]1CNCCN1 Amb6307277 [1,0,0,1,0,0|1,0,1]=4 1740 B9R1.6 O=C(O)[C@@H]1CNCCN1 Amb6307319 [1,0,0,1,0,0|1,0,1]=4 1741 B9R1.6 O=C(O)[C@@H]1COCCN1 Amb10576585 [1,0,0,1,0,0|0,0,1]=3 1742 B9R1.6 O=C(O)[C@@H]1COCCN1 Amb2696709 [1,0,0,1,0,0|0,0,1]=3 1743 B9R1.6 O=C(O)[C@@H]1COCCO1 Amb23438856 [1,0,0,1,0,0|1,0,1]=4 1744 B9R1.6 O=C(O)[C@@H]1CSCCN1 Amb22386830 [1,0,0,1,0,0|0,1,1]=4 1745 B9R1.6 O=C(O)[C@@H]1CSCCN1 Amb8630483 [1,0,0,1,0,0|0,1,1]=4 1746 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb2700060 [1,0,0,1,0,0|1,0,1]=4 1747 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb8515100 [1,0,0,1,0,0|1,0,1]=4 1748 B9R1.6 O=C(O)[C@H]1CCCNN1 Amb27154761 [1,0,0,1,0,0|2,0,0]=4 1749 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb20241207 [1,0,0,1,0,0|1,0,1]=4 1750 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb2694998 [1,0,0,1,0,0|1,0,1]=4 1751 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb8628465 [1,0,0,1,0,0|1,0,1]=4 1752 B9R1.6 O=C(O)[C@H]1COCCN1 Amb16232575 [1,0,0,1,0,0|0,0,1]=3 1753 B9R1.6 O=C(O)[C@H]1COCCN1 Amb2696766 [1,0,0,1,0,0|0,0,1]=3 1754 B9R1.6 O=C(O)[C@H]1COCCO1 Amb26430807 [1,0,0,1,0,0|1,0,1]=4 1755 B9R1.6 O=C(O)[C@H]1CSCCN1 Amb2700568 [1,0,0,1,0,0|0,1,1]=4 1756 B9R1.15 O=C1NCCNC1CO Amb8010659 [1,0,0,1,0,0|1,0,1]=4 1757 B9R1.15 O=C1NCCN[C@H]1CO Amb27391825 [1,0,0,1,0,0|1,0,1]=4 1758 B9R1.22 CCC1CC(=O)OC1=O Amb24571652 [1,0,0,1,0,0|2,0,0]=4 1759 B9R1.22 CCC1NC(=O)CC1=O Amb18203277 [1,0,0,1,0,0|2,0,0]=4 1760 B9R1.22 CCC1NC(=O)NC1=O Amb1126591 [1,0,0,1,0,0|2,0,0]=4 1761 B9R1.22 CC[C@@H]1NC(=O)NC1=O Amb25146165 [1,0,0,1,0,0|2,0,0]=4 1762 B9R1.22 CC[C@@H]1NC(=O)OC1=O Amb27837741 [1,0,0,1,0,0|1,0,0]=3 1763 B9R1.22 CC[C@H]1NC(=O)NC1=O Amb28325068 [1,0,0,1,0,0|2,0,0]=4 1764 B9R1.22 C[C@H]1OC(=O)N[C@@H]1CO Amb27237045 [1,0,0,1,0,0|1,0,1]=4 1765 B9R1.22 C[C@H]1OC(=O)N[C@H]1CO Amb27440525 [1,0,0,1,0,0|1,0,1]=4 1766 B9R1.22 NCC1NC(=O)NC1=O Amb18832575 [1,0,0,1,0,0|2,0,0]=4 1767 B9R1.22 NC[C@@H]1NC(=O)NC1=O Amb27180356 [1,0,0,1,0,0|2,0,0]=4 1768 B9R1.22 NC[C@H]1NC(=O)NC1=O Amb28252348 [1,0,0,1,0,0|2,0,0]=4 1769 B9R1.22 O=C1CC(CF)C(=O)O1 Amb33379253 [1,0,0,1,0,0|2,0,0]=4 1770 B9R1.22 O=C1C[C@@H](O)[C@H](CO)N1 Amb28346278 [1,0,0,1,0,0|1,0,1]=4 1771 B9R1.22 O=C1NC(=O)C(CCl)N1 Amb27606273 [1,0,0,1,0,0|2,0,0]=4 1772 B9R1.22 O=C1NC(=O)C(CO)N1 Amb3941042 [1,0,0,1,0,0|1,0,0]=3 1773 B9R1.22 O=C1NC(=O)C(CS)N1 Amb525869 [1,0,0,1,0,0|1,1,0]=4 1774 B9R1.22 O=C1NC(=O)[C@H](CO)N1 Amb3941043 [1,0,0,1,0,0|1,0,0]=3 1775 B9R1.22 O=C1NC(=O)[C@H](CS)N1 Amb25104738 [1,0,0,1,0,0|1,1,0]=4 1776 B9R1.22 O=C1NC(=S)NC1CO Amb27483503 [1,0,0,1,0,0|1,1,0]=4 1777 B9R1.22 O=C1NC(CCl)C(=O)O1 Amb22054711 [1,0,0,1,0,0|1,0,0]=3 1778 B9R1.22 O=C1N[C@@H](CCl)C(=O)O1 Amb28411496 [1,0,0,1,0,0|1,0,0]=3 1779 B9R1.22 O=C1N[C@@H](CO)C(=O)O1 Amb26430671 [1,0,0,1,0,0|0,0,0]=2 1780 B9R1.22 O=C1N[C@H](CCl)C(=O)O1 Amb33624521 [1,0,0,1,0,0|1,0,0]=3 1781 B9R1.25 C\C=C1/[C@@H](C)[C@H]1C(=O)O Amb27614281 [1,0,0,1,0,0|2,0,0]=4 1782 B9R1.33 CCN[C@H]1CCOC1=O Amb28249000 [1,0,0,1,0,0|1,0,1]=4 1783 B9R1.33 CONC1CCOC1=O Amb28128618 [1,0,0,1,0,0|2,0,0]=4 1784 B9R1.33 O=CNC1CCOC1=O Amb27391272 [1,0,0,1,0,0|1,0,0]=3 1785 B9R1.33 O=CN[C@@H]1CONC1=O Amb27784848 [1,0,0,1,0,0|1,0,0]=3 1786 B9R1.33 O=CN[C@H]1CCNC1=O Amb27236896 [1,0,0,1,0,0|2,0,0]=4 1787 B9R1.33 O=CN[C@H]1CCOC1=O Amb35688702 [1,0,0,1,0,0|1,0,0]=3 1788 B9R1.35 C=C(C)C1COC(=O)N1 Amb24477743 [1,0,0,1,0,0|2,0,0]=4 1789 B9R1.35 CC(=O)[C@@H]1CCC(=O)N1 Amb27167616 [1,0,0,1,0,0|2,0,0]=4 1790 B9R1.35 CC(=O)[C@H]1CCC(=O)N1 Amb27877407 [1,0,0,1,0,0|2,0,0]=4 1791 B9R1.35 CC(=O)[C@H]1COC(=O)C1 Amb18832647 [1,0,0,1,0,0|2,0,0]=4 1792 B9R1.35 CC1=NC(C(=O)O)CC1 Amb23438203 [1,0,0,1,0,0|1,0,1]=4 1793 B9R1.35 CC1=NC(C(=O)O)CC1 Amb32409643 [1,0,0,1,0,0|1,0,1]=4 1794 B9R1.35 CC1=NC(C(=O)O)CO1 Amb20621597 [1,0,0,1,0,0|0,0,1]=3 1795 B9R1.35 CC1=NC(C(=O)O)CS1 Amb18124720 [1,0,0,1,0,0|0,1,1]=4 1796 B9R1.35 CC1=NCC(C(=O)O)N1 Amb24599993 [1,0,0,1,0,0|1,0,0]=3 1797 B9R1.35 CC1=NCC(C(=O)O)S1 Amb27958674 [1,0,0,1,0,0|2,0,0]=4 1798 B9R1.35 CC1=NC[C@H](C(=O)O)N1 Amb27827434 [1,0,0,1,0,0|1,0,0]=3 1799 B9R1.35 CC1=N[C@@H](C(=O)O)CS1 Amb32676192 [1,0,0,1,0,0|0,1,1]=4 1800 B9R1.35 CC1=N[C@H](C(=O)O)CC1 Amb27455557 [1,0,0,1,0,0|1,0,1]=4 1801 B9R1.35 CC1=N[C@H](C(=O)O)CS1 Amb35648200 [1,0,0,1,0,0|0,1,1]=4 1802 B9R1.35 CC1CC(C(=O)O)CO1 Amb25922998 [1,0,0,1,0,0|1,0,1]=4 1803 B9R1.35 CC1CCC(C(=O)O)N1 Amb18832572 [1,0,0,1,0,0|1,0,1]=4 1804 B9R1.35 CC1CCC(C(=O)O)N1 Amb32652343 [1,0,0,1,0,0|1,0,1]=4 1805 B9R1.35 CC1CC[C@H](C(=O)O)N1 Amb22748252 [1,0,0,1,0,0|1,0,1]=4 1806 B9R1.35 CC1NC(C(=O)O)CS1 Amb9718451 [1,0,0,1,0,0|0,1,1]=4 1807 B9R1.35 CC1N[C@H](C(=O)O)CS1 Amb16203706 [1,0,0,1,0,0|0,1,1]=4 1808 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 Amb31308105 [1,0,0,1,0,0|1,0,1]=4 1809 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb24399449 [1,0,0,1,0,0|1,0,1]=4 1810 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb32652487 [1,0,0,1,0,0|1,0,1]=4 1811 B9R1.35 C[C@@H]1C[C@H](C(=O)O)CO1 Amb27961253 [1,0,0,1,0,0|1,0,1]=4 1812 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb24598417 [1,0,0,1,0,0|1,0,1]=4 1813 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb35745779 [1,0,0,1,0,0|1,0,1]=4 1814 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 Amb33871500 [1,0,0,1,0,0|1,0,1]=4 1815 B9R1.35 C[C@H]1N[C@@H](C(=O)O)CS1 Amb28198473 [1,0,0,1,0,0|0,1,1]=4 1816 B9R1.35 N=C1OCC(C(=O)O)S1 Amb27954988 [1,0,0,1,0,0|2,0,0]=4 1817 B9R1.35 NC(=O)C1CCC(=O)N1 Amb17142856 [1,0,0,1,0,0|2,0,0]=4 1818 B9R1.35 NC(=O)C1CSC(=O)N1 Amb27595631 [1,0,0,1,0,0|1,1,0]=4 1819 B9R1.35 NC(=O)[C@@H]1CCC(=O)N1 Amb4018786 [1,0,0,1,0,0|2,0,0]=4 1820 B9R1.35 NC(=O)[C@H]1CCC(=O)N1 Amb27961076 [1,0,0,1,0,0|2,0,0]=4 1821 B9R1.35 O=C(O)C1CSC(=S)N1 Amb7089160 [1,0,0,1,0,0|0,2,0]=4 1822 B9R1.35 O=C(O)[C@@H]1CCC(=S)N1 Amb26857015 [1,0,0,1,0,0|1,1,0]=4 1823 B9R1.35 O=C(O)[C@@H]1CSC(=S)N1 Amb9809722 [1,0,0,1,0,0|0,2,0]=4 1824 B9R1.35 O=C1C=CC(C(=O)O)N1 Amb27775192 [1,0,0,1,0,0|1,0,1]=4 1825 B9R1.35 O=C1CC(C(=O)O)CN1 Amb33545000 [1,0,0,1,0,0|2,0,0]=4 1826 B9R1.35 O=C1CC(C(=O)O)CO1 Amb22642307 [1,0,0,1,0,0|1,0,0]=3 1827 B9R1.35 O=C1CC(C(=O)O)CS1 Amb10073724 [1,0,0,1,0,0|1,1,0]=4 1828 B9R1.35 O=C1CCC(C(=O)Cl)N1 Amb17142869 [1,0,0,1,0,0|2,0,0]=4 1829 B9R1.35 O=C1CCC(C(=O)O)C1 Amb2695400 [1,0,0,1,0,0|2,0,0]=4 1830 B9R1.35 O=C1CCC(C(=O)O)N1 Amb9703102 [1,0,0,1,0,0|1,0,0]=3 1831 B9R1.35 O=C1CCC(C(=O)O)O1 Amb20623076 [1,0,0,1,0,0|2,0,0]=4 1832 B9R1.35 O=C1CCC(C(=O)O)S1 Amb23439315 [1,0,0,1,0,0|2,0,0]=4 1833 B9R1.35 O=C1CCC(C(=O)[O-])N1 Amb8514777 [1,0,0,1,0,0|1,0,1]=4 1834 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 Amb27254141 [1,0,0,1,0,0|2,0,0]=4 1835 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 Amb1995036 [1,0,0,1,0,0|1,0,0]=3 1836 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 Amb24099403 [1,0,0,1,0,0|1,0,0]=3 1837 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 Amb2722887 [1,0,0,1,0,0|2,0,0]=4 1838 B9R1.35 O=C1CC[C@@H](C(=O)[O-])N1 Amb8395173 [1,0,0,1,0,0|1,0,1]=4 1839 B9R1.35 O=C1CC[C@H](C(=O)O)C1 Amb22746923 [1,0,0,1,0,0|2,0,0]=4 1840 B9R1.35 O=C1CC[C@H](C(=O)O)N1 Amb2694994 [1,0,0,1,0,0|1,0,0]=3 1841 B9R1.35 O=C1CC[C@H](C(=O)O)O1 Amb2720513 [1,0,0,1,0,0|2,0,0]=4 1842 B9R1.35 O=C1C[C@@H](C(=O)O)CN1 Amb23439643 [1,0,0,1,0,0|2,0,0]=4 1843 B9R1.35 O=C1C[C@@H](C(=O)O)CO1 Amb27253217 [1,0,0,1,0,0|1,0,0]=3 1844 B9R1.35 O=C1C[C@H](C(=O)O)CN1 Amb25946886 [1,0,0,1,0,0|2,0,0]=4 1845 B9R1.35 O=C1NC(C(=O)Cl)CO1 Amb27484689 [1,0,0,1,0,0|1,0,0]=3 1846 B9R1.35 O=C1NC(C(=O)Cl)CS1 Amb28040993 [1,0,0,1,0,0|1,1,0]=4 1847 B9R1.35 O=C1NC(C(=O)O)CO1 Amb15701690 [1,0,0,1,0,0|0,0,0]=2 1848 B9R1.35 O=C1NC(C(=O)O)CS1 Amb3319393 [1,0,0,1,0,0|0,1,0]=3 1849 B9R1.35 O=C1NCC(C(=O)O)N1 Amb2780032 [1,0,0,1,0,0|1,0,0]=3 1850 B9R1.35 O=C1NCC(C(=O)O)O1 Amb24112958 [1,0,0,1,0,0|2,0,0]=4 1851 B9R1.35 O=C1NCC(C(=O)O)S1 Amb24084914 [1,0,0,1,0,0|2,0,0]=4 1852 B9R1.35 O=C1NC[C@@H](C(=O)O)N1 Amb3997304 [1,0,0,1,0,0|1,0,0]=3 1853 B9R1.35 O=C1NC[C@@H](C(=O)O)O1 Amb25146207 [1,0,0,1,0,0|2,0,0]=4 1854 B9R1.35 O=C1NC[C@H](C(=O)O)N1 Amb24079612 [1,0,0,1,0,0|1,0,0]=3 1855 B9R1.35 O=C1NC[C@H](C(=O)O)O1 Amb27771494 [1,0,0,1,0,0|2,0,0]=4 1856 B9R1.35 O=C1N[C@@H](C(=O)O)CO1 Amb24340149 [1,0,0,1,0,0|0,0,0]=2 1857 B9R1.35 O=C1N[C@@H](C(=O)O)CS1 Amb537246 [1,0,0,1,0,0|0,1,0]=3 1858 B9R1.35 O=C1N[C@H](C(=O)O)CO1 Amb19517080 [1,0,0,1,0,0|0,0,0]=2 1859 B9R1.35 O=C1N[C@H](C(=O)O)CS1 Amb1157856 [1,0,0,1,0,0|0,1,0]=3 1860 B9R1.35 O=C1OCC(C(=O)O)O1 Amb25767974 [1,0,0,1,0,0|1,0,0]=3 1861 B9R1.35 O=C1SCC(C(=O)O)S1 Amb23504458 [1,0,0,1,0,0|1,1,0]=4 1862 B9R1.41 CC1CCNC1C(=O)O Amb22496299 [1,0,0,1,0,0|1,0,1]=4 1863 B9R1.41 CC1CCNC1C(=O)O Amb28895929 [1,0,0,1,0,0|1,0,1]=4 1864 B9R1.41 CC1CCN[C@@H]1C(=O)O Amb25786199 [1,0,0,1,0,0|1,0,1]=4 1865 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O Amb22747259 [1,0,0,1,0,0|1,0,1]=4 1866 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O Amb8387164 [1,0,0,1,0,0|1,0,1]=4 1867 B9R1.41 NC(=O)C1NCCC1O Amb24709283 [1,0,0,1,0,0|1,0,1]=4 1868 B9R1.41 NC(=O)[C@@H]1NCC[C@@H]1O Amb27779452 [1,0,0,1,0,0|1,0,1]=4 1869 B9R1.41 NC(=O)[C@@H]1NCC[C@H]1O Amb22744802 [1,0,0,1,0,0|1,0,1]=4 1870 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O Amb25194866 [1,0,0,1,0,0|1,0,1]=4 1871 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O Amb27630066 [1,0,0,1,0,0|1,0,1]=4 1872 B9R1.41 NC1CCNC1C(=O)O Amb27153692 [1,0,0,1,0,0|1,0,1]=4 1873 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb19929517 [1,0,0,1,0,0|1,0,1]=4 1874 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb31028940 [1,0,0,1,0,0|1,0,1]=4 1875 B9R1.41 N[C@H]1CCN[C@@H]1C(=O)O Amb27460833 [1,0,0,1,0,0|1,0,1]=4 1876 B9R1.41 N[C@H]1CCN[C@H]1C(=O)O Amb26904835 [1,0,0,1,0,0|1,0,1]=4 1877 B9R1.41 O=C(O)C1CCCC1O Amb19148040 [1,0,0,1,0,0|1,0,1]=4 1878 B9R1.41 O=C(O)C1CNCC1O Amb22886381 [1,0,0,1,0,0|2,0,0]=4 1879 B9R1.41 O=C(O)C1CNCC1O Amb26026738 [1,0,0,1,0,0|2,0,0]=4 1880 B9R1.41 O=C(O)C1COCC1O Amb27270738 [1,0,0,1,0,0|2,0,0]=4 1881 B9R1.41 O=C(O)C1CSCC1O Amb18831363 [1,0,0,1,0,0|2,0,0]=4 1882 B9R1.41 O=C(O)C1NCCC1F Amb25772909 [1,0,0,1,0,0|1,0,1]=4 1883 B9R1.41 O=C(O)C1NCCC1O Amb22387784 [1,0,0,1,0,0|0,0,1]=3 1884 B9R1.41 O=C(O)C1NCC[C@@H]1O Amb34913313 [1,0,0,1,0,0|0,0,1]=3 1885 B9R1.41 O=C(O)[C@@H]1CNC[C@@H]1O Amb27186915 [1,0,0,1,0,0|2,0,0]=4 1886 B9R1.41 O=C(O)[C@@H]1CNC[C@H]1O Amb24120417 [1,0,0,1,0,0|2,0,0]=4 1887 B9R1.41 O=C(O)[C@@H]1NCCC1F Amb30988050 [1,0,0,1,0,0|1,0,1]=4 1888 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F Amb26904377 [1,0,0,1,0,0|1,0,1]=4 1889 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb22230426 [1,0,0,1,0,0|0,0,1]=3 1890 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801217 [1,0,0,1,0,0|0,0,1]=3 1891 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801367 [1,0,0,1,0,0|0,0,1]=3 1892 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Amb26891987 [1,0,0,1,0,0|1,0,1]=4 1893 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Amb30988051 [1,0,0,1,0,0|1,0,1]=4 1894 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb22746713 [1,0,0,1,0,0|0,0,1]=3 1895 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb24183557 [1,0,0,1,0,0|0,0,1]=3 1896 B9R1.41 O=C(O)[C@H]1CCC[C@@H]1O Amb27437088 [1,0,0,1,0,0|1,0,1]=4 1897 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O Amb22747315 [1,0,0,1,0,0|1,0,1]=4 1898 B9R1.41 O=C(O)[C@H]1CNC[C@@H]1O Amb27421639 [1,0,0,1,0,0|2,0,0]=4 1899 B9R1.41 O=C(O)[C@H]1CNC[C@H]1O Amb27818119 [1,0,0,1,0,0|2,0,0]=4 1900 B9R1.41 O=C(O)[C@H]1NCCC1O Amb10604192 [1,0,0,1,0,0|0,0,1]=3 1901 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1Cl Amb27618755 [1,0,0,1,0,0|1,0,1]=4 1902 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb24055327 [1,0,0,1,0,0|0,0,1]=3 1903 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb34154004 [1,0,0,1,0,0|0,0,1]=3 1904 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb8515204 [1,0,0,1,0,0|0,0,1]=3 1905 B9R1.41 O=C(O)[C@H]1NCC[C@H]1Br Amb27232994 [1,0,0,1,0,0|1,0,1]=4 1906 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb22746928 [1,0,0,1,0,0|0,0,1]=3 1907 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb23439285 [1,0,0,1,0,0|0,0,1]=3 1908 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb24183503 [1,0,0,1,0,0|0,0,1]=3 1909 B9R1.41 O=C(O)[C@H]1NCC[C@H]1S Amb27421961 [1,0,0,1,0,0|0,1,1]=4 1910 B9R1.55 NC(=O)C1NC(=O)C1N Amb27445718 [1,0,0,1,0,0|2,0,0]=4 1911 B9R1.55 NC1C(=O)NC1C(=O)O Amb25871338 [1,0,0,1,0,0|1,0,0]=3 1912 B9R1.96 CCN1CCC1C(=O)O Amb22011877 [1,0,0,1,0,0|1,0,1]=4 1913 B9R1.96 CCN1CC[C@@H]1C(=O)O Amb24634744 [1,0,0,1,0,0|1,0,1]=4 1914 B9R1.96 CCN1CC[C@H]1C(=O)O Amb25347394 [1,0,0,1,0,0|1,0,1]=4 1915 B9R1.96 NC(=O)C1CCN1C=O Amb33251168 [1,0,0,1,0,0|2,0,0]=4 1916 B9R1.119 CCC1(C(=O)O)C=CC1 Amb27664148 [1,0,0,1,0,0|2,0,0]=4 1917 B9R1.119 CC[C@@]1(C(=O)O)CCN1 Amb27392754 [1,0,0,1,0,0|1,0,1]=4 1918 B9R1.119 O=C(O)C1(CO)CCC1 Amb20248637 [1,0,0,1,0,0|1,0,1]=4 1919 B9R1.119 O=C(O)C1(CO)CNC1 Amb24622488 [1,0,0,1,0,0|2,0,0]=4 1920 B9R1.119 O=C(O)C1(CO)COC1 Amb20668032 [1,0,0,1,0,0|2,0,0]=4 1921 B9R1.130 CC1CC1(CO)C(=O)O Amb27876946 [1,0,0,1,0,0|1,0,1]=4 1922 B9R1.179 CCNC1(C(=O)O)CC1 Amb27962756 [1,0,0,1,0,0|1,0,1]=4 1923 B9R1.179 O=CNC1(C(=O)O)CC1 Amb27589943 [1,0,0,1,0,0|1,0,0]=3 1924 B9R1.2 C=CC1CCCC(=O)N1 Amb26036889 [1,0,0,1,0,0|2,0,0]=4 1925 B9R1.2 C=C[C@H]1COCC(=O)N1 Amb27237122 [1,0,0,1,0,0|1,0,0]=3 1926 B9R1.2 CCC1COCC(=O)N1 Amb10608051 [1,0,0,1,0,0|1,0,1]=4 1927 B9R1.2 CC[C@@H]1COCC(=O)N1 Amb25146204 [1,0,0,1,0,0|1,0,1]=4 1928 B9R1.2 COC1COCC(=O)N1 Amb28043309 [1,0,0,1,0,0|2,0,0]=4 1929 B9R1.2 O=C1CCCC(CO)N1 Amb13886257 [1,0,0,1,0,0|1,0,1]=4 1930 B9R1.2 O=C1CCC[C@H](CO)N1 Amb25187085 [1,0,0,1,0,0|1,0,1]=4 1931 B9R1.2 O=C1CNCC(CO)N1 Amb27834544 [1,0,0,1,0,0|1,0,1]=4 1932 B9R1.2 O=C1CNCC(CO)N1 Amb32665951 [1,0,0,1,0,0|1,0,1]=4 1933 B9R1.2 O=C1CNC[C@@H](CO)N1 Amb26994402 [1,0,0,1,0,0|1,0,1]=4 1934 B9R1.2 O=C1CNC[C@@H](CO)N1 Amb30526697 [1,0,0,1,0,0|1,0,1]=4 1935 B9R1.2 O=C1CNC[C@H](CO)N1 Amb27828103 [1,0,0,1,0,0|1,0,1]=4 1936 B9R1.2 O=C1COCC(CO)N1 Amb22236095 [1,0,0,1,0,0|0,0,1]=3 1937 B9R1.2 O=C1CSCC(CO)N1 Amb28388256 [1,0,0,1,0,0|0,1,1]=4 1938 B9R1.13 CC(=O)N[C@H]1CNOC1 Amb33098987 [1,0,0,1,0,0|1,0,1]=4 1939 B9R1.124 O=C1CC(CO)(CO)C1 Amb26893355 [1,0,0,1,0,0|1,0,1]=4 1940 B9R1.133 CC1(C)NC(C=O)CO1 Amb27614244 [1,0,0,1,0,0|1,0,1]=4 1941 B9R1.133 CC1(C)N[C@@H](C=O)CO1 Amb27454967 [1,0,0,1,0,0|1,0,1]=4 1942 B9R1.45 C=C1CC1C(O)C(=O)O Amb27816361 [1,0,0,1,0,0|2,0,0]=4 1943 B9R1.45 C=C1C[C@@H]1C(O)C(=O)O Amb28410295 [1,0,0,1,0,0|2,0,0]=4 1944 B9R1.69 CC1=CNC(=O)C(C)N1 Amb27758403 [1,0,0,1,0,0|2,0,0]=4 1945 B9R1.69 CC1=N[C@@H](C)C(=O)OC1 Amb27656381 [1,0,0,1,0,0|1,0,1]=4 1946 B9R1.69 CC1NC(=O)CCC1=O Amb27874094 [1,0,0,1,0,0|1,0,0]=3 1947 B9R1.69 CC1NC(=O)CCC1O Amb22229985 [1,0,0,1,0,0|1,0,1]=4 1948 B9R1.69 CC1NC(=O)CNC1=O Amb24477892 [1,0,0,1,0,0|1,0,0]=3 1949 B9R1.69 CC1NC(=O)COC1=O Amb20669551 [1,0,0,1,0,0|0,0,0]=2 1950 B9R1.69 CC1NC(=O)COC1C Amb27440075 [1,0,0,1,0,0|1,0,1]=4 1951 B9R1.69 CC1OC(=O)COC1=O Amb27421415 [1,0,0,1,0,0|1,0,0]=3 1952 B9R1.69 C[C@@H]1NC(=O)CNC1=O Amb22233064 [1,0,0,1,0,0|1,0,0]=3 1953 B9R1.69 C[C@@H]1NC(=O)COC1=O Amb28059067 [1,0,0,1,0,0|0,0,0]=2 1954 B9R1.69 C[C@@H]1OCC(=O)N[C@@H]1C Amb26870419 [1,0,0,1,0,0|1,0,1]=4 1955 B9R1.69 C[C@H]1NC(=O)CC[C@@H]1O Amb28128446 [1,0,0,1,0,0|1,0,1]=4 1956 B9R1.69 C[C@H]1NC(=O)CNC1=O Amb25726602 [1,0,0,1,0,0|1,0,0]=3 1957 B9R1.69 O=C1CNC(=O)C(Br)N1 Amb26341108 [1,0,0,1,0,0|2,0,0]=4 1958 B9R1.69 O=C1CNC(=O)C(O)N1 Amb27204459 [1,0,0,1,0,0|1,0,0]=3 1959 B9R1.112 CC(NC1CC1)C(=O)O Amb9620653 [1,0,0,1,0,0|1,0,1]=4 1960 B9R1.112 C[C@@H](NC1CC1)C(=O)O Amb24398132 [1,0,0,1,0,0|1,0,1]=4 1961 B9R1.152 C=C(C)C1(C)CC(=O)N1 Amb25791049 [1,0,0,1,0,0|2,0,0]=4 1962 B9R1.152 C=C1CC(C)(C(=O)O)C1 Amb25887446 [1,0,0,1,0,0|2,0,0]=4 1963 B9R1.152 C=C1CC(O)(C(=O)O)C1 Amb28201676 [1,0,0,1,0,0|2,0,0]=4 1964 B9R1.152 CC1(C(=O)O)CC(=O)C1 Amb22406208 [1,0,0,1,0,0|1,0,0]=3 1965 B9R1.152 O=C1CC(F)(C(=O)O)C1 Amb34136578 [1,0,0,1,0,0|2,0,0]=4 1966 B9R1.161 C=C(C)C1CC1C(=O)O Amb25887453 [1,0,0,1,0,0|2,0,0]=4 1967 B9R1.161 C=C(C)[C@@H]1C[C@H]1C(=O)O Amb33199898 [1,0,0,1,0,0|2,0,0]=4 1968 B9R1.161 CC(=O)C1CC1C(C)=O Amb27861276 [1,0,0,1,0,0|2,0,0]=4 1969 B9R1.161 CC(=O)C1OC1C(N)=O Amb28383609 [1,0,0,1,0,0|2,0,0]=4 1970 B9R1.161 CC(=O)[C@@H]1C[C@H]1C(C)=O Amb28246517 [1,0,0,1,0,0|2,0,0]=4 1971 B9R1.161 CC(=O)[C@@H]1O[C@@H]1C(N)=O Amb27194051 [1,0,0,1,0,0|2,0,0]=4 1972 B9R1.161 CC(=O)[C@H]1C[C@H]1C(C)=O Amb28248083 [1,0,0,1,0,0|2,0,0]=4 1973 B9R1.161 NC(=O)C1CC1C(=O)O Amb17606123 [1,0,0,1,0,0|2,0,0]=4 1974 B9R1.161 NC(=O)C1OC1C(=O)O Amb25695985 [1,0,0,1,0,0|2,0,0]=4 1975 B9R1.161 NC(=O)[C@@H]1C[C@@H]1C(=O)O Amb24623178 [1,0,0,1,0,0|2,0,0]=4 1976 B9R1.161 NC(=O)[C@@H]1C[C@H]1C(=O)O Amb27447217 [1,0,0,1,0,0|2,0,0]=4 1977 B9R1.161 NC(=O)[C@H]1C[C@H]1C(=O)O Amb27436130 [1,0,0,1,0,0|2,0,0]=4 1978 B9R1.161 O=C(O)C1CC1C(=O)Cl Amb26959493 [1,0,0,1,0,0|2,0,0]=4 1979 B9R1.161 O=C(O)C1CC1C(=O)O Amb1350467 [1,0,0,1,0,0|2,0,0]=4 1980 B9R1.161 O=C(O)C1OC1C(=O)O Amb4001391 [1,0,0,1,0,0|2,0,0]=4 1981 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O Amb22901897 [1,0,0,1,0,0|2,0,0]=4 1982 B9R1.161 O=C(O)[C@@H]1O[C@H]1C(=O)O Amb22799776 [1,0,0,1,0,0|2,0,0]=4 1983 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O Amb25979295 [1,0,0,1,0,0|2,0,0]=4 1984 B9R1.161 O=C(O)[C@H]1C[C@H]1C(=O)O Amb3442175 [1,0,0,1,0,0|2,0,0]=4 1985 B9R1.161 O=C(O)[C@H]1O[C@@H]1C(=O)O Amb22262951 [1,0,0,1,0,0|2,0,0]=4 1986 B9R1.164 CC1(C)CC(C(=O)O)N1 Amb24117447 [1,0,0,1,0,0|1,0,1]=4 1987 B9R1.27 CC1=C(CO)C(=O)OC1 Amb27430811 [0,0,0,1,1,0|1,0,1]=4 1988 B9R1.27 CCC1C(=O)CCC1=O Amb8513847 [0,0,0,1,1,0|2,0,0]=4 1989 B9R1.27 CCC1C(=O)ON=C1C Amb27449167 [0,0,0,1,1,0|2,0,0]=4 1990 B9R1.27 O=C1CCC(=O)N1CO Amb2793167 [0,0,0,1,1,0|2,0,0]=4 1991 B9R1.27 O=C1COC(=O)N1CCl Amb27243875 [0,0,0,1,1,0|2,0,0]=4 1992 B9R1.27 O=C1COC(=O)N1CO Amb26973184 [0,0,0,1,1,0|1,0,0]=3 1993 B9R1.27 O=C1CSC(=O)N1CO Amb28315543 [0,0,0,1,1,0|1,1,0]=4 1994 B9R1.27 O=C1OCC(O)C1CO Amb27456568 [0,0,0,1,1,0|0,0,2]=4 1995 B9R1.27 O=C1OC[C@@H](O)[C@@H]1CO Amb27484769 [0,0,0,1,1,0|0,0,2]=4 1996 B9R1.52 C=C1CC(N)C1C(=O)O Amb27590177 [0,0,0,1,1,0|2,0,0]=4 1997 B9R1.52 CC1=CC(C)C1C(=O)O Amb28281140 [0,0,0,1,1,0|2,0,0]=4 1998 B9R1.52 CC1CC(O)C1C(=O)O Amb28076807 [0,0,0,1,1,0|1,0,1]=4 1999 B9R1.52 C[C@H]1C[C@@H](O)[C@H]1C(=O)O Amb28057126 [0,0,0,1,1,0|1,0,1]=4 2000 B9R1.168 C=C(C)C1(C(=O)O)CC1 Amb25356431 [0,0,0,1,1,0|2,0,0]=4 2001 B9R1.168 CC(=O)C1(C(=O)O)CC1 Amb16233343 [0,0,0,1,1,0|1,0,0]=3 2002 B9R1.168 CC(=O)C1(C(C)=O)CC1 Amb17836206 [0,0,0,1,1,0|2,0,0]=4 2003 B9R1.168 CC(=O)C1(C(C)O)CO1 Amb27754833 [0,0,0,1,1,0|1,0,1]=4 2004 B9R1.168 CC(=O)C1(C(N)=O)CC1 Amb25709592 [0,0,0,1,1,0|2,0,0]=4 2005 B9R1.168 CC(=O)[C@@]1([C@@H](C)O)CO1 Amb28250208 [0,0,0,1,1,0|1,0,1]=4 2006 B9R1.168 NC(=O)C1(C(=O)O)CC1 Amb2685732 [0,0,0,1,1,0|2,0,0]=4 2007 B9R1.168 O=C(O)C1(C(=O)Cl)CC1 Amb27154675 [0,0,0,1,1,0|2,0,0]=4 2008 B9R1.168 O=C(O)C1(C(=O)O)CC1 Amb535072 [0,0,0,1,1,0|2,0,0]=4 2009 B11R1.49 CC(=O)N1CC(O)CC1CO Amb27206465 [0,0,0,1,0,1|1,0,1]=4 2010 B11R1.49 CC(=O)N1C[C@@H](O)C[C@H]1CO Amb27632222 [0,0,0,1,0,1|1,0,1]=4 2011 B11R1.49 CC(=O)N1C[C@H](O)C[C@H]1CO Amb27422561 [0,0,0,1,0,1|1,0,1]=4 2012 B11R1.49 CCC1CC(=O)CC1C(=O)O Amb27657710 [0,0,0,1,0,1|2,0,0]=4 2013 B11R1.49 CCC1NC(=O)CC1C(=O)O Amb18200025 [0,0,0,1,0,1|1,0,0]=3 2014 B11R1.49 CCC1NC(=O)NC1C(=O)O Amb28385625 [0,0,0,1,0,1|2,0,0]=4 2015 B11R1.49 CCN1NC(=O)CC1C(=O)O Amb27883073 [0,0,0,1,0,1|2,0,0]=4 2016 B11R1.49 CC[C@@H]1NC(=O)C[C@H]1C(=O)O Amb27632492 [0,0,0,1,0,1|1,0,0]=3 2017 B11R1.49 CC[C@H]1CC(=O)C[C@H]1C(=O)O Amb28144970 [0,0,0,1,0,1|2,0,0]=4 2018 B11R1.49 NC(=O)[C@@H]1CC(=O)N[C@@H]1CO Amb27793137 [0,0,0,1,0,1|1,0,0]=3 2019 B11R1.49 NC(=O)[C@H]1CC(=O)N[C@@H]1CO Amb27638079 [0,0,0,1,0,1|1,0,0]=3 2020 B11R1.157 CC(=O)CC1CCCC(=O)N1 Amb24634713 [0,0,0,1,0,1|2,0,0]=4 2021 B11R1.157 NC(=O)CC1CCCC(=O)N1 Amb19515424 [0,0,0,1,0,1|2,0,0]=4 2022 B11R1.157 NC(=O)CC1CNCC(=O)N1 Amb27636641 [0,0,0,1,0,1|2,0,0]=4 2023 B11R1.157 O=C(O)CC1CCCC(=O)C1 Amb8487121 [0,0,0,1,0,1|2,0,0]=4 2024 B11R1.157 O=C(O)CC1CCCC(=O)N1 Amb18200018 [0,0,0,1,0,1|1,0,0]=3 2025 B11R1.157 O=C(O)CC1CNCC(=O)N1 Amb25800398 [0,0,0,1,0,1|1,0,0]=3 2026 B11R1.157 O=C(O)C[C@@H]1CCCC(=O)N1 Amb27397390 [0,0,0,1,0,1|1,0,0]=3 2027 B11R1.157 O=C(O)C[C@H]1CCCC(=O)C1 Amb28289879 [0,0,0,1,0,1|2,0,0]=4 2028 B11R1.157 O=C(O)C[C@H]1CCCC(=O)N1 Amb27983727 [0,0,0,1,0,1|1,0,0]=3 2029 B11R1.645 CC(=O)NC1CC(=O)OC1=O Amb19664157 [0,0,0,1,0,1|0,0,2]=4 2030 B11R1.645 CC(=O)N[C@@H]1C[C@@H](C)OC1O Amb28193800 [0,0,0,1,0,1|1,0,1]=4 2031 B11R1.645 CC(=O)N[C@H]1CC(=O)NC1O Amb27176484 [0,0,0,1,0,1|1,0,0]=3 2032 B11R1.645 CC(=O)N[C@H]1CC(=O)OC1=O Amb22737462 [0,0,0,1,0,1|0,0,2]=4 2033 B11R1.645 CC(=O)OC1CC(=O)NC1O Amb27950888 [0,0,0,1,0,1|2,0,0]=4 2034 B11R1.645 CC(=O)O[C@H]1CC(=O)NC1O Amb27455009 [0,0,0,1,0,1|2,0,0]=4 2035 B11R1.645 CC1CC(=O)OC1CC(=O)O Amb28458582 [0,0,0,1,0,1|2,0,0]=4 2036 B11R1.708 CC(=O)C1CCC1CC(=O)O Amb25918239 [0,0,0,1,0,1|2,0,0]=4 2037 B11R1.708 CC(=O)SC1CCC1C(=O)O Amb27201581 [0,0,0,1,0,1|2,0,0]=4 2038 B11R1.933 CC(=O)NC1(CC(=O)O)CC1 Amb25201513 [0,0,0,1,0,1|1,0,0]=3 2039 B11R1.933 CS(=O)NC1(CC(=O)O)CC1 Amb27671981 [0,0,0,1,0,1|2,0,0]=4 2040 B11R1.933 NC(=O)NC1(CC(=O)O)CC1 Amb27475056 [0,0,0,1,0,1|2,0,0]=4 2041 B11R1.48 CC(=O)N1CC(O)C(CO)C1 Amb25202241 [0,0,0,1,0,1|1,0,1]=4 2042 B11R1.48 CCC1CC(C(C)=O)OC1=O Amb28121700 [0,0,0,1,0,1|2,0,0]=4 2043 B11R1.90 CC(=O)CSC1CCOC1=O Amb27840333 [0,0,0,1,0,1|2,0,0]=4 2044 B11R1.90 CC(=O)NCC1CCCC1=O Amb27840284 [0,0,0,1,0,1|2,0,0]=4 2045 B11R1.90 NC(=O)CN[C@H]1CCOC1=O Amb27946688 [0,0,0,1,0,1|2,0,0]=4 2046 B11R1.166 CC1=CC(O)C(C(=O)O)CC1 Amb28285405 [0,0,0,1,0,1|2,0,0]=4 2047 B11R1.166 CC1CC(=O)CCC1C(=O)O Amb18125961 [0,0,0,1,0,1|2,0,0]=4 2048 B11R1.166 CC1CC(=O)NCC1C(=O)O Amb25149101 [0,0,0,1,0,1|1,0,0]=3 2049 B11R1.166 CC1CC(O)C(C(=O)O)CN1 Amb18830395 [0,0,0,1,0,1|1,0,1]=4 2050 B11R1.166 C[C@@H]1CC(=O)CC[C@H]1C(=O)O Amb24511958 [0,0,0,1,0,1|2,0,0]=4 2051 B11R1.166 C[C@H]1CC(=O)CC[C@H]1C(=O)O Amb24571688 [0,0,0,1,0,1|2,0,0]=4 2052 B11R1.166 NC(=O)C1CNC(=O)CC1O Amb27843739 [0,0,0,1,0,1|1,0,0]=3 2053 B11R1.175 CC(=O)C1CCC(C(=O)O)C1 Amb24373216 [0,0,0,1,0,1|2,0,0]=4 2054 B11R1.175 CC(=O)C1CCN(C(C)=O)C1 Amb27642976 [0,0,0,1,0,1|2,0,0]=4 2055 B11R1.175 CC(=O)C1NC(C(=O)O)CS1 Amb27408644 [0,0,0,1,0,1|0,1,0]=3 2056 B11R1.175 CC(=O)N1CCC(C(=O)O)C1 Amb18949041 [0,0,0,1,0,1|1,0,0]=3 2057 B11R1.175 CC(=O)N1CCC(C(N)=O)C1 Amb28430047 [0,0,0,1,0,1|2,0,0]=4 2058 B11R1.175 CC(=O)[C@@H]1CC[C@H](C(=O)O)C1 Amb28052085 [0,0,0,1,0,1|2,0,0]=4 2059 B11R1.175 CC(=O)[C@@H]1C[C@@H](C(=O)O)CO1 Amb27424004 [0,0,0,1,0,1|1,0,0]=3 2060 B11R1.175 CC(=O)[C@H]1CC[C@H](C(=O)O)C1 Amb28052084 [0,0,0,1,0,1|2,0,0]=4 2061 B11R1.175 CC(=O)[C@H]1C[C@@H](C(=O)O)CO1 Amb27221215 [0,0,0,1,0,1|1,0,0]=3 2062 B11R1.175 NC(=O)C1CCC(C(=O)O)N1 Amb27397702 [0,0,0,1,0,1|2,0,0]=4 2063 B11R1.175 NC(=O)[C@@H]1CC[C@@H](C(=O)O)N1 Amb23560427 [0,0,0,1,0,1|2,0,0]=4 2064 B11R1.175 NC(=O)[C@@H]1CC[C@H](C(=O)O)N1 Amb23560440 [0,0,0,1,0,1|2,0,0]=4 2065 B11R1.175 O=C(O)C1COC(C(=O)O)C1 Amb23454154 [0,0,0,1,0,1|2,0,0]=4 2066 B11R1.175 O=C(O)C1CSC(C(=O)O)N1 Amb16203736 [0,0,0,1,0,1|1,1,0]=4 2067 B11R1.175 O=C(O)[C@@H]1CC[C@@H](C(=O)O)N1 Amb25174831 [0,0,0,1,0,1|2,0,0]=4 2068 B11R1.175 O=C(O)[C@H]1CC[C@H](C(=O)O)N1 Amb27195626 [0,0,0,1,0,1|2,0,0]=4 2069 B11R1.355 C=C1CN(C(CC)C(=O)O)C1 Amb35605519 [0,0,0,1,0,1|2,0,0]=4 2070 B11R1.355 C=C1CN(C(CN)C(=O)O)C1 Amb35605523 [0,0,0,1,0,1|2,0,0]=4 2071 B11R1.416 CCC1(C(=O)O)CNC(=O)C1 Amb25848400 [0,0,0,1,0,1|1,0,0]=3 2072 B11R1.416 CCC1(C(=O)O)CNC(=O)N1 Amb33746214 [0,0,0,1,0,1|2,0,0]=4 2073 B11R1.416 CCC1(C(=O)O)CNC(=O)O1 Amb33735540 [0,0,0,1,0,1|2,0,0]=4 2074 B11R1.416 O=C(O)C1(CO)CC(O)CN1 Amb35656412 [0,0,0,1,0,1|0,0,2]=4 2075 B11R1.416 O=C1CCC(CO)(C(=O)O)O1 Amb27816272 [0,0,0,1,0,1|2,0,0]=4 2076 B11R1.416 O=C1CC[C@@](CO)(C(=O)O)N1 Amb27845485 [0,0,0,1,0,1|2,0,0]=4 2077 B11R1.418 O=C(O)[C@@H]1C[C@]1(CO)C(=O)O Amb27768045 [0,0,0,1,0,1|2,0,0]=4 2078 B11R1.418 O=C(O)[C@H]1C[C@@]1(CO)C(=O)O Amb26023028 [0,0,0,1,0,1|2,0,0]=4 2079 B11R1.565 NC(=O)C1CCCC(=O)NC1 Amb27963105 [0,0,0,1,0,1|2,0,0]=4 2080 B11R1.565 O=C1CCCC(C(=O)O)CC1 Amb23399610 [0,0,0,1,0,1|2,0,0]=4 2081 B11R1.565 O=C1CCSC(C(=O)O)CN1 Amb27441231 [0,0,0,1,0,1|2,0,0]=4 2082 B11R1.727 CC1(C)CNC(C(=O)O)CO1 Amb10608911 [0,0,0,1,0,1|1,0,1]=4 2083 B11R1.727 CC1(C)CNC(C(=O)O)CO1 Amb19889803 [0,0,0,1,0,1|1,0,1]=4 2084 B11R1.727 CC1(C)CN[C@@H](C(=O)O)CO1 Amb25207391 [0,0,0,1,0,1|1,0,1]=4 2085 B11R1.727 CC1(C)CN[C@@H](C(=O)O)CO1 Amb31291605 [0,0,0,1,0,1|1,0,1]=4 2086 B11R1.727 CC1(C)CN[C@H](C(=O)O)CO1 Amb19889802 [0,0,0,1,0,1|1,0,1]=4 2087 B11R1.727 CC1(C)CN[C@H](C(=O)O)CO1 Amb25111013 [0,0,0,1,0,1|1,0,1]=4 2088 B11R1.1391 CC(=O)CCC1(C(=O)O)CC1 Amb27990274 [0,0,0,1,0,1|2,0,0]=4 2089 B11R1.1391 CC(=O)CNC1(C(=O)O)CC1 Amb27989525 [0,0,0,1,0,1|1,0,0]=3 2090 B11R1.1391 CC(=O)NCC1(C(=O)O)CC1 Amb23441145 [0,0,0,1,0,1|1,0,0]=3 2091 B11R1.1391 CC(=O)OCC1(C(C)=O)CO1 Amb24766976 [0,0,0,1,0,1|2,0,0]=4 2092 B11R1.1391 CS(=O)NCC1(C(=O)O)CC1 Amb27272517 [0,0,0,1,0,1|2,0,0]=4 2093 B11R1.74 CC1CC(=O)CC(C(=O)O)N1 Amb18200027 [0,1,0,1,0,0|2,0,0]=4 2094 B11R1.74 CC1CC(=O)NC(C(=O)O)C1 Amb26352891 [0,1,0,1,0,0|1,0,0]=3 2095 B11R1.74 C[C@@H]1CC(=O)N[C@H](C(=O)O)C1 Amb28134065 [0,1,0,1,0,0|1,0,0]=3 2096 B11R1.74 C[C@@H]1CC(=O)N[C@H](C(N)=O)C1 Amb27854487 [0,1,0,1,0,0|2,0,0]=4 2097 B11R1.74 C[C@H]1CC(=O)N[C@@H](C(=O)O)C1 Amb28284476 [0,1,0,1,0,0|1,0,0]=3 2098 B11R1.74 NC(=O)C1NC(=O)NC(O)N1 Amb27840375 [0,1,0,1,0,0|2,0,0]=4 2099 B11R1.74 NC1CC(=O)NC(C(=O)O)C1 Amb18199921 [0,1,0,1,0,0|1,0,0]=3 2100 B11R1.74 O=C1CC(=O)CC(C(=O)O)C1 Amb10069927 [0,1,0,1,0,0|1,0,1]=4 2101 B11R1.74 O=C1CC(=O)NC(C(=O)O)C1 Amb18200050 [0,1,0,1,0,0|0,0,1]=3 2102 B11R1.74 O=C1CC(=O)N[C@H](C(=O)O)C1 Amb27985272 [0,1,0,1,0,0|0,0,1]=3 2103 B11R1.74 O=C1CC(=O)OC(C(=O)O)C1 Amb26849736 [0,1,0,1,0,0|1,0,1]=4 2104 B11R1.74 O=C1CC(C(=O)O)CC(O)N1 Amb27234573 [0,1,0,1,0,0|2,0,0]=4 2105 B11R1.74 O=C1CC(C(=O)O)NC(=O)N1 Amb4006223 [0,1,0,1,0,0|1,0,1]=4 2106 B11R1.74 O=C1CC(O)CC(C(=O)O)N1 Amb28077591 [0,1,0,1,0,0|0,0,0]=2 2107 B11R1.74 O=C1CS(=O)CC(C(=O)O)N1 Amb27444598 [0,1,0,1,0,0|0,0,1]=3 2108 B11R1.74 O=C1C[C@@H](C(=O)O)NC(=O)N1 Amb6296191 [0,1,0,1,0,0|1,0,1]=4 2109 B11R1.74 O=C1C[C@H](C(=O)O)NC(=O)N1 Amb3997218 [0,1,0,1,0,0|1,0,1]=4 2110 B11R1.86 CC(=O)N[C@H]1CCCNC1=O Amb27475880 [0,1,0,1,0,0|2,0,0]=4 2111 B11R1.86 CC(=O)OC1COCCC1=O Amb27262955 [0,1,0,1,0,0|2,0,0]=4 2112 B11R1.178 C=C(C)C1OCCC1C(=O)O Amb25149367 [0,1,0,1,0,0|2,0,0]=4 2113 B11R1.178 C=C(C)N1CCCC1C(=O)O Amb27176559 [0,1,0,1,0,0|2,0,0]=4 2114 B11R1.178 C=C(C)[C@@H]1OCC[C@@H]1C(=O)O Amb26585795 [0,1,0,1,0,0|2,0,0]=4 2115 B11R1.178 C=C(C)[C@H]1OCC[C@H]1C(=O)O Amb25176580 [0,1,0,1,0,0|2,0,0]=4 2116 B11R1.178 CC(=O)C1CCCC1C(=O)O Amb28120981 [0,1,0,1,0,0|2,0,0]=4 2117 B11R1.178 CC(=O)C1CNCC1C(=O)O Amb2694843 [0,1,0,1,0,0|2,0,0]=4 2118 B11R1.178 CC(=O)N1CC=CC1C(=O)O Amb28254452 [0,1,0,1,0,0|1,0,1]=4 2119 B11R1.178 CC(=O)N1CCC=C1C(=O)O Amb27249478 [0,1,0,1,0,0|1,0,1]=4 2120 B11R1.178 CC(=O)N1CCCC1C(=O)O Amb9745654 [0,1,0,1,0,0|1,0,0]=3 2121 B11R1.178 CC(=O)N1CCCC1C(N)=O Amb4013544 [0,1,0,1,0,0|2,0,0]=4 2122 B11R1.178 CC(=O)N1CCC[C@@H]1C(=O)O Amb10072246 [0,1,0,1,0,0|1,0,0]=3 2123 B11R1.178 CC(=O)N1CCC[C@@H]1C(N)=O Amb22756686 [0,1,0,1,0,0|2,0,0]=4 2124 B11R1.178 CC(=O)N1CCC[C@H]1C(=O)Cl Amb27265756 [0,1,0,1,0,0|2,0,0]=4 2125 B11R1.178 CC(=O)N1CCC[C@H]1C(=O)O Amb1154281 [0,1,0,1,0,0|1,0,0]=3 2126 B11R1.178 CC(=O)N1CCC[C@H]1C(N)=O Amb8393632 [0,1,0,1,0,0|2,0,0]=4 2127 B11R1.178 CC(=O)N1CCSC1C(=O)O Amb18647907 [0,1,0,1,0,0|1,0,0]=3 2128 B11R1.178 CC(=O)N1COCC1C(=O)O Amb27237614 [0,1,0,1,0,0|0,0,0]=2 2129 B11R1.178 CC(=O)N1CSCC1C(=O)O Amb9723702 [0,1,0,1,0,0|0,1,0]=3 2130 B11R1.178 CC(=O)N1CSCC1C(N)=O Amb27662068 [0,1,0,1,0,0|1,1,0]=4 2131 B11R1.178 CC(=O)N1CSC[C@@H]1C(=O)O Amb18795582 [0,1,0,1,0,0|0,1,0]=3 2132 B11R1.178 CC(=O)N1CSC[C@H]1C(=O)O Amb17608078 [0,1,0,1,0,0|0,1,0]=3 2133 B11R1.178 CC(=O)[C@@H]1CCCN1C(C)=O Amb28422607 [0,1,0,1,0,0|2,0,0]=4 2134 B11R1.178 CS(=O)N1CCCC1C(=O)O Amb28195242 [0,1,0,1,0,0|2,0,0]=4 2135 B11R1.178 CS(=O)N1CCC[C@H]1C(=O)O Amb27777985 [0,1,0,1,0,0|2,0,0]=4 2136 B11R1.178 CS(=O)N1CSCC1C(=O)O Amb27220675 [0,1,0,1,0,0|1,1,0]=4 2137 B11R1.178 NC(=O)C1OCCC1C(=O)O Amb35649185 [0,1,0,1,0,0|2,0,0]=4 2138 B11R1.178 NC(=O)N1CCCC1C(=O)O Amb9745667 [0,1,0,1,0,0|2,0,0]=4 2139 B11R1.178 NC(=O)N1CCC[C@@H]1C(=O)O Amb18787750 [0,1,0,1,0,0|2,0,0]=4 2140 B11R1.178 NC(=O)N1CCC[C@H]1C(=O)O Amb6893269 [0,1,0,1,0,0|2,0,0]=4 2141 B11R1.178 NC(=O)N1CSCC1C(=O)O Amb6263476 [0,1,0,1,0,0|1,1,0]=4 2142 B11R1.178 O=C(O)C1CCCN1C(=O)O Amb24060622 [0,1,0,1,0,0|2,0,0]=4 2143 B11R1.178 O=C(O)C1COCC1C(=O)O Amb23571987 [0,1,0,1,0,0|2,0,0]=4 2144 B11R1.178 O=C(O)[C@@H]1CCCN1C(=O)Cl Amb24407327 [0,1,0,1,0,0|2,0,0]=4 2145 B11R1.178 O=C(O)[C@@H]1COC[C@@H]1C(=O)O Amb26847108 [0,1,0,1,0,0|2,0,0]=4 2146 B11R1.182 C=CCC1NC(=O)CNC1=O Amb24375277 [0,1,0,1,0,0|2,0,0]=4 2147 B11R1.182 CCCC1NC(=O)CNC1=O Amb27248073 [0,1,0,1,0,0|2,0,0]=4 2148 B11R1.182 COCC1NC(=O)CNC1=O Amb27465149 [0,1,0,1,0,0|1,0,0]=3 2149 B11R1.182 COC[C@@H]1NC(=O)CNC1=O Amb27815171 [0,1,0,1,0,0|1,0,0]=3 2150 B11R1.182 NOCC1NC(=O)CNC1=O Amb27798360 [0,1,0,1,0,0|1,0,0]=3 2151 B11R1.182 O=C1CNC(=O)C(CCO)C1 Amb27636637 [0,1,0,1,0,0|2,0,0]=4 2152 B11R1.182 O=C1CNC(=O)C(CCO)N1 Amb24564424 [0,1,0,1,0,0|1,0,0]=3 2153 B11R1.182 O=C1CNC(=O)C(CCS)N1 Amb27850802 [0,1,0,1,0,0|1,1,0]=4 2154 B11R1.182 O=C1CNC(=O)[C@H](CCBr)N1 Amb10601675 [0,1,0,1,0,0|2,0,0]=4 2155 B11R1.497 CC(=O)C1CCCCC(=O)N1 Amb27873410 [0,1,0,1,0,0|2,0,0]=4 2156 B11R1.497 CC1=NCCC[C@H](C(=O)O)N1 Amb27231815 [0,1,0,1,0,0|2,0,0]=4 2157 B11R1.497 NC(=O)C1CCCCC(=O)N1 Amb26852005 [0,1,0,1,0,0|2,0,0]=4 2158 B11R1.497 NC(=O)C1CSCCC(=O)N1 Amb21943337 [0,1,0,1,0,0|1,1,0]=4 2159 B11R1.497 O=C1CCCCC(C(=O)O)C1 Amb10603800 [0,1,0,1,0,0|2,0,0]=4 2160 B11R1.497 O=C1CCCCC(C(=O)O)N1 Amb19515429 [0,1,0,1,0,0|1,0,0]=3 2161 B11R1.497 O=C1CCOCC(C(=O)O)C1 Amb27414004 [0,1,0,1,0,0|1,0,0]=3 2162 B11R1.497 O=C1CCOC[C@H](C(=O)O)N1 Amb27483038 [0,1,0,1,0,0|0,0,0]=2 2163 B11R1.497 O=C1CCSCC(C(=O)O)N1 Amb21937059 [0,1,0,1,0,0|0,1,0]=3 2164 B11R1.497 O=C1NCCCC(C(=O)O)N1 Amb27657613 [0,1,0,1,0,0|1,0,0]=3 2165 B11R1.497 O=C1NCCC[C@H](C(=O)O)N1 Amb27803711 [0,1,0,1,0,0|1,0,0]=3 2166 B11R1.730 CC1(C)COCC(C(=O)O)N1 Amb28653017 [0,1,0,1,0,0|1,0,1]=4 2167 B11R1.782 CCCC1(C(=O)O)CC(=O)C1 Amb33374800 [0,1,0,1,0,0|2,0,0]=4 2168 B11R1.782 CCSC1(C(=O)O)CC(=O)C1 Amb27470440 [0,1,0,1,0,0|2,0,0]=4 2169 B11R1.782 COCC1(C(=O)O)CC(=O)C1 Amb33429411 [0,1,0,1,0,0|1,0,0]=3 2170 B11R1.782 CSCC1(C(=O)O)CC(=O)C1 Amb33269654 [0,1,0,1,0,0|1,1,0]=4 2171 B11R1.782 O=C1CC(CCF)(C(=O)O)C1 Amb33195740 [0,1,0,1,0,0|2,0,0]=4 2172 B11R1.806 COCC(NC1CC1)C(=O)O Amb28652825 [0,1,0,1,0,0|1,0,1]=4 2173 B11R1.925 CC(=O)NC(C(=O)O)C1CC1 Amb18300436 [0,1,0,1,0,0|1,0,0]=3 2174 B11R1.925 CS(=O)NC(C(=O)O)C1CC1 Amb27272518 [0,1,0,1,0,0|2,0,0]=4 2175 B11R1.929 CC(=O)CC1(C(=O)O)CCC1 Amb25893452 [0,1,0,1,0,0|2,0,0]=4 2176 B11R1.929 CC(=O)NC1(C(N)=O)CNC1 Amb27471171 [0,1,0,1,0,0|2,0,0]=4 2177 B11R1.21 CC(=O)C1CNC(C)C(=O)N1 Amb27839760 [0,1,0,1,0,0|2,0,0]=4 2178 B11R1.21 CC(=O)C1CN[C@@H](C)C(=O)N1 Amb18200213 [0,1,0,1,0,0|2,0,0]=4 2179 B11R1.21 CC1NC(C(=O)O)COC1C Amb28248835 [0,1,0,1,0,0|1,0,1]=4 2180 B11R1.21 CC1NC(C(=O)O)COC1C Amb32663609 [0,1,0,1,0,0|1,0,1]=4 2181 B11R1.21 CC1SCC(C(=O)O)NC1=O Amb23590306 [0,1,0,1,0,0|0,1,0]=3 2182 B11R1.21 CC1SCC(C(N)=O)NC1=O Amb27658814 [0,1,0,1,0,0|1,1,0]=4 2183 B11R1.21 CN1CCC(C(=O)O)CC1=O Amb6892357 [0,1,0,1,0,0|2,0,0]=4 2184 B11R1.21 NC(=O)C1CCC(N)C(=O)N1 Amb24707747 [0,1,0,1,0,0|2,0,0]=4 2185 B11R1.21 O=C1CC(C(=O)O)CCC1O Amb27176349 [0,1,0,1,0,0|2,0,0]=4 2186 B11R1.21 O=C1NC(C(=O)O)COC1=O Amb28132729 [0,1,0,1,0,0|0,0,1]=3 2187 B11R1.21 O=C1NCC(C(=O)O)NC1=O Amb27444105 [0,1,0,1,0,0|1,0,1]=4 2188 B11R1.167 CC(C)C1NC(=O)CCC1=O Amb27162024 [0,1,0,1,0,0|2,0,0]=4 2189 B11R1.167 CC(C)C1NC(=O)CNC1=O Amb5720088 [0,1,0,1,0,0|2,0,0]=4 2190 B11R1.167 CC(C)C1NC(=O)COC1=O Amb25233041 [0,1,0,1,0,0|1,0,0]=3 2191 B11R1.167 CC(C)[C@@H]1NC(=O)CNC1=O Amb2719613 [0,1,0,1,0,0|2,0,0]=4 2192 B11R1.167 CC(C)[C@H]1NC(=O)CNC1=O Amb540835 [0,1,0,1,0,0|2,0,0]=4 2193 B11R1.167 CC(F)C1NC(=O)CNC1=O Amb27464391 [0,1,0,1,0,0|2,0,0]=4 2194 B11R1.167 CC(O)C1NC(=O)CNC1=O Amb25095695 [0,1,0,1,0,0|1,0,0]=3 2195 B11R1.167 CC1=NCC(O)C(C(=O)O)N1 Amb24392171 [0,1,0,1,0,0|1,0,0]=3 2196 B11R1.167 CC1=N[C@H](C(=O)O)[C@@H](O)CN1 Amb9825644 [0,1,0,1,0,0|1,0,1]=4 2197 B11R1.167 CC1CCC(=O)CC1C(=O)O Amb32867785 [0,1,0,1,0,0|2,0,0]=4 2198 B11R1.167 CC1CNC(=O)CC1C(=O)O Amb33099388 [0,1,0,1,0,0|2,0,0]=4 2199 B11R1.167 C[C@@H](O)[C@@H]1NC(=O)CNC1=O Amb26451023 [0,1,0,1,0,0|1,0,0]=3 2200 B11R1.167 C[C@H]1OCC(=O)N[C@@H]1C(=O)O Amb27453688 [0,1,0,1,0,0|0,0,0]=2 2201 B11R1.167 C[C@H]1OCC(=O)N[C@@H]1C(N)=O Amb27973909 [0,1,0,1,0,0|1,0,0]=3 2202 B11R1.167 N=C1NCC(O)C(C(=O)O)N1 Amb27872268 [0,1,0,1,0,0|1,0,0]=3 2203 B11R1.167 NC(=O)C1NC(=O)CCC1O Amb27209797 [0,1,0,1,0,0|1,0,0]=3 2204 B11R1.167 O=C1CC[C@H](O)[C@H](C(=O)O)N1 Amb25174915 [0,1,0,1,0,0|0,0,0]=2 2205 B11R1.167 O=C1CNC(=O)C(C(=O)O)N1 Amb22492426 [0,1,0,1,0,0|0,0,2]=4 2206 B11R1.228 C#CC(=O)NC1CONC1=O Amb35712452 [0,1,0,1,0,0|1,0,1]=4 2207 B11R1.228 C=CC(=O)N[C@H]1CCOC1=O Amb35696339 [0,1,0,1,0,0|1,0,1]=4 2208 B11R1.228 CCC(=O)NC1CCNC1=O Amb29889975 [0,1,0,1,0,0|2,0,0]=4 2209 B11R1.228 CCC(=O)NC1CCOC1=O Amb24447418 [0,1,0,1,0,0|1,0,0]=3 2210 B11R1.228 CCC(=O)NC1COCC1O Amb24397875 [0,1,0,1,0,0|1,0,1]=4 2211 B11R1.228 CCC(=O)NC1CONC1=O Amb27766432 [0,1,0,1,0,0|1,0,0]=3 2212 B11R1.228 CCC(=O)N[C@@H]1COC[C@@H]1O Amb32671844 [0,1,0,1,0,0|1,0,1]=4 2213 B11R1.228 CCC(=O)N[C@@H]1COC[C@H]1O Amb27860545 [0,1,0,1,0,0|1,0,1]=4 2214 B11R1.228 CCC(=O)N[C@H]1CCNC1=O Amb35662969 [0,1,0,1,0,0|2,0,0]=4 2215 B11R1.228 CNC(=O)NC1CCNC1=O Amb35701034 [0,1,0,1,0,0|2,0,0]=4 2216 B11R1.228 CNC(=O)NC1CONC1=O Amb27879599 [0,1,0,1,0,0|1,0,0]=3 2217 B11R1.228 CNC(=O)N[C@H]1CCNC1=O Amb35660531 [0,1,0,1,0,0|2,0,0]=4 2218 B11R1.228 CNC(=S)NC1CONC1=O Amb27983957 [0,1,0,1,0,0|1,1,0]=4 2219 B11R1.228 COC(=O)NC1CCNC1=O Amb35701035 [0,1,0,1,0,0|2,0,0]=4 2220 B11R1.228 COC(=O)NC1CCOC1=O Amb27201623 [0,1,0,1,0,0|1,0,0]=3 2221 B11R1.228 COC(=O)N[C@@H]1CCOC1=O Amb25299312 [0,1,0,1,0,0|1,0,0]=3 2222 B11R1.228 COC(=O)N[C@H]1CCNC1=O Amb35660532 [0,1,0,1,0,0|2,0,0]=4 2223 B11R1.228 NCC(=O)NC1CCNC1=O Amb35685890 [0,1,0,1,0,0|2,0,0]=4 2224 B11R1.228 NCC(=O)NC1COCC1O Amb27251030 [0,1,0,1,0,0|1,0,1]=4 2225 B11R1.228 NCC(=O)N[C@@H]1CONC1=O Amb28050924 [0,1,0,1,0,0|1,0,0]=3 2226 B11R1.228 NCC(=O)N[C@H]1CCNC1=O Amb30040123 [0,1,0,1,0,0|2,0,0]=4 2227 B11R1.228 NCC(=O)N[C@H]1CCOC1=O Amb27776840 [0,1,0,1,0,0|1,0,0]=3 2228 B11R1.228 O=C(CBr)NC1CCNC1=O Amb29862172 [0,1,0,1,0,0|2,0,0]=4 2229 B11R1.228 O=C(CBr)N[C@H]1CCNC1=O Amb35660624 [0,1,0,1,0,0|2,0,0]=4 2230 B11R1.228 O=C(CCl)NC1CCNC1=O Amb29861359 [0,1,0,1,0,0|2,0,0]=4 2231 B11R1.228 O=C(CCl)NC1CCSC1=O Amb1101740 [0,1,0,1,0,0|1,1,0]=4 2232 B11R1.228 O=C(CCl)NN1CCOC1=O Amb24426206 [0,1,0,1,0,0|2,0,0]=4 2233 B11R1.228 O=C(CCl)N[C@H]1CCNC1=O Amb35660623 [0,1,0,1,0,0|2,0,0]=4 2234 B11R1.228 O=C(CCl)N[C@H]1CCOC1=O Amb35696340 [0,1,0,1,0,0|1,0,0]=3 2235 B11R1.228 O=C(CCl)O[C@@H]1CCOC1=O Amb27860370 [0,1,0,1,0,0|2,0,0]=4 2236 B11R1.228 O=C(CS)NC1CCNC1=O Amb29861913 [0,1,0,1,0,0|2,0,0]=4 2237 B11R1.228 O=C(CS)NC1CONC1=O Amb28128829 [0,1,0,1,0,0|1,0,0]=3 2238 B11R1.266 N#CC1COC[C@H](C(=O)O)N1 Amb18200250 [0,1,0,1,0,0|1,0,1]=4 2239 B11R1.277 CC1NC(=O)C(CO)NC1=O Amb25799598 [0,1,0,1,0,0|1,0,0]=3 2240 B11R1.277 CC1NC(=O)[C@H](CS)NC1=O Amb27617503 [0,1,0,1,0,0|1,1,0]=4 2241 B11R1.277 C[C@@H]1NC(=O)C(CO)NC1=O Amb24394784 [0,1,0,1,0,0|1,0,0]=3 2242 B11R1.277 C[C@@H]1NC(=O)[C@H](CO)NC1=O Amb10844948 [0,1,0,1,0,0|1,0,0]=3 2243 B11R1.277 C[C@H]1NC(=O)[C@H](CO)NC1=O Amb27206014 [0,1,0,1,0,0|1,0,0]=3 2244 B11R1.427 COC(=O)C1CC(=O)C1CO Amb28240362 [0,1,0,1,0,0|2,0,0]=4 2245 B11R1.672 CC(=O)C1OC(=O)C(O)C1O Amb28074805 [0,1,0,1,0,0|2,0,0]=4 2246 B11R1.672 CC1C(C(=O)O)CC(=O)N1C Amb27839647 [0,1,0,1,0,0|2,0,0]=4 2247 B11R1.672 CC1C(C(N)=O)NC(=O)N1C Amb27963078 [0,1,0,1,0,0|2,0,0]=4 2248 B11R1.672 CC1NC(C(=O)O)C(O)C1=O Amb28123093 [0,1,0,1,0,0|0,0,1]=3 2249 B11R1.672 CC1N[C@H](C(=O)O)C(O)C1=O Amb25319073 [0,1,0,1,0,0|0,0,1]=3 2250 B11R1.672 C[C@@H]1N[C@H](C(=O)O)[C@H](O)[C@@H]1O Amb27634870 [0,1,0,1,0,0|0,0,2]=4 2251 B11R1.672 C[C@@H]1[C@@H](C(=O)O)CC(=O)N1C Amb18200021 [0,1,0,1,0,0|2,0,0]=4 2252 B11R1.672 O=C1OC(C(=O)O)C(O)C1O Amb27875078 [0,1,0,1,0,0|1,0,0]=3 2253 B11R1.870 C#CC(=O)N1CCC1C(=O)O Amb27771057 [0,1,0,1,0,0|1,0,1]=4 2254 B11R1.870 C=CC(=O)N1CCC1C(=O)O Amb27442509 [0,1,0,1,0,0|1,0,1]=4 2255 B11R1.870 CCC(=O)N1CCC1C(N)=O Amb33251170 [0,1,0,1,0,0|2,0,0]=4 2256 B11R1.870 CNC(=O)C1CCC1C(=O)O Amb27447635 [0,1,0,1,0,0|2,0,0]=4 2257 B11R1.870 CNC(=O)N1CCC1C(N)=O Amb33251996 [0,1,0,1,0,0|2,0,0]=4 2258 B11R1.870 COC(=O)C1CCC1C(=O)O Amb25844392 [0,1,0,1,0,0|2,0,0]=4 2259 B11R1.870 COC(=O)C1CCN1C(=O)Cl Amb25351297 [0,1,0,1,0,0|2,0,0]=4 2260 B11R1.870 COC(=O)N1CCC1C(=O)O Amb25690182 [0,1,0,1,0,0|1,0,0]=3 2261 B11R1.870 COC(=O)N1CCC1C(N)=O Amb33251997 [0,1,0,1,0,0|2,0,0]=4 2262 B11R1.870 COC(=O)N1CC[C@H]1C(=O)O Amb26481329 [0,1,0,1,0,0|1,0,0]=3 2263 B11R1.870 COC(=O)[C@@H]1CC[C@@H]1C(=O)O Amb23439085 [0,1,0,1,0,0|2,0,0]=4 2264 B11R1.870 COC(=O)[C@@H]1CC[C@H]1C(=O)O Amb26948041 [0,1,0,1,0,0|2,0,0]=4 2265 B11R1.870 COC(=O)[C@H]1CC[C@@H]1C(=O)O Amb28247482 [0,1,0,1,0,0|2,0,0]=4 2266 B11R1.870 COC(=O)[C@H]1CC[C@H]1C(=O)O Amb28138440 [0,1,0,1,0,0|2,0,0]=4 2267 B11R1.870 NC(=O)C1CCN1C(=O)CBr Amb33250977 [0,1,0,1,0,0|2,0,0]=4 2268 B11R1.870 NC(=O)C1CCN1C(=O)CCl Amb25104875 [0,1,0,1,0,0|2,0,0]=4 2269 B11R1.870 NC(=O)C1CCN1C(=O)CS Amb33251984 [0,1,0,1,0,0|2,0,0]=4 2270 B11R1.870 NC(=O)[C@@H]1CCN1C(=O)CCl Amb26480745 [0,1,0,1,0,0|2,0,0]=4 2271 B11R1.870 NCC(=O)N1CCC1C(N)=O Amb33251196 [0,1,0,1,0,0|2,0,0]=4 2272 B11R1.870 O=C(O)C1CCN1C(=O)CCl Amb28240357 [0,1,0,1,0,0|1,0,0]=3 2273 B11R1.870 O=C(O)[C@@H]1CCN1C(=O)CCl Amb26888776 [0,1,0,1,0,0|1,0,0]=3 2274 B11R1.870 O=C(O)[C@@H]1CCN1C(=O)CS Amb27632740 [0,1,0,1,0,0|1,0,0]=3 2275 B11R1.873 COC(=O)[C@@H]1[C@H](C)[C@H]1C(=O)O Amb28320477 [0,1,0,1,0,0|2,0,0]=4 2276 B11R1.873 COC(=O)[C@H]1[C@H](C)[C@H]1C(=O)O Amb25974979 [0,1,0,1,0,0|2,0,0]=4 2277 B11R1.1477 COC(=O)N[C@H]1C(=O)N[C@H]1C Amb27978296 [0,1,0,1,0,0|2,0,0]=4 2278 B11R1.1493 C#CC(=O)NC1(C(=O)O)CC1 Amb28186905 [0,1,0,1,0,0|1,0,1]=4 2279 B11R1.1493 CCC(=O)NC1(C(N)=O)CC1 Amb28256656 [0,1,0,1,0,0|2,0,0]=4 2280 B11R1.1493 CCS(=O)NC1(C(=O)O)CC1 Amb27272539 [0,1,0,1,0,0|2,0,0]=4 2281 B11R1.1493 CNC(=O)CC1(C(=O)O)CC1 Amb24396179 [0,1,0,1,0,0|2,0,0]=4 2282 B11R1.1493 COC(=O)NC1(C(=O)O)CC1 Amb24726240 [0,1,0,1,0,0|1,0,0]=3 2283 B11R1.1493 COC(=O)NC1(C(N)=O)CC1 Amb27749636 [0,1,0,1,0,0|2,0,0]=4 2284 B11R1.1493 NC(=O)C1(NC(=O)CCl)CC1 Amb28365769 [0,1,0,1,0,0|2,0,0]=4 2285 B11R1.8 CCC1NC(=O)CN(C)C1=O Amb25289983 [0,1,0,1,0,0|2,0,0]=4 2286 B11R1.8 CN1CC(=O)N[C@@H](CO)C1=O Amb24486070 [0,1,0,1,0,0|1,0,0]=3 2287 B11R1.8 O=C1NC(=O)C(=O)C(CO)N1 Amb27823140 [0,1,0,1,0,0|1,0,1]=4 2288 B11R1.8 O=C1NC(=O)C(O)=C(CO)N1 Amb26372682 [0,1,0,1,0,0|1,0,1]=4 2289 B11R1.23 CNC(=O)C1CCCC(=O)N1 Amb27981911 [0,1,0,1,0,0|2,0,0]=4 2290 B11R1.23 COC(=O)C1CCCC(=O)C1 Amb33543758 [0,1,0,1,0,0|2,0,0]=4 2291 B11R1.23 COC(=O)C1CCCC(=O)N1 Amb13886339 [0,1,0,1,0,0|1,0,0]=3 2292 B11R1.23 COC(=O)C1CCNC(=O)N1 Amb27596662 [0,1,0,1,0,0|2,0,0]=4 2293 B11R1.23 COC(=O)C1CCOC(=O)N1 Amb25044321 [0,1,0,1,0,0|2,0,0]=4 2294 B11R1.23 COC(=O)C1CNCC(=O)N1 Amb18126111 [0,1,0,1,0,0|1,0,0]=3 2295 B11R1.23 COC(=O)C1COCC(=O)C1 Amb25086714 [0,1,0,1,0,0|1,0,0]=3 2296 B11R1.23 COC(=O)C1COCC(=O)N1 Amb24118077 [0,1,0,1,0,0|0,0,0]=2 2297 B11R1.23 COC(=O)[C@@H]1CC=CC(=O)N1 Amb25734856 [0,1,0,1,0,0|1,0,1]=4 2298 B11R1.23 COC(=O)[C@@H]1CCCC(=O)C1 Amb24486283 [0,1,0,1,0,0|2,0,0]=4 2299 B11R1.23 COC(=O)[C@@H]1CCCC(=O)N1 Amb25375349 [0,1,0,1,0,0|1,0,0]=3 2300 B11R1.23 COC(=O)[C@@H]1CCOC(=O)N1 Amb25785572 [0,1,0,1,0,0|2,0,0]=4 2301 B11R1.23 COC(=O)[C@@H]1CNCC(=O)N1 Amb25759494 [0,1,0,1,0,0|1,0,0]=3 2302 B11R1.23 COC(=O)[C@H]1CC=CC(=O)N1 Amb26419606 [0,1,0,1,0,0|1,0,1]=4 2303 B11R1.23 COC(=O)[C@H]1CCCC(=O)C1 Amb25084961 [0,1,0,1,0,0|2,0,0]=4 2304 B11R1.23 COC(=O)[C@H]1CCCC(=O)N1 Amb27862528 [0,1,0,1,0,0|1,0,0]=3 2305 B11R1.23 COC(=O)[C@H]1CNCC(=O)N1 Amb26632942 [0,1,0,1,0,0|1,0,0]=3 2306 B11R1.23 COC(=O)[C@H]1COC[C@@H](C)N1 Amb33035910 [0,1,0,1,0,0|1,0,1]=4 2307 B11R1.23 COC(=O)[C@H]1CSCC(=O)N1 Amb27879944 [0,1,0,1,0,0|0,1,0]=3 2308 B11R1.23 NNC(=O)C1CCCC(=O)N1 Amb27390167 [0,1,0,1,0,0|2,0,0]=4 2309 B11R1.64 CC(=O)N1CC[C@@H](O)[C@H]1CO Amb27662324 [0,1,0,1,0,0|1,0,1]=4 2310 B11R1.64 CC(=O)N1NC[C@H](O)[C@H]1CO Amb27421986 [0,1,0,1,0,0|1,0,1]=4 2311 B11R1.64 CCC1C(=O)OCN1C(C)=O Amb27645148 [0,1,0,1,0,0|1,0,0]=3 2312 B11R1.64 CC[C@H]1C(=O)OCN1C(C)=O Amb27490878 [0,1,0,1,0,0|1,0,0]=3 2313 B11R1.225 C=C=C(C)[C@H]1NC(=O)C[C@@H]1O Amb27423219 [0,1,0,1,0,0|2,0,0]=4 2314 B11R1.225 COC(=O)C1CC(=O)CC1C Amb27948667 [0,1,0,1,0,0|2,0,0]=4 2315 B11R1.225 COC(=O)C1NC(=O)CC1F Amb27601967 [0,1,0,1,0,0|1,0,0]=3 2316 B11R1.225 COC(=O)C1NC(=O)CC1O Amb27176450 [0,1,0,1,0,0|0,0,0]=2 2317 B11R1.225 COC(=O)C1NC(=O)OC1C Amb27617364 [0,1,0,1,0,0|2,0,0]=4 2318 B11R1.225 COC(=O)C1NC(C)CC1O Amb27176302 [0,1,0,1,0,0|1,0,1]=4 2319 B11R1.225 COC(=O)C1NC(C)C[C@H]1O Amb27394203 [0,1,0,1,0,0|1,0,1]=4 2320 B11R1.225 COC(=O)[C@@H]1NC(=O)C[C@@H]1C Amb27635775 [0,1,0,1,0,0|1,0,0]=3 2321 B11R1.225 COC(=O)[C@@H]1NC(=O)C[C@@H]1F Amb28435001 [0,1,0,1,0,0|1,0,0]=3 2322 B11R1.225 COC(=O)[C@H]1NC(=O)C[C@@H]1F Amb27197202 [0,1,0,1,0,0|1,0,0]=3 2323 B11R1.225 COC(=O)[C@H]1NC(=O)C[C@H]1C Amb27799766 [0,1,0,1,0,0|1,0,0]=3 2324 B11R1.225 COC(=O)[C@H]1NC(=O)C[C@H]1F Amb27452051 [0,1,0,1,0,0|1,0,0]=3 2325 B11R1.225 COC(=O)[C@H]1NC(=O)O[C@@H]1C Amb26425659 [0,1,0,1,0,0|2,0,0]=4 2326 B11R1.225 COC(=O)[C@H]1NC(=O)O[C@H]1C Amb28144756 [0,1,0,1,0,0|2,0,0]=4 2327 B11R1.225 COC(=O)[C@H]1N[C@@H](C)C[C@@H]1O Amb27423798 [0,1,0,1,0,0|1,0,1]=4 2328 B11R1.225 O=CC(O)C1OC(=O)CC1O Amb28253835 [0,1,0,1,0,0|1,0,1]=4 2329 B11R1.313 C=C1C(=O)OC[C@H]1NC(C)=O Amb28068779 [0,1,0,1,0,0|1,0,0]=3 2330 B11R1.495 CC(=O)N[C@@H]1C(O)OC[C@H]1O Amb28319954 [0,1,0,1,0,0|0,0,2]=4 2331 B11R1.495 CC(=O)N[C@H]1C(O)OC[C@H]1O Amb27853879 [0,1,0,1,0,0|0,0,2]=4 2332 B11R1.495 CC(=O)OC1C(=O)COC1C Amb27861230 [0,1,0,1,0,0|2,0,0]=4 2333 B11R1.592 CC(=O)NC1C(=O)N(O)C1C Amb27166549 [0,1,0,1,0,0|1,0,0]=3 2334 B11R1.866 COC(=O)C1COC(C)(C)N1 Amb26004984 [0,1,0,1,0,0|1,0,1]=4 2335 B11R1.866 COC(=O)C1COC(C)(O)N1 Amb27780160 [0,1,0,1,0,0|0,0,2]=4 2336 B11R1.866 COC(=O)[C@@H]1COC(C)(C)N1 Amb26880278 [0,1,0,1,0,0|1,0,1]=4 2337 B11R1.866 COC(=O)[C@@H]1COS(=O)(=O)N1 Amb33078540 [0,1,0,1,0,0|2,0,0]=4 2338 B11R1.884 CCC1(C(=O)OC)CC(=O)O1 Amb28077557 [0,1,0,1,0,0|2,0,0]=4 2339 B11R1.884 COC(=O)C1(CN)CC(=O)C1 Amb26549168 [0,1,0,1,0,0|2,0,0]=4 2340 B11R1.884 COC(=O)C1(CO)CC(=O)N1 Amb27443035 [0,1,0,1,0,0|0,0,0]=2 2341 B11R1.884 COC(=O)[C@@]1(CO)CC(=O)N1 Amb25873293 [0,1,0,1,0,0|0,0,0]=2 2342 B11R1.889 C=C(C)NC1(C(=O)OC)CC1 Amb25979445 [0,1,0,1,0,0|2,0,0]=4 2343 B11R1.889 CC(=O)NC1(\C(N)=N\O)CC1 Amb35676469 [0,1,0,1,0,0|2,0,0]=4 2344 B11R1.72 CN1C(=O)CNC(=O)C1CO Amb27236320 [0,1,0,1,0,0|1,0,0]=3 2345 B11R1.159 CN1C(=O)CCCC1C(=O)O Amb18830654 [0,1,0,1,0,0|1,0,0]=3 2346 B11R1.159 CN1C(=O)COCC1C(=O)O Amb27969427 [0,1,0,1,0,0|0,0,0]=2 2347 B11R1.159 C[C@H]1COC[C@@H](C(=O)O)N1C Amb27883227 [0,1,0,1,0,0|1,0,1]=4 2348 B11R1.673 CN1C(=N)CC(O)[C@H]1C(=O)O Amb25028079 [0,1,0,1,0,0|1,0,0]=3 2349 B11R1.673 C[C@H]1OC(=O)N(C)[C@@H]1C(=O)O Amb27634869 [0,1,0,1,0,0|2,0,0]=4 2350 B11R1.723 CC(=O)C1CCC1(C)C(=O)O Amb25858072 [0,1,0,1,0,0|2,0,0]=4 2351 B11R1.723 CC(=O)[C@@H]1CC[C@]1(C)C(=O)O Amb27409379 [0,1,0,1,0,0|2,0,0]=4 2352 B11R1.723 CC(=O)[C@H]1CC[C@@]1(C)C(=O)O Amb27781464 [0,1,0,1,0,0|2,0,0]=4 2353 B11R1.105 CS(=N)(=O)NC1CONC1=O Amb35695689 [0,1,0,1,0,0|2,0,0]=4 2354 B11R1.105 CS(=N)(=O)N[C@@H]1CONC1=O Amb29851590 [0,1,0,1,0,0|2,0,0]=4 2355 B11R1.105 CS(=O)(=O)N[C@@H]1CONC1=O Amb27260962 [0,1,0,1,0,0|2,0,0]=4 2356 B11R1.488 C[C@H]1OC(C)(C)N[C@@H]1C(=O)O Amb33804202 [0,1,0,1,0,0|1,0,1]=4 2357 B11R1.731 CS(=N)(=O)N1CCC1C(=O)O Amb29851357 [0,1,0,1,0,0|2,0,0]=4 2358 B11R1.731 CS(=O)(=O)N1CCC1C(=O)O Amb27427006 [0,1,0,1,0,0|2,0,0]=4 2359 B11R1.736 CS(=N)(=O)NC1(C(=O)O)CC1 Amb35687761 [0,1,0,1,0,0|2,0,0]=4 2360 B11R1.88 CC(=O)NC1(C)CCOC1=O Amb28130423 [0,1,0,1,0,0|1,0,0]=3 2361 B11R1.88 CC(=O)N[C@@]1(C)CCOC1=O Amb27636933 [0,1,0,1,0,0|1,0,0]=3 2362 B11R1.490 CC1CC(=O)NC1(C)C(N)=O Amb27613221 [0,1,0,1,0,0|2,0,0]=4 2363 B11R1.490 CC1CC(=O)OC1(C)C(=O)O Amb18644983 [0,1,0,1,0,0|2,0,0]=4 2364 B11R1.490 NC(=O)C1(O)NC(=O)NC1O Amb28195085 [0,1,0,1,0,0|2,0,0]=4 2365 B11R1.667 CC1(C(N)=O)CCCC(=O)N1 Amb27860558 [0,1,0,1,0,0|2,0,0]=4 2366 B11R1.667 C[C@@]1(C(=O)O)CCCC(=O)C1 Amb25138624 [0,1,0,1,0,0|2,0,0]=4 2367 B11R1.667 NC1(C(=O)O)CCCC(=O)C1 Amb23560233 [0,1,0,1,0,0|2,0,0]=4 2368 B11R1.667 O=C1CCCC(O)(C(=O)O)O1 Amb27760512 [0,1,0,1,0,0|2,0,0]=4 2369 B11R1.1052 CCC1(C)NC(=O)CNC1=O Amb25141715 [0,1,0,1,0,0|2,0,0]=4 2370 B11R1.1152 CC(CO)(NC1CC1)C(=O)O Amb27269508 [0,1,0,1,0,0|1,0,1]=4 2371 B11R1.584 CC(=O)NC1C(=O)SC1(C)C Amb3483317 [0,1,0,1,0,0|1,1,0]=4 2372 B11R1.489 CC1(C)CC(=O)CC1C(=O)O Amb27408973 [0,1,0,1,0,0|2,0,0]=4 2373 B11R1.489 CC1(C)CC(=O)NC1C(=O)O Amb18126047 [0,1,0,1,0,0|1,0,0]=3 2374 B11R1.489 CC1(C)CC(=O)N[C@@H]1C(=O)O Amb24551055 [0,1,0,1,0,0|1,0,0]=3 2375 B11R1.489 CC1(C)SC(=O)N[C@@H]1C(=O)O Amb27231722 [0,1,0,1,0,0|2,0,0]=4 2376 B11R1.581 CC(C)C1(C(=O)O)CC(=O)C1 Amb24651079 [0,1,0,1,0,0|2,0,0]=4 2377 B11R1.581 CC(O)C1(C(=O)O)CC(=O)C1 Amb24552967 [0,1,0,1,0,0|1,0,0]=3 2378 B11R1.581 O=C1CC(C(=O)O)(C(=O)O)C1 Amb25363428 [0,1,0,1,0,0|1,0,1]=4 2379 B11R1.581 O=C1CC(C(=O)O)(C(=O)O)N1 Amb25274417 [0,1,0,1,0,0|0,0,1]=3 2380 B11R1.581 O=C1CC(C(=O)O)(C(F)F)C1 Amb32811486 [0,1,0,1,0,0|2,0,0]=4 2381 B11R1.732 CC(=O)C1C(C(=O)O)C1(C)C Amb27232878 [0,1,0,1,0,0|2,0,0]=4 2382 B11R1.732 CC(=O)[C@@H]1[C@@H](C(=O)O)C1(C)C Amb27229293 [0,1,0,1,0,0|2,0,0]=4 2383 B11R1.732 CC(=O)[C@H]1[C@H](C(=O)O)C1(C)C Amb27776755 [0,1,0,1,0,0|2,0,0]=4 2384 B11R2.47 O=C1NC2CCC1NC2=O Amb27801415 [0,0,0,2,0,0|2,0,0]=4 2385 B11R2.47 O=C1N[C@@H]2CC[C@H]1NC2=O Amb26440040 [0,0,0,2,0,0|2,0,0]=4 2386 B11R2.207 O=C1NCC(=O)N2CCC12 Amb27832016 [0,0,0,2,0,0|2,0,0]=4 2387 B11R2.208 O=C1CNC(=O)C2(CC2)N1 Amb22264431 [0,0,0,2,0,0|2,0,0]=4 2388 B11R2.104 O=C1CN2C(=O)CCC[C@H]12 Amb28246588 [0,0,0,2,0,0|2,0,0]=4 2389 B11R2.66 O=C1CC2CNC(=O)C2N1 Amb27976247 [0,0,0,2,0,0|2,0,0]=4 2390 B11R2.66 O=C1C[C@@H]2C(=O)OC[C@@H]2C1 Amb27631333 [0,0,0,2,0,0|2,0,0]=4 2391 B11R2.411 O=C1CC2CC2(C(=O)O)N1 Amb24480704 [0,0,0,2,0,0|1,0,0]=3 2392 B11R2.411 O=C1C[C@@H]2C[C@]2(C(=O)Cl)N1 Amb28194285 [0,0,0,2,0,0|2,0,0]=4 2393 B11R2.411 O=C1C[C@@H]2C[C@]2(C(=O)O)N1 Amb27784689 [0,0,0,2,0,0|1,0,0]=3 2394 B11R2.612 O=C1N[C@@H](C(=O)O)[C@H]2C[C@@H]12 Amb35752797 [0,0,0,2,0,0|1,0,0]=3 2395 B11R2.530 O=C(O)C1C2CCC(=O)C21 Amb25263963 [0,0,0,2,0,0|2,0,0]=4 2396 B11R2.530 O=C(O)[C@@H]1[C@H]2C(=O)CC[C@@H]12 Amb25970058 [0,0,0,2,0,0|2,0,0]=4 2397 B11R2.530 O=C(O)[C@@H]1[C@H]2CCC(=O)[C@H]21 Amb25174904 [0,0,0,2,0,0|2,0,0]=4 2398 B7R0.16 C=C(C)C(C)C(=O)O Amb18641781 [1,0,0,0,1,0|1,0,0]=3 2399 B7R0.16 C=C(C)C(C)C(N)=O Amb26327976 [1,0,0,0,1,0|2,0,0]=4 2400 B7R0.16 C=C(C)C(N)C(=O)O Amb18641831 [1,0,0,0,1,0|2,0,0]=4 2401 B7R0.16 C=C(C)C(O)C(=O)O Amb27859701 [1,0,0,0,1,0|1,0,0]=3 2402 B7R0.16 C=C(C)C(O)C(N)=O Amb28123135 [1,0,0,0,1,0|2,0,0]=4 2403 B7R0.16 C=C(C)[C@@H](N)C(=O)O Amb26012631 [1,0,0,0,1,0|2,0,0]=4 2404 B7R0.16 C=C(C)[C@@H](O)C(=O)O Amb28071409 [1,0,0,0,1,0|1,0,0]=3 2405 B7R0.16 CC(=N)C(C)C(C)=O Amb28315572 [1,0,0,0,1,0|2,0,0]=4 2406 B7R0.16 CC(=O)C(=O)C(=O)O Amb24101563 [1,0,0,0,1,0|0,0,2]=4 2407 B7R0.16 CC(=O)C(Br)C(C)=O Amb22000680 [1,0,0,0,1,0|2,0,0]=4 2408 B7R0.16 CC(=O)C(C)C(=O)Cl Amb27971652 [1,0,0,0,1,0|1,0,0]=3 2409 B7R0.16 CC(=O)C(C)C(=S)S Amb27261425 [1,0,0,0,1,0|0,2,0]=4 2410 B7R0.16 CC(=O)C(C)C(C)=O Amb1152249 [1,0,0,0,1,0|1,0,0]=3 2411 B7R0.16 CC(=O)C(C)C(C)O Amb17593202 [1,0,0,0,1,0|1,0,1]=4 2412 B7R0.16 CC(=O)C(C)[C@@H](C)O Amb28316228 [1,0,0,0,1,0|1,0,1]=4 2413 B7R0.16 CC(=O)C(Cl)C(C)=O Amb3940505 [1,0,0,0,1,0|2,0,0]=4 2414 B7R0.16 CC(=O)C(N)C(=O)O Amb21962887 [1,0,0,0,1,0|1,0,0]=3 2415 B7R0.16 CC(=O)C(N)C(C)=O Amb18632931 [1,0,0,0,1,0|2,0,0]=4 2416 B7R0.16 CC(=O)C(N)C(C)=O Amb6893881 [1,0,0,0,1,0|2,0,0]=4 2417 B7R0.16 CC(=O)C(O)C(C)=O Amb28048968 [1,0,0,0,1,0|1,0,0]=3 2418 B7R0.16 CC(=O)C(O)C(C)O Amb26597030 [1,0,0,0,1,0|1,0,1]=4 2419 B7R0.16 CC(=O)N(C)C(=O)Cl Amb33338974 [1,0,0,0,1,0|2,0,0]=4 2420 B7R0.16 CC(=O)N(C)C(C)=O Amb2720846 [1,0,0,0,1,0|2,0,0]=4 2421 B7R0.16 CC(=O)N(O)C(C)=O Amb22750106 [1,0,0,0,1,0|2,0,0]=4 2422 B7R0.16 CC(=O)[C@@H](C)[C@H](C)O Amb26966954 [1,0,0,0,1,0|1,0,1]=4 2423 B7R0.16 CC(=O)[C@@H](O)[C@@H](C)O Amb24481484 [1,0,0,0,1,0|1,0,1]=4 2424 B7R0.16 CC(=O)[C@@H](O)[C@H](C)O Amb28045145 [1,0,0,0,1,0|1,0,1]=4 2425 B7R0.16 CC(=O)[C@H](C)[C@H](C)O Amb28249967 [1,0,0,0,1,0|1,0,1]=4 2426 B7R0.16 CC(=O)[C@H](O)[C@@H](C)O Amb24701454 [1,0,0,0,1,0|1,0,1]=4 2427 B7R0.16 CC(=S)C(S)C(=O)O Amb27791825 [1,0,0,0,1,0|0,2,0]=4 2428 B7R0.16 CC(C(=O)O)C(=O)O Amb6600127 [1,0,0,0,1,0|1,0,0]=3 2429 B7R0.16 CC(C(=O)O)N(C)C Amb21955631 [1,0,0,0,1,0|2,0,0]=4 2430 B7R0.16 CC(C(=O)O)N(C)C Amb6653762 [1,0,0,0,1,0|2,0,0]=4 2431 B7R0.16 CC(C(=O)O)N(C)N Amb22372039 [1,0,0,0,1,0|2,0,0]=4 2432 B7R0.16 CC(C(N)=O)C(=O)O Amb27401562 [1,0,0,0,1,0|1,0,0]=3 2433 B7R0.16 CC(C(N)=O)C(N)=O Amb4034611 [1,0,0,0,1,0|2,0,0]=4 2434 B7R0.16 CC(C)=C(C)C(=O)O Amb17593186 [1,0,0,0,1,0|1,0,1]=4 2435 B7R0.16 CC(C)C(C)C(=O)O Amb17087469 [1,0,0,0,1,0|1,0,1]=4 2436 B7R0.16 CC(C)C(O)C(=O)O Amb2582547 [1,0,0,0,1,0|1,0,1]=4 2437 B7R0.16 CC(C)[C@@H](C)C(=O)O Amb10844600 [1,0,0,0,1,0|1,0,1]=4 2438 B7R0.16 CC(C)[C@@H](O)C(=O)O Amb10071589 [1,0,0,0,1,0|1,0,1]=4 2439 B7R0.16 CC(C)[C@H](C)C(=O)O Amb10844601 [1,0,0,0,1,0|1,0,1]=4 2440 B7R0.16 CC(C)[C@H](O)C(=O)O Amb2694861 [1,0,0,0,1,0|1,0,1]=4 2441 B7R0.16 CC(Cl)C(C)C(=O)O Amb28325096 [1,0,0,0,1,0|1,0,1]=4 2442 B7R0.16 CC(N)C(C)C(=O)O Amb18124261 [1,0,0,0,1,0|1,0,1]=4 2443 B7R0.16 CC(N)C(C)C(=O)O Amb28934866 [1,0,0,0,1,0|1,0,1]=4 2444 B7R0.16 CC(N)C(O)C(=O)O Amb18641970 [1,0,0,0,1,0|1,0,1]=4 2445 B7R0.16 CC(N)C(O)C(=O)O Amb33299223 [1,0,0,0,1,0|1,0,1]=4 2446 B7R0.16 CC(O)C(C)C(=O)O Amb17615515 [1,0,0,0,1,0|0,0,2]=4 2447 B7R0.16 CC(O)C(O)C(=O)O Amb18124272 [1,0,0,0,1,0|0,0,2]=4 2448 B7R0.16 CN(C)C(O)C(=O)O Amb28399618 [1,0,0,0,1,0|2,0,0]=4 2449 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb22587534 [1,0,0,0,1,0|2,0,0]=4 2450 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb28934882 [1,0,0,0,1,0|2,0,0]=4 2451 B7R0.16 C[C@@H](N)[C@@H](C)C(=O)O Amb25679842 [1,0,0,0,1,0|1,0,1]=4 2452 B7R0.16 C[C@@H](O)[C@@H](O)C(=O)O Amb27812084 [1,0,0,0,1,0|0,0,2]=4 2453 B7R0.16 C[C@H](C(=O)O)N(C)C Amb22586633 [1,0,0,0,1,0|2,0,0]=4 2454 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O Amb10844572 [1,0,0,0,1,0|0,0,2]=4 2455 B7R0.16 C[C@H](N)[C@@H](C)C(=O)O Amb26887656 [1,0,0,0,1,0|1,0,1]=4 2456 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O Amb27751951 [1,0,0,0,1,0|1,0,1]=4 2457 B7R0.16 C[C@H](O)[C@@H](O)C(=O)O Amb25844932 [1,0,0,0,1,0|0,0,2]=4 2458 B7R0.16 C[C@H](O)[C@H](C)C(=O)O Amb27440373 [1,0,0,0,1,0|0,0,2]=4 2459 B7R0.16 C[C@H](O)[C@H](O)C(=O)O Amb27831803 [1,0,0,0,1,0|0,0,2]=4 2460 B7R0.16 C[PH](=O)C(O)C(=O)O Amb34916646 [1,0,0,0,1,0|1,0,0]=3 2461 B7R0.16 C\C(Br)=C(/C)C(=O)O Amb2611697 [1,0,0,0,1,0|1,0,1]=4 2462 B7R0.16 C\C(O)=C(\O)C(=O)O Amb28282804 [1,0,0,0,1,0|0,0,2]=4 2463 B7R0.16 NC(=O)C(O)C(N)=O Amb27212957 [1,0,0,0,1,0|2,0,0]=4 2464 B7R0.16 NC(=O)[C@H](N)C(=O)O Amb28397054 [1,0,0,0,1,0|2,0,0]=4 2465 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [1,0,0,0,1,0|2,0,0]=4 2466 B7R0.16 O=C(O)C(Br)C(=O)O Amb17594708 [1,0,0,0,1,0|2,0,0]=4 2467 B7R0.16 O=C(O)C(F)C(=O)O Amb24055884 [1,0,0,0,1,0|2,0,0]=4 2468 B7R0.16 O=C(O)C(O)C(=O)O Amb1215315 [1,0,0,0,1,0|1,0,0]=3 2469 B7R0.16 O=C(O)C(S)C(=O)O Amb28346986 [1,0,0,0,1,0|1,1,0]=4 2470 B9R0.43 C=CC(CO)COC(C)=O Amb28400888 [1,0,0,0,0,1|2,0,0]=4 2471 B9R0.43 CC(=O)OCC(CO)CO Amb27839393 [1,0,0,0,0,1|1,0,1]=4 2472 B9R0.43 CCC(C=O)CCC(C)=O Amb18643911 [1,0,0,0,0,1|2,0,0]=4 2473 B9R0.43 CCC(C=O)COC(C)=O Amb28321979 [1,0,0,0,0,1|2,0,0]=4 2474 B9R0.43 CC[C@H](C=O)CCC(C)=O Amb24573990 [1,0,0,0,0,1|2,0,0]=4 2475 B9R0.7 C=C(Br)CNC(C)C(=O)O Amb18303282 [1,0,0,0,0,1|1,0,1]=4 2476 B9R0.7 C=C(Br)CN[C@@H](C)C(=O)O Amb27174841 [1,0,0,0,0,1|1,0,1]=4 2477 B9R0.7 C=C(C)CCC(C)C(=O)O Amb25809141 [1,0,0,0,0,1|2,0,0]=4 2478 B9R0.7 C=C(C)CCC(O)C(=O)O Amb27436256 [1,0,0,0,0,1|2,0,0]=4 2479 B9R0.7 C=C(C)CSC(C)C(=O)O Amb6263518 [1,0,0,0,0,1|2,0,0]=4 2480 B9R0.7 CC(=O)CCC(N)C(=O)O Amb20669473 [1,0,0,0,0,1|2,0,0]=4 2481 B9R0.7 CC(=O)CCC(N)C(=O)O Amb22157242 [1,0,0,0,0,1|2,0,0]=4 2482 B9R0.7 CC(=O)CC[C@@H](N)C(=O)O Amb26516732 [1,0,0,0,0,1|2,0,0]=4 2483 B9R0.7 CC(=O)CC[C@H](N)C(=O)O Amb25147501 [1,0,0,0,0,1|2,0,0]=4 2484 B9R0.7 CC(=O)CNC(=O)C(=O)O Amb24480846 [1,0,0,0,0,1|0,0,2]=4 2485 B9R0.7 CC(=O)CSC(C)C(=O)O Amb17501621 [1,0,0,0,0,1|1,0,0]=3 2486 B9R0.7 CC(=O)CSC(C)C(N)=O Amb27949123 [1,0,0,0,0,1|2,0,0]=4 2487 B9R0.7 CC(=O)NCC(C)S(C)=O Amb28137643 [1,0,0,0,0,1|2,0,0]=4 2488 B9R0.7 CC(=O)NCC(N)C(=O)O Amb26046380 [1,0,0,0,0,1|1,0,0]=3 2489 B9R0.7 CC(=O)NC[C@H](C)C(=O)O Amb27472985 [1,0,0,0,0,1|0,0,0]=2 2490 B9R0.7 CC(=O)NOC(C)C(N)=O Amb28206966 [1,0,0,0,0,1|1,0,0]=3 2491 B9R0.7 CC(=O)OCC(C)C(=O)O Amb28050166 [1,0,0,0,0,1|1,0,0]=3 2492 B9R0.7 CC(=O)OCC(C)C(C)=O Amb27471984 [1,0,0,0,0,1|2,0,0]=4 2493 B9R0.7 CC(=O)OCC(N)C(=O)O Amb17593668 [1,0,0,0,0,1|2,0,0]=4 2494 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O Amb2699176 [1,0,0,0,0,1|2,0,0]=4 2495 B9R0.7 CC(=O)OC[C@@H]([NH3+])C(=O)O Amb3499386 [1,0,0,0,0,1|2,0,0]=4 2496 B9R0.7 CC(=O)OC[C@H](C)C(=O)O Amb28340504 [1,0,0,0,0,1|1,0,0]=3 2497 B9R0.7 CC(=O)OC[C@H](C)C(C)=O Amb28049898 [1,0,0,0,0,1|2,0,0]=4 2498 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb2778750 [1,0,0,0,0,1|2,0,0]=4 2499 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb33757552 [1,0,0,0,0,1|2,0,0]=4 2500 B9R0.7 CC(=O)ONC(C)C(=O)O Amb27765574 [1,0,0,0,0,1|0,0,0]=2 2501 B9R0.7 CC(=O)O\N=C(/C)C(=O)O Amb27473311 [1,0,0,0,0,1|0,0,2]=4 2502 B9R0.7 CC(=O)SCC(C)C(=O)O Amb2732386 [1,0,0,0,0,1|1,0,0]=3 2503 B9R0.7 CC(=O)SCC(C)C(N)=O Amb22586594 [1,0,0,0,0,1|2,0,0]=4 2504 B9R0.7 CC(=O)SCC(N)C(=O)O Amb22490452 [1,0,0,0,0,1|2,0,0]=4 2505 B9R0.7 CC(=O)SCC(O)C(=O)O Amb31030973 [1,0,0,0,0,1|1,0,0]=3 2506 B9R0.7 CC(=O)SC[C@@H](C)C(=O)Cl Amb26641827 [1,0,0,0,0,1|2,0,0]=4 2507 B9R0.7 CC(=O)SC[C@@H](C)C(=O)O Amb8628177 [1,0,0,0,0,1|1,0,0]=3 2508 B9R0.7 CC(=O)SC[C@H](C)C(=O)Cl Amb25230202 [1,0,0,0,0,1|2,0,0]=4 2509 B9R0.7 CC(C)=CCC(C)C(=O)O Amb18643879 [1,0,0,0,0,1|2,0,0]=4 2510 B9R0.7 CC(C)=NOC(C)C(=O)O Amb9814220 [1,0,0,0,0,1|1,0,1]=4 2511 B9R0.7 CC(C)=NO[C@H](C)C(=O)O Amb27831924 [1,0,0,0,0,1|1,0,1]=4 2512 B9R0.7 CC(C)CNC(C)C(=O)O Amb9326958 [1,0,0,0,0,1|1,0,1]=4 2513 B9R0.7 CC(C)CN[C@@H](C)C(=O)O Amb27872965 [1,0,0,0,0,1|1,0,1]=4 2514 B9R0.7 CC(C)NCC(C)C(=O)O Amb9400283 [1,0,0,0,0,1|1,0,1]=4 2515 B9R0.7 CC(CCC(=O)O)C(=O)O Amb6296609 [1,0,0,0,0,1|2,0,0]=4 2516 B9R0.7 CC(CCS(C)=O)C(=O)O Amb27237254 [1,0,0,0,0,1|2,0,0]=4 2517 B9R0.7 CC(CNC(=N)N)C(=O)O Amb28050103 [1,0,0,0,0,1|2,0,0]=4 2518 B9R0.7 CC(CNC(N)=O)C(=O)O Amb18298054 [1,0,0,0,0,1|1,0,0]=3 2519 B9R0.7 CC(CNN(C)C)C(=O)O Amb27855116 [1,0,0,0,0,1|2,0,0]=4 2520 B9R0.7 CC(NCC(=O)O)C(=O)O Amb26506272 [1,0,0,0,0,1|1,0,0]=3 2521 B9R0.7 CC(NCC(=O)O)C(=O)O Amb3427836 [1,0,0,0,0,1|1,0,0]=3 2522 B9R0.7 CC(NCC(=O)O)C(N)=O Amb9285399 [1,0,0,0,0,1|2,0,0]=4 2523 B9R0.7 CC(NC[C@@H](C)O)C(=O)O Amb27617222 [1,0,0,0,0,1|0,0,2]=4 2524 B9R0.7 CC(NC[C@H](C)O)C(=O)O Amb27248684 [1,0,0,0,0,1|0,0,2]=4 2525 B9R0.7 CC(NNC(N)=O)C(=O)O Amb26391983 [1,0,0,0,0,1|1,0,0]=3 2526 B9R0.7 CC(O)CNC(C)C(=O)O Amb18523859 [1,0,0,0,0,1|0,0,2]=4 2527 B9R0.7 CC(O)CN[C@H](C)C(=O)O Amb28246243 [1,0,0,0,0,1|0,0,2]=4 2528 B9R0.7 CC(SCC(=O)O)C(=O)O Amb2431034 [1,0,0,0,0,1|2,0,0]=4 2529 B9R0.7 CS(=O)CCC(O)C(=O)O Amb28118981 [1,0,0,0,0,1|2,0,0]=4 2530 B9R0.7 CS(=O)NCC(N)C(=O)O Amb28122995 [1,0,0,0,0,1|2,0,0]=4 2531 B9R0.7 C[C@@H](CCC(=O)O)C(=O)O Amb22799543 [1,0,0,0,0,1|2,0,0]=4 2532 B9R0.7 C[C@@H](CNC(N)=O)C(=O)O Amb10844047 [1,0,0,0,0,1|1,0,0]=3 2533 B9R0.7 C[C@@H](N)CN[C@H](C)C(=O)O Amb27646700 [1,0,0,0,0,1|1,0,1]=4 2534 B9R0.7 C[C@@H](NCC(=O)O)C(=O)O Amb22748947 [1,0,0,0,0,1|1,0,0]=3 2535 B9R0.7 C[C@H](CCC(=O)O)C(=O)O Amb22225175 [1,0,0,0,0,1|2,0,0]=4 2536 B9R0.7 C[C@H](CNC(N)=O)C(=O)O Amb27235917 [1,0,0,0,0,1|1,0,0]=3 2537 B9R0.7 C[C@H](N)CN[C@H](C)C(=O)O Amb27445282 [1,0,0,0,0,1|1,0,1]=4 2538 B9R0.7 C[C@H](NCC(=O)O)C(=O)O Amb25133540 [1,0,0,0,0,1|1,0,0]=3 2539 B9R0.7 C[C@H](NCC(=O)O)C(=O)O Amb33803333 [1,0,0,0,0,1|1,0,0]=3 2540 B9R0.7 C[C@H](NCC(=O)O)C(N)=O Amb27771293 [1,0,0,0,0,1|2,0,0]=4 2541 B9R0.7 C\C(=N/NC(N)=O)C(=O)O Amb9901909 [1,0,0,0,0,1|1,0,1]=4 2542 B9R0.7 N=C(N)NCC(O)C(=O)O Amb27229727 [1,0,0,0,0,1|2,0,0]=4 2543 B9R0.7 NC(=O)NCC(F)C(=O)O Amb17610485 [1,0,0,0,0,1|2,0,0]=4 2544 B9R0.7 NC(=O)NCC(N)C(=O)O Amb4037018 [1,0,0,0,0,1|2,0,0]=4 2545 B9R0.7 NC(=O)NCC(O)C(=O)O Amb27464106 [1,0,0,0,0,1|1,0,0]=3 2546 B9R0.7 NC(=O)NCC(O)C(N)=O Amb28384014 [1,0,0,0,0,1|2,0,0]=4 2547 B9R0.7 NC(=O)NC[C@@H](N)C(=O)O Amb10068479 [1,0,0,0,0,1|2,0,0]=4 2548 B9R0.7 NC(=O)NC[C@H](N)C(=O)O Amb6298794 [1,0,0,0,0,1|2,0,0]=4 2549 B9R0.7 O=C(O)CCC(O)C(=O)O Amb18124864 [1,0,0,0,0,1|2,0,0]=4 2550 B9R0.7 O=C(O)CC[C@@H](O)C(=O)O Amb22799690 [1,0,0,0,0,1|2,0,0]=4 2551 B9R0.7 O=C(O)CC[C@H](O)C(=O)O Amb25948742 [1,0,0,0,0,1|2,0,0]=4 2552 B9R0.53 CC(=O)CC(C)OC(N)=O Amb27196213 [1,0,0,0,0,1|2,0,0]=4 2553 B9R0.53 CC(=O)C[C@@H](C)CC(=O)O Amb27881969 [1,0,0,0,0,1|1,0,0]=3 2554 B9R0.53 CC(=O)C[C@H](C)OC(C)=O Amb25863249 [1,0,0,0,0,1|2,0,0]=4 2555 B9R0.53 CC(=O)NC(=O)CC(=O)O Amb24671240 [1,0,0,0,0,1|0,0,2]=4 2556 B9R0.53 CC(=O)NC(C)CC(=O)O Amb9007551 [1,0,0,0,0,1|0,0,0]=2 2557 B9R0.53 CC(=O)NC(C)CC(N)=O Amb27454423 [1,0,0,0,0,1|1,0,0]=3 2558 B9R0.53 CC(=O)NC(C)CC(N)=S Amb18800429 [1,0,0,0,0,1|1,1,0]=4 2559 B9R0.53 CC(=O)NC(C)CS(C)=O Amb27243706 [1,0,0,0,0,1|2,0,0]=4 2560 B9R0.53 CC(=O)NC(C)NC(C)=O Amb4035096 [1,0,0,0,0,1|1,0,0]=3 2561 B9R0.53 CC(=O)NN(C)CC(=O)O Amb24430379 [1,0,0,0,0,1|1,0,0]=3 2562 B9R0.53 CC(=O)N[C@@H](C)CC(=O)O Amb2372568 [1,0,0,0,0,1|0,0,0]=2 2563 B9R0.53 CC(=O)OC(C)OC(C)=O Amb8516628 [1,0,0,0,0,1|2,0,0]=4 2564 B9R0.53 CC(=O)O[C@@H](C)CC(=O)O Amb28340506 [1,0,0,0,0,1|1,0,0]=3 2565 B9R0.53 CC(=O)SC(C)CC(=O)O Amb4014288 [1,0,0,0,0,1|1,0,0]=3 2566 B9R0.53 CC(C)NC(C)CC(=O)O Amb9398367 [1,0,0,0,0,1|1,0,1]=4 2567 B9R0.53 CC(CC(=O)O)CC(=O)O Amb2782854 [1,0,0,0,0,1|2,0,0]=4 2568 B9R0.53 CC(CC(=O)O)NC(=N)N Amb25696242 [1,0,0,0,0,1|2,0,0]=4 2569 B9R0.53 CC(CC(=O)O)NC(N)=O Amb9018480 [1,0,0,0,0,1|1,0,0]=3 2570 B9R0.53 CC(CC(=O)O)NN(C)C Amb28317947 [1,0,0,0,0,1|2,0,0]=4 2571 B9R0.53 C[C@@H](CC(N)=O)CC(=O)O Amb27404517 [1,0,0,0,0,1|2,0,0]=4 2572 B9R0.53 O=C(O)CC(O)CC(=O)O Amb17615401 [1,0,0,0,0,1|2,0,0]=4 2573 B11R0.143 CC(=O)NC[C@@H](CCl)OC(C)=O Amb8394729 [0,0,0,0,0,2|2,0,0]=4 2574 B11R0.143 CC(=O)NC[C@H](CBr)OC(C)=O Amb10071005 [0,0,0,0,0,2|2,0,0]=4 2575 B11R0.143 CC(=O)N\C(=C\CC(=O)O)CS Amb27191772 [0,0,0,0,0,2|0,1,1]=4 2576 B11R0.143 CC(=O)OCC(CO)OC(C)=O Amb19960032 [0,0,0,0,0,2|2,0,0]=4 2577 B11R0.143 CC(=O)OCC(CO)OC(C)=O Amb33987901 [0,0,0,0,0,2|2,0,0]=4 2578 B11R0.273 CCC(NCCC(C)=O)C(=O)O Amb32675830 [0,0,0,0,0,2|1,0,0]=3