0 B9R1.35 C=C(C)C1CCC(O)C1 Amb27807267 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.35 C=C(C)[C@@H]1CC[C@H](O)C1 Amb27857420 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.35 C=C(C)[C@H]1COC(O)C1 Amb27956635 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.35 C=C(C)[C@H]1C[C@H](O)CO1 Amb28401070 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.35 C=C1CCC(C(=O)O)C1 Amb28369274 [0,0,0,0,0,0|2,0,1]=3 5 B9R1.35 C=C1CCC(C(C)=O)C1 Amb27476121 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.35 C=C1CNC(C(N)=O)C1 Amb27640101 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.35 C=C1CN[C@@H](C(=O)O)C1 Amb27795857 [0,0,0,0,0,0|1,0,1]=2 8 B9R1.35 C=C1CN[C@H](C(=O)O)C1 Amb27400250 [0,0,0,0,0,0|1,0,1]=2 9 B9R1.35 CC(=O)C1=CCC(N)C1 Amb35741226 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.35 CC(=O)C1C=CC(N)C1 Amb25889700 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.35 CC(=O)C1CC(C)CO1 Amb27780018 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.35 CC(=O)C1CCC(=O)C1 Amb24423910 [0,0,0,0,0,0|2,0,2]=4 13 B9R1.35 CC(=O)C1CCC(N)C1 Amb27960182 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.35 CC(=O)C1CCC(N)C1 Amb33447083 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.35 CC(=O)C1CCC(O)O1 Amb27838664 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.35 CC(=O)C1CCN(C)C1 Amb27829019 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.35 CC(=O)C1CC[C@@H](C)O1 Amb33423868 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.35 CC(=O)C1CC[C@H](C)C1 Amb27261938 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.35 CC(=O)C1SCC(C)S1 Amb24676738 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.35 CC(=O)N1CCC(F)C1 Amb35614292 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.35 CC(=O)N1CCC(N)C1 Amb17739841 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.35 CC(=O)N1CCC(N)C1 Amb33549525 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.35 CC(=O)N1CCC(O)C1 Amb20622704 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.35 CC(=O)N1CC[C@@H](Br)C1 Amb22227483 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.35 CC(=O)N1CC[C@@H](Cl)C1 Amb22227481 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.35 CC(=O)N1CC[C@@H](I)C1 Amb22227495 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.35 CC(=O)N1CC[C@@H](N)C1 Amb19891343 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.35 CC(=O)N1CC[C@@H](N)C1 Amb22227487 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.35 CC(=O)N1CC[C@@H](O)C1 Amb17935744 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.35 CC(=O)N1CC[C@H](Cl)C1 Amb22227524 [0,0,0,0,0,0|4,0,0]=4 31 B9R1.35 CC(=O)N1CC[C@H](I)C1 Amb22227531 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.35 CC(=O)N1CC[C@H](N)C1 Amb19890016 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.35 CC(=O)N1CC[C@H](N)C1 Amb22227520 [0,0,0,0,0,0|4,0,0]=4 34 B9R1.35 CC(=O)N1CC[C@H](O)C1 Amb17935745 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.35 CC(=O)N1C[C@@H](O)CO1 Amb27956502 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.35 CC(=O)[C@@H]1CCC(=O)C1 Amb24407171 [0,0,0,0,0,0|2,0,2]=4 37 B9R1.35 CC(=O)[C@@H]1CC[C@@H](C)C1 Amb27861348 [0,0,0,0,0,0|3,0,0]=3 38 B9R1.35 CC(=O)[C@@H]1CC[C@H](C)C1 Amb27861349 [0,0,0,0,0,0|3,0,0]=3 39 B9R1.35 CC(=O)[C@@H]1CC[C@H](C)O1 Amb26958731 [0,0,0,0,0,0|4,0,0]=4 40 B9R1.35 CC(=O)[C@H]1CCC(=O)C1 Amb26590768 [0,0,0,0,0,0|2,0,2]=4 41 B9R1.35 CC(C)=C1CCC(O)C1 Amb27956597 [0,0,0,0,0,0|3,0,1]=4 42 B9R1.35 CC(C)C1CC(O)CN1 Amb27162965 [0,0,0,0,0,0|2,0,1]=3 43 B9R1.35 CC(C)C1CC(O)CO1 Amb35700372 [0,0,0,0,0,0|3,0,1]=4 44 B9R1.35 CC(C)[C@H]1CC[C@H](O)C1 Amb28292198 [0,0,0,0,0,0|3,0,1]=4 45 B9R1.35 CC(C)[C@H]1C[C@H](F)CN1 Amb27818080 [0,0,0,0,0,0|3,0,1]=4 46 B9R1.35 CC(O)C1CC(F)CN1 Amb23536931 [0,0,0,0,0,0|2,0,1]=3 47 B9R1.35 CC(O)C1CCC(N)C1 Amb35582009 [0,0,0,0,0,0|3,0,1]=4 48 B9R1.35 CC(O)[C@@H]1CC[C@H](O)O1 Amb27853826 [0,0,0,0,0,0|3,0,1]=4 49 B9R1.35 CC(O)[C@@H]1C[C@H](N)CO1 Amb28429637 [0,0,0,0,0,0|3,0,1]=4 50 B9R1.35 CC1=CC(C(=O)O)NC1 Amb27751727 [0,0,0,0,0,0|1,0,2]=3 51 B9R1.35 CC1=CC(C(=O)O)SC1 Amb10809142 [0,0,0,0,0,0|2,0,2]=4 52 B9R1.35 CC1=NC(C(=O)O)CC1 Amb23438203 [0,0,0,0,0,0|3,0,1]=4 53 B9R1.35 CC1=NC(C(=O)O)CC1 Amb32409643 [0,0,0,0,0,0|3,0,1]=4 54 B9R1.35 CC1=NOC(C(=O)O)C1 Amb7088977 [0,0,0,0,0,0|3,0,1]=4 55 B9R1.35 CC1=NO[C@H](C(=O)O)C1 Amb25189709 [0,0,0,0,0,0|3,0,1]=4 56 B9R1.35 CC1=N[C@H](C(=O)O)CC1 Amb27455557 [0,0,0,0,0,0|3,0,1]=4 57 B9R1.35 CC1C=C(C(=O)O)CC1 Amb18642397 [0,0,0,0,0,0|2,0,2]=4 58 B9R1.35 CC1C=CC(C(=O)O)O1 Amb18642586 [0,0,0,0,0,0|3,0,1]=4 59 B9R1.35 CC1CC(C(=O)O)=NO1 Amb25694020 [0,0,0,0,0,0|2,0,2]=4 60 B9R1.35 CC1CC(C(=O)O)CN1 Amb18832566 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.35 CC1CC(C(=O)O)CO1 Amb25922998 [0,0,0,0,0,0|3,0,0]=3 62 B9R1.35 CC1CC(C(=O)O)SS1 Amb28385584 [0,0,0,0,0,0|3,0,0]=3 63 B9R1.35 CC1CC(C(N)=O)CN1 Amb27665690 [0,0,0,0,0,0|4,0,0]=4 64 B9R1.35 CC1CCC(C(=O)Cl)O1 Amb27424709 [0,0,0,0,0,0|4,0,0]=4 65 B9R1.35 CC1CCC(C(=O)O)C1 Amb18642624 [0,0,0,0,0,0|2,0,0]=2 66 B9R1.35 CC1CCC(C(=O)O)N1 Amb18832572 [0,0,0,0,0,0|3,0,0]=3 67 B9R1.35 CC1CCC(C(=O)O)N1 Amb32652343 [0,0,0,0,0,0|3,0,0]=3 68 B9R1.35 CC1CCC(C(=O)O)O1 Amb17593370 [0,0,0,0,0,0|3,0,0]=3 69 B9R1.35 CC1CCC(C(=O)O)S1 Amb25719281 [0,0,0,0,0,0|3,0,0]=3 70 B9R1.35 CC1CCC(C(N)=O)O1 Amb27838521 [0,0,0,0,0,0|4,0,0]=4 71 B9R1.35 CC1CCC(S(=O)Cl)C1 Amb32720564 [0,0,0,0,0,0|4,0,0]=4 72 B9R1.35 CC1CCC(S(=O)[O-])C1 Amb32755283 [0,0,0,0,0,0|3,0,1]=4 73 B9R1.35 CC1CCC(S(N)=O)C1 Amb32720565 [0,0,0,0,0,0|4,0,0]=4 74 B9R1.35 CC1CCN(C(=O)Cl)C1 Amb27391470 [0,0,0,0,0,0|4,0,0]=4 75 B9R1.35 CC1CC[C@H](C(=O)O)N1 Amb22748252 [0,0,0,0,0,0|3,0,0]=3 76 B9R1.35 CC1CNC(C(C)C)C1 Amb27217292 [0,0,0,0,0,0|3,0,1]=4 77 B9R1.35 CC1CNC(C(N)=O)C1 Amb27783370 [0,0,0,0,0,0|2,0,0]=2 78 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb33756822 [0,0,0,0,0,0|1,0,0]=1 79 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb8386516 [0,0,0,0,0,0|1,0,0]=1 80 B9R1.35 CC1COC(C(=O)O)C1 Amb32679237 [0,0,0,0,0,0|2,0,0]=2 81 B9R1.35 CC1NC(C(=O)O)CS1 Amb9718451 [0,0,0,0,0,0|4,0,0]=4 82 B9R1.35 CC1N[C@H](C(=O)O)CS1 Amb16203706 [0,0,0,0,0,0|4,0,0]=4 83 B9R1.35 CN(C)C1CCC(O)C1 Amb25311037 [0,0,0,0,0,0|4,0,0]=4 84 B9R1.35 CN(C)[C@@H]1CC[C@@H](O)C1 Amb25338336 [0,0,0,0,0,0|4,0,0]=4 85 B9R1.35 CN(C)[C@@H]1CC[C@@H](O)C1 Amb33620308 [0,0,0,0,0,0|4,0,0]=4 86 B9R1.35 CN(C)[C@@H]1CC[C@H](O)C1 Amb24516012 [0,0,0,0,0,0|4,0,0]=4 87 B9R1.35 CN(C)[C@@H]1CC[C@H](O)C1 Amb33620307 [0,0,0,0,0,0|4,0,0]=4 88 B9R1.35 CN1C=NC(C(=O)O)C1 Amb28934983 [0,0,0,0,0,0|2,0,2]=4 89 B9R1.35 CN1C=NC(C(=O)O)C1 Amb8393352 [0,0,0,0,0,0|2,0,2]=4 90 B9R1.35 CN1CCC(C(=O)O)C1 Amb3941190 [0,0,0,0,0,0|3,0,0]=3 91 B9R1.35 CN1CCC(C(=O)O)C1 Amb9154860 [0,0,0,0,0,0|3,0,0]=3 92 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22746030 [0,0,0,0,0,0|3,0,0]=3 93 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22756448 [0,0,0,0,0,0|3,0,0]=3 94 B9R1.35 CN1CC[C@H](C(=O)O)C1 Amb26635487 [0,0,0,0,0,0|3,0,0]=3 95 B9R1.35 CS(=O)C1CCC(N)C1 Amb27229434 [0,0,0,0,0,0|4,0,0]=4 96 B9R1.35 CS(=O)C1CCC(O)C1 Amb33620330 [0,0,0,0,0,0|3,0,0]=3 97 B9R1.35 CS(=O)N1CC[C@H](O)C1 Amb28254372 [0,0,0,0,0,0|4,0,0]=4 98 B9R1.35 C[C@@H](O)[C@@H]1C[C@@H](O)CN1 Amb27810862 [0,0,0,0,0,0|1,0,1]=2 99 B9R1.35 C[C@@H]1C=C[C@@H](C(=O)O)S1 Amb28347473 [0,0,0,0,0,0|3,0,1]=4 100 B9R1.35 C[C@@H]1C=N[C@H](C(=O)O)C1 Amb27468755 [0,0,0,0,0,0|1,0,2]=3 101 B9R1.35 C[C@@H]1CCC(C(=O)O)O1 Amb33423875 [0,0,0,0,0,0|3,0,0]=3 102 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)C1 Amb28429501 [0,0,0,0,0,0|2,0,0]=2 103 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 Amb31308105 [0,0,0,0,0,0|3,0,0]=3 104 B9R1.35 C[C@@H]1CC[C@@H](C(N)=O)N1 Amb28456271 [0,0,0,0,0,0|4,0,0]=4 105 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)C1 Amb10843961 [0,0,0,0,0,0|2,0,0]=2 106 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb24399449 [0,0,0,0,0,0|3,0,0]=3 107 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb32652487 [0,0,0,0,0,0|3,0,0]=3 108 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)O1 Amb22886534 [0,0,0,0,0,0|3,0,0]=3 109 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb19888348 [0,0,0,0,0,0|1,0,0]=1 110 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb33812626 [0,0,0,0,0,0|1,0,0]=1 111 B9R1.35 C[C@@H]1CS[C@@H](C(=O)Cl)S1 Amb25110654 [0,0,0,0,0,0|4,0,0]=4 112 B9R1.35 C[C@@H]1C[C@H](C(=O)O)CO1 Amb27961253 [0,0,0,0,0,0|3,0,0]=3 113 B9R1.35 C[C@@H]1O[C@H](C(=O)O)CS1 Amb26951854 [0,0,0,0,0,0|4,0,0]=4 114 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb24598417 [0,0,0,0,0,0|3,0,0]=3 115 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb35745779 [0,0,0,0,0,0|3,0,0]=3 116 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)O1 Amb24651587 [0,0,0,0,0,0|3,0,0]=3 117 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)C1 Amb27630457 [0,0,0,0,0,0|3,0,0]=3 118 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)N1 Amb28059269 [0,0,0,0,0,0|4,0,0]=4 119 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)O1 Amb27390111 [0,0,0,0,0,0|4,0,0]=4 120 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 Amb33871500 [0,0,0,0,0,0|3,0,0]=3 121 B9R1.35 C[C@H]1CC[C@H](C(N)=O)N1 Amb27204783 [0,0,0,0,0,0|4,0,0]=4 122 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb19887682 [0,0,0,0,0,0|1,0,0]=1 123 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb23439040 [0,0,0,0,0,0|1,0,0]=1 124 B9R1.35 C[C@H]1CS[C@H](C(=O)Cl)S1 Amb28320678 [0,0,0,0,0,0|4,0,0]=4 125 B9R1.35 C[C@H]1N[C@@H](C(=O)O)CS1 Amb28198473 [0,0,0,0,0,0|4,0,0]=4 126 B9R1.35 C[C@H]1O[C@H](C(=O)O)CS1 Amb27252305 [0,0,0,0,0,0|4,0,0]=4 127 B9R1.35 N=C(N)N1CCC(O)C1 Amb25696246 [0,0,0,0,0,0|4,0,0]=4 128 B9R1.35 NC(=O)C1CC(F)CN1 Amb21963545 [0,0,0,0,0,0|2,0,0]=2 129 B9R1.35 NC(=O)C1CC(F)CN1 Amb32666337 [0,0,0,0,0,0|2,0,0]=2 130 B9R1.35 NC(=O)C1CC(O)CN1 Amb1152420 [0,0,0,0,0,0|1,0,0]=1 131 B9R1.35 NC(=O)C1CC(O)CN1 Amb32668520 [0,0,0,0,0,0|1,0,0]=1 132 B9R1.35 NC(=O)C1CC(S)C=N1 Amb25145958 [0,0,0,0,0,0|1,1,2]=4 133 B9R1.35 NC(=O)C1CCC(Cl)C1 Amb27253059 [0,0,0,0,0,0|3,0,0]=3 134 B9R1.35 NC(=O)C1CCC(F)C1 Amb27155322 [0,0,0,0,0,0|3,0,0]=3 135 B9R1.35 NC(=O)C1CCC(N)C1 Amb25104222 [0,0,0,0,0,0|3,0,0]=3 136 B9R1.35 NC(=O)C1CCC(N)C1 Amb32663130 [0,0,0,0,0,0|3,0,0]=3 137 B9R1.35 NC(=O)N1CCC(F)C1 Amb35591996 [0,0,0,0,0,0|4,0,0]=4 138 B9R1.35 NC(=O)N1CCC(N)C1 Amb18943828 [0,0,0,0,0,0|4,0,0]=4 139 B9R1.35 NC(=O)N1CCC(N)C1 Amb19373727 [0,0,0,0,0,0|4,0,0]=4 140 B9R1.35 NC(=O)N1CCC(O)C1 Amb24635585 [0,0,0,0,0,0|3,0,0]=3 141 B9R1.35 NC(=O)N1CC[C@@H](O)C1 Amb27763323 [0,0,0,0,0,0|3,0,0]=3 142 B9R1.35 NC(=O)N1CC[C@H](S)C1 Amb27602032 [0,0,0,0,0,0|3,1,0]=4 143 B9R1.35 NC(=O)N1C[C@H](O)CO1 Amb27223754 [0,0,0,0,0,0|3,0,0]=3 144 B9R1.35 NC(=O)[C@@H]1CC(F)CN1 Amb22747998 [0,0,0,0,0,0|2,0,0]=2 145 B9R1.35 NC(=O)[C@@H]1CC(O)CN1 Amb28054059 [0,0,0,0,0,0|1,0,0]=1 146 B9R1.35 NC(=O)[C@@H]1CC[C@H](S)C1 Amb25290990 [0,0,0,0,0,0|2,1,0]=3 147 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745766 [0,0,0,0,0,0|2,0,0]=2 148 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745768 [0,0,0,0,0,0|2,0,0]=2 149 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 Amb24061354 [0,0,0,0,0,0|1,0,0]=1 150 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 Amb28985696 [0,0,0,0,0,0|1,0,0]=1 151 B9R1.35 NC(=O)[C@@H]1C[C@H](F)CN1 Amb10808100 [0,0,0,0,0,0|2,0,0]=2 152 B9R1.35 NC(=O)[C@@H]1C[C@H](O)CN1 Amb27476480 [0,0,0,0,0,0|1,0,0]=1 153 B9R1.35 NC(=O)[C@H]1CC[C@@H](N)C1 Amb25321319 [0,0,0,0,0,0|3,0,0]=3 154 B9R1.35 NC(=O)[C@H]1CC[C@@H](N)C1 Amb28921043 [0,0,0,0,0,0|3,0,0]=3 155 B9R1.35 NC(=O)[C@H]1C[C@@H](O)CN1 Amb27628841 [0,0,0,0,0,0|1,0,0]=1 156 B9R1.35 NC(=O)[C@H]1C[C@H](F)CN1 Amb27205380 [0,0,0,0,0,0|2,0,0]=2 157 B9R1.35 NC(=O)[C@H]1C[C@H](O)CN1 Amb24586279 [0,0,0,0,0,0|1,0,0]=1 158 B9R1.35 NC(=S)N1CCC(O)C1 Amb27411678 [0,0,0,0,0,0|3,1,0]=4 159 B9R1.35 NC1=NC(C(=O)O)CC1 Amb32718833 [0,0,0,0,0,0|3,0,1]=4 160 B9R1.35 NC1=N[C@@H](C(=O)O)CC1 Amb27202599 [0,0,0,0,0,0|3,0,1]=4 161 B9R1.35 NC1C=C(C(=O)O)CC1 Amb18642496 [0,0,0,0,0,0|2,0,2]=4 162 B9R1.35 NC1C=CC(C(=O)O)C1 Amb20622377 [0,0,0,0,0,0|2,0,1]=3 163 B9R1.35 NC1C=CC(C(=O)O)C1 Amb20623555 [0,0,0,0,0,0|2,0,1]=3 164 B9R1.35 NC1CC=C(C(=O)O)C1 Amb18642495 [0,0,0,0,0,0|2,0,1]=3 165 B9R1.35 NC1CC=C(C(=O)O)C1 Amb32667606 [0,0,0,0,0,0|2,0,1]=3 166 B9R1.35 NC1CCC(C(=O)O)C1 Amb10066880 [0,0,0,0,0,0|2,0,0]=2 167 B9R1.35 NC1CCC(C(=O)O)C1 Amb2694935 [0,0,0,0,0,0|2,0,0]=2 168 B9R1.35 NC1CN[C@H](C(=O)O)C1 Amb28145911 [0,0,0,0,0,0|1,0,0]=1 169 B9R1.35 NC1COC(C(=O)O)C1 Amb18642828 [0,0,0,0,0,0|2,0,0]=2 170 B9R1.35 NC1CSC(C(=O)O)C1 Amb18831415 [0,0,0,0,0,0|2,0,0]=2 171 B9R1.35 N[C@@H]1C=C[C@H](C(=O)O)C1 Amb8516355 [0,0,0,0,0,0|2,0,1]=3 172 B9R1.35 N[C@@H]1CC=C(C(=O)O)C1 Amb25824589 [0,0,0,0,0,0|2,0,1]=3 173 B9R1.35 N[C@@H]1CCC(C(=O)O)C1 Amb27263056 [0,0,0,0,0,0|2,0,0]=2 174 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb10066881 [0,0,0,0,0,0|2,0,0]=2 175 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb33801942 [0,0,0,0,0,0|2,0,0]=2 176 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb33801272 [0,0,0,0,0,0|2,0,0]=2 177 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb8516357 [0,0,0,0,0,0|2,0,0]=2 178 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb19515889 [0,0,0,0,0,0|1,0,0]=1 179 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb25992752 [0,0,0,0,0,0|1,0,0]=1 180 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10070446 [0,0,0,0,0,0|1,0,0]=1 181 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10603136 [0,0,0,0,0,0|1,0,0]=1 182 B9R1.35 N[C@@H]1CO[C@@H](C(=O)O)C1 Amb25691536 [0,0,0,0,0,0|2,0,0]=2 183 B9R1.35 N[C@H]1C=C[C@@H](C(=O)O)C1 Amb16232675 [0,0,0,0,0,0|2,0,1]=3 184 B9R1.35 N[C@H]1C=C[C@@H](C(=O)O)C1 Amb19515761 [0,0,0,0,0,0|2,0,1]=3 185 B9R1.35 N[C@H]1CC=C(C(=O)O)C1 Amb25143919 [0,0,0,0,0,0|2,0,1]=3 186 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb22746692 [0,0,0,0,0,0|2,0,0]=2 187 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb8516356 [0,0,0,0,0,0|2,0,0]=2 188 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb10066883 [0,0,0,0,0,0|2,0,0]=2 189 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb22756038 [0,0,0,0,0,0|2,0,0]=2 190 B9R1.35 N[C@H]1CN[C@@H](C(=O)O)C1 Amb27255323 [0,0,0,0,0,0|1,0,0]=1 191 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10070445 [0,0,0,0,0,0|1,0,0]=1 192 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10603131 [0,0,0,0,0,0|1,0,0]=1 193 B9R1.35 N[C@H]1CO[C@H](C(=O)O)C1 Amb24117069 [0,0,0,0,0,0|2,0,0]=2 194 B9R1.35 O=C(Cl)C1CCC(Cl)C1 Amb24707520 [0,0,0,0,0,0|3,0,0]=3 195 B9R1.35 O=C(Cl)N1CCC(F)C1 Amb29869318 [0,0,0,0,0,0|4,0,0]=4 196 B9R1.35 O=C(O)C1=CC(Br)CC1 Amb27776760 [0,0,0,0,0,0|2,0,2]=4 197 B9R1.35 O=C(O)C1=CC(O)CC1 Amb27619747 [0,0,0,0,0,0|1,0,2]=3 198 B9R1.35 O=C(O)C1=C[C@@H](O)CC1 Amb27412374 [0,0,0,0,0,0|1,0,2]=3 199 B9R1.35 O=C(O)C1=NC[C@@H](O)C1 Amb28198348 [0,0,0,0,0,0|0,0,2]=2 200 B9R1.35 O=C(O)C1CC(Br)=NO1 Amb26852251 [0,0,0,0,0,0|3,0,1]=4 201 B9R1.35 O=C(O)C1CC(Cl)CN1 Amb28436107 [0,0,0,0,0,0|1,0,0]=1 202 B9R1.35 O=C(O)C1CC(F)CN1 Amb10608925 [0,0,0,0,0,0|1,0,0]=1 203 B9R1.35 O=C(O)C1CC(I)CN1 Amb27467588 [0,0,0,0,0,0|1,0,0]=1 204 B9R1.35 O=C(O)C1CC(O)CN1 Amb32666298 [0,0,0,0,0,0|0,0,0]=0 205 B9R1.35 O=C(O)C1CC(O)CN1 Amb33481348 [0,0,0,0,0,0|0,0,0]=0 206 B9R1.35 O=C(O)C1CC(O)CN1 Amb9702801 [0,0,0,0,0,0|0,0,0]=0 207 B9R1.35 O=C(O)C1CC(O)CO1 Amb18642869 [0,0,0,0,0,0|1,0,0]=1 208 B9R1.35 O=C(O)C1CCC(Br)C1 Amb2695404 [0,0,0,0,0,0|2,0,0]=2 209 B9R1.35 O=C(O)C1CCC(F)C1 Amb22886545 [0,0,0,0,0,0|2,0,0]=2 210 B9R1.35 O=C(O)C1CCC(I)C1 Amb23456141 [0,0,0,0,0,0|2,0,0]=2 211 B9R1.35 O=C(O)C1CCC(O)C1 Amb21963572 [0,0,0,0,0,0|1,0,0]=1 212 B9R1.35 O=C(O)C1CCC(S)C1 Amb27403449 [0,0,0,0,0,0|1,1,0]=2 213 B9R1.35 O=C(O)C1CSS(=O)C1 Amb27165800 [0,0,0,0,0,0|3,0,1]=4 214 B9R1.35 O=C(O)C1C[C@H](O)CN1 Amb34913473 [0,0,0,0,0,0|0,0,0]=0 215 B9R1.35 O=C(O)C1NC(O)CS1 Amb26536906 [0,0,0,0,0,0|2,0,0]=2 216 B9R1.35 O=C(O)[C@@H]1CC(O)CN1 Amb25743296 [0,0,0,0,0,0|0,0,0]=0 217 B9R1.35 O=C(O)[C@@H]1CC(S)CN1 Amb28430216 [0,0,0,0,0,0|0,1,0]=1 218 B9R1.35 O=C(O)[C@@H]1CCC(=S)N1 Amb26857015 [0,0,0,0,0,0|2,1,1]=4 219 B9R1.35 O=C(O)[C@@H]1CC[C@@H](O)C1 Amb22746558 [0,0,0,0,0,0|1,0,0]=1 220 B9R1.35 O=C(O)[C@@H]1CC[C@H](O)C1 Amb27784295 [0,0,0,0,0,0|1,0,0]=1 221 B9R1.35 O=C(O)[C@@H]1CC[C@H](S)C1 Amb26438302 [0,0,0,0,0,0|1,1,0]=2 222 B9R1.35 O=C(O)[C@@H]1C[C@@H](Br)CN1 Amb10603132 [0,0,0,0,0,0|1,0,0]=1 223 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 Amb16232298 [0,0,0,0,0,0|1,0,0]=1 224 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 Amb8386381 [0,0,0,0,0,0|1,0,0]=1 225 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)C=N1 Amb27215307 [0,0,0,0,0,0|0,0,2]=2 226 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CN1 Amb1994991 [0,0,0,0,0,0|0,0,0]=0 227 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CO1 Amb28287549 [0,0,0,0,0,0|1,0,0]=1 228 B9R1.35 O=C(O)[C@@H]1C[C@@H](S)CN1 Amb22831348 [0,0,0,0,0,0|0,1,0]=1 229 B9R1.35 O=C(O)[C@@H]1C[C@H](Br)CN1 Amb10603137 [0,0,0,0,0,0|1,0,0]=1 230 B9R1.35 O=C(O)[C@@H]1C[C@H](Cl)CN1 Amb27630657 [0,0,0,0,0,0|1,0,0]=1 231 B9R1.35 O=C(O)[C@@H]1C[C@H](Cl)CN1 Amb35749342 [0,0,0,0,0,0|1,0,0]=1 232 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 Amb10603139 [0,0,0,0,0,0|1,0,0]=1 233 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 Amb22757085 [0,0,0,0,0,0|1,0,0]=1 234 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb22748218 [0,0,0,0,0,0|0,0,0]=0 235 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8384483 [0,0,0,0,0,0|0,0,0]=0 236 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8629987 [0,0,0,0,0,0|0,0,0]=0 237 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 Amb27783148 [0,0,0,0,0,0|0,1,0]=1 238 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 Amb28994765 [0,0,0,0,0,0|0,1,0]=1 239 B9R1.35 O=C(O)[C@H]1CC(F)CN1 Amb27447262 [0,0,0,0,0,0|1,0,0]=1 240 B9R1.35 O=C(O)[C@H]1CC[C@H](O)C1 Amb26960428 [0,0,0,0,0,0|1,0,0]=1 241 B9R1.35 O=C(O)[C@H]1CC[C@H](O)N1 Amb27421972 [0,0,0,0,0,0|2,0,0]=2 242 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 Amb10839999 [0,0,0,0,0,0|1,0,0]=1 243 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 Amb33726117 [0,0,0,0,0,0|1,0,0]=1 244 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5718663 [0,0,0,0,0,0|0,0,0]=0 245 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5719209 [0,0,0,0,0,0|0,0,0]=0 246 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 Amb10067741 [0,0,0,0,0,0|1,0,0]=1 247 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 Amb28989995 [0,0,0,0,0,0|1,0,0]=1 248 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb16230723 [0,0,0,0,0,0|0,0,0]=0 249 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb8628928 [0,0,0,0,0,0|0,0,0]=0 250 B9R1.35 O=C(O)[C@H]1O[C@H](O)CS1 Amb25288477 [0,0,0,0,0,0|2,0,0]=2 251 B9R1.35 O=C1C=CC(C(=O)O)C1 Amb26002884 [0,0,0,0,0,0|1,0,3]=4 252 B9R1.35 O=C1CC(C(=O)O)CN1 Amb33545000 [0,0,0,0,0,0|2,0,2]=4 253 B9R1.35 O=C1CC(C(=O)O)CO1 Amb22642307 [0,0,0,0,0,0|2,0,2]=4 254 B9R1.35 O=C1CC(C(=O)O)CS1 Amb10073724 [0,0,0,0,0,0|2,0,2]=4 255 B9R1.35 O=C1CC(C(=O)O)NN1 Amb18642739 [0,0,0,0,0,0|1,0,2]=3 256 B9R1.35 O=C1CCC(C(=O)Cl)C1 Amb25282784 [0,0,0,0,0,0|2,0,2]=4 257 B9R1.35 O=C1CCC(C(=O)O)C1 Amb2695400 [0,0,0,0,0,0|1,0,2]=3 258 B9R1.35 O=C1CCC(C(=O)O)N1 Amb9703102 [0,0,0,0,0,0|2,0,2]=4 259 B9R1.35 O=C1CCC(C(=O)O)O1 Amb20623076 [0,0,0,0,0,0|2,0,2]=4 260 B9R1.35 O=C1CCC(C(=O)O)S1 Amb23439315 [0,0,0,0,0,0|2,0,2]=4 261 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 Amb27254141 [0,0,0,0,0,0|1,0,2]=3 262 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 Amb1995036 [0,0,0,0,0,0|2,0,2]=4 263 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 Amb24099403 [0,0,0,0,0,0|2,0,2]=4 264 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 Amb2722887 [0,0,0,0,0,0|2,0,2]=4 265 B9R1.35 O=C1CC[C@H](C(=O)O)C1 Amb22746923 [0,0,0,0,0,0|1,0,2]=3 266 B9R1.35 O=C1CC[C@H](C(=O)O)N1 Amb2694994 [0,0,0,0,0,0|2,0,2]=4 267 B9R1.35 O=C1CC[C@H](C(=O)O)O1 Amb2720513 [0,0,0,0,0,0|2,0,2]=4 268 B9R1.35 O=C1CNC(C(=O)O)C1 Amb30625211 [0,0,0,0,0,0|0,0,2]=2 269 B9R1.35 O=C1CNC(C(=O)O)C1 Amb8386094 [0,0,0,0,0,0|0,0,2]=2 270 B9R1.35 O=C1CN[C@H](C(=O)O)C1 Amb22747440 [0,0,0,0,0,0|0,0,2]=2 271 B9R1.35 O=C1CN[C@H](C(=O)O)C1 Amb8628977 [0,0,0,0,0,0|0,0,2]=2 272 B9R1.35 O=C1COC(C(=O)O)C1 Amb32651713 [0,0,0,0,0,0|1,0,2]=3 273 B9R1.35 O=C1CSC(C(=O)O)C1 Amb24061425 [0,0,0,0,0,0|1,0,2]=3 274 B9R1.35 O=C1CSC(C(=O)O)O1 Amb25063335 [0,0,0,0,0,0|2,0,2]=4 275 B9R1.35 O=C1C[C@@H](C(=O)O)CN1 Amb23439643 [0,0,0,0,0,0|2,0,2]=4 276 B9R1.35 O=C1C[C@@H](C(=O)O)CO1 Amb27253217 [0,0,0,0,0,0|2,0,2]=4 277 B9R1.35 O=C1C[C@H](C(=O)O)CN1 Amb25946886 [0,0,0,0,0,0|2,0,2]=4 278 B9R1.35 OC1CCC(C(F)F)C1 Amb28061024 [0,0,0,0,0,0|3,0,1]=4 279 B8R1.1 C#CC1CCC(O)C1 Amb28430662 [1,0,0,0,0,0|2,0,1]=4 280 B8R1.1 C=C1CN[C@H](CO)C1 Amb27205082 [1,0,0,0,0,0|1,0,2]=4 281 B8R1.1 C=CC1C=CC(O)C1 Amb27974069 [1,0,0,0,0,0|2,0,1]=4 282 B8R1.1 C=CC1CCC(O)C1 Amb28285222 [1,0,0,0,0,0|2,0,0]=3 283 B8R1.1 C=CC1CCC(O)O1 Amb22752546 [1,0,0,0,0,0|3,0,0]=4 284 B8R1.1 C=CC1COC(O)C1 Amb28061049 [1,0,0,0,0,0|3,0,0]=4 285 B8R1.1 C=C[C@@H]1C=C[C@@H](O)C1 Amb27663669 [1,0,0,0,0,0|2,0,1]=4 286 B8R1.1 C=C[C@@H]1C=C[C@H](O)C1 Amb27219062 [1,0,0,0,0,0|2,0,1]=4 287 B8R1.1 C=C[C@@H]1CC[C@@H](Br)C1 Amb27161500 [1,0,0,0,0,0|3,0,0]=4 288 B8R1.1 C=C[C@@H]1CC[C@@H](O)C1 Amb27451639 [1,0,0,0,0,0|2,0,0]=3 289 B8R1.1 CC1CCC(C=O)C1 Amb33549452 [1,0,0,0,0,0|2,0,0]=3 290 B8R1.1 CC1CNC(CF)C1 Amb27818144 [1,0,0,0,0,0|2,0,1]=4 291 B8R1.1 CC1COC(C=O)C1 Amb28285207 [1,0,0,0,0,0|2,0,0]=3 292 B8R1.1 CC1COC(CO)C1 Amb25856417 [1,0,0,0,0,0|2,0,1]=4 293 B8R1.1 CCC1CC(C)CN1 Amb19375396 [1,0,0,0,0,0|2,0,1]=4 294 B8R1.1 CCC1CC(F)CN1 Amb28199169 [1,0,0,0,0,0|2,0,1]=4 295 B8R1.1 CCC1CC(O)CN1 Amb27398576 [1,0,0,0,0,0|1,0,1]=3 296 B8R1.1 CCC1CC(O)CN1 Amb32753264 [1,0,0,0,0,0|1,0,1]=3 297 B8R1.1 CCC1CCC(O)C1 Amb24471617 [1,0,0,0,0,0|2,0,1]=4 298 B8R1.1 CC[C@@H]1CC[C@H](O)C1 Amb27626637 [1,0,0,0,0,0|2,0,1]=4 299 B8R1.1 CC[C@@H]1C[C@H](C)CN1 Amb18833051 [1,0,0,0,0,0|2,0,1]=4 300 B8R1.1 CC[C@@H]1C[C@H](O)CN1 Amb27787989 [1,0,0,0,0,0|1,0,1]=3 301 B8R1.1 CC[C@H]1C[C@@H](O)CN1 Amb32676625 [1,0,0,0,0,0|1,0,1]=3 302 B8R1.1 CC[C@H]1C[C@@H](O)CN1 Amb32676626 [1,0,0,0,0,0|1,0,1]=3 303 B8R1.1 CN1CCC(C=O)C1 Amb18833062 [1,0,0,0,0,0|3,0,0]=4 304 B8R1.1 CNC1CCC(O)C1 Amb27595077 [1,0,0,0,0,0|3,0,0]=4 305 B8R1.1 COC1CCC(O)C1 Amb26330676 [1,0,0,0,0,0|3,0,0]=4 306 B8R1.1 CO[C@@H]1CC[C@H](O)C1 Amb25913334 [1,0,0,0,0,0|3,0,0]=4 307 B8R1.1 CSC1CCC(O)C1 Amb33620320 [1,0,0,0,0,0|3,0,0]=4 308 B8R1.1 C[C@@H]1CN[C@H](CF)C1 Amb22886265 [1,0,0,0,0,0|2,0,1]=4 309 B8R1.1 C[C@@H]1CN[C@H](CF)C1 Amb27626760 [1,0,0,0,0,0|2,0,1]=4 310 B8R1.1 C[C@@H]1CN[C@H](CO)C1 Amb28056022 [1,0,0,0,0,0|1,0,1]=3 311 B8R1.1 C[C@@H]1CO[C@@H](CO)C1 Amb27776409 [1,0,0,0,0,0|2,0,1]=4 312 B8R1.1 C[C@H]1CN[C@@H](CO)C1 Amb22886264 [1,0,0,0,0,0|1,0,1]=3 313 B8R1.1 FC[C@@H]1C[C@H](F)CN1 Amb22886228 [1,0,0,0,0,0|2,0,1]=4 314 B8R1.1 FC[C@@H]1C[C@H](F)CN1 Amb27640611 [1,0,0,0,0,0|2,0,1]=4 315 B8R1.1 N#CC1CC(F)CN1 Amb26422241 [1,0,0,0,0,0|2,0,1]=4 316 B8R1.1 N#CC1CC(F)CN1 Amb33339234 [1,0,0,0,0,0|2,0,1]=4 317 B8R1.1 N#CC1CCC(O)C1 Amb22059665 [1,0,0,0,0,0|2,0,1]=4 318 B8R1.1 N#C[C@@H]1CC[C@@H](O)C1 Amb22886830 [1,0,0,0,0,0|2,0,1]=4 319 B8R1.1 N#C[C@@H]1CC[C@H](O)C1 Amb22886829 [1,0,0,0,0,0|2,0,1]=4 320 B8R1.1 N#C[C@@H]1C[C@@H](F)CN1 Amb26960870 [1,0,0,0,0,0|2,0,1]=4 321 B8R1.1 N#C[C@@H]1C[C@H](F)CN1 Amb28250854 [1,0,0,0,0,0|2,0,1]=4 322 B8R1.1 N#C[C@@H]1C[C@H](F)CN1 Amb30640075 [1,0,0,0,0,0|2,0,1]=4 323 B8R1.1 N#C[C@H]1CC[C@@H](O)C1 Amb24540761 [1,0,0,0,0,0|2,0,1]=4 324 B8R1.1 NC1CCC(CO)C1 Amb18641837 [1,0,0,0,0,0|2,0,1]=4 325 B8R1.1 NC1CCC(CO)C1 Amb32666336 [1,0,0,0,0,0|2,0,1]=4 326 B8R1.1 NC1CSC(CO)C1 Amb27851559 [1,0,0,0,0,0|2,0,1]=4 327 B8R1.1 NCC1CC(O)CN1 Amb22059798 [1,0,0,0,0,0|1,0,1]=3 328 B8R1.1 NCC1CCC(O)C1 Amb22886211 [1,0,0,0,0,0|2,0,1]=4 329 B8R1.1 NCC1CCC(O)C1 Amb33547590 [1,0,0,0,0,0|2,0,1]=4 330 B8R1.1 NC[C@@H]1CC[C@@H](O)C1 Amb10066974 [1,0,0,0,0,0|2,0,1]=4 331 B8R1.1 NC[C@@H]1CC[C@H](O)C1 Amb10066982 [1,0,0,0,0,0|2,0,1]=4 332 B8R1.1 NC[C@@H]1C[C@@H](O)CN1 Amb27850549 [1,0,0,0,0,0|1,0,1]=3 333 B8R1.1 NC[C@H]1CC[C@@H](O)C1 Amb10066975 [1,0,0,0,0,0|2,0,1]=4 334 B8R1.1 N[C@@H]1CC[C@@H](CO)C1 Amb24603976 [1,0,0,0,0,0|2,0,1]=4 335 B8R1.1 N[C@@H]1CC[C@H](CO)C1 Amb24526904 [1,0,0,0,0,0|2,0,1]=4 336 B8R1.1 N[C@H]1CC[C@@H](CO)C1 Amb26949648 [1,0,0,0,0,0|2,0,1]=4 337 B8R1.1 N[C@H]1CC[C@@H](CO)C1 Amb32661812 [1,0,0,0,0,0|2,0,1]=4 338 B8R1.1 N[C@H]1CO[C@@H](CO)C1 Amb26397441 [1,0,0,0,0,0|2,0,1]=4 339 B8R1.1 N[C@H]1CO[C@H](CO)C1 Amb27638129 [1,0,0,0,0,0|2,0,1]=4 340 B8R1.1 O=CC1CCC(=O)C1 Amb18124240 [1,0,0,0,0,0|1,0,2]=4 341 B8R1.1 O=CC1CCC(F)C1 Amb25938998 [1,0,0,0,0,0|2,0,0]=3 342 B8R1.1 O=CC1CCC(O)C1 Amb18641801 [1,0,0,0,0,0|1,0,0]=2 343 B8R1.1 O=CN1CC(O)CO1 Amb28368023 [1,0,0,0,0,0|2,0,0]=3 344 B8R1.1 O=CN1CC(S)CN1 Amb20621388 [1,0,0,0,0,0|1,1,0]=3 345 B8R1.1 O=CN1CCC(F)C1 Amb35614291 [1,0,0,0,0,0|3,0,0]=4 346 B8R1.1 O=CN1CC[C@H](O)C1 Amb27459549 [1,0,0,0,0,0|2,0,0]=3 347 B8R1.1 O=CN1CC[C@H](S)C1 Amb26490592 [1,0,0,0,0,0|2,1,0]=4 348 B8R1.1 O=NN1CCC(O)C1 Amb25781793 [1,0,0,0,0,0|3,0,0]=4 349 B8R1.1 OC1COC(CCl)C1 Amb28208531 [1,0,0,0,0,0|2,0,1]=4 350 B8R1.1 OC1COC(CI)C1 Amb22229903 [1,0,0,0,0,0|2,0,1]=4 351 B8R1.1 OCC1CC(F)CN1 Amb10608927 [1,0,0,0,0,0|1,0,1]=3 352 B8R1.1 OCC1CC(F)CN1 Amb28934835 [1,0,0,0,0,0|1,0,1]=3 353 B8R1.1 OCC1CC(O)CN1 Amb1102176 [1,0,0,0,0,0|0,0,1]=2 354 B8R1.1 OCC1CC(O)CN1 Amb24268900 [1,0,0,0,0,0|0,0,1]=2 355 B8R1.1 OCC1CCC(F)C1 Amb23455679 [1,0,0,0,0,0|2,0,1]=4 356 B8R1.1 OCC1CCC(O)C1 Amb22168730 [1,0,0,0,0,0|1,0,1]=3 357 B8R1.1 OCC1CCC(O)O1 Amb22492783 [1,0,0,0,0,0|2,0,1]=4 358 B8R1.1 OCC1CCC(S)C1 Amb27453693 [1,0,0,0,0,0|1,1,1]=4 359 B8R1.1 OC[C@@H]1CC(O)CN1 Amb27591630 [1,0,0,0,0,0|0,0,1]=2 360 B8R1.1 OC[C@@H]1CCC(O)O1 Amb27642087 [1,0,0,0,0,0|2,0,1]=4 361 B8R1.1 OC[C@@H]1CC[C@@H](F)C1 Amb33714553 [1,0,0,0,0,0|2,0,1]=4 362 B8R1.1 OC[C@@H]1CC[C@@H](O)O1 Amb27220239 [1,0,0,0,0,0|2,0,1]=4 363 B8R1.1 OC[C@@H]1CC[C@H](F)C1 Amb33714552 [1,0,0,0,0,0|2,0,1]=4 364 B8R1.1 OC[C@@H]1CC[C@H](O)O1 Amb27664169 [1,0,0,0,0,0|2,0,1]=4 365 B8R1.1 OC[C@@H]1C[C@@H](F)CN1 Amb22886257 [1,0,0,0,0,0|1,0,1]=3 366 B8R1.1 OC[C@@H]1C[C@@H](F)CN1 Amb28074052 [1,0,0,0,0,0|1,0,1]=3 367 B8R1.1 OC[C@@H]1C[C@@H](O)CN1 Amb19929426 [1,0,0,0,0,0|0,0,1]=2 368 B8R1.1 OC[C@@H]1C[C@@H](O)CN1 Amb27783820 [1,0,0,0,0,0|0,0,1]=2 369 B8R1.1 OC[C@@H]1C[C@@H](O)CO1 Amb22224988 [1,0,0,0,0,0|1,0,1]=3 370 B8R1.1 OC[C@@H]1C[C@H](Cl)CN1 Amb24117113 [1,0,0,0,0,0|1,0,1]=3 371 B8R1.1 OC[C@@H]1C[C@H](Cl)CN1 Amb33804308 [1,0,0,0,0,0|1,0,1]=3 372 B8R1.1 OC[C@@H]1C[C@H](F)CN1 Amb10844960 [1,0,0,0,0,0|1,0,1]=3 373 B8R1.1 OC[C@@H]1C[C@H](F)CN1 Amb22886229 [1,0,0,0,0,0|1,0,1]=3 374 B8R1.1 OC[C@@H]1C[C@H](O)CN1 Amb24117087 [1,0,0,0,0,0|0,0,1]=2 375 B8R1.1 OC[C@@H]1C[C@H](O)CN1 Amb30634319 [1,0,0,0,0,0|0,0,1]=2 376 B8R1.1 OC[C@@H]1C[C@H](O)CO1 Amb22224993 [1,0,0,0,0,0|1,0,1]=3 377 B8R1.1 OC[C@H]1C=C[C@@H](O)C1 Amb27207178 [1,0,0,0,0,0|1,0,2]=4 378 B8R1.1 OC[C@H]1CC(O)CN1 Amb27430315 [1,0,0,0,0,0|0,0,1]=2 379 B8R1.1 OC[C@H]1CC[C@H](O)C1 Amb24544575 [1,0,0,0,0,0|1,0,1]=3 380 B8R1.1 OC[C@H]1C[C@@H](O)CN1 Amb33858981 [1,0,0,0,0,0|0,0,1]=2 381 B8R1.1 OC[C@H]1C[C@@H](O)CO1 Amb22224987 [1,0,0,0,0,0|1,0,1]=3 382 B8R1.1 OC[C@H]1C[C@H](Br)CO1 Amb27491768 [1,0,0,0,0,0|2,0,1]=4 383 B8R1.1 OC[C@H]1C[C@H](O)CN1 Amb22756284 [1,0,0,0,0,0|0,0,1]=2 384 B8R1.1 OC[C@H]1C[C@H](O)CS1 Amb27853945 [1,0,0,0,0,0|1,0,1]=3 385 B8R1.1 OC[C@H]1OC[C@@H](O)O1 Amb28346689 [1,0,0,0,0,0|2,0,1]=4 386 B8R1.1 OC[C@H]1OC[C@H](O)O1 Amb27197067 [1,0,0,0,0,0|2,0,1]=4 387 B8R1.1 O[C@@H]1CC[C@@H](CS)C1 Amb27448845 [1,0,0,0,0,0|1,1,1]=4 388 B8R1.1 O[C@H]1CN[C@@H](CF)C1 Amb27459828 [1,0,0,0,0,0|1,0,1]=3 389 B8R1.7 C=C(C)C1CCCC1 Amb26515703 [1,0,0,0,0,0|3,0,0]=4 390 B8R1.7 C=C(C)C1CCCN1 Amb23536664 [1,0,0,0,0,0|2,0,0]=3 391 B8R1.7 C=C(C)[C@@H]1CCCN1 Amb28186967 [1,0,0,0,0,0|2,0,0]=3 392 B8R1.7 CC(=O)C1=CCCC1 Amb22338190 [1,0,0,0,0,0|2,0,1]=4 393 B8R1.7 CC(=O)C1=CCCN1 Amb27880337 [1,0,0,0,0,0|1,0,2]=4 394 B8R1.7 CC(=O)C1CC=CN1 Amb26979687 [1,0,0,0,0,0|1,0,2]=4 395 B8R1.7 CC(=O)C1CCC=N1 Amb22496787 [1,0,0,0,0,0|1,0,2]=4 396 B8R1.7 CC(=O)C1CCCC1 Amb2612425 [1,0,0,0,0,0|2,0,0]=3 397 B8R1.7 CC(=O)C1CCCN1 Amb17231815 [1,0,0,0,0,0|1,0,0]=2 398 B8R1.7 CC(=O)C1CCCN1 Amb33870768 [1,0,0,0,0,0|1,0,0]=2 399 B8R1.7 CC(=O)C1CCCO1 Amb23590167 [1,0,0,0,0,0|2,0,0]=3 400 B8R1.7 CC(=O)C1CCCS1 Amb27838322 [1,0,0,0,0,0|2,0,0]=3 401 B8R1.7 CC(=O)C1CCNC1 Amb18833067 [1,0,0,0,0,0|3,0,0]=4 402 B8R1.7 CC(=O)C1CCNC1 Amb22899078 [1,0,0,0,0,0|3,0,0]=4 403 B8R1.7 CC(=O)C1CCOC1 Amb18833038 [1,0,0,0,0,0|3,0,0]=4 404 B8R1.7 CC(=O)C1CCSC1 Amb27412975 [1,0,0,0,0,0|3,0,0]=4 405 B8R1.7 CC(=O)C1NCCS1 Amb22757393 [1,0,0,0,0,0|2,0,0]=3 406 B8R1.7 CC(=O)C1OCCO1 Amb24053150 [1,0,0,0,0,0|3,0,0]=4 407 B8R1.7 CC(=O)C1OCCS1 Amb27262730 [1,0,0,0,0,0|3,0,0]=4 408 B8R1.7 CC(=O)N1CCCC1 Amb3358093 [1,0,0,0,0,0|3,0,0]=4 409 B8R1.7 CC(=O)[C@@H]1CCCN1 Amb27170693 [1,0,0,0,0,0|1,0,0]=2 410 B8R1.7 CC(=O)[C@@H]1CCCN1 Amb31291120 [1,0,0,0,0,0|1,0,0]=2 411 B8R1.7 CC(=O)[C@@H]1CCCO1 Amb22746525 [1,0,0,0,0,0|2,0,0]=3 412 B8R1.7 CC(=O)[C@@H]1CCNC1 Amb30039124 [1,0,0,0,0,0|3,0,0]=4 413 B8R1.7 CC(=O)[C@H]1CCCN1 Amb27453624 [1,0,0,0,0,0|1,0,0]=2 414 B8R1.7 CC(=O)[C@H]1CCCO1 Amb25173839 [1,0,0,0,0,0|2,0,0]=3 415 B8R1.7 CC(=O)[C@H]1CCNC1 Amb33132071 [1,0,0,0,0,0|3,0,0]=4 416 B8R1.7 CC(C)C1CCCN1 Amb2234804 [1,0,0,0,0,0|2,0,1]=4 417 B8R1.7 CC(C)C1CCCN1 Amb2237165 [1,0,0,0,0,0|2,0,1]=4 418 B8R1.7 CC(C)[C@@H]1CCCN1 Amb24183507 [1,0,0,0,0,0|2,0,1]=4 419 B8R1.7 CC(C)[C@@H]1CCCN1 Amb26515753 [1,0,0,0,0,0|2,0,1]=4 420 B8R1.7 CC(C)[C@H]1CCCN1 Amb28071990 [1,0,0,0,0,0|2,0,1]=4 421 B8R1.7 CC(C)[C@H]1CCCN1 Amb31204629 [1,0,0,0,0,0|2,0,1]=4 422 B8R1.7 CC(F)C1CCCN1 Amb23454743 [1,0,0,0,0,0|2,0,1]=4 423 B8R1.7 CC(N)C1CCCN1 Amb10609840 [1,0,0,0,0,0|2,0,1]=4 424 B8R1.7 CC(N)C1CCCN1 Amb10610386 [1,0,0,0,0,0|2,0,1]=4 425 B8R1.7 CC(O)C1CCCC1 Amb32409773 [1,0,0,0,0,0|2,0,1]=4 426 B8R1.7 CC(O)C1CCCC1 Amb4035956 [1,0,0,0,0,0|2,0,1]=4 427 B8R1.7 CC(O)C1CCCN1 Amb17231822 [1,0,0,0,0,0|1,0,1]=3 428 B8R1.7 CC(O)C1CCCO1 Amb26319231 [1,0,0,0,0,0|2,0,1]=4 429 B8R1.7 CC(O)[C@@H]1CCCN1 Amb24685154 [1,0,0,0,0,0|1,0,1]=3 430 B8R1.7 CC(O)[C@H]1CCCN1 Amb26394098 [1,0,0,0,0,0|1,0,1]=3 431 B8R1.7 CC(S)C1CCCN1 Amb30029014 [1,0,0,0,0,0|1,1,1]=4 432 B8R1.7 CS(=O)C1CCCC1 Amb28049298 [1,0,0,0,0,0|3,0,0]=4 433 B8R1.7 C[C@@H](O)C1CCCC1 Amb19515558 [1,0,0,0,0,0|2,0,1]=4 434 B8R1.7 C[C@@H](O)C1CCCO1 Amb26854223 [1,0,0,0,0,0|2,0,1]=4 435 B8R1.7 C[C@@H](O)C1CCCS1 Amb33416214 [1,0,0,0,0,0|2,0,1]=4 436 B8R1.7 C[C@H](O)C1CCCC1 Amb25842291 [1,0,0,0,0,0|2,0,1]=4 437 B8R1.7 C[C@H](O)C1CCCO1 Amb25985121 [1,0,0,0,0,0|2,0,1]=4 438 B8R1.7 C[C@H](O)C1CCCS1 Amb33416213 [1,0,0,0,0,0|2,0,1]=4 439 B8R1.7 C[C@H](O)[C@H]1CCCO1 Amb26563465 [1,0,0,0,0,0|2,0,1]=4 440 B8R1.7 FC(F)C1CCCN1 Amb23439426 [1,0,0,0,0,0|2,0,1]=4 441 B8R1.7 FC(F)C1CCCN1 Amb26973800 [1,0,0,0,0,0|2,0,1]=4 442 B8R1.7 FC(F)[C@@H]1CCCN1 Amb19148414 [1,0,0,0,0,0|2,0,1]=4 443 B8R1.7 FC(F)[C@@H]1CCCN1 Amb23439427 [1,0,0,0,0,0|2,0,1]=4 444 B8R1.7 FC(F)[C@H]1CCCN1 Amb25760268 [1,0,0,0,0,0|2,0,1]=4 445 B8R1.7 FC(F)[C@H]1CCCN1 Amb33871531 [1,0,0,0,0,0|2,0,1]=4 446 B8R1.7 N=C(N)C1CCCC1 Amb2695059 [1,0,0,0,0,0|3,0,0]=4 447 B8R1.7 N=C(N)C1CCCC1 Amb8630086 [1,0,0,0,0,0|3,0,0]=4 448 B8R1.7 N=C(N)C1CCCN1 Amb24549144 [1,0,0,0,0,0|2,0,0]=3 449 B8R1.7 N=C(N)C1CCCN1 Amb32718817 [1,0,0,0,0,0|2,0,0]=3 450 B8R1.7 N=C(N)C1CCCO1 Amb22059430 [1,0,0,0,0,0|3,0,0]=4 451 B8R1.7 N=C(N)C1CCCO1 Amb28934896 [1,0,0,0,0,0|3,0,0]=4 452 B8R1.7 N=C(N)C1CCCS1 Amb24470321 [1,0,0,0,0,0|3,0,0]=4 453 B8R1.7 NC(=O)C1=CCCC1 Amb20622488 [1,0,0,0,0,0|2,0,1]=4 454 B8R1.7 NC(=O)C1=NCCN1 Amb1068371 [1,0,0,0,0,0|2,0,1]=4 455 B8R1.7 NC(=O)C1C=CCC1 Amb25063981 [1,0,0,0,0,0|2,0,1]=4 456 B8R1.7 NC(=O)C1C=CCN1 Amb27246432 [1,0,0,0,0,0|1,0,2]=4 457 B8R1.7 NC(=O)C1CCCC1 Amb8858372 [1,0,0,0,0,0|2,0,0]=3 458 B8R1.7 NC(=O)C1CCCN1 Amb2720282 [1,0,0,0,0,0|1,0,0]=2 459 B8R1.7 NC(=O)C1CCCN1 Amb9724672 [1,0,0,0,0,0|1,0,0]=2 460 B8R1.7 NC(=O)C1CCCO1 Amb33545693 [1,0,0,0,0,0|2,0,0]=3 461 B8R1.7 NC(=O)C1CCNC1 Amb19373271 [1,0,0,0,0,0|3,0,0]=4 462 B8R1.7 NC(=O)C1CCNC1 Amb9728548 [1,0,0,0,0,0|3,0,0]=4 463 B8R1.7 NC(=O)C1CCOC1 Amb9677690 [1,0,0,0,0,0|3,0,0]=4 464 B8R1.7 NC(=O)C1CSCN1 Amb2967256 [1,0,0,0,0,0|2,0,0]=3 465 B8R1.7 NC(=O)C1NCCS1 Amb27655014 [1,0,0,0,0,0|2,0,0]=3 466 B8R1.7 NC(=O)N1CCCC1 Amb1107229 [1,0,0,0,0,0|3,0,0]=4 467 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb20240600 [1,0,0,0,0,0|1,0,0]=2 468 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb2690398 [1,0,0,0,0,0|1,0,0]=2 469 B8R1.7 NC(=O)[C@@H]1CCCO1 Amb4166303 [1,0,0,0,0,0|2,0,0]=3 470 B8R1.7 NC(=O)[C@@H]1CCNC1 Amb20671394 [1,0,0,0,0,0|3,0,0]=4 471 B8R1.7 NC(=O)[C@@H]1CCNC1 Amb22405894 [1,0,0,0,0,0|3,0,0]=4 472 B8R1.7 NC(=O)[C@@H]1CCOC1 Amb27413583 [1,0,0,0,0,0|3,0,0]=4 473 B8R1.7 NC(=O)[C@@H]1COCN1 Amb27194677 [1,0,0,0,0,0|2,0,0]=3 474 B8R1.7 NC(=O)[C@H]1CCCN1 Amb17942785 [1,0,0,0,0,0|1,0,0]=2 475 B8R1.7 NC(=O)[C@H]1CCCN1 Amb2690397 [1,0,0,0,0,0|1,0,0]=2 476 B8R1.7 NC(=O)[C@H]1CCNC1 Amb20671395 [1,0,0,0,0,0|3,0,0]=4 477 B8R1.7 NC(=O)[C@H]1CCNC1 Amb22405893 [1,0,0,0,0,0|3,0,0]=4 478 B8R1.7 NC(=O)[C@H]1CCOC1 Amb33228699 [1,0,0,0,0,0|3,0,0]=4 479 B8R1.7 NC(=O)[C@H]1CNCO1 Amb27838356 [1,0,0,0,0,0|3,0,0]=4 480 B8R1.7 NC(=O)[C@H]1CNCS1 Amb27488571 [1,0,0,0,0,0|3,0,0]=4 481 B8R1.7 NC(=S)C1CCCC1 Amb6245625 [1,0,0,0,0,0|2,1,0]=4 482 B8R1.7 NC(=S)C1CCCN1 Amb19148043 [1,0,0,0,0,0|1,1,0]=3 483 B8R1.7 NC(=S)C1CCCO1 Amb18108094 [1,0,0,0,0,0|2,1,0]=4 484 B8R1.7 NC(=S)C1CCCS1 Amb26896532 [1,0,0,0,0,0|2,1,0]=4 485 B8R1.7 NC(=S)N1CCCN1 Amb27838409 [1,0,0,0,0,0|2,1,0]=4 486 B8R1.7 NC(=S)[C@@H]1CCCN1 Amb24588473 [1,0,0,0,0,0|1,1,0]=3 487 B8R1.7 NC(=S)[C@H]1CCCN1 Amb24469314 [1,0,0,0,0,0|1,1,0]=3 488 B8R1.7 NS(=O)C1CCCC1 Amb26405101 [1,0,0,0,0,0|3,0,0]=4 489 B8R1.7 O=C(Br)C1CCCC1 Amb27793826 [1,0,0,0,0,0|2,0,0]=3 490 B8R1.7 O=C(Cl)C1=CCCC1 Amb25870845 [1,0,0,0,0,0|2,0,1]=4 491 B8R1.7 O=C(Cl)C1CCCC1 Amb3939172 [1,0,0,0,0,0|2,0,0]=3 492 B8R1.7 O=C(Cl)C1CCCN1 Amb27258805 [1,0,0,0,0,0|1,0,0]=2 493 B8R1.7 O=C(Cl)C1CCCO1 Amb5747111 [1,0,0,0,0,0|2,0,0]=3 494 B8R1.7 O=C(Cl)C1CCCS1 Amb25189766 [1,0,0,0,0,0|2,0,0]=3 495 B8R1.7 O=C(Cl)C1CCNC1 Amb28316213 [1,0,0,0,0,0|3,0,0]=4 496 B8R1.7 O=C(Cl)C1CCOC1 Amb9677595 [1,0,0,0,0,0|3,0,0]=4 497 B8R1.7 O=C(Cl)C1CCSC1 Amb27778382 [1,0,0,0,0,0|3,0,0]=4 498 B8R1.7 O=C(Cl)C1CSCN1 Amb17142875 [1,0,0,0,0,0|2,0,0]=3 499 B8R1.7 O=C(Cl)N1CCCC1 Amb8516771 [1,0,0,0,0,0|3,0,0]=4 500 B8R1.7 O=C(Cl)[C@@H]1CCCN1 Amb28313801 [1,0,0,0,0,0|1,0,0]=2 501 B8R1.7 O=C(O)C1=CCCC1 Amb3940288 [1,0,0,0,0,0|1,0,1]=3 502 B8R1.7 O=C(O)C1=CCCN1 Amb17593173 [1,0,0,0,0,0|0,0,2]=3 503 B8R1.7 O=C(O)C1=CCCO1 Amb19148920 [1,0,0,0,0,0|1,0,2]=4 504 B8R1.7 O=C(O)C1=CCCS1 Amb18642795 [1,0,0,0,0,0|1,0,2]=4 505 B8R1.7 O=C(O)C1=CCNC1 Amb26017269 [1,0,0,0,0,0|2,0,1]=4 506 B8R1.7 O=C(O)C1=CCOC1 Amb24434391 [1,0,0,0,0,0|2,0,1]=4 507 B8R1.7 O=C(O)C1=CCSC1 Amb18642797 [1,0,0,0,0,0|2,0,1]=4 508 B8R1.7 O=C(O)C1=COCC1 Amb18124248 [1,0,0,0,0,0|2,0,1]=4 509 B8R1.7 O=C(O)C1=NCCN1 Amb27787520 [1,0,0,0,0,0|1,0,1]=3 510 B8R1.7 O=C(O)C1=NOCC1 Amb24353499 [1,0,0,0,0,0|1,0,2]=4 511 B8R1.7 O=C(O)C1C=CCC1 Amb18641680 [1,0,0,0,0,0|1,0,1]=3 512 B8R1.7 O=C(O)C1C=CCN1 Amb22899488 [1,0,0,0,0,0|0,0,2]=3 513 B8R1.7 O=C(O)C1C=CCN1 Amb9804432 [1,0,0,0,0,0|0,0,2]=3 514 B8R1.7 O=C(O)C1C=CCO1 Amb18641762 [1,0,0,0,0,0|1,0,2]=4 515 B8R1.7 O=C(O)C1CC=CC1 Amb2694750 [1,0,0,0,0,0|1,0,2]=4 516 B8R1.7 O=C(O)C1CC=NN1 Amb18641765 [1,0,0,0,0,0|1,0,1]=3 517 B8R1.7 O=C(O)C1CC=NO1 Amb27216537 [1,0,0,0,0,0|2,0,1]=4 518 B8R1.7 O=C(O)C1CCC=N1 Amb27849168 [1,0,0,0,0,0|0,0,2]=3 519 B8R1.7 O=C(O)C1CCCC1 Amb3939849 [1,0,0,0,0,0|1,0,0]=2 520 B8R1.7 O=C(O)C1CCCN1 Amb1157517 [1,0,0,0,0,0|0,0,0]=1 521 B8R1.7 O=C(O)C1CCCN1 Amb22040086 [1,0,0,0,0,0|0,0,0]=1 522 B8R1.7 O=C(O)C1CCCO1 Amb9702828 [1,0,0,0,0,0|1,0,0]=2 523 B8R1.7 O=C(O)C1CCCS1 Amb18124363 [1,0,0,0,0,0|1,0,0]=2 524 B8R1.7 O=C(O)C1CCNC1 Amb16230724 [1,0,0,0,0,0|2,0,0]=3 525 B8R1.7 O=C(O)C1CCNC1 Amb16233446 [1,0,0,0,0,0|2,0,0]=3 526 B8R1.7 O=C(O)C1CCNC1 Amb2694866 [1,0,0,0,0,0|2,0,0]=3 527 B8R1.7 O=C(O)C1CCNO1 Amb28205451 [1,0,0,0,0,0|2,0,0]=3 528 B8R1.7 O=C(O)C1CCNO1 Amb33329025 [1,0,0,0,0,0|2,0,0]=3 529 B8R1.7 O=C(O)C1CCOC1 Amb33542759 [1,0,0,0,0,0|2,0,0]=3 530 B8R1.7 O=C(O)C1CCSC1 Amb18124360 [1,0,0,0,0,0|2,0,0]=3 531 B8R1.7 O=C(O)C1CCSS1 Amb8388097 [1,0,0,0,0,0|2,0,0]=3 532 B8R1.7 O=C(O)C1CNCN1 Amb27597638 [1,0,0,0,0,0|1,0,0]=2 533 B8R1.7 O=C(O)C1COC=N1 Amb28291372 [1,0,0,0,0,0|1,0,2]=4 534 B8R1.7 O=C(O)C1COCN1 Amb2694915 [1,0,0,0,0,0|1,0,0]=2 535 B8R1.7 O=C(O)C1COCN1 Amb2696354 [1,0,0,0,0,0|1,0,0]=2 536 B8R1.7 O=C(O)C1COCO1 Amb27810510 [1,0,0,0,0,0|2,0,0]=3 537 B8R1.7 O=C(O)C1CSCN1 Amb532947 [1,0,0,0,0,0|1,0,0]=2 538 B8R1.7 O=C(O)C1CSSC1 Amb17593735 [1,0,0,0,0,0|3,0,0]=4 539 B8R1.7 O=C(O)C1NCCS1 Amb2444644 [1,0,0,0,0,0|1,0,0]=2 540 B8R1.7 O=C(O)C1OCCO1 Amb24349582 [1,0,0,0,0,0|2,0,0]=3 541 B8R1.7 O=C(O)C1SCCS1 Amb20669087 [1,0,0,0,0,0|2,0,0]=3 542 B8R1.7 O=C(O)[C@@H]1C=CCN1 Amb16183937 [1,0,0,0,0,0|0,0,2]=3 543 B8R1.7 O=C(O)[C@@H]1C=CCN1 Amb22750611 [1,0,0,0,0,0|0,0,2]=3 544 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb3940757 [1,0,0,0,0,0|0,0,0]=1 545 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb6754105 [1,0,0,0,0,0|0,0,0]=1 546 B8R1.7 O=C(O)[C@@H]1CCCO1 Amb3940908 [1,0,0,0,0,0|1,0,0]=2 547 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb6893875 [1,0,0,0,0,0|2,0,0]=3 548 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb8630322 [1,0,0,0,0,0|2,0,0]=3 549 B8R1.7 O=C(O)[C@@H]1CCOC1 Amb10603235 [1,0,0,0,0,0|2,0,0]=3 550 B8R1.7 O=C(O)[C@@H]1CCON1 Amb26919409 [1,0,0,0,0,0|1,0,0]=2 551 B8R1.7 O=C(O)[C@@H]1COCN1 Amb19515958 [1,0,0,0,0,0|1,0,0]=2 552 B8R1.7 O=C(O)[C@@H]1CSC=N1 Amb35648199 [1,0,0,0,0,0|1,0,2]=4 553 B8R1.7 O=C(O)[C@@H]1CSCN1 Amb3940400 [1,0,0,0,0,0|1,0,0]=2 554 B8R1.7 O=C(O)[C@H]1C=CCC1 Amb27872028 [1,0,0,0,0,0|1,0,1]=3 555 B8R1.7 O=C(O)[C@H]1C=CCN1 Amb34158387 [1,0,0,0,0,0|0,0,2]=3 556 B8R1.7 O=C(O)[C@H]1CCC=N1 Amb28128325 [1,0,0,0,0,0|0,0,2]=3 557 B8R1.7 O=C(O)[C@H]1CCCN1 Amb2720569 [1,0,0,0,0,0|0,0,0]=1 558 B8R1.7 O=C(O)[C@H]1CCCO1 Amb3941554 [1,0,0,0,0,0|1,0,0]=2 559 B8R1.7 O=C(O)[C@H]1CCNC1 Amb2700058 [1,0,0,0,0,0|2,0,0]=3 560 B8R1.7 O=C(O)[C@H]1CCNC1 Amb6893874 [1,0,0,0,0,0|2,0,0]=3 561 B8R1.7 O=C(O)[C@H]1CCOC1 Amb22226787 [1,0,0,0,0,0|2,0,0]=3 562 B8R1.7 O=C(O)[C@H]1CCSC1 Amb28241390 [1,0,0,0,0,0|2,0,0]=3 563 B8R1.7 O=C(O)[C@H]1CNCS1 Amb27414077 [1,0,0,0,0,0|2,0,0]=3 564 B8R1.7 O=C(O)[C@H]1CSC=N1 Amb35641724 [1,0,0,0,0,0|1,0,2]=4 565 B8R1.7 O=C(O)[C@H]1CSCN1 Amb544887 [1,0,0,0,0,0|1,0,0]=2 566 B8R1.7 O=C(O)[C@H]1NCCS1 Amb25920370 [1,0,0,0,0,0|1,0,0]=2 567 B8R1.7 O=C(S)C1CCCO1 Amb27827519 [1,0,0,0,0,0|1,1,0]=3 568 B8R1.7 O=C(S)[C@@H]1CCCN1 Amb27468669 [1,0,0,0,0,0|0,1,0]=2 569 B8R1.7 O=C(S)[C@@H]1CCCO1 Amb24117867 [1,0,0,0,0,0|1,1,0]=3 570 B8R1.7 O=C([O-])C1CCC=N1 Amb33624430 [1,0,0,0,0,0|0,0,3]=4 571 B8R1.7 O=C([O-])[C@@H]1CCCN1 Amb34160472 [1,0,0,0,0,0|0,0,1]=2 572 B8R1.7 O=S(Cl)C1CCCC1 Amb25914787 [1,0,0,0,0,0|3,0,0]=4 573 B8R1.7 O=S(O)C1NCCN1 Amb27846291 [1,0,0,0,0,0|2,0,0]=3 574 B8R1.7 O=S([O-])C1CCCC1 Amb26419894 [1,0,0,0,0,0|2,0,1]=4 575 B8R1.7 O=[N+]([O-])C1CCCC1 Amb8517343 [1,0,0,0,0,0|2,0,1]=4 576 B8R1.7 O=[PH](O)C1CCCN1 Amb27450678 [1,0,0,0,0,0|1,0,0]=2 577 B8R1.7 OB(O)C1CCCC1 Amb2447144 [1,0,0,0,0,0|2,0,1]=4 578 B8R1.7 OB(O)C1CCCO1 Amb24317356 [1,0,0,0,0,0|2,0,1]=4 579 B8R1.7 OC(O)[C@H]1CCCN1 Amb27836006 [1,0,0,0,0,0|0,0,2]=3 580 B10R1.14 C#CC(=O)C1CCC(N)C1 Amb28313566 [0,1,0,0,0,0|3,0,0]=4 581 B10R1.14 C#CC(=O)N1CC(O)CO1 Amb27776619 [0,1,0,0,0,0|3,0,0]=4 582 B10R1.14 C#CC(=O)N1CCC(O)C1 Amb24716631 [0,1,0,0,0,0|3,0,0]=4 583 B10R1.14 C#CC(=O)N1C[C@H](O)CO1 Amb27945346 [0,1,0,0,0,0|3,0,0]=4 584 B10R1.14 C=C1CCC(C(=O)OC)C1 Amb25853444 [0,1,0,0,0,0|2,0,1]=4 585 B10R1.14 C=C1CNC(C(=O)OC)C1 Amb27403406 [0,1,0,0,0,0|1,0,1]=3 586 B10R1.14 C=C1CNC(C(=O)OC)C1 Amb32753510 [0,1,0,0,0,0|1,0,1]=3 587 B10R1.14 C=C1CN[C@H](C(=O)OC)C1 Amb28314230 [0,1,0,0,0,0|1,0,1]=3 588 B10R1.14 C=C1CN[C@H](C(=O)OC)C1 Amb32675124 [0,1,0,0,0,0|1,0,1]=3 589 B10R1.14 C=CC(=O)C1CCC(N)C1 Amb25074117 [0,1,0,0,0,0|3,0,0]=4 590 B10R1.14 C=CC(=O)N1C[C@H](O)CO1 Amb27857328 [0,1,0,0,0,0|3,0,0]=4 591 B10R1.14 CC1CCC(C(=O)NO)O1 Amb28289930 [0,1,0,0,0,0|3,0,0]=4 592 B10R1.14 CC1CCC(\C(N)=N\O)C1 Amb26516561 [0,1,0,0,0,0|3,0,0]=4 593 B10R1.14 CC1CCN(C(=O)CO)C1 Amb28189342 [0,1,0,0,0,0|3,0,0]=4 594 B10R1.14 CCC(=O)C1CCC(N)C1 Amb27954767 [0,1,0,0,0,0|3,0,0]=4 595 B10R1.14 CCC(=O)N1CC(O)CO1 Amb28070588 [0,1,0,0,0,0|3,0,0]=4 596 B10R1.14 CCC(=O)N1CCC(O)C1 Amb20669201 [0,1,0,0,0,0|3,0,0]=4 597 B10R1.14 CCC(=O)N1CC[C@H](O)C1 Amb25240174 [0,1,0,0,0,0|3,0,0]=4 598 B10R1.14 CCC(C)C1CC(O)CN1 Amb27265389 [0,1,0,0,0,0|2,0,1]=4 599 B10R1.14 CNC(=O)C1CCC(N)C1 Amb27490505 [0,1,0,0,0,0|3,0,0]=4 600 B10R1.14 CNC(=O)C1CCC(O)C1 Amb28456895 [0,1,0,0,0,0|2,0,0]=3 601 B10R1.14 CNC(=O)N1CC[C@H](O)C1 Amb27424836 [0,1,0,0,0,0|3,0,0]=4 602 B10R1.14 CNC(=O)[C@@H]1CC[C@@H](O)C1 Amb27827101 [0,1,0,0,0,0|2,0,0]=3 603 B10R1.14 CNC(=O)[C@@H]1C[C@@H](F)CN1 Amb27266121 [0,1,0,0,0,0|2,0,0]=3 604 B10R1.14 CNC(=O)[C@@H]1C[C@@H](F)CN1 Amb33747342 [0,1,0,0,0,0|2,0,0]=3 605 B10R1.14 CNC(=O)[C@H]1C[C@H](O)CN1 Amb27854129 [0,1,0,0,0,0|1,0,0]=2 606 B10R1.14 COC(=O)C1=CC(O)NN1 Amb33716468 [0,1,0,0,0,0|1,0,2]=4 607 B10R1.14 COC(=O)C1=CCC(N)C1 Amb27594016 [0,1,0,0,0,0|2,0,1]=4 608 B10R1.14 COC(=O)C1=CCC(N)C1 Amb32668499 [0,1,0,0,0,0|2,0,1]=4 609 B10R1.14 COC(=O)C1=CC[C@H](C)C1 Amb26590931 [0,1,0,0,0,0|2,0,1]=4 610 B10R1.14 COC(=O)C1=C[C@@H](O)CC1 Amb28345358 [0,1,0,0,0,0|1,0,2]=4 611 B10R1.14 COC(=O)C1=C[C@H](O)CC1 Amb27217866 [0,1,0,0,0,0|1,0,2]=4 612 B10R1.14 COC(=O)C1=NCC(O)C1 Amb27863813 [0,1,0,0,0,0|0,0,2]=3 613 B10R1.14 COC(=O)C1=NC[C@H](O)C1 Amb27470314 [0,1,0,0,0,0|0,0,2]=3 614 B10R1.14 COC(=O)C1C=C(O)NN1 Amb27798974 [0,1,0,0,0,0|1,0,2]=4 615 B10R1.14 COC(=O)C1C=CC(N)C1 Amb23597961 [0,1,0,0,0,0|2,0,1]=4 616 B10R1.14 COC(=O)C1C=CC(N)C1 Amb32676698 [0,1,0,0,0,0|2,0,1]=4 617 B10R1.14 COC(=O)C1CC(=O)CN1 Amb27874114 [0,1,0,0,0,0|0,0,2]=3 618 B10R1.14 COC(=O)C1CC(=O)CO1 Amb22755134 [0,1,0,0,0,0|1,0,2]=4 619 B10R1.14 COC(=O)C1CC(=O)CS1 Amb18199422 [0,1,0,0,0,0|1,0,2]=4 620 B10R1.14 COC(=O)C1CC(=O)NN1 Amb32993767 [0,1,0,0,0,0|1,0,2]=4 621 B10R1.14 COC(=O)C1CC(C)CN1 Amb27455152 [0,1,0,0,0,0|1,0,0]=2 622 B10R1.14 COC(=O)C1CC(C)NO1 Amb27631193 [0,1,0,0,0,0|3,0,0]=4 623 B10R1.14 COC(=O)C1CC(F)CN1 Amb23597507 [0,1,0,0,0,0|1,0,0]=2 624 B10R1.14 COC(=O)C1CC(F)CN1 Amb33969360 [0,1,0,0,0,0|1,0,0]=2 625 B10R1.14 COC(=O)C1CC(N)CS1 Amb18199086 [0,1,0,0,0,0|2,0,0]=3 626 B10R1.14 COC(=O)C1CC(O)CN1 Amb1152079 [0,1,0,0,0,0|0,0,0]=1 627 B10R1.14 COC(=O)C1CC(O)CN1 Amb9702913 [0,1,0,0,0,0|0,0,0]=1 628 B10R1.14 COC(=O)C1CC(O)CO1 Amb24648233 [0,1,0,0,0,0|1,0,0]=2 629 B10R1.14 COC(=O)C1CCC(=O)C1 Amb10067354 [0,1,0,0,0,0|1,0,2]=4 630 B10R1.14 COC(=O)C1CCC(Br)C1 Amb27839371 [0,1,0,0,0,0|2,0,0]=3 631 B10R1.14 COC(=O)C1CCC(C)C1 Amb27831203 [0,1,0,0,0,0|2,0,0]=3 632 B10R1.14 COC(=O)C1CCC(C)O1 Amb17939078 [0,1,0,0,0,0|3,0,0]=4 633 B10R1.14 COC(=O)C1CCC(F)C1 Amb23456070 [0,1,0,0,0,0|2,0,0]=3 634 B10R1.14 COC(=O)C1CCC(N)C1 Amb22001889 [0,1,0,0,0,0|2,0,0]=3 635 B10R1.14 COC(=O)C1CCC(N)C1 Amb22491847 [0,1,0,0,0,0|2,0,0]=3 636 B10R1.14 COC(=O)C1CCC(O)C1 Amb22755872 [0,1,0,0,0,0|1,0,0]=2 637 B10R1.14 COC(=O)C1CCC(O)N1 Amb27838033 [0,1,0,0,0,0|2,0,0]=3 638 B10R1.14 COC(=O)C1CCN(C)C1 Amb9901745 [0,1,0,0,0,0|3,0,0]=4 639 B10R1.14 COC(=O)C1CNC(C)C1 Amb18831572 [0,1,0,0,0,0|3,0,0]=4 640 B10R1.14 COC(=O)C1C[C@@H](O)CN1 Amb33249653 [0,1,0,0,0,0|0,0,0]=1 641 B10R1.14 COC(=O)C1C[C@H](O)CN1 Amb27785434 [0,1,0,0,0,0|0,0,0]=1 642 B10R1.14 COC(=O)C1NC(C)CS1 Amb28290260 [0,1,0,0,0,0|3,0,0]=4 643 B10R1.14 COC(=O)N1CC(O)CO1 Amb27970344 [0,1,0,0,0,0|2,0,0]=3 644 B10R1.14 COC(=O)N1CCC(F)C1 Amb35594399 [0,1,0,0,0,0|3,0,0]=4 645 B10R1.14 COC(=O)N1CCC(N)C1 Amb18279589 [0,1,0,0,0,0|3,0,0]=4 646 B10R1.14 COC(=O)N1CCC(N)C1 Amb33549976 [0,1,0,0,0,0|3,0,0]=4 647 B10R1.14 COC(=O)N1CCC(O)C1 Amb24457006 [0,1,0,0,0,0|2,0,0]=3 648 B10R1.14 COC(=O)N1CC[C@@H](N)C1 Amb28049495 [0,1,0,0,0,0|3,0,0]=4 649 B10R1.14 COC(=O)N1CC[C@@H](O)C1 Amb24479237 [0,1,0,0,0,0|2,0,0]=3 650 B10R1.14 COC(=O)[C@@H]1C=C(C)CN1 Amb28456827 [0,1,0,0,0,0|1,0,2]=4 651 B10R1.14 COC(=O)[C@@H]1C=C[C@H](N)C1 Amb25911944 [0,1,0,0,0,0|2,0,1]=4 652 B10R1.14 COC(=O)[C@@H]1CC(=O)CN1 Amb27213178 [0,1,0,0,0,0|0,0,2]=3 653 B10R1.14 COC(=O)[C@@H]1CC(=O)CN1 Amb33743709 [0,1,0,0,0,0|0,0,2]=3 654 B10R1.14 COC(=O)[C@@H]1CC(C)CN1 Amb27413549 [0,1,0,0,0,0|1,0,0]=2 655 B10R1.14 COC(=O)[C@@H]1CC(F)CN1 Amb23536935 [0,1,0,0,0,0|1,0,0]=2 656 B10R1.14 COC(=O)[C@@H]1CC(O)CN1 Amb32411768 [0,1,0,0,0,0|0,0,0]=1 657 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 Amb27459673 [0,1,0,0,0,0|1,0,2]=4 658 B10R1.14 COC(=O)[C@@H]1CCC(C)N1 Amb25843220 [0,1,0,0,0,0|3,0,0]=4 659 B10R1.14 COC(=O)[C@@H]1CCC(O)N1 Amb27252881 [0,1,0,0,0,0|2,0,0]=3 660 B10R1.14 COC(=O)[C@@H]1CCC(O)O1 Amb27838942 [0,1,0,0,0,0|2,0,0]=3 661 B10R1.14 COC(=O)[C@@H]1CC[C@@H](Br)C1 Amb31028914 [0,1,0,0,0,0|2,0,0]=3 662 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C)C1 Amb25868500 [0,1,0,0,0,0|2,0,0]=3 663 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C)N1 Amb25919536 [0,1,0,0,0,0|3,0,0]=4 664 B10R1.14 COC(=O)[C@@H]1CC[C@@H](N)C1 Amb24183379 [0,1,0,0,0,0|2,0,0]=3 665 B10R1.14 COC(=O)[C@@H]1CC[C@@H](N)C1 Amb28137702 [0,1,0,0,0,0|2,0,0]=3 666 B10R1.14 COC(=O)[C@@H]1CC[C@@H](O)C1 Amb26642322 [0,1,0,0,0,0|1,0,0]=2 667 B10R1.14 COC(=O)[C@@H]1CC[C@H](C)C1 Amb24578320 [0,1,0,0,0,0|2,0,0]=3 668 B10R1.14 COC(=O)[C@@H]1CC[C@H](C)N1 Amb26966282 [0,1,0,0,0,0|3,0,0]=4 669 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 Amb23440272 [0,1,0,0,0,0|2,0,0]=3 670 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 Amb26907379 [0,1,0,0,0,0|2,0,0]=3 671 B10R1.14 COC(=O)[C@@H]1CC[C@H](O)C1 Amb22746119 [0,1,0,0,0,0|1,0,0]=2 672 B10R1.14 COC(=O)[C@@H]1CC[C@H](O)N1 Amb27814660 [0,1,0,0,0,0|2,0,0]=3 673 B10R1.14 COC(=O)[C@@H]1C[C@@H](F)CN1 Amb22739014 [0,1,0,0,0,0|1,0,0]=2 674 B10R1.14 COC(=O)[C@@H]1C[C@@H](F)CN1 Amb8386380 [0,1,0,0,0,0|1,0,0]=2 675 B10R1.14 COC(=O)[C@@H]1C[C@@H](N)CO1 Amb27639251 [0,1,0,0,0,0|2,0,0]=3 676 B10R1.14 COC(=O)[C@@H]1C[C@@H](O)CN1 Amb2716189 [0,1,0,0,0,0|0,0,0]=1 677 B10R1.14 COC(=O)[C@@H]1C[C@@H](O)CN1 Amb5718689 [0,1,0,0,0,0|0,0,0]=1 678 B10R1.14 COC(=O)[C@@H]1C[C@@H](O)CO1 Amb27970939 [0,1,0,0,0,0|1,0,0]=2 679 B10R1.14 COC(=O)[C@@H]1C[C@@H](S)CN1 Amb34912876 [0,1,0,0,0,0|0,1,0]=2 680 B10R1.14 COC(=O)[C@@H]1C[C@H](C)CN1 Amb28141858 [0,1,0,0,0,0|1,0,0]=2 681 B10R1.14 COC(=O)[C@@H]1C[C@H](C)CN1 Amb33623683 [0,1,0,0,0,0|1,0,0]=2 682 B10R1.14 COC(=O)[C@@H]1C[C@H](Cl)CN1 Amb25202432 [0,1,0,0,0,0|1,0,0]=2 683 B10R1.14 COC(=O)[C@@H]1C[C@H](Cl)CN1 Amb35750164 [0,1,0,0,0,0|1,0,0]=2 684 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 Amb22587327 [0,1,0,0,0,0|1,0,0]=2 685 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 Amb8393719 [0,1,0,0,0,0|1,0,0]=2 686 B10R1.14 COC(=O)[C@@H]1C[C@H](N)CN1 Amb10603141 [0,1,0,0,0,0|1,0,0]=2 687 B10R1.14 COC(=O)[C@@H]1C[C@H](N)CS1 Amb33802884 [0,1,0,0,0,0|2,0,0]=3 688 B10R1.14 COC(=O)[C@@H]1C[C@H](N)CS1 Amb33802885 [0,1,0,0,0,0|2,0,0]=3 689 B10R1.14 COC(=O)[C@@H]1C[C@H](O)CN1 Amb22230437 [0,1,0,0,0,0|0,0,0]=1 690 B10R1.14 COC(=O)[C@@H]1C[C@H](O)CN1 Amb9785165 [0,1,0,0,0,0|0,0,0]=1 691 B10R1.14 COC(=O)[C@H]1C=C[C@@H](N)C1 Amb22274549 [0,1,0,0,0,0|2,0,1]=4 692 B10R1.14 COC(=O)[C@H]1C=C[C@@H](N)C1 Amb22504308 [0,1,0,0,0,0|2,0,1]=4 693 B10R1.14 COC(=O)[C@H]1CC(F)CN1 Amb26602159 [0,1,0,0,0,0|1,0,0]=2 694 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 Amb23440273 [0,1,0,0,0,0|1,0,2]=4 695 B10R1.14 COC(=O)[C@H]1CCC(O)O1 Amb28323721 [0,1,0,0,0,0|2,0,0]=3 696 B10R1.14 COC(=O)[C@H]1CC[C@@H](C)C1 Amb26602282 [0,1,0,0,0,0|2,0,0]=3 697 B10R1.14 COC(=O)[C@H]1CC[C@@H](C)N1 Amb26655238 [0,1,0,0,0,0|3,0,0]=4 698 B10R1.14 COC(=O)[C@H]1CC[C@@H](C)O1 Amb24630211 [0,1,0,0,0,0|3,0,0]=4 699 B10R1.14 COC(=O)[C@H]1CC[C@@H](N)C1 Amb25230396 [0,1,0,0,0,0|2,0,0]=3 700 B10R1.14 COC(=O)[C@H]1CC[C@@H](N)C1 Amb33801647 [0,1,0,0,0,0|2,0,0]=3 701 B10R1.14 COC(=O)[C@H]1CC[C@@H](O)C1 Amb26393349 [0,1,0,0,0,0|1,0,0]=2 702 B10R1.14 COC(=O)[C@H]1CC[C@H](Br)C1 Amb33801095 [0,1,0,0,0,0|2,0,0]=3 703 B10R1.14 COC(=O)[C@H]1CC[C@H](N)C1 Amb26617210 [0,1,0,0,0,0|2,0,0]=3 704 B10R1.14 COC(=O)[C@H]1CC[C@H](N)C1 Amb33806306 [0,1,0,0,0,0|2,0,0]=3 705 B10R1.14 COC(=O)[C@H]1CC[C@H](O)C1 Amb26024878 [0,1,0,0,0,0|1,0,0]=2 706 B10R1.14 COC(=O)[C@H]1C[C@@H](F)CN1 Amb22886953 [0,1,0,0,0,0|1,0,0]=2 707 B10R1.14 COC(=O)[C@H]1C[C@@H](F)CN1 Amb27869054 [0,1,0,0,0,0|1,0,0]=2 708 B10R1.14 COC(=O)[C@H]1C[C@@H](O)CN1 Amb26926087 [0,1,0,0,0,0|0,0,0]=1 709 B10R1.14 COC(=O)[C@H]1C[C@@H](O)CN1 Amb5718674 [0,1,0,0,0,0|0,0,0]=1 710 B10R1.14 COC(=O)[C@H]1C[C@H](F)CN1 Amb24631116 [0,1,0,0,0,0|1,0,0]=2 711 B10R1.14 COC(=O)[C@H]1C[C@H](N)CO1 Amb27963287 [0,1,0,0,0,0|2,0,0]=3 712 B10R1.14 COC(=O)[C@H]1C[C@H](O)CN1 Amb10069258 [0,1,0,0,0,0|0,0,0]=1 713 B10R1.14 COC(=O)[C@H]1C[C@H](O)CN1 Amb26919920 [0,1,0,0,0,0|0,0,0]=1 714 B10R1.14 COC(C)C1CC(C)CN1 Amb28067798 [0,1,0,0,0,0|2,0,1]=4 715 B10R1.14 COC(C)C1CC(O)CN1 Amb28287386 [0,1,0,0,0,0|1,0,1]=3 716 B10R1.14 COC(C)C1CC(O)CO1 Amb35711526 [0,1,0,0,0,0|2,0,1]=4 717 B10R1.14 C[C@H](CO)[C@@H]1CCC(O)C1 Amb27184492 [0,1,0,0,0,0|2,0,1]=4 718 B10R1.14 NC1CC=C(C(=O)NO)C1 Amb35582096 [0,1,0,0,0,0|2,0,1]=4 719 B10R1.14 NCC(=O)N1CC(O)CO1 Amb27785456 [0,1,0,0,0,0|3,0,0]=4 720 B10R1.14 NCC(=O)N1CC[C@@H](O)C1 Amb28126036 [0,1,0,0,0,0|3,0,0]=4 721 B10R1.14 NCC(=O)N1C[C@H](O)CO1 Amb28045231 [0,1,0,0,0,0|3,0,0]=4 722 B10R1.14 NNC(=O)[C@@H]1C[C@@H](O)CN1 Amb27788188 [0,1,0,0,0,0|1,0,0]=2 723 B10R1.14 N\C(=N/O)N1CCC(O)C1 Amb27760913 [0,1,0,0,0,0|3,0,0]=4 724 B10R1.14 O=C(CCl)N1CCC(O)C1 Amb18788242 [0,1,0,0,0,0|3,0,0]=4 725 B10R1.14 O=C(CCl)N1CC[C@H](O)C1 Amb28069933 [0,1,0,0,0,0|3,0,0]=4 726 B10R1.14 OCC(O)C1CC(O)CN1 Amb27607530 [0,1,0,0,0,0|0,0,2]=3 727 B10R1.31 C#C[C@@H]1CC[C@@H](C(=O)O)N1 Amb25930020 [0,1,0,0,0,0|3,0,0]=4 728 B10R1.31 C#C[C@@H]1CC[C@H](C(=O)O)N1 Amb27964144 [0,1,0,0,0,0|3,0,0]=4 729 B10R1.31 C#C[C@H]1CC[C@@H](C(=O)O)N1 Amb28141834 [0,1,0,0,0,0|3,0,0]=4 730 B10R1.31 C#C[C@H]1CC[C@H](C(=O)O)N1 Amb27789120 [0,1,0,0,0,0|3,0,0]=4 731 B10R1.31 C=CC1CCC(C(=O)O)C1 Amb18643554 [0,1,0,0,0,0|2,0,0]=3 732 B10R1.31 C=C[C@@H]1CC[C@H](C(=O)O)N1 Amb27196476 [0,1,0,0,0,0|3,0,0]=4 733 B10R1.31 C=C[C@H]1CC[C@@H](C(=O)O)N1 Amb27195910 [0,1,0,0,0,0|3,0,0]=4 734 B10R1.31 CC(=O)N1CCC(CO)C1 Amb33530059 [0,1,0,0,0,0|3,0,0]=4 735 B10R1.31 CC(=O)[C@@H]1CC[C@H](C=O)C1 Amb28052707 [0,1,0,0,0,0|2,0,1]=4 736 B10R1.31 CCC1CCC(C(=O)O)N1 Amb24694112 [0,1,0,0,0,0|3,0,0]=4 737 B10R1.31 CCC1CCC(C(=O)O)N1 Amb28555622 [0,1,0,0,0,0|3,0,0]=4 738 B10R1.31 CCC1CCC(C(=O)O)O1 Amb20668759 [0,1,0,0,0,0|3,0,0]=4 739 B10R1.31 CCC1CCC(C(C)=O)C1 Amb27490849 [0,1,0,0,0,0|3,0,0]=4 740 B10R1.31 CCC1CNC(C(=O)O)C1 Amb22496300 [0,1,0,0,0,0|1,0,0]=2 741 B10R1.31 CCC1CNC(C(N)=O)C1 Amb27852411 [0,1,0,0,0,0|2,0,0]=3 742 B10R1.31 CCC1CN[C@H](C(=O)O)C1 Amb27168235 [0,1,0,0,0,0|1,0,0]=2 743 B10R1.31 CCN1CCC(C(=O)O)C1 Amb10607746 [0,1,0,0,0,0|3,0,0]=4 744 B10R1.31 CCN1CC[C@H](C(=O)O)C1 Amb27406792 [0,1,0,0,0,0|3,0,0]=4 745 B10R1.31 CC[C@@H]1CC[C@@H](C(=O)O)O1 Amb35750180 [0,1,0,0,0,0|3,0,0]=4 746 B10R1.31 CC[C@@H]1CN[C@H](C(=O)O)C1 Amb35747486 [0,1,0,0,0,0|1,0,0]=2 747 B10R1.31 CC[C@@H]1CN[C@H](C(=O)O)C1 Amb35747917 [0,1,0,0,0,0|1,0,0]=2 748 B10R1.31 CC[C@H]1CC[C@@H](C(=O)O)N1 Amb28053433 [0,1,0,0,0,0|3,0,0]=4 749 B10R1.31 CNC1CCC(C(=O)O)C1 Amb23454119 [0,1,0,0,0,0|2,0,0]=3 750 B10R1.31 CN[C@H]1CN[C@H](C(=O)O)C1 Amb27781818 [0,1,0,0,0,0|1,0,0]=2 751 B10R1.31 COC1=NC(C(=O)O)CC1 Amb27246925 [0,1,0,0,0,0|2,0,1]=4 752 B10R1.31 COC1CCC(C(=O)O)C1 Amb24399167 [0,1,0,0,0,0|1,0,0]=2 753 B10R1.31 COC1CNC(C(=O)O)C1 Amb33530569 [0,1,0,0,0,0|0,0,0]=1 754 B10R1.31 COC1CNC(C(C)=O)C1 Amb27390642 [0,1,0,0,0,0|1,0,0]=2 755 B10R1.31 COC1CNC(C(C)O)C1 Amb35740747 [0,1,0,0,0,0|1,0,1]=3 756 B10R1.31 COC1CNC(C(N)=O)C1 Amb18951799 [0,1,0,0,0,0|1,0,0]=2 757 B10R1.31 COC1CNC(C(N)=O)C1 Amb32666414 [0,1,0,0,0,0|1,0,0]=2 758 B10R1.31 COC1CN[C@H](C(=O)O)C1 Amb26037119 [0,1,0,0,0,0|0,0,0]=1 759 B10R1.31 CO[C@@H]1CCN(C(=O)Cl)C1 Amb32863960 [0,1,0,0,0,0|3,0,0]=4 760 B10R1.31 CO[C@@H]1CCN(C(C)=O)C1 Amb27827252 [0,1,0,0,0,0|3,0,0]=4 761 B10R1.31 CO[C@@H]1CN[C@@H](C(=O)O)C1 Amb24112984 [0,1,0,0,0,0|0,0,0]=1 762 B10R1.31 CO[C@@H]1CN[C@H](C(=O)O)C1 Amb24514992 [0,1,0,0,0,0|0,0,0]=1 763 B10R1.31 CO[C@@H]1CN[C@H](C(N)=O)C1 Amb27860461 [0,1,0,0,0,0|1,0,0]=2 764 B10R1.31 CO[C@@H]1CN[C@H](C(N)=O)C1 Amb28697022 [0,1,0,0,0,0|1,0,0]=2 765 B10R1.31 CO[C@H]1CCN(C(=O)Cl)C1 Amb33482600 [0,1,0,0,0,0|3,0,0]=4 766 B10R1.31 CO[C@H]1CC[C@@H](C(=O)O)C1 Amb26657399 [0,1,0,0,0,0|1,0,0]=2 767 B10R1.31 CO[C@H]1CN[C@@H](C(=O)O)C1 Amb25231723 [0,1,0,0,0,0|0,0,0]=1 768 B10R1.31 CO[C@H]1CN[C@@H](C(N)=O)C1 Amb27882640 [0,1,0,0,0,0|1,0,0]=2 769 B10R1.31 CO[C@H]1CN[C@H](C(=O)O)C1 Amb25959597 [0,1,0,0,0,0|0,0,0]=1 770 B10R1.31 CSC1CNC(C(=O)O)C1 Amb27838029 [0,1,0,0,0,0|0,1,0]=2 771 B10R1.31 CSC1CN[C@H](C(=O)O)C1 Amb27620352 [0,1,0,0,0,0|0,1,0]=2 772 B10R1.31 CS[C@@H]1CN[C@H](C(=O)O)C1 Amb27637696 [0,1,0,0,0,0|0,1,0]=2 773 B10R1.31 N#CC1CCC(C(=O)O)O1 Amb28280556 [0,1,0,0,0,0|3,0,0]=4 774 B10R1.31 N#CC1CNC(C(N)=O)C1 Amb27408555 [0,1,0,0,0,0|2,0,0]=3 775 B10R1.31 N#CN1CCC(C(=O)O)C1 Amb30031679 [0,1,0,0,0,0|3,0,0]=4 776 B10R1.31 N#C[C@@H]1CN[C@H](C(=O)O)C1 Amb10603138 [0,1,0,0,0,0|1,0,0]=2 777 B10R1.31 N#C[C@H]1CN[C@H](C(=O)O)C1 Amb10603133 [0,1,0,0,0,0|1,0,0]=2 778 B10R1.31 NC(=O)C1CCC(CO)C1 Amb26317542 [0,1,0,0,0,0|2,0,0]=3 779 B10R1.31 NC(=O)N1CCC(CO)C1 Amb27165252 [0,1,0,0,0,0|3,0,0]=4 780 B10R1.31 NC(=O)[C@@H]1CC[C@H](CO)C1 Amb25708732 [0,1,0,0,0,0|2,0,0]=3 781 B10R1.31 NC(=O)[C@@H]1CC[C@H](CO)O1 Amb27643548 [0,1,0,0,0,0|3,0,0]=4 782 B10R1.31 NCC1CCC(C(=O)O)C1 Amb28202595 [0,1,0,0,0,0|2,0,0]=3 783 B10R1.31 NCC1CCC(C(=O)O)O1 Amb27451875 [0,1,0,0,0,0|3,0,0]=4 784 B10R1.31 NC[C@@H]1CC[C@@H](C(=O)O)C1 Amb10066932 [0,1,0,0,0,0|2,0,0]=3 785 B10R1.31 NC[C@@H]1CC[C@@H](C(=O)O)O1 Amb27420232 [0,1,0,0,0,0|3,0,0]=4 786 B10R1.31 NC[C@@H]1CC[C@H](C(=O)O)O1 Amb32645997 [0,1,0,0,0,0|3,0,0]=4 787 B10R1.31 NC[C@@H]1CC[C@H](C(=O)O)O1 Amb33098523 [0,1,0,0,0,0|3,0,0]=4 788 B10R1.31 NC[C@@H]1CN[C@H](C(=O)O)C1 Amb24117206 [0,1,0,0,0,0|1,0,0]=2 789 B10R1.31 NC[C@@H]1CN[C@H](C(=O)O)C1 Amb26415233 [0,1,0,0,0,0|1,0,0]=2 790 B10R1.31 NC[C@H]1CC[C@@H](C(=O)O)O1 Amb27959990 [0,1,0,0,0,0|3,0,0]=4 791 B10R1.31 NC[C@H]1CN[C@H](C(=O)O)C1 Amb24117205 [0,1,0,0,0,0|1,0,0]=2 792 B10R1.31 NC[C@H]1CN[C@H](C(=O)O)C1 Amb25912130 [0,1,0,0,0,0|1,0,0]=2 793 B10R1.31 NO[C@@H]1CN[C@H](C(=O)O)C1 Amb25188204 [0,1,0,0,0,0|0,0,0]=1 794 B10R1.31 O=C(Cl)C1CCC(CO)C1 Amb27660986 [0,1,0,0,0,0|2,0,0]=3 795 B10R1.31 O=C(O)C1=NOC(CO)C1 Amb27433282 [0,1,0,0,0,0|1,0,2]=4 796 B10R1.31 O=C(O)C1CC(OS)CN1 Amb27446350 [0,1,0,0,0,0|0,0,0]=1 797 B10R1.31 O=C(O)C1CCC(CF)N1 Amb27233067 [0,1,0,0,0,0|3,0,0]=4 798 B10R1.31 O=C(O)C1CCC(CO)N1 Amb24502434 [0,1,0,0,0,0|2,0,0]=3 799 B10R1.31 O=C(O)C1CC\C(=N/O)C1 Amb23453115 [0,1,0,0,0,0|1,0,1]=3 800 B10R1.31 O=C(O)C1CSC(CO)N1 Amb27837995 [0,1,0,0,0,0|3,0,0]=4 801 B10R1.31 O=C(O)C1C\C(=C\F)CN1 Amb27838047 [0,1,0,0,0,0|1,0,1]=3 802 B10R1.31 O=C(O)[C@@H]1CC(CO)CN1 Amb25917979 [0,1,0,0,0,0|0,0,0]=1 803 B10R1.31 O=C(O)[C@@H]1CC(OS)CN1 Amb27983817 [0,1,0,0,0,0|0,0,0]=1 804 B10R1.31 O=C(O)[C@@H]1CS[C@H](CO)N1 Amb26530942 [0,1,0,0,0,0|3,0,0]=4 805 B10R1.31 O=C(O)[C@@H]1C[C@@H](CO)CN1 Amb24514873 [0,1,0,0,0,0|0,0,0]=1 806 B10R1.31 O=C(O)[C@@H]1C\C(=C/F)CN1 Amb25141421 [0,1,0,0,0,0|1,0,1]=3 807 B10R1.31 O=C(O)[C@H]1CC[C@@H](CO)O1 Amb25968230 [0,1,0,0,0,0|2,0,0]=3 808 B10R1.31 O=C(O)[C@H]1CC\C(=N/O)C1 Amb25888967 [0,1,0,0,0,0|1,0,1]=3 809 B10R1.31 O=C(O)[C@H]1CS[C@H](CS)C1 Amb28458525 [0,1,0,0,0,0|2,1,0]=4 810 B10R1.55 CC(C)(O)C1CCC(O)C1 Amb28319638 [0,1,0,0,0,0|2,0,1]=4 811 B10R1.55 CC(C)(O)[C@@H]1CC[C@H](O)C1 Amb27980720 [0,1,0,0,0,0|2,0,1]=4 812 B10R1.55 CP(=O)(O)[C@@H]1CC[C@@H](N)C1 Amb27855558 [0,1,0,0,0,0|3,0,0]=4 813 B10R1.55 CS(=N)(=O)C1CCC(O)C1 Amb35751611 [0,1,0,0,0,0|3,0,0]=4 814 B10R1.55 CS(=N)(=O)[C@@H]1CC[C@H](O)C1 Amb35753120 [0,1,0,0,0,0|3,0,0]=4 815 B10R1.55 CS(=O)(=O)C1CCC(O)C1 Amb20624006 [0,1,0,0,0,0|2,0,1]=4 816 B10R1.55 O=P(O)(O)[C@H]1C[C@@H](O)CN1 Amb27430251 [0,1,0,0,0,0|1,0,0]=2 817 B10R1.58 C=C(C)C1CC(C)C(O)C1 Amb27191936 [0,1,0,0,0,0|3,0,0]=4 818 B10R1.58 C=C(C)C1C[C@@H](C)[C@H](O)C1 Amb27790334 [0,1,0,0,0,0|3,0,0]=4 819 B10R1.58 C=C(C)C1C[C@H](O)[C@H](C)C1 Amb27199266 [0,1,0,0,0,0|3,0,0]=4 820 B10R1.58 C=C1CC(C(=O)O)CC1N Amb25996162 [0,1,0,0,0,0|2,0,1]=4 821 B10R1.58 C=C1C[C@@H](C(=O)O)NC1=O Amb27437052 [0,1,0,0,0,0|1,0,2]=4 822 B10R1.58 C=C1C[C@H](C(=O)O)C[C@@H]1N Amb25229776 [0,1,0,0,0,0|2,0,1]=4 823 B10R1.58 CC(=O)N1CC(C)C(O)C1 Amb27651259 [0,1,0,0,0,0|3,0,0]=4 824 B10R1.58 CC(O)C1CC(O)C(O)O1 Amb27659578 [0,1,0,0,0,0|2,0,1]=4 825 B10R1.58 CC1=NC(C(=O)O)CC1C Amb27397721 [0,1,0,0,0,0|1,0,2]=4 826 B10R1.58 CC1CC(C(=O)O)CC1=O Amb27413499 [0,1,0,0,0,0|1,0,2]=4 827 B10R1.58 CC1CC(C(=O)O)CC1C Amb28251040 [0,1,0,0,0,0|2,0,0]=3 828 B10R1.58 CC1CC(C(=O)O)CN1C Amb18831573 [0,1,0,0,0,0|3,0,0]=4 829 B10R1.58 CC1CC(C(=O)O)NC1C Amb18831587 [0,1,0,0,0,0|1,0,0]=2 830 B10R1.58 CC1CC(C(=O)O)OC1=O Amb27836333 [0,1,0,0,0,0|2,0,1]=4 831 B10R1.58 CC1CN(C(N)=O)CC1O Amb27877996 [0,1,0,0,0,0|3,0,0]=4 832 B10R1.58 CC1C[C@@H](C(=O)O)OC1=O Amb27615055 [0,1,0,0,0,0|2,0,1]=4 833 B10R1.58 CC1C[C@H](C(=O)O)CC1O Amb27882643 [0,1,0,0,0,0|1,0,0]=2 834 B10R1.58 CC1NC(C(=O)O)CC1N Amb27768615 [0,1,0,0,0,0|1,0,0]=2 835 B10R1.58 CC1NC(C(=O)O)CC1O Amb27876074 [0,1,0,0,0,0|0,0,0]=1 836 B10R1.58 CC1NC(C(=O)O)C[C@H]1O Amb27167587 [0,1,0,0,0,0|0,0,0]=1 837 B10R1.58 CC1O[C@@H](C(=O)O)C[C@H]1O Amb27216683 [0,1,0,0,0,0|1,0,0]=2 838 B10R1.58 CN1CC(C(=O)O)NC1=O Amb33545035 [0,1,0,0,0,0|2,0,1]=4 839 B10R1.58 CN1C[C@@H](C(=O)O)NC1=O Amb27770517 [0,1,0,0,0,0|2,0,1]=4 840 B10R1.58 CN1C[C@H](C(=O)O)NC1=O Amb23598492 [0,1,0,0,0,0|2,0,1]=4 841 B10R1.58 CN1NC(C(=O)O)CC1=O Amb27495618 [0,1,0,0,0,0|1,0,2]=4 842 B10R1.58 C[C@@H]1C[C@@H](C(=O)O)N[C@@H]1C Amb27640711 [0,1,0,0,0,0|1,0,0]=2 843 B10R1.58 C[C@@H]1C[C@H](C(=O)O)CN1C Amb35788874 [0,1,0,0,0,0|3,0,0]=4 844 B10R1.58 C[C@@H]1N[C@H](C(=O)O)C[C@H]1F Amb27781898 [0,1,0,0,0,0|1,0,0]=2 845 B10R1.58 C[C@H]1C[C@@H](C(=O)O)C[C@H]1C Amb27447222 [0,1,0,0,0,0|2,0,0]=3 846 B10R1.58 C[C@H]1O[C@H](C(=O)O)C[C@@H]1O Amb27194347 [0,1,0,0,0,0|1,0,0]=2 847 B10R1.58 C[C@H]1SC(C(=O)O)S[C@@H]1C Amb27845407 [0,1,0,0,0,0|3,0,0]=4 848 B10R1.58 NC(=O)C1CC(F)C(=O)N1 Amb27593081 [0,1,0,0,0,0|2,0,1]=4 849 B10R1.58 NC(=O)C1CC(N)C(N)C1 Amb27837970 [0,1,0,0,0,0|3,0,0]=4 850 B10R1.58 NC(=O)N1CC(O)C(O)C1 Amb27782651 [0,1,0,0,0,0|3,0,0]=4 851 B10R1.58 NC(=O)N1C[C@H](O)[C@H](O)C1 Amb27185450 [0,1,0,0,0,0|3,0,0]=4 852 B10R1.58 NC1CC(C(=O)O)CC1F Amb27666691 [0,1,0,0,0,0|2,0,0]=3 853 B10R1.58 NC1CC(C(=O)O)OC1=O Amb25147458 [0,1,0,0,0,0|2,0,1]=4 854 B10R1.58 N[C@@H]1C[C@H](C(=O)O)C[C@H]1O Amb27630763 [0,1,0,0,0,0|1,0,0]=2 855 B10R1.58 N[C@@H]1C[C@H](C(=O)O)C[C@H]1O Amb33017585 [0,1,0,0,0,0|1,0,0]=2 856 B10R1.58 N[C@H]1CC(C(=O)O)C[C@@H]1O Amb27238051 [0,1,0,0,0,0|1,0,0]=2 857 B10R1.58 N[C@H]1C[C@@H](C(=O)O)C[C@@H]1F Amb24568879 [0,1,0,0,0,0|2,0,0]=3 858 B10R1.58 N[C@H]1C[C@@H](C(=O)O)C[C@@H]1O Amb27420224 [0,1,0,0,0,0|1,0,0]=2 859 B10R1.58 N[C@H]1C[C@@H](C(=O)O)OC1=O Amb27782562 [0,1,0,0,0,0|2,0,1]=4 860 B10R1.58 N[C@H]1C[C@@H](C(=O)O)SC1=O Amb27486281 [0,1,0,0,0,0|2,0,1]=4 861 B10R1.58 N[C@H]1C[C@H](C(=O)O)C[C@@H]1O Amb28437238 [0,1,0,0,0,0|1,0,0]=2 862 B10R1.58 O=C(Cl)C1CC(Cl)C(Cl)C1 Amb27185447 [0,1,0,0,0,0|3,0,0]=4 863 B10R1.58 O=C(O)C1CC(=O)N(O)C1 Amb27779851 [0,1,0,0,0,0|2,0,1]=4 864 B10R1.58 O=C(O)C1CC(Cl)C(Cl)C1 Amb27484189 [0,1,0,0,0,0|2,0,0]=3 865 B10R1.58 O=C(O)C1CC(O)C(Br)C1 Amb28453598 [0,1,0,0,0,0|1,0,0]=2 866 B10R1.58 O=C(O)C1CC(O)C(O)C1 Amb26034622 [0,1,0,0,0,0|1,0,0]=2 867 B10R1.58 O=C(O)C1C[C@@H](Br)[C@H](Br)C1 Amb19297771 [0,1,0,0,0,0|2,0,0]=3 868 B10R1.58 O=C(O)C1C[C@H](F)[C@H](F)C1 Amb26410348 [0,1,0,0,0,0|2,0,0]=3 869 B10R1.58 O=C(O)C1C[C@H](O)[C@H](O)C1 Amb28126711 [0,1,0,0,0,0|1,0,0]=2 870 B10R1.58 O=C(O)C1OC(O)C(O)O1 Amb27838116 [0,1,0,0,0,0|2,0,0]=3 871 B10R1.58 O=C(O)C1O[C@H](O)[C@@H](O)O1 Amb27204841 [0,1,0,0,0,0|2,0,0]=3 872 B10R1.58 O=C(O)[C@@H]1C[C@@H](Br)C(=O)O1 Amb28436779 [0,1,0,0,0,0|2,0,1]=4 873 B10R1.58 O=C(O)[C@@H]1C[C@@H](F)C(=O)N1 Amb10839466 [0,1,0,0,0,0|1,0,1]=3 874 B10R1.58 O=C(O)[C@@H]1C[C@@H](O)[C@H](F)C1 Amb28046336 [0,1,0,0,0,0|1,0,0]=2 875 B10R1.58 O=C1NC(C(=O)O)CC1F Amb24696741 [0,1,0,0,0,0|1,0,1]=3 876 B10R1.58 O=C1N[C@@H](C(=O)O)C[C@@H]1F Amb27421959 [0,1,0,0,0,0|1,0,1]=3 877 B10R1.58 O=C1N[C@H](C(=O)O)CC1F Amb25360897 [0,1,0,0,0,0|1,0,1]=3 878 B10R1.58 O=C1N[C@H](C(=O)O)CC1O Amb28208546 [0,1,0,0,0,0|0,0,1]=2 879 B10R1.58 O=C1N[C@H](C(=O)O)C[C@@H]1F Amb10838332 [0,1,0,0,0,0|1,0,1]=3 880 B10R1.58 O=C1O[C@H](C(=O)O)C[C@@H]1O Amb25230626 [0,1,0,0,0,0|1,0,1]=3 881 B10R1.59 C=C1CC(N)C(C(=O)O)C1 Amb27779891 [0,1,0,0,0,0|2,0,1]=4 882 B10R1.59 C=C1C[C@H](N)[C@@H](C(=O)O)C1 Amb10071928 [0,1,0,0,0,0|2,0,1]=4 883 B10R1.59 C=C1C[C@H](N)[C@H](C(=O)O)C1 Amb17938168 [0,1,0,0,0,0|2,0,1]=4 884 B10R1.59 CC(=O)C1CC(Cl)CN1C Amb27471855 [0,1,0,0,0,0|2,0,0]=3 885 B10R1.59 CC1CC(C(=O)O)C(=O)O1 Amb27883641 [0,1,0,0,0,0|3,0,0]=4 886 B10R1.59 CC1CC(C(=O)O)C(C)O1 Amb27779714 [0,1,0,0,0,0|3,0,0]=4 887 B10R1.59 CC1CC(C)C(C(=O)O)O1 Amb25943591 [0,1,0,0,0,0|3,0,0]=4 888 B10R1.59 CC1CC(F)C(C(=O)O)O1 Amb28198814 [0,1,0,0,0,0|3,0,0]=4 889 B10R1.59 CC1CC(N)C(C(=O)O)C1 Amb28075037 [0,1,0,0,0,0|2,0,0]=3 890 B10R1.59 CC1CC(O)CC1C(=O)O Amb27447223 [0,1,0,0,0,0|1,0,0]=2 891 B10R1.59 CC1CN(C)CC1C(=O)O Amb24478023 [0,1,0,0,0,0|3,0,0]=4 892 B10R1.59 CC1CN(C)CC1C(=O)O Amb33552546 [0,1,0,0,0,0|3,0,0]=4 893 B10R1.59 CC1C[C@@H](O)[C@@H](C(=O)O)N1 Amb27818206 [0,1,0,0,0,0|3,0,0]=4 894 B10R1.59 CC1C[C@H](N)[C@H](C(=O)O)C1 Amb27871980 [0,1,0,0,0,0|2,0,0]=3 895 B10R1.59 CN1CC(F)C(C(=O)O)C1 Amb27658048 [0,1,0,0,0,0|3,0,0]=4 896 B10R1.59 CN1CC(F)CC1C(=O)O Amb28050082 [0,1,0,0,0,0|1,0,0]=2 897 B10R1.59 CN1CC(F)CC1C(=O)O Amb32666364 [0,1,0,0,0,0|1,0,0]=2 898 B10R1.59 CN1CC(N)CC1C(=O)O Amb27403072 [0,1,0,0,0,0|1,0,0]=2 899 B10R1.59 CN1CC(O)CC1C(=O)O Amb5719759 [0,1,0,0,0,0|0,0,0]=1 900 B10R1.59 CN1CC(O)CC1C(N)=O Amb25300409 [0,1,0,0,0,0|1,0,0]=2 901 B10R1.59 CN1CC(O)C[C@H]1C(=O)O Amb27849693 [0,1,0,0,0,0|0,0,0]=1 902 B10R1.59 CN1C[C@@H](N)C[C@@H]1C(=O)O Amb34915546 [0,1,0,0,0,0|1,0,0]=2 903 B10R1.59 CN1C[C@@H](N)C[C@H]1C(=O)O Amb19516794 [0,1,0,0,0,0|1,0,0]=2 904 B10R1.59 CN1C[C@@H](O)C[C@H]1C(=O)O Amb22757084 [0,1,0,0,0,0|0,0,0]=1 905 B10R1.59 CN1C[C@@H](S)C[C@H]1C(=O)O Amb26027085 [0,1,0,0,0,0|0,1,0]=2 906 B10R1.59 CN1C[C@@H](S)C[C@H]1C(N)=O Amb24617357 [0,1,0,0,0,0|1,1,0]=3 907 B10R1.59 CN1C[C@H](F)C[C@@H]1C(=O)O Amb34916254 [0,1,0,0,0,0|1,0,0]=2 908 B10R1.59 CN1C[C@H](F)C[C@H]1C(=O)O Amb25175012 [0,1,0,0,0,0|1,0,0]=2 909 B10R1.59 CN1C[C@H](F)C[C@H]1C(=O)O Amb32662833 [0,1,0,0,0,0|1,0,0]=2 910 B10R1.59 CN1C[C@H](N)C[C@H]1C(=O)O Amb23385233 [0,1,0,0,0,0|1,0,0]=2 911 B10R1.59 CN1C[C@H](N)C[C@H]1C(N)=O Amb28067698 [0,1,0,0,0,0|2,0,0]=3 912 B10R1.59 CN1C[C@H](O)C[C@H]1C(=O)O Amb27447191 [0,1,0,0,0,0|0,0,0]=1 913 B10R1.59 CN1N=C(Cl)CC1C(=O)O Amb27797504 [0,1,0,0,0,0|2,0,1]=4 914 B10R1.59 CN1NC(=O)CC1C(=O)O Amb25761701 [0,1,0,0,0,0|1,0,2]=4 915 B10R1.59 C[C@@H]1CC(=O)C[C@H]1C(=O)O Amb26891990 [0,1,0,0,0,0|1,0,2]=4 916 B10R1.59 C[C@@H]1CN(C)C[C@H]1C(=O)O Amb24643115 [0,1,0,0,0,0|3,0,0]=4 917 B10R1.59 C[C@@H]1C[C@@H](C(=O)O)N(C)C1 Amb30869371 [0,1,0,0,0,0|1,0,0]=2 918 B10R1.59 C[C@@H]1C[C@@H](F)[C@@H](C(=O)O)O1 Amb28058745 [0,1,0,0,0,0|3,0,0]=4 919 B10R1.59 C[C@@H]1C[C@@H](O)[C@@H](C(=O)O)N1 Amb25966968 [0,1,0,0,0,0|3,0,0]=4 920 B10R1.59 C[C@@H]1C[C@@H](O)[C@H](C(=O)O)N1 Amb27204031 [0,1,0,0,0,0|3,0,0]=4 921 B10R1.59 C[C@@H]1C[C@H](C(=O)O)N(C)C1 Amb30869372 [0,1,0,0,0,0|1,0,0]=2 922 B10R1.59 C[C@@H]1C[C@H](C(=O)O)N(C)C1 Amb33716166 [0,1,0,0,0,0|1,0,0]=2 923 B10R1.59 C[C@@H]1C[C@H](Cl)[C@H](C(=O)O)O1 Amb28457445 [0,1,0,0,0,0|3,0,0]=4 924 B10R1.59 C[C@@H]1C[C@H](O)[C@@H](C(=O)O)N1 Amb27249841 [0,1,0,0,0,0|3,0,0]=4 925 B10R1.59 C[C@H]1C[C@@H](C(=O)O)N(C)C1 Amb33801092 [0,1,0,0,0,0|1,0,0]=2 926 B10R1.59 C[C@H]1C[C@@H](O)[C@H](C(=O)O)N1 Amb27420162 [0,1,0,0,0,0|3,0,0]=4 927 B10R1.59 C[C@H]1C[C@H](C(=O)O)N(C)C1 Amb34915561 [0,1,0,0,0,0|1,0,0]=2 928 B10R1.59 C[C@H]1C[C@H](O)[C@@H](C(=O)O)N1 Amb26930084 [0,1,0,0,0,0|3,0,0]=4 929 B10R1.59 NC1CC(=O)CC1C(=O)O Amb24523031 [0,1,0,0,0,0|1,0,2]=4 930 B10R1.59 NC1CC(O)CC1C(=O)O Amb26583126 [0,1,0,0,0,0|1,0,0]=2 931 B10R1.59 NC1C[C@H](N)[C@H](C(=O)O)C1 Amb27202789 [0,1,0,0,0,0|2,0,0]=3 932 B10R1.59 N[C@@H]1C[C@H](O)C[C@@H]1C(=O)O Amb32651666 [0,1,0,0,0,0|1,0,0]=2 933 B10R1.59 N[C@@H]1C[C@H](O)C[C@@H]1C(=O)O Amb32992726 [0,1,0,0,0,0|1,0,0]=2 934 B10R1.59 N[C@H]1CC(=O)C[C@H]1C(=O)O Amb27658876 [0,1,0,0,0,0|1,0,2]=4 935 B10R1.59 N[C@H]1CC(O)C[C@H]1C(=O)O Amb27818161 [0,1,0,0,0,0|1,0,0]=2 936 B10R1.59 O=C(O)N1CC(O)CC1=O Amb34912667 [0,1,0,0,0,0|2,0,0]=3 937 B10R1.59 O=C(O)[C@H]1O[C@@H](O)C[C@@H]1O Amb27961459 [0,1,0,0,0,0|2,0,0]=3 938 B10R1.59 O=C(O)[C@H]1O[C@H](O)C[C@@H]1O Amb27422050 [0,1,0,0,0,0|2,0,0]=3 939 B10R1.194 C=C(C)[C@H]1CC[C@H](O)[C@@H]1C Amb27857951 [0,1,0,0,0,0|3,0,0]=4 940 B10R1.194 C=C(C)[C@H]1CC[C@H](O)[C@H]1C Amb28401117 [0,1,0,0,0,0|3,0,0]=4 941 B10R1.194 C=C1CCC(C(=O)O)C1C Amb27442987 [0,1,0,0,0,0|2,0,1]=4 942 B10R1.194 C=C1CCC(C(=O)O)C1N Amb25690409 [0,1,0,0,0,0|2,0,1]=4 943 B10R1.194 C=C1CC[C@@H](C(=O)O)[C@H]1N Amb26884928 [0,1,0,0,0,0|2,0,1]=4 944 B10R1.194 C=C1CC[C@H](C(=O)O)[C@@H]1C Amb27961118 [0,1,0,0,0,0|2,0,1]=4 945 B10R1.194 C=C1CC[C@H](C(=O)O)[C@@H]1N Amb28345701 [0,1,0,0,0,0|2,0,1]=4 946 B10R1.194 CC(=O)C1COC(O)C1C Amb27607619 [0,1,0,0,0,0|3,0,0]=4 947 B10R1.194 CC(=O)C1NCC(C)C1C Amb25684648 [0,1,0,0,0,0|2,0,0]=3 948 B10R1.194 CC(=O)C1NCC(O)C1O Amb27234084 [0,1,0,0,0,0|1,0,0]=2 949 B10R1.194 CC(=O)C1NC[C@@H](O)[C@@H]1O Amb27483158 [0,1,0,0,0,0|1,0,0]=2 950 B10R1.194 CC(=O)C1SCC(O)C1O Amb27953832 [0,1,0,0,0,0|2,0,0]=3 951 B10R1.194 CC(=O)C1SC[C@@H](O)[C@H]1O Amb27973089 [0,1,0,0,0,0|2,0,0]=3 952 B10R1.194 CC(=O)[C@@H]1COC(O)[C@@H]1C Amb27428191 [0,1,0,0,0,0|3,0,0]=4 953 B10R1.194 CC(=O)[C@@H]1COC(O)[C@H]1C Amb26555749 [0,1,0,0,0,0|3,0,0]=4 954 B10R1.194 CC(=O)[C@@H]1NC[C@@H](O)[C@@H]1O Amb27626038 [0,1,0,0,0,0|1,0,0]=2 955 B10R1.194 CC(=O)[C@H]1COC(O)[C@@H]1C Amb28052107 [0,1,0,0,0,0|3,0,0]=4 956 B10R1.194 CC(=O)[C@H]1CO[C@H](O)[C@H]1C Amb27626851 [0,1,0,0,0,0|3,0,0]=4 957 B10R1.194 CC(C)[C@@H]1NC[C@H](O)[C@H]1O Amb25929524 [0,1,0,0,0,0|2,0,1]=4 958 B10R1.194 CC(O)C1CCC(O)C1O Amb28069583 [0,1,0,0,0,0|2,0,1]=4 959 B10R1.194 CC(O)C1NCC(O)C1O Amb27838087 [0,1,0,0,0,0|1,0,1]=3 960 B10R1.194 CC(O)C1NC[C@@H](O)[C@@H]1O Amb27786348 [0,1,0,0,0,0|1,0,1]=3 961 B10R1.194 CC1C(C(=O)O)CCN1C Amb28050081 [0,1,0,0,0,0|3,0,0]=4 962 B10R1.194 CC1C(C(=O)O)CCN1C Amb28555552 [0,1,0,0,0,0|3,0,0]=4 963 B10R1.194 CC1C(O)CN[C@@H]1C(=O)O Amb27618170 [0,1,0,0,0,0|0,0,0]=1 964 B10R1.194 CC1C(O)CN[C@H]1C(=O)O Amb24120643 [0,1,0,0,0,0|0,0,0]=1 965 B10R1.194 CC1C(O)COC1C(=O)O Amb25738059 [0,1,0,0,0,0|1,0,0]=2 966 B10R1.194 CC1CC=C(C(=O)O)C1C Amb27607553 [0,1,0,0,0,0|2,0,1]=4 967 B10R1.194 CC1CCC(C(=O)O)C1N Amb20623936 [0,1,0,0,0,0|2,0,0]=3 968 B10R1.194 CC1CCC(C(N)=O)C1C Amb26365871 [0,1,0,0,0,0|3,0,0]=4 969 B10R1.194 CC1CC[C@@H](C(=O)O)N1C Amb27242545 [0,1,0,0,0,0|3,0,0]=4 970 B10R1.194 CC1CC[C@@H](C(=O)O)[C@H]1N Amb27789618 [0,1,0,0,0,0|2,0,0]=3 971 B10R1.194 CC1CC[C@H](C(=O)O)C1C Amb28347215 [0,1,0,0,0,0|2,0,0]=3 972 B10R1.194 CC1OCC(C(=O)O)C1C Amb30018712 [0,1,0,0,0,0|3,0,0]=4 973 B10R1.194 C[C@@H](O)C1NC[C@@H](O)[C@H]1O Amb27422569 [0,1,0,0,0,0|1,0,1]=3 974 B10R1.194 C[C@@H](O)[C@@H]1NC[C@H](O)[C@@H]1O Amb27421979 [0,1,0,0,0,0|1,0,1]=3 975 B10R1.194 C[C@@H]1C(O)CCN1C(=O)O Amb33714409 [0,1,0,0,0,0|2,0,0]=3 976 B10R1.194 C[C@@H]1CC[C@@H](C(=O)O)N1C Amb24715908 [0,1,0,0,0,0|3,0,0]=4 977 B10R1.194 C[C@@H]1CC[C@@H](C(=O)O)[C@H]1N Amb27874070 [0,1,0,0,0,0|2,0,0]=3 978 B10R1.194 C[C@@H]1CC[C@H](C(=O)O)N1C Amb33714494 [0,1,0,0,0,0|3,0,0]=4 979 B10R1.194 C[C@@H]1CC[C@H](C(=O)O)[C@@H]1C Amb27217301 [0,1,0,0,0,0|2,0,0]=3 980 B10R1.194 C[C@@H]1CC[C@H](C(=O)O)[C@H]1N Amb24618144 [0,1,0,0,0,0|2,0,0]=3 981 B10R1.194 C[C@@H]1CN[C@@H](C(=O)O)[C@@H]1O Amb24540945 [0,1,0,0,0,0|1,0,0]=2 982 B10R1.194 C[C@@H]1[C@@H](C(=O)O)CCN1C Amb18202481 [0,1,0,0,0,0|3,0,0]=4 983 B10R1.194 C[C@@H]1[C@@H](C(=O)O)NC[C@@H]1O Amb24120648 [0,1,0,0,0,0|0,0,0]=1 984 B10R1.194 C[C@@H]1[C@H](C(=O)O)CCN1C Amb28721110 [0,1,0,0,0,0|3,0,0]=4 985 B10R1.194 C[C@H](O)[C@@H]1NC[C@H](O)[C@H]1O Amb27473377 [0,1,0,0,0,0|1,0,1]=3 986 B10R1.194 C[C@H](O)[C@H]1NC[C@@H](O)[C@@H]1O Amb27254146 [0,1,0,0,0,0|1,0,1]=3 987 B10R1.194 C[C@H](O)[C@H]1NC[C@H](O)[C@@H]1O Amb27422032 [0,1,0,0,0,0|1,0,1]=3 988 B10R1.194 C[C@H]1C(=O)CC[C@H]1C(=O)O Amb27778459 [0,1,0,0,0,0|1,0,2]=4 989 B10R1.194 C[C@H]1C(=O)CN[C@@H]1C(=O)O Amb18831599 [0,1,0,0,0,0|0,0,2]=3 990 B10R1.194 C[C@H]1CC[C@@H](C(=O)O)N1C Amb32643970 [0,1,0,0,0,0|3,0,0]=4 991 B10R1.194 C[C@H]1CC[C@H](C(=O)O)[C@@H]1C Amb28067785 [0,1,0,0,0,0|2,0,0]=3 992 B10R1.194 C[C@H]1CNC(C(=O)O)[C@H]1O Amb27216674 [0,1,0,0,0,0|1,0,0]=2 993 B10R1.194 NC(=O)[C@@H]1OC[C@@H](O)[C@H]1O Amb24683290 [0,1,0,0,0,0|2,0,0]=3 994 B10R1.194 NC1C(O)CCC1C(=O)O Amb28077395 [0,1,0,0,0,0|1,0,0]=2 995 B10R1.194 NC1C(O)CNC1C(=O)O Amb28247453 [0,1,0,0,0,0|0,0,0]=1 996 B10R1.194 NC1CNC(C(=O)O)C1O Amb27838148 [0,1,0,0,0,0|1,0,0]=2 997 B10R1.194 N[C@@H]1CN[C@H](C(=O)O)[C@H]1O Amb25912150 [0,1,0,0,0,0|1,0,0]=2 998 B10R1.194 N[C@@H]1[C@@H](C(=O)O)NC[C@H]1O Amb24579561 [0,1,0,0,0,0|0,0,0]=1 999 B10R1.194 N[C@H]1[C@@H](O)CC[C@@H]1C(=O)O Amb27473358 [0,1,0,0,0,0|1,0,0]=2 1000 B10R1.194 O=C(O)C1CCC(O)C1O Amb24480401 [0,1,0,0,0,0|1,0,0]=2 1001 B10R1.194 O=C(O)C1NCC(O)C1O Amb24120646 [0,1,0,0,0,0|0,0,0]=1 1002 B10R1.194 O=C(O)[C@@H]1CC[C@@H](O)[C@@H]1O Amb28248507 [0,1,0,0,0,0|1,0,0]=2 1003 B10R1.194 O=C(O)[C@@H]1CC[C@@H](O)[C@H]1O Amb27482063 [0,1,0,0,0,0|1,0,0]=2 1004 B10R1.194 O=C(O)[C@@H]1CC[C@H](O)[C@@H]1O Amb27438244 [0,1,0,0,0,0|1,0,0]=2 1005 B10R1.194 O=C(O)[C@@H]1NC[C@@H](O)[C@@H]1O Amb27258648 [0,1,0,0,0,0|0,0,0]=1 1006 B10R1.194 O=C(O)[C@@H]1NC[C@@H](O)[C@H]1O Amb24546981 [0,1,0,0,0,0|0,0,0]=1 1007 B10R1.194 O=C(O)[C@@H]1NC[C@H](O)[C@@H]1O Amb24605220 [0,1,0,0,0,0|0,0,0]=1 1008 B10R1.194 O=C(O)[C@@H]1NC[C@H](O)[C@H]1O Amb25259269 [0,1,0,0,0,0|0,0,0]=1 1009 B10R1.194 O=C(O)[C@H]1NCC(O)C1O Amb27647851 [0,1,0,0,0,0|0,0,0]=1 1010 B10R1.194 O=C(O)[C@H]1NCC(O)[C@@H]1O Amb28203927 [0,1,0,0,0,0|0,0,0]=1 1011 B10R1.194 O=C(O)[C@H]1NC[C@@H](O)[C@@H]1O Amb27252019 [0,1,0,0,0,0|0,0,0]=1 1012 B10R1.194 O=C(O)[C@H]1NC[C@@H](O)[C@H]1O Amb27246425 [0,1,0,0,0,0|0,0,0]=1 1013 B10R1.194 O=C(O)[C@H]1NC[C@H](O)[C@@H]1O Amb24120647 [0,1,0,0,0,0|0,0,0]=1 1014 B10R1.359 CC(=O)C1CC(F)(F)CN1 Amb33307735 [0,1,0,0,0,0|2,0,0]=3 1015 B10R1.359 CC(=O)C1CCC(C)(C)C1 Amb25136434 [0,1,0,0,0,0|3,0,0]=4 1016 B10R1.359 CC(=O)C1CCC(F)(F)C1 Amb26591006 [0,1,0,0,0,0|3,0,0]=4 1017 B10R1.359 CC(=O)N1CCC(C)(O)C1 Amb27433845 [0,1,0,0,0,0|3,0,0]=4 1018 B10R1.359 CC(=O)[C@@H]1CC(F)(F)CN1 Amb33307720 [0,1,0,0,0,0|2,0,0]=3 1019 B10R1.359 CC(=O)[C@H]1CC(F)(F)CN1 Amb33307725 [0,1,0,0,0,0|2,0,0]=3 1020 B10R1.359 CC1(C)CC(C(=O)O)CO1 Amb24312661 [0,1,0,0,0,0|3,0,0]=4 1021 B10R1.359 CC1(C)CCC(C(=O)O)C1 Amb33545093 [0,1,0,0,0,0|2,0,0]=3 1022 B10R1.359 CC1(C)CCC(C(=O)O)N1 Amb17593611 [0,1,0,0,0,0|3,0,0]=4 1023 B10R1.359 CC1(C)CCC(C(=O)O)N1 Amb22755806 [0,1,0,0,0,0|3,0,0]=4 1024 B10R1.359 CC1(C)CCC(C(=O)O)O1 Amb23455423 [0,1,0,0,0,0|3,0,0]=4 1025 B10R1.359 CC1(C)CNC(C(=O)O)C1 Amb22756172 [0,1,0,0,0,0|1,0,0]=2 1026 B10R1.359 CC1(C)CNC(C(=O)O)C1 Amb33295174 [0,1,0,0,0,0|1,0,0]=2 1027 B10R1.359 CC1(C)CN[C@@H](C(=O)O)C1 Amb24620405 [0,1,0,0,0,0|1,0,0]=2 1028 B10R1.359 CC1(C)CN[C@H](C(=O)O)C1 Amb20671421 [0,1,0,0,0,0|1,0,0]=2 1029 B10R1.359 CC1(C)CN[C@H](C(=O)O)C1 Amb22751658 [0,1,0,0,0,0|1,0,0]=2 1030 B10R1.359 CC1(C)COC(C(=O)O)C1 Amb35788745 [0,1,0,0,0,0|2,0,0]=3 1031 B10R1.359 CC1(Cl)CCC(C(=O)Cl)C1 Amb25861826 [0,1,0,0,0,0|3,0,0]=4 1032 B10R1.359 C[C@]1(O)CN[C@H](C(=O)O)C1 Amb27439990 [0,1,0,0,0,0|0,0,0]=1 1033 B10R1.359 C[Si]1(C)CCC(C(=O)O)C1 Amb29837961 [0,1,0,0,0,0|2,1,0]=4 1034 B10R1.359 C[Si]1(C)CNC(C(=O)O)C1 Amb29837967 [0,1,0,0,0,0|1,1,0]=3 1035 B10R1.359 NC(=O)C1CCC(F)(F)C1 Amb26480059 [0,1,0,0,0,0|3,0,0]=4 1036 B10R1.359 NC(=O)C1CS(=O)(=O)CN1 Amb33716136 [0,1,0,0,0,0|2,0,1]=4 1037 B10R1.359 NC(=O)[C@@H]1CC(F)(F)CN1 Amb10807711 [0,1,0,0,0,0|2,0,0]=3 1038 B10R1.359 NC(=O)[C@@H]1CC(F)(F)CN1 Amb22388433 [0,1,0,0,0,0|2,0,0]=3 1039 B10R1.359 NC(=O)[C@@H]1CC(F)(F)CN1 Amb28990761 [0,1,0,0,0,0|2,0,0]=3 1040 B10R1.359 NC(=O)[C@H]1CC(F)(F)CN1 Amb27195592 [0,1,0,0,0,0|2,0,0]=3 1041 B10R1.359 O=C(O)C1CC(F)(F)CN1 Amb19148521 [0,1,0,0,0,0|1,0,0]=2 1042 B10R1.359 O=C(O)C1CC(F)(F)CN1 Amb19149214 [0,1,0,0,0,0|1,0,0]=2 1043 B10R1.359 O=C(O)C1CCC(F)(F)C1 Amb22406172 [0,1,0,0,0,0|2,0,0]=3 1044 B10R1.359 O=C(O)C1CCP(=O)(O)C1 Amb27450568 [0,1,0,0,0,0|2,0,0]=3 1045 B10R1.359 O=C(O)C1CCS(=O)(=O)C1 Amb2568469 [0,1,0,0,0,0|2,0,1]=4 1046 B10R1.359 O=C(O)[C@@H]1CC(F)(F)CN1 Amb19374734 [0,1,0,0,0,0|1,0,0]=2 1047 B10R1.359 O=C(O)[C@@H]1CC(F)(F)CN1 Amb22169907 [0,1,0,0,0,0|1,0,0]=2 1048 B10R1.359 O=C(O)[C@@H]1CC(F)(F)CN1 Amb22747185 [0,1,0,0,0,0|1,0,0]=2 1049 B10R1.359 O=C(O)[C@@H]1CCC(F)(F)C1 Amb24757593 [0,1,0,0,0,0|2,0,0]=3 1050 B10R1.359 O=C(O)[C@H]1CC(F)(F)CN1 Amb26346483 [0,1,0,0,0,0|1,0,0]=2 1051 B10R1.359 O=C(O)[C@H]1CC(F)(F)CN1 Amb28989948 [0,1,0,0,0,0|1,0,0]=2 1052 B10R1.359 O=C(O)[C@H]1CCC(F)(F)C1 Amb23440260 [0,1,0,0,0,0|2,0,0]=3 1053 B10R1.470 C=C1CCC(C)(C(=O)O)C1 Amb25789474 [0,1,0,0,0,0|2,0,1]=4 1054 B10R1.470 C=C1CCC(O)(C(=O)O)C1 Amb27620508 [0,1,0,0,0,0|2,0,1]=4 1055 B10R1.470 CC(=O)C1(C)CCC(O)O1 Amb27270879 [0,1,0,0,0,0|3,0,0]=4 1056 B10R1.470 CC(=O)[C@@]1(C)CC[C@H](O)C1 Amb28202199 [0,1,0,0,0,0|2,0,0]=3 1057 B10R1.470 CC(=O)[C@]1(C)CC[C@@H](O)O1 Amb28436808 [0,1,0,0,0,0|3,0,0]=4 1058 B10R1.470 CC(=O)[C@]1(C)NC[C@@H](C)O1 Amb24590151 [0,1,0,0,0,0|3,0,0]=4 1059 B10R1.470 CC(=O)[C@]1(C)NC[C@H](C)O1 Amb25919514 [0,1,0,0,0,0|3,0,0]=4 1060 B10R1.470 CC1(C(=O)O)CC(O)CN1 Amb27876103 [0,1,0,0,0,0|0,0,0]=1 1061 B10R1.470 CC1(C(=O)O)CC(O)CN1 Amb32666815 [0,1,0,0,0,0|0,0,0]=1 1062 B10R1.470 CC1(C(=O)O)CCC(=O)C1 Amb23454199 [0,1,0,0,0,0|1,0,2]=4 1063 B10R1.470 CC1(C(=O)O)CCC(F)C1 Amb28193818 [0,1,0,0,0,0|2,0,0]=3 1064 B10R1.470 CC1(C(=O)O)CCC(N)C1 Amb23454122 [0,1,0,0,0,0|2,0,0]=3 1065 B10R1.470 CC1(C(=O)O)CCC(N)C1 Amb30666627 [0,1,0,0,0,0|2,0,0]=3 1066 B10R1.470 CC1(C(=O)O)CCC(O)C1 Amb23454235 [0,1,0,0,0,0|1,0,0]=2 1067 B10R1.470 CC1(C(N)=O)CC(O)CN1 Amb24477071 [0,1,0,0,0,0|1,0,0]=2 1068 B10R1.470 CC1(C(N)=O)CCC(N)C1 Amb27637247 [0,1,0,0,0,0|3,0,0]=4 1069 B10R1.470 CC1CC(C)(C(=O)O)CO1 Amb32654901 [0,1,0,0,0,0|3,0,0]=4 1070 B10R1.470 CC1CC(N)(C(=O)O)CO1 Amb30010992 [0,1,0,0,0,0|3,0,0]=4 1071 B10R1.470 CC1CC(O)(C(=O)O)CN1 Amb26426348 [0,1,0,0,0,0|3,0,0]=4 1072 B10R1.470 CC1CC(O)(C(=O)O)CO1 Amb29850198 [0,1,0,0,0,0|3,0,0]=4 1073 B10R1.470 CC1CC(O)(C(=O)O)CS1 Amb27390741 [0,1,0,0,0,0|3,0,0]=4 1074 B10R1.470 CC1CCC(C)(C(=O)O)C1 Amb33545098 [0,1,0,0,0,0|2,0,0]=3 1075 B10R1.470 CC1CCC(C)(C(N)=O)C1 Amb23454043 [0,1,0,0,0,0|3,0,0]=4 1076 B10R1.470 CC1CCC(N)(C(=O)O)C1 Amb2695735 [0,1,0,0,0,0|2,0,0]=3 1077 B10R1.470 CC1CCC(N)(C(=O)O)C1 Amb31188353 [0,1,0,0,0,0|2,0,0]=3 1078 B10R1.470 CC1CCC(O)(C(=O)O)C1 Amb8836763 [0,1,0,0,0,0|2,0,0]=3 1079 B10R1.470 CC1CCC(O)(C(N)=O)C1 Amb27147897 [0,1,0,0,0,0|3,0,0]=4 1080 B10R1.470 CN1CCC(C)(C(=O)O)C1 Amb7088950 [0,1,0,0,0,0|3,0,0]=4 1081 B10R1.470 C[C@@H]1CC[C@@](N)(C(=O)O)C1 Amb24373352 [0,1,0,0,0,0|2,0,0]=3 1082 B10R1.470 C[C@@]1(C(=O)O)C[C@@H](O)CN1 Amb26611422 [0,1,0,0,0,0|0,0,0]=1 1083 B10R1.470 C[C@@]1(C(N)=O)C[C@@H](O)CN1 Amb27420141 [0,1,0,0,0,0|1,0,0]=2 1084 B10R1.470 C[C@H]1CC[C@@](N)(C(=O)O)C1 Amb27622425 [0,1,0,0,0,0|2,0,0]=3 1085 B10R1.470 C[C@H]1C[C@](N)(C(=O)O)CS1 Amb27439498 [0,1,0,0,0,0|3,0,0]=4 1086 B10R1.470 C[C@]1(C(=O)O)C[C@H](O)CN1 Amb24117149 [0,1,0,0,0,0|0,0,0]=1 1087 B10R1.470 C[C@]1(C(N)=O)C[C@H](O)CN1 Amb33715733 [0,1,0,0,0,0|1,0,0]=2 1088 B10R1.470 NC(=O)C1(N)CCC(O)C1 Amb30013934 [0,1,0,0,0,0|2,0,0]=3 1089 B10R1.470 NC(=O)C1(O)CCC(N)C1 Amb27209744 [0,1,0,0,0,0|3,0,0]=4 1090 B10R1.470 NC(=O)[C@@]1(O)C=C[C@H](O)C1 Amb27494068 [0,1,0,0,0,0|2,0,1]=4 1091 B10R1.470 NC1(C(=O)O)CCC(O)C1 Amb26331332 [0,1,0,0,0,0|1,0,0]=2 1092 B10R1.470 NC1(C(=O)O)CCC(O)C1 Amb33456869 [0,1,0,0,0,0|1,0,0]=2 1093 B10R1.470 NC1(C(=O)O)CCS(=O)C1 Amb26884927 [0,1,0,0,0,0|2,0,1]=4 1094 B10R1.470 NC1CCC(F)(C(=O)O)C1 Amb24352012 [0,1,0,0,0,0|2,0,0]=3 1095 B10R1.470 NC1CCC(F)(C(=O)O)C1 Amb32952913 [0,1,0,0,0,0|2,0,0]=3 1096 B10R1.470 N[C@@]1(C(=O)O)CC[C@@H](O)C1 Amb10066916 [0,1,0,0,0,0|1,0,0]=2 1097 B10R1.470 N[C@H]1CC[C@@](O)(C(=O)O)C1 Amb27796254 [0,1,0,0,0,0|2,0,0]=3 1098 B10R1.470 N[C@]1(C(=O)O)CC[C@H](O)C1 Amb35745821 [0,1,0,0,0,0|1,0,0]=2 1099 B10R1.470 O=C(O)C1(O)CC(O)CO1 Amb27220131 [0,1,0,0,0,0|1,0,0]=2 1100 B8R0.8 C#CCCC(C)C(=O)O Amb27464960 [0,0,1,0,0,0|2,0,1]=4 1101 B8R0.8 C#CCNC(C)C(=O)O Amb9327029 [0,0,1,0,0,0|1,0,1]=3 1102 B8R0.8 C#CCNC(C)C(N)=O Amb9203314 [0,0,1,0,0,0|2,0,1]=4 1103 B8R0.8 C#CCN[C@H](C)C(=O)O Amb27815665 [0,0,1,0,0,0|1,0,1]=3 1104 B8R0.8 C#CCOC(C)C(=O)O Amb9208661 [0,0,1,0,0,0|2,0,1]=4 1105 B8R0.8 C#CCO[C@H](C)C(=O)O Amb28042909 [0,0,1,0,0,0|2,0,1]=4 1106 B8R0.8 C#CCSC(C)C(=O)O Amb6274343 [0,0,1,0,0,0|2,0,1]=4 1107 B8R0.8 C=C(C)C(C)CCCO Amb28069648 [0,0,1,0,0,0|3,0,0]=4 1108 B8R0.8 C=C(CCCO)C(=O)O Amb28313844 [0,0,1,0,0,0|1,0,2]=4 1109 B8R0.8 C=CCCC(C)C(=O)O Amb18642656 [0,0,1,0,0,0|2,0,1]=4 1110 B8R0.8 C=CCNC(C)C(=O)O Amb9326762 [0,0,1,0,0,0|1,0,1]=3 1111 B8R0.8 C=CCNC(C)C(N)=O Amb9203284 [0,0,1,0,0,0|2,0,1]=4 1112 B8R0.8 C=CCOC(C)C(=O)O Amb9208699 [0,0,1,0,0,0|2,0,1]=4 1113 B8R0.8 C=CCSC(C)C(=O)O Amb6273705 [0,0,1,0,0,0|2,0,1]=4 1114 B8R0.8 CC(=O)C(C)CCCF Amb27593343 [0,0,1,0,0,0|3,0,0]=4 1115 B8R0.8 CC(=O)C(C)CCCO Amb27628329 [0,0,1,0,0,0|2,0,0]=3 1116 B8R0.8 CC(=O)C(C)OCCN Amb18111235 [0,0,1,0,0,0|3,0,0]=4 1117 B8R0.8 CC(=O)C(Cl)CCCO Amb27860344 [0,0,1,0,0,0|3,0,0]=4 1118 B8R0.8 CC(=O)[C@@H](N)CCCO Amb27835141 [0,0,1,0,0,0|3,0,0]=4 1119 B8R0.8 CC(C)C(C)NCCO Amb9209123 [0,0,1,0,0,0|2,0,1]=4 1120 B8R0.8 CC(CCC#N)C(=O)O Amb24462559 [0,0,1,0,0,0|2,0,1]=4 1121 B8R0.8 CC(CCCCl)C(=O)O Amb2720283 [0,0,1,0,0,0|2,0,0]=3 1122 B8R0.8 CC(CCCF)C(=O)O Amb25244585 [0,0,1,0,0,0|2,0,0]=3 1123 B8R0.8 CC(CCCN)C(=O)O Amb25146072 [0,0,1,0,0,0|2,0,0]=3 1124 B8R0.8 CC(CCCN)C(=O)O Amb32686960 [0,0,1,0,0,0|2,0,0]=3 1125 B8R0.8 CC(CCCN)C(N)=O Amb27667997 [0,0,1,0,0,0|3,0,0]=4 1126 B8R0.8 CC(C\C=N\O)C(=O)O Amb27217284 [0,0,1,0,0,0|2,0,1]=4 1127 B8R0.8 CC(NCCF)C(N)=O Amb27453201 [0,0,1,0,0,0|2,0,0]=3 1128 B8R0.8 CC(NCCS)C(=O)O Amb28057720 [0,0,1,0,0,0|0,1,0]=2 1129 B8R0.8 CC(NCCS)C(N)=O Amb27168964 [0,0,1,0,0,0|1,1,0]=3 1130 B8R0.8 CC(O)C(C)CCCO Amb28457820 [0,0,1,0,0,0|2,0,1]=4 1131 B8R0.8 CC(O)C(C)NCCN Amb27869883 [0,0,1,0,0,0|2,0,1]=4 1132 B8R0.8 CC(O)C(C)NCCO Amb28340819 [0,0,1,0,0,0|1,0,1]=3 1133 B8R0.8 CC(O)C(C)NCCS Amb28313983 [0,0,1,0,0,0|1,1,1]=4 1134 B8R0.8 CC(OCC#N)C(=O)O Amb27465969 [0,0,1,0,0,0|2,0,1]=4 1135 B8R0.8 CC(OCCF)C(=O)O Amb27240801 [0,0,1,0,0,0|2,0,0]=3 1136 B8R0.8 CC(OCCN)C(=O)O Amb22546285 [0,0,1,0,0,0|2,0,0]=3 1137 B8R0.8 CC(OCCO)C(=O)O Amb6680915 [0,0,1,0,0,0|1,0,0]=2 1138 B8R0.8 CC(OCCS)C(=O)O Amb27857332 [0,0,1,0,0,0|1,1,0]=3 1139 B8R0.8 CC(SCC#N)C(=O)O Amb6260833 [0,0,1,0,0,0|2,0,1]=4 1140 B8R0.8 CC(SCCCl)C(=O)O Amb27404902 [0,0,1,0,0,0|2,0,0]=3 1141 B8R0.8 CC(SCCN)C(=O)O Amb17500447 [0,0,1,0,0,0|2,0,0]=3 1142 B8R0.8 CCCCC(Br)C(=O)O Amb9703129 [0,0,1,0,0,0|3,0,0]=4 1143 B8R0.8 CCCCC(C)C(=O)O Amb3939937 [0,0,1,0,0,0|2,0,0]=3 1144 B8R0.8 CCCCC(C)C(C)=O Amb4034582 [0,0,1,0,0,0|3,0,0]=4 1145 B8R0.8 CCCCC(C)C(N)=O Amb8504697 [0,0,1,0,0,0|3,0,0]=4 1146 B8R0.8 CCCCC(Cl)C(=O)O Amb17593750 [0,0,1,0,0,0|3,0,0]=4 1147 B8R0.8 CCCCC(F)C(=O)O Amb25238781 [0,0,1,0,0,0|3,0,0]=4 1148 B8R0.8 CCCCC(N)C(=O)O Amb4134813 [0,0,1,0,0,0|3,0,0]=4 1149 B8R0.8 CCCCC(O)C(=O)O Amb3941634 [0,0,1,0,0,0|3,0,0]=4 1150 B8R0.8 CCCCC(S)C(=O)O Amb25323873 [0,0,1,0,0,0|3,0,0]=4 1151 B8R0.8 CCCC[C@@H](C)C(=O)O Amb24590691 [0,0,1,0,0,0|2,0,0]=3 1152 B8R0.8 CCCC[C@@H](Cl)C(=O)O Amb27471038 [0,0,1,0,0,0|3,0,0]=4 1153 B8R0.8 CCCC[C@@H](N)C(=O)O Amb1995006 [0,0,1,0,0,0|3,0,0]=4 1154 B8R0.8 CCCC[C@H](Br)C(=O)O Amb28385588 [0,0,1,0,0,0|3,0,0]=4 1155 B8R0.8 CCCC[C@H](C)C(=O)O Amb25850678 [0,0,1,0,0,0|2,0,0]=3 1156 B8R0.8 CCCC[C@H](Cl)C(=O)O Amb27955265 [0,0,1,0,0,0|3,0,0]=4 1157 B8R0.8 CCCC[C@H](N)C(=O)O Amb1995007 [0,0,1,0,0,0|3,0,0]=4 1158 B8R0.8 CCCC[C@H](O)C(=O)O Amb27626002 [0,0,1,0,0,0|3,0,0]=4 1159 B8R0.8 CCCNC(=O)C(=O)O Amb9303791 [0,0,1,0,0,0|2,0,1]=4 1160 B8R0.8 CCCNC(C)C(=O)O Amb9326994 [0,0,1,0,0,0|1,0,0]=2 1161 B8R0.8 CCCN[C@H](C)C(=O)O Amb28073462 [0,0,1,0,0,0|1,0,0]=2 1162 B8R0.8 CCCOC(C)C(=O)O Amb8874518 [0,0,1,0,0,0|2,0,0]=3 1163 B8R0.8 CCCOC(C)C(N)=O Amb27424673 [0,0,1,0,0,0|3,0,0]=4 1164 B8R0.8 CCCSC(C)C(=O)O Amb6274283 [0,0,1,0,0,0|2,0,0]=3 1165 B8R0.8 CCCSC(C)C(N)=O Amb28070722 [0,0,1,0,0,0|3,0,0]=4 1166 B8R0.8 CCCSC(F)C(=O)O Amb27655346 [0,0,1,0,0,0|3,0,0]=4 1167 B8R0.8 CCCSC(N)C(=O)O Amb27865736 [0,0,1,0,0,0|3,0,0]=4 1168 B8R0.8 CCCSC(O)C(=O)O Amb27592135 [0,0,1,0,0,0|3,0,0]=4 1169 B8R0.8 CCC\C=C(/C)C(=O)O Amb10844998 [0,0,1,0,0,0|2,0,1]=4 1170 B8R0.8 CCNCC(C)C(=O)O Amb13952782 [0,0,1,0,0,0|3,0,0]=4 1171 B8R0.8 CCNCC(C)C(=O)O Amb9400285 [0,0,1,0,0,0|3,0,0]=4 1172 B8R0.8 CCOCC(C)C(=O)O Amb9172215 [0,0,1,0,0,0|3,0,0]=4 1173 B8R0.8 CCOC[C@@H](C)C(=O)O Amb25790635 [0,0,1,0,0,0|3,0,0]=4 1174 B8R0.8 CCOC[C@H](C)C(=O)O Amb10844265 [0,0,1,0,0,0|3,0,0]=4 1175 B8R0.8 CCONC(C)C(N)=O Amb27228322 [0,0,1,0,0,0|3,0,0]=4 1176 B8R0.8 CCSCC(C)C(=O)O Amb9400067 [0,0,1,0,0,0|3,0,0]=4 1177 B8R0.8 CC\C=C\C(C)C(=O)O Amb33172515 [0,0,1,0,0,0|2,0,1]=4 1178 B8R0.8 COCCC(C)C(=O)O Amb18523823 [0,0,1,0,0,0|3,0,0]=4 1179 B8R0.8 COCOC(C)C(=O)O Amb28120688 [0,0,1,0,0,0|3,0,0]=4 1180 B8R0.8 COCSC(C)C(=O)O Amb28410278 [0,0,1,0,0,0|3,0,0]=4 1181 B8R0.8 CSCCC(C)C(=O)O Amb24739356 [0,0,1,0,0,0|3,0,0]=4 1182 B8R0.8 C[C@@H](CCC#N)C(=O)O Amb27870712 [0,0,1,0,0,0|2,0,1]=4 1183 B8R0.8 C[C@@H](CCCN)C(=O)O Amb28314637 [0,0,1,0,0,0|2,0,0]=3 1184 B8R0.8 C[C@@H](NCCF)C(=O)O Amb28073998 [0,0,1,0,0,0|1,0,0]=2 1185 B8R0.8 C[C@@H](NCCO)C(=O)O Amb26885478 [0,0,1,0,0,0|0,0,0]=1 1186 B8R0.8 C[C@@H](O)[C@@H](C)OCCO Amb27641937 [0,0,1,0,0,0|2,0,1]=4 1187 B8R0.8 C[C@@H](OCCF)C(=O)O Amb27763930 [0,0,1,0,0,0|2,0,0]=3 1188 B8R0.8 C[C@@H](OCCO)C(=O)O Amb28318043 [0,0,1,0,0,0|1,0,0]=2 1189 B8R0.8 C[C@@H](SCCN)C(=O)O Amb27170977 [0,0,1,0,0,0|2,0,0]=3 1190 B8R0.8 C[C@H](NCC#N)C(=O)O Amb28079480 [0,0,1,0,0,0|1,0,1]=3 1191 B8R0.8 C[C@H](NCCN)[C@@H](C)O Amb27216624 [0,0,1,0,0,0|2,0,1]=4 1192 B8R0.8 C[C@H](NCCO)C(=O)O Amb28058421 [0,0,1,0,0,0|0,0,0]=1 1193 B8R0.8 C[C@H](OCCN)C(=O)O Amb27479935 [0,0,1,0,0,0|2,0,0]=3 1194 B8R0.8 C[C@H](OCCO)C(=O)O Amb27398048 [0,0,1,0,0,0|1,0,0]=2 1195 B8R0.8 C\C(=C/CCN)C(=O)O Amb28397850 [0,0,1,0,0,0|2,0,1]=4 1196 B8R0.8 N=C(NCCO)C(=O)O Amb18124348 [0,0,1,0,0,0|1,0,1]=3 1197 B8R0.8 NC(=O)C(=O)NCCO Amb27804506 [0,0,1,0,0,0|2,0,1]=4 1198 B8R0.8 NC(=O)C(N)CCCO Amb33066182 [0,0,1,0,0,0|3,0,0]=4 1199 B8R0.8 NC(CCCBr)C(=O)O Amb24480263 [0,0,1,0,0,0|3,0,0]=4 1200 B8R0.8 NC(CCCF)C(=O)O Amb25366994 [0,0,1,0,0,0|3,0,0]=4 1201 B8R0.8 NC(CCCO)C(=O)O Amb18642915 [0,0,1,0,0,0|2,0,0]=3 1202 B8R0.8 NC(CCCO)C(=O)O Amb22900028 [0,0,1,0,0,0|2,0,0]=3 1203 B8R0.8 NC(CCCS)C(=O)O Amb27947968 [0,0,1,0,0,0|2,1,0]=4 1204 B8R0.8 NC(CCNO)C(=O)O Amb28285114 [0,0,1,0,0,0|3,0,0]=4 1205 B8R0.8 NCCCC(Br)C(=O)O Amb17595166 [0,0,1,0,0,0|3,0,0]=4 1206 B8R0.8 NCCCC(F)C(=O)O Amb27235092 [0,0,1,0,0,0|3,0,0]=4 1207 B8R0.8 NCCCC(N)C(=O)O Amb22489477 [0,0,1,0,0,0|3,0,0]=4 1208 B8R0.8 NCCCC(N)C(=O)O Amb4006442 [0,0,1,0,0,0|3,0,0]=4 1209 B8R0.8 NCCCC(N)C(=O)O Amb9173756 [0,0,1,0,0,0|3,0,0]=4 1210 B8R0.8 NCCC[C@@H](N)C(=O)O Amb32411789 [0,0,1,0,0,0|3,0,0]=4 1211 B8R0.8 NCCC[C@@H](N)C(=O)O Amb6600152 [0,0,1,0,0,0|3,0,0]=4 1212 B8R0.8 NCCC[C@@H](N)C(=O)O Amb8390415 [0,0,1,0,0,0|3,0,0]=4 1213 B8R0.8 NCCC[C@H](N)C(=O)O Amb20240598 [0,0,1,0,0,0|3,0,0]=4 1214 B8R0.8 NCCC[C@H](N)C(=O)O Amb22746434 [0,0,1,0,0,0|3,0,0]=4 1215 B8R0.8 NCCC[C@H](N)C(=O)O Amb8513279 [0,0,1,0,0,0|3,0,0]=4 1216 B8R0.8 NCCC[C@H](N)C(=O)O Amb8627869 [0,0,1,0,0,0|3,0,0]=4 1217 B8R0.8 NCCC[C@H](O)C(=O)O Amb27804309 [0,0,1,0,0,0|3,0,0]=4 1218 B8R0.8 N[C@@H](CCCCl)C(=O)O Amb27227989 [0,0,1,0,0,0|3,0,0]=4 1219 B8R0.8 N[C@@H](CCCF)C(=O)O Amb27223043 [0,0,1,0,0,0|3,0,0]=4 1220 B8R0.8 N[C@@H](CCCO)C(=O)O Amb16183887 [0,0,1,0,0,0|2,0,0]=3 1221 B8R0.8 N[C@@H](CCNO)C(=O)O Amb24117852 [0,0,1,0,0,0|3,0,0]=4 1222 B8R0.8 N[C@@H](CSCO)C(=O)O Amb27470985 [0,0,1,0,0,0|3,0,0]=4 1223 B8R0.8 N[C@H](CCCBr)C(=O)O Amb26080278 [0,0,1,0,0,0|3,0,0]=4 1224 B8R0.8 N[C@H](CCCF)C(=O)O Amb26908418 [0,0,1,0,0,0|3,0,0]=4 1225 B8R0.8 N[C@H](CCCO)C(=O)O Amb28120579 [0,0,1,0,0,0|2,0,0]=3 1226 B8R0.8 N[C@H](CCCO)C(=O)O Amb34913429 [0,0,1,0,0,0|2,0,0]=3 1227 B8R0.8 O=C(O)C(=O)CCCO Amb27470301 [0,0,1,0,0,0|2,0,1]=4 1228 B8R0.8 O=C(O)C(=O)CCCO Amb30666618 [0,0,1,0,0,0|2,0,1]=4 1229 B8R0.8 O=C(O)C(Br)CCCCl Amb17595866 [0,0,1,0,0,0|3,0,0]=4 1230 B8R0.8 O=C(O)C(Br)CCCO Amb28313364 [0,0,1,0,0,0|2,0,0]=3 1231 B8R0.8 O=C(O)C(O)CCCF Amb33196454 [0,0,1,0,0,0|3,0,0]=4 1232 B8R0.8 O=C(O)C(O)CCCO Amb18642939 [0,0,1,0,0,0|2,0,0]=3 1233 B8R0.8 O=C([O-])C(O)CCCO Amb28935028 [0,0,1,0,0,0|2,0,1]=4 1234 B8R0.9 C#CC(F)CCC(=O)O Amb28041990 [0,0,1,0,0,0|2,0,1]=4 1235 B8R0.9 C#CC(N)CCC(=O)O Amb22352566 [0,0,1,0,0,0|2,0,1]=4 1236 B8R0.9 C=C(C)CCC(C)CN Amb27180681 [0,0,1,0,0,0|3,0,0]=4 1237 B8R0.9 C=C(C)CCC(N)CN Amb27422880 [0,0,1,0,0,0|3,0,0]=4 1238 B8R0.9 C=C(C)CCC(O)CO Amb28315440 [0,0,1,0,0,0|3,0,0]=4 1239 B8R0.9 C=CC(N)CCC(=O)O Amb10843623 [0,0,1,0,0,0|2,0,1]=4 1240 B8R0.9 C=CC(N)CCC(=O)O Amb22056347 [0,0,1,0,0,0|2,0,1]=4 1241 B8R0.9 C=CC(O)CCC(=O)O Amb25785193 [0,0,1,0,0,0|1,0,1]=3 1242 B8R0.9 C=CC([NH3+])CCC(=O)O Amb10845648 [0,0,1,0,0,0|2,0,1]=4 1243 B8R0.9 C=C[C@H](N)CCC(=O)O Amb25694354 [0,0,1,0,0,0|2,0,1]=4 1244 B8R0.9 C=C[C@H](O)CCC(=O)O Amb27168215 [0,0,1,0,0,0|1,0,1]=3 1245 B8R0.9 CC(=O)CCC(C)CO Amb27838673 [0,0,1,0,0,0|3,0,0]=4 1246 B8R0.9 CC(=O)CCC(Cl)CCl Amb27259129 [0,0,1,0,0,0|3,0,0]=4 1247 B8R0.9 CC(=O)CCC(F)CCl Amb28060125 [0,0,1,0,0,0|3,0,0]=4 1248 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,0,1,0,0,0|3,0,0]=4 1249 B8R0.9 CC(=O)CCC(O)CF Amb28322193 [0,0,1,0,0,0|2,0,0]=3 1250 B8R0.9 CC(=O)COC(C)CN Amb18110559 [0,0,1,0,0,0|3,0,0]=4 1251 B8R0.9 CC(=O)NCC(C)CN Amb18300590 [0,0,1,0,0,0|3,0,0]=4 1252 B8R0.9 CC(=O)NC[C@@H](O)CO Amb27156658 [0,0,1,0,0,0|3,0,0]=4 1253 B8R0.9 CC(=O)NC[C@H](O)CCl Amb25760218 [0,0,1,0,0,0|3,0,0]=4 1254 B8R0.9 CC(=O)OCC(O)CCl Amb17593815 [0,0,1,0,0,0|3,0,0]=4 1255 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,0,1,0,0,0|3,0,0]=4 1256 B8R0.9 CC(=O)OC[C@@H](O)CCl Amb27469927 [0,0,1,0,0,0|3,0,0]=4 1257 B8R0.9 CC(=O)SC[C@H](O)CO Amb27261704 [0,0,1,0,0,0|3,0,0]=4 1258 B8R0.9 CC(C#CC(=O)O)CN Amb33168959 [0,0,1,0,0,0|1,0,2]=4 1259 B8R0.9 CC(C)CCC(O)CN Amb28282095 [0,0,1,0,0,0|2,0,1]=4 1260 B8R0.9 CC(CCC(=O)O)NO Amb27945567 [0,0,1,0,0,0|3,0,0]=4 1261 B8R0.9 CC(CCl)CCC(=O)Cl Amb25921088 [0,0,1,0,0,0|3,0,0]=4 1262 B8R0.9 CC(CCl)CCC(=O)O Amb27838484 [0,0,1,0,0,0|2,0,0]=3 1263 B8R0.9 CC(CN)CCC(=O)O Amb22059189 [0,0,1,0,0,0|1,0,0]=2 1264 B8R0.9 CC(CN)CCC(=O)O Amb28935016 [0,0,1,0,0,0|1,0,0]=2 1265 B8R0.9 CC(CN)CCS(C)=O Amb28430263 [0,0,1,0,0,0|3,0,0]=4 1266 B8R0.9 CC(CN)CC[N+](=O)[O-] Amb33746654 [0,0,1,0,0,0|2,0,1]=4 1267 B8R0.9 CC(CN)CNC(N)=O Amb18994081 [0,0,1,0,0,0|3,0,0]=4 1268 B8R0.9 CC(CN)OCC(=O)O Amb18629591 [0,0,1,0,0,0|2,0,0]=3 1269 B8R0.9 CC(CN)SCC(=O)O Amb28142553 [0,0,1,0,0,0|2,0,0]=3 1270 B8R0.9 CC(\C=C\C(=O)O)CN Amb27234754 [0,0,1,0,0,0|1,0,2]=4 1271 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,0,1,0,0,0|1,0,2]=4 1272 B8R0.9 CCC(Br)CCC(=O)O Amb28367201 [0,0,1,0,0,0|2,0,0]=3 1273 B8R0.9 CCC(C)CCC(=O)O Amb22352932 [0,0,1,0,0,0|2,0,0]=3 1274 B8R0.9 CCC(C)CCC(C)=O Amb22229980 [0,0,1,0,0,0|3,0,0]=4 1275 B8R0.9 CCC(C)NCC(=O)O Amb7766416 [0,0,1,0,0,0|3,0,0]=4 1276 B8R0.9 CCC(C)NCC(=O)O Amb9184562 [0,0,1,0,0,0|3,0,0]=4 1277 B8R0.9 CCC(C)OCC(=O)O Amb18307944 [0,0,1,0,0,0|3,0,0]=4 1278 B8R0.9 CCC(C)SCC(=O)O Amb6680193 [0,0,1,0,0,0|3,0,0]=4 1279 B8R0.9 CCC(Cl)CCC(=O)Cl Amb24524189 [0,0,1,0,0,0|3,0,0]=4 1280 B8R0.9 CCC(Cl)CCC(=O)O Amb27955847 [0,0,1,0,0,0|2,0,0]=3 1281 B8R0.9 CCC(N)CCC(=O)O Amb21961489 [0,0,1,0,0,0|2,0,0]=3 1282 B8R0.9 CCC(N)CCC(=O)O Amb5717972 [0,0,1,0,0,0|2,0,0]=3 1283 B8R0.9 CCC(N)CCC(N)=O Amb27194979 [0,0,1,0,0,0|3,0,0]=4 1284 B8R0.9 CCC(O)C#CC(=O)O Amb27169546 [0,0,1,0,0,0|1,0,2]=4 1285 B8R0.9 CCC(O)CCB(O)O Amb24353745 [0,0,1,0,0,0|2,0,1]=4 1286 B8R0.9 CCC(O)CCC(=O)O Amb27149373 [0,0,1,0,0,0|1,0,0]=2 1287 B8R0.9 CCC(O)CCC(N)=O Amb27234638 [0,0,1,0,0,0|2,0,0]=3 1288 B8R0.9 CCC(O)CC[C@@H](C)O Amb28049249 [0,0,1,0,0,0|2,0,1]=4 1289 B8R0.9 CCC(O)CNC(N)=O Amb27235306 [0,0,1,0,0,0|3,0,0]=4 1290 B8R0.9 CCC(O)COC(N)=O Amb27175099 [0,0,1,0,0,0|3,0,0]=4 1291 B8R0.9 CCC(S)CCC(=O)O Amb27954753 [0,0,1,0,0,0|1,1,0]=3 1292 B8R0.9 CCN(C)CCC(=O)O Amb8428205 [0,0,1,0,0,0|3,0,0]=4 1293 B8R0.9 CCN(C)CCC(=O)O Amb8890954 [0,0,1,0,0,0|3,0,0]=4 1294 B8R0.9 CCS(=O)CCC(=O)O Amb9173461 [0,0,1,0,0,0|2,0,1]=4 1295 B8R0.9 CC[C@@H](C)CCC(=O)O Amb25887394 [0,0,1,0,0,0|2,0,0]=3 1296 B8R0.9 CC[C@@H](O)CCC(N)=O Amb27254154 [0,0,1,0,0,0|2,0,0]=3 1297 B8R0.9 CC[C@H](C)CCC(C)=O Amb27447760 [0,0,1,0,0,0|3,0,0]=4 1298 B8R0.9 CC[C@H](C)CCC(N)=O Amb28346481 [0,0,1,0,0,0|3,0,0]=4 1299 B8R0.9 CC[C@H](O)CCC(=O)O Amb27170465 [0,0,1,0,0,0|1,0,0]=2 1300 B8R0.9 CC[C@H](O)CNC(C)=O Amb27762160 [0,0,1,0,0,0|3,0,0]=4 1301 B8R0.9 CN(C)CCC(O)CN Amb18124365 [0,0,1,0,0,0|3,0,0]=4 1302 B8R0.9 CN(C)CC[C@@H](O)CN Amb33272523 [0,0,1,0,0,0|3,0,0]=4 1303 B8R0.9 CN(C)CC[C@H](O)CN Amb33272522 [0,0,1,0,0,0|3,0,0]=4 1304 B8R0.9 COC(C)CCC(=O)O Amb24271104 [0,0,1,0,0,0|3,0,0]=4 1305 B8R0.9 CO[C@@H](C)CCC(=O)O Amb28241276 [0,0,1,0,0,0|3,0,0]=4 1306 B8R0.9 CS(=O)CCC(O)CN Amb27403927 [0,0,1,0,0,0|2,0,0]=3 1307 B8R0.9 CSC(C)CCC(=O)O Amb22059071 [0,0,1,0,0,0|3,0,0]=4 1308 B8R0.9 C[C@@H](CN)CC[N+](=O)[O-] Amb33744961 [0,0,1,0,0,0|2,0,1]=4 1309 B8R0.9 C[C@H](CN)CC[N+](=O)[O-] Amb33748017 [0,0,1,0,0,0|2,0,1]=4 1310 B8R0.9 N#CC(N)CCC(=O)O Amb27596135 [0,0,1,0,0,0|1,0,2]=4 1311 B8R0.9 N#CC(N)CCC(=O)O Amb30666632 [0,0,1,0,0,0|1,0,2]=4 1312 B8R0.9 NC(=O)CCC(O)CO Amb28073389 [0,0,1,0,0,0|2,0,0]=3 1313 B8R0.9 NC(=O)CC[C@H](N)CF Amb27431484 [0,0,1,0,0,0|3,0,0]=4 1314 B8R0.9 NC(=O)CC[C@H](N)CO Amb24368577 [0,0,1,0,0,0|3,0,0]=4 1315 B8R0.9 NC(CCl)CCC(=O)O Amb27440510 [0,0,1,0,0,0|2,0,0]=3 1316 B8R0.9 NC(CF)CCC(=O)Cl Amb27876552 [0,0,1,0,0,0|3,0,0]=4 1317 B8R0.9 NC(CF)CCC(=O)O Amb19148378 [0,0,1,0,0,0|2,0,0]=3 1318 B8R0.9 NC(CF)CCC(=O)O Amb33473114 [0,0,1,0,0,0|2,0,0]=3 1319 B8R0.9 NC(CO)CCC(=O)O Amb18642916 [0,0,1,0,0,0|2,0,0]=3 1320 B8R0.9 NC(CO)CCC(=O)O Amb32665461 [0,0,1,0,0,0|2,0,0]=3 1321 B8R0.9 NC(CS)CCC(=O)O Amb27458291 [0,0,1,0,0,0|2,0,0]=3 1322 B8R0.9 NCC(=O)CCC(=O)O Amb2720232 [0,0,1,0,0,0|0,0,2]=3 1323 B8R0.9 NCC(=O)CCC(=O)O Amb5395775 [0,0,1,0,0,0|0,0,2]=3 1324 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,0,1,0,0,0|1,0,2]=4 1325 B8R0.9 NCC(=O)NCC(=O)O Amb8382637 [0,0,1,0,0,0|1,0,2]=4 1326 B8R0.9 NCC(N)CCC(=O)O Amb19328773 [0,0,1,0,0,0|1,0,0]=2 1327 B8R0.9 NCC(N)CCC(=O)O Amb27837536 [0,0,1,0,0,0|1,0,0]=2 1328 B8R0.9 NCC(O)CCC(=O)O Amb29838305 [0,0,1,0,0,0|0,0,0]=1 1329 B8R0.9 NCC(O)CCC(=O)[O-] Amb33330648 [0,0,1,0,0,0|0,0,1]=2 1330 B8R0.9 NCC(O)CNC(N)=O Amb27838588 [0,0,1,0,0,0|2,0,0]=3 1331 B8R0.9 NCC(O)CNC(N)=O Amb33457634 [0,0,1,0,0,0|2,0,0]=3 1332 B8R0.9 NC[C@@H](O)CCC(=O)O Amb27477096 [0,0,1,0,0,0|0,0,0]=1 1333 B8R0.9 NC[C@H](N)CCC(=O)O Amb28068164 [0,0,1,0,0,0|1,0,0]=2 1334 B8R0.9 N[C@@H](CS)CCC(=O)O Amb28341808 [0,0,1,0,0,0|2,0,0]=3 1335 B8R0.9 N[C@H](CF)CCC(=O)O Amb32729481 [0,0,1,0,0,0|2,0,0]=3 1336 B8R0.9 N[C@H](CO)CCC(=O)O Amb24685421 [0,0,1,0,0,0|2,0,0]=3 1337 B8R0.9 N[C@H](CO)CCC(=O)O Amb32664911 [0,0,1,0,0,0|2,0,0]=3 1338 B8R0.9 O=C(O)CCC(=O)CCl Amb25736440 [0,0,1,0,0,0|1,0,2]=4 1339 B8R0.9 O=C(O)CCC(O)CCl Amb27799910 [0,0,1,0,0,0|1,0,0]=2 1340 B8R0.9 O=C(O)CCC(S)CS Amb27407074 [0,0,1,0,0,0|1,1,0]=3 1341 B8R0.9 O=C(O)CC\C(O)=N\O Amb24745795 [0,0,1,0,0,0|2,0,1]=4 1342 B8R0.9 O=C(O)\C=C\C(O)CO Amb18642875 [0,0,1,0,0,0|1,0,2]=4 1343 B8R0.9 O=C(O)\C=C\[C@H](O)CO Amb27437218 [0,0,1,0,0,0|1,0,2]=4 1344 B8R0.9 O=NN(O)CCC(=O)O Amb27495384 [0,0,1,0,0,0|3,0,0]=4 1345 B8R0.15 C#CC[C@H](CC)C(=O)O Amb28120786 [0,0,1,0,0,0|2,0,1]=4 1346 B8R0.15 C=C(C)C(CC)CCO Amb28321566 [0,0,1,0,0,0|3,0,0]=4 1347 B8R0.15 C=C(C)C(CCC)NC Amb27667465 [0,0,1,0,0,0|3,0,0]=4 1348 B8R0.15 C=CCC(CC)C(=O)O Amb18642632 [0,0,1,0,0,0|2,0,1]=4 1349 B8R0.15 C=CCC(NO)C(=O)O Amb27768789 [0,0,1,0,0,0|2,0,1]=4 1350 B8R0.15 C=C[C@@H](CCC)C(=O)O Amb27658640 [0,0,1,0,0,0|2,0,1]=4 1351 B8R0.15 CCC(CCF)C(=O)O Amb26321627 [0,0,1,0,0,0|2,0,0]=3 1352 B8R0.15 CCC(CCN)C(=O)O Amb24699884 [0,0,1,0,0,0|2,0,0]=3 1353 B8R0.15 CCC(CCN)C(=O)O Amb32662662 [0,0,1,0,0,0|2,0,0]=3 1354 B8R0.15 CCC(CCO)C(=O)O Amb18642884 [0,0,1,0,0,0|1,0,0]=2 1355 B8R0.15 CCC(COC)C(=O)O Amb18124352 [0,0,1,0,0,0|3,0,0]=4 1356 B8R0.15 CCC(CSC)C(=O)O Amb33272061 [0,0,1,0,0,0|3,0,0]=4 1357 B8R0.15 CCCC(C=O)C(=O)O Amb27464964 [0,0,1,0,0,0|3,0,0]=4 1358 B8R0.15 CCCC(CC)C(=O)O Amb19009626 [0,0,1,0,0,0|2,0,0]=3 1359 B8R0.15 CCCC(CF)C(=O)O Amb27186472 [0,0,1,0,0,0|3,0,0]=4 1360 B8R0.15 CCCC(CN)C(=O)O Amb19373497 [0,0,1,0,0,0|3,0,0]=4 1361 B8R0.15 CCCC(CO)C(=O)O Amb25881510 [0,0,1,0,0,0|3,0,0]=4 1362 B8R0.15 CCCC(NC)C(=O)O Amb21961534 [0,0,1,0,0,0|1,0,0]=2 1363 B8R0.15 CCCC(NC)C(=O)O Amb22587444 [0,0,1,0,0,0|1,0,0]=2 1364 B8R0.15 CCCC(NC)C(=O)O Amb9496293 [0,0,1,0,0,0|1,0,0]=2 1365 B8R0.15 CCCC(NC)C(N)=O Amb19006602 [0,0,1,0,0,0|2,0,0]=3 1366 B8R0.15 CCCC(NO)C(=O)O Amb22372057 [0,0,1,0,0,0|2,0,0]=3 1367 B8R0.15 CCCC(OC)C(=O)O Amb8455302 [0,0,1,0,0,0|2,0,0]=3 1368 B8R0.15 CCCC(OC)C(C)=O Amb27207958 [0,0,1,0,0,0|3,0,0]=4 1369 B8R0.15 CCCC(SC)C(=O)O Amb28289849 [0,0,1,0,0,0|2,0,0]=3 1370 B8R0.15 CCC[C@@H](CO)C(=O)O Amb24571859 [0,0,1,0,0,0|3,0,0]=4 1371 B8R0.15 CCC[C@@H](NC)C(=O)O Amb25771939 [0,0,1,0,0,0|1,0,0]=2 1372 B8R0.15 CCC[C@@H](NC)C(=O)O Amb33801471 [0,0,1,0,0,0|1,0,0]=2 1373 B8R0.15 CCC[C@H](CN)C(=O)O Amb27460612 [0,0,1,0,0,0|3,0,0]=4 1374 B8R0.15 CCC[C@H](CO)C(=O)O Amb25063310 [0,0,1,0,0,0|3,0,0]=4 1375 B8R0.15 CCC[C@H](NC)C(=O)O Amb25062610 [0,0,1,0,0,0|1,0,0]=2 1376 B8R0.15 CCC[C@H](NC)C(=O)O Amb33456398 [0,0,1,0,0,0|1,0,0]=2 1377 B8R0.15 CCC[C@H](NC)C(N)=O Amb27475077 [0,0,1,0,0,0|2,0,0]=3 1378 B8R0.15 CCN(CCO)C(N)=O Amb27466149 [0,0,1,0,0,0|3,0,0]=4 1379 B8R0.15 CCNC(CC)C(=O)O Amb33339265 [0,0,1,0,0,0|3,0,0]=4 1380 B8R0.15 CCNC(CC)C(=O)O Amb9620054 [0,0,1,0,0,0|3,0,0]=4 1381 B8R0.15 CCN[C@@H](CC)C(=O)O Amb26019582 [0,0,1,0,0,0|3,0,0]=4 1382 B8R0.15 CCN[C@H](CC)C(=O)O Amb33347493 [0,0,1,0,0,0|3,0,0]=4 1383 B8R0.15 CCOC(CC)C(=O)O Amb9675410 [0,0,1,0,0,0|3,0,0]=4 1384 B8R0.15 CCSC(CC)C(=O)O Amb9675503 [0,0,1,0,0,0|3,0,0]=4 1385 B8R0.15 CC[C@H](CCN)C(=O)O Amb27754665 [0,0,1,0,0,0|2,0,0]=3 1386 B8R0.15 CNC(CCO)C(=O)O Amb27390592 [0,0,1,0,0,0|0,0,0]=1 1387 B8R0.15 CNC(CCO)C(C)C Amb27982739 [0,0,1,0,0,0|2,0,1]=4 1388 B8R0.15 CNC(CCO)C(C)O Amb27849768 [0,0,1,0,0,0|1,0,1]=3 1389 B8R0.15 CNC(COC)C(=O)O Amb19304133 [0,0,1,0,0,0|2,0,0]=3 1390 B8R0.15 CNC(COC)C(=O)O Amb22059040 [0,0,1,0,0,0|2,0,0]=3 1391 B8R0.15 CNC(COC)C(N)=O Amb24120142 [0,0,1,0,0,0|3,0,0]=4 1392 B8R0.15 CNC(COC)C(N)=O Amb32666305 [0,0,1,0,0,0|3,0,0]=4 1393 B8R0.15 CN[C@@H](COC)C(N)=O Amb26458948 [0,0,1,0,0,0|3,0,0]=4 1394 B8R0.15 CN[C@@H](COC)C(N)=O Amb28935003 [0,0,1,0,0,0|3,0,0]=4 1395 B8R0.15 CN[C@H](CCO)[C@H](C)O Amb27489692 [0,0,1,0,0,0|1,0,1]=3 1396 B8R0.15 CN[C@H](COC)C(=O)O Amb33347473 [0,0,1,0,0,0|2,0,0]=3 1397 B8R0.15 CN[C@H](COC)C(N)=O Amb26507221 [0,0,1,0,0,0|3,0,0]=4 1398 B8R0.15 CN[C@H](COC)C(N)=O Amb32661128 [0,0,1,0,0,0|3,0,0]=4 1399 B8R0.15 COC(CC#N)C(=O)O Amb27157791 [0,0,1,0,0,0|2,0,1]=4 1400 B8R0.15 COC(CCF)C(=O)O Amb33379286 [0,0,1,0,0,0|2,0,0]=3 1401 B8R0.15 COC(CCN)C(=O)O Amb26631814 [0,0,1,0,0,0|2,0,0]=3 1402 B8R0.15 COC(CCN)C(=O)O Amb32661022 [0,0,1,0,0,0|2,0,0]=3 1403 B8R0.15 COCC(NO)C(=O)O Amb27247213 [0,0,1,0,0,0|3,0,0]=4 1404 B8R0.15 COCC(OC)C(=O)O Amb26627988 [0,0,1,0,0,0|3,0,0]=4 1405 B8R0.15 COCC(SC)C(=O)O Amb28046503 [0,0,1,0,0,0|3,0,0]=4 1406 B8R0.15 CON(CCO)C(C)=O Amb27765826 [0,0,1,0,0,0|3,0,0]=4 1407 B8R0.15 C\C=C(/CCN)C(=O)O Amb27493438 [0,0,1,0,0,0|2,0,1]=4 1408 B8R0.15 N#CC(CCF)C(=O)O Amb35741465 [0,0,1,0,0,0|3,0,0]=4 1409 B8R0.15 N#CC(CCO)C(=O)O Amb35741464 [0,0,1,0,0,0|2,0,0]=3 1410 B8R0.15 NCC(CCF)C(=O)O Amb33196465 [0,0,1,0,0,0|3,0,0]=4 1411 B8R0.15 O=C(O)C(CO)CCF Amb27876842 [0,0,1,0,0,0|3,0,0]=4 1412 B8R0.15 O=C(O)C(CS)CCS Amb27477377 [0,0,1,0,0,0|2,1,0]=4 1413 B8R0.15 O=C(O)[C@H](CS)NCO Amb27980938 [0,0,1,0,0,0|3,0,0]=4 1414 B8R0.23 BC(CC(=O)O)C(=O)O Amb28287358 [0,0,1,0,0,0|2,0,1]=4 1415 B8R0.23 C=C(Br)CC(N)C(=O)O Amb24557771 [0,0,1,0,0,0|1,0,2]=4 1416 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O Amb22746251 [0,0,1,0,0,0|1,0,2]=4 1417 B8R0.23 C=C(Br)C[C@H](N)C(=O)O Amb25918807 [0,0,1,0,0,0|1,0,2]=4 1418 B8R0.23 C=C(C)CC(C)C(=O)O Amb24471924 [0,0,1,0,0,0|2,0,1]=4 1419 B8R0.23 C=C(C)CC(N)C(=O)O Amb6280366 [0,0,1,0,0,0|1,0,1]=3 1420 B8R0.23 C=C(C)CC(N)C(N)=O Amb26326676 [0,0,1,0,0,0|2,0,1]=4 1421 B8R0.23 C=C(C)CC(O)C(=O)O Amb24534477 [0,0,1,0,0,0|2,0,1]=4 1422 B8R0.23 C=C(C)C[C@@H](C)C(=O)O Amb24340253 [0,0,1,0,0,0|2,0,1]=4 1423 B8R0.23 C=C(C)C[C@@H](N)C(=O)O Amb22801689 [0,0,1,0,0,0|1,0,1]=3 1424 B8R0.23 C=C(C)C[C@H](C)C(=O)O Amb10843988 [0,0,1,0,0,0|2,0,1]=4 1425 B8R0.23 C=C(C)C[C@H](N)C(=O)O Amb25757900 [0,0,1,0,0,0|1,0,1]=3 1426 B8R0.23 C=C(CC(C)C)C(=O)O Amb33542856 [0,0,1,0,0,0|2,0,1]=4 1427 B8R0.23 C=C(CN(C)O)C(=O)O Amb27640409 [0,0,1,0,0,0|2,0,1]=4 1428 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb24411473 [0,0,1,0,0,0|1,0,2]=4 1429 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb28935021 [0,0,1,0,0,0|1,0,2]=4 1430 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660529 [0,0,1,0,0,0|1,0,2]=4 1431 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660530 [0,0,1,0,0,0|1,0,2]=4 1432 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb28059492 [0,0,1,0,0,0|1,0,2]=4 1433 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb32656263 [0,0,1,0,0,0|1,0,2]=4 1434 B8R0.23 C=C(F)C[C@@H](N)C(=O)O Amb27771842 [0,0,1,0,0,0|1,0,2]=4 1435 B8R0.23 CC(=O)C(C)CC(C)C Amb24640121 [0,0,1,0,0,0|3,0,0]=4 1436 B8R0.23 CC(=O)C(Cl)CC(C)O Amb27454439 [0,0,1,0,0,0|2,0,0]=3 1437 B8R0.23 CC(=O)C(N)CC(=O)O Amb2697582 [0,0,1,0,0,0|2,0,1]=4 1438 B8R0.23 CC(=O)C(O)CC(C)C Amb26845888 [0,0,1,0,0,0|3,0,0]=4 1439 B8R0.23 CC(=O)CC(C)C(=O)O Amb3939893 [0,0,1,0,0,0|1,0,2]=4 1440 B8R0.23 CC(=O)CC(N)C(=O)O Amb18832532 [0,0,1,0,0,0|0,0,2]=3 1441 B8R0.23 CC(=O)CC(N)C(=O)O Amb22546289 [0,0,1,0,0,0|0,0,2]=3 1442 B8R0.23 CC(=O)CC(N)C(N)=O Amb27485103 [0,0,1,0,0,0|1,0,2]=4 1443 B8R0.23 CC(=O)CC(O)C(=O)O Amb22500917 [0,0,1,0,0,0|1,0,2]=4 1444 B8R0.23 CC(=O)C[C@@H](N)C(=O)O Amb22745939 [0,0,1,0,0,0|0,0,2]=3 1445 B8R0.23 CC(=O)C[C@@H](O)C(=O)O Amb26845481 [0,0,1,0,0,0|1,0,2]=4 1446 B8R0.23 CC(=O)C[C@H](C)C(=O)O Amb26318005 [0,0,1,0,0,0|1,0,2]=4 1447 B8R0.23 CC(=O)C[C@H](N)C(=O)O Amb27832342 [0,0,1,0,0,0|0,0,2]=3 1448 B8R0.23 CC(=O)C[C@H](O)C(=O)O Amb24358758 [0,0,1,0,0,0|1,0,2]=4 1449 B8R0.23 CC(=O)[C@@H](N)CC(C)C Amb28344512 [0,0,1,0,0,0|2,0,0]=3 1450 B8R0.23 CC(=O)[C@@H](O)CC(C)C Amb28202353 [0,0,1,0,0,0|3,0,0]=4 1451 B8R0.23 CC(=O)[C@H](N)CC(C)C Amb27490707 [0,0,1,0,0,0|2,0,0]=3 1452 B8R0.23 CC(Br)CC(=O)C(=O)O Amb28146183 [0,0,1,0,0,0|2,0,1]=4 1453 B8R0.23 CC(Br)CC(C)C(=O)O Amb27760411 [0,0,1,0,0,0|2,0,0]=3 1454 B8R0.23 CC(C)CC(=N)C(=O)O Amb27268516 [0,0,1,0,0,0|1,0,2]=4 1455 B8R0.23 CC(C)CC(=O)C(=O)O Amb8387123 [0,0,1,0,0,0|2,0,1]=4 1456 B8R0.23 CC(C)CC(Br)C(=O)Cl Amb26515942 [0,0,1,0,0,0|3,0,0]=4 1457 B8R0.23 CC(C)CC(Br)C(=O)O Amb16233356 [0,0,1,0,0,0|2,0,0]=3 1458 B8R0.23 CC(C)CC(C)C(=O)O Amb18975244 [0,0,1,0,0,0|2,0,0]=3 1459 B8R0.23 CC(C)CC(Cl)C(=O)Cl Amb27400431 [0,0,1,0,0,0|3,0,0]=4 1460 B8R0.23 CC(C)CC(Cl)C(=O)O Amb17593753 [0,0,1,0,0,0|2,0,0]=3 1461 B8R0.23 CC(C)CC(F)C(=O)O Amb24565634 [0,0,1,0,0,0|2,0,0]=3 1462 B8R0.23 CC(C)CC(N)C(=O)O Amb9703094 [0,0,1,0,0,0|1,0,0]=2 1463 B8R0.23 CC(C)CC(N)C(C)O Amb18642850 [0,0,1,0,0,0|2,0,1]=4 1464 B8R0.23 CC(C)CC(N)C(N)=O Amb6334827 [0,0,1,0,0,0|2,0,0]=3 1465 B8R0.23 CC(C)CC(N)C(N)=O Amb9729639 [0,0,1,0,0,0|2,0,0]=3 1466 B8R0.23 CC(C)CC(N)C(N)=S Amb28292675 [0,0,1,0,0,0|2,1,0]=4 1467 B8R0.23 CC(C)CC(N)C(O)O Amb27970496 [0,0,1,0,0,0|1,0,2]=4 1468 B8R0.23 CC(C)CC(N)P(O)O Amb27231724 [0,0,1,0,0,0|2,0,1]=4 1469 B8R0.23 CC(C)CC(N)[PH](=O)O Amb27831348 [0,0,1,0,0,0|2,0,0]=3 1470 B8R0.23 CC(C)CC(O)C(=O)O Amb2694726 [0,0,1,0,0,0|2,0,0]=3 1471 B8R0.23 CC(C)CC(O)C(=O)[O-] Amb33872314 [0,0,1,0,0,0|2,0,1]=4 1472 B8R0.23 CC(C)CC(O)[PH](=O)O Amb27255267 [0,0,1,0,0,0|3,0,0]=4 1473 B8R0.23 CC(C)CC(S)C(=O)O Amb18296292 [0,0,1,0,0,0|2,0,0]=3 1474 B8R0.23 CC(C)CN(N)C(N)=O Amb27624191 [0,0,1,0,0,0|3,0,0]=4 1475 B8R0.23 CC(C)C[C@@H](C)C(=O)O Amb10844070 [0,0,1,0,0,0|2,0,0]=3 1476 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O Amb22800398 [0,0,1,0,0,0|2,0,0]=3 1477 B8R0.23 CC(C)C[C@@H](F)C(=O)O Amb24616998 [0,0,1,0,0,0|2,0,0]=3 1478 B8R0.23 CC(C)C[C@@H](N)B(O)O Amb27978098 [0,0,1,0,0,0|2,0,1]=4 1479 B8R0.23 CC(C)C[C@@H](N)C(=O)O Amb2720579 [0,0,1,0,0,0|1,0,0]=2 1480 B8R0.23 CC(C)C[C@@H](N)C(C)O Amb28201191 [0,0,1,0,0,0|2,0,1]=4 1481 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb16183944 [0,0,1,0,0,0|2,0,0]=3 1482 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [0,0,1,0,0,0|2,0,0]=3 1483 B8R0.23 CC(C)C[C@@H](N)C(N)=S Amb27450783 [0,0,1,0,0,0|2,1,0]=4 1484 B8R0.23 CC(C)C[C@@H](N)[C@@H](C)O Amb27593782 [0,0,1,0,0,0|2,0,1]=4 1485 B8R0.23 CC(C)C[C@@H](O)C(=O)O Amb8630052 [0,0,1,0,0,0|2,0,0]=3 1486 B8R0.23 CC(C)C[C@@H](S)C(=O)O Amb27786874 [0,0,1,0,0,0|2,0,0]=3 1487 B8R0.23 CC(C)C[C@H](Br)C(=O)O Amb22226489 [0,0,1,0,0,0|2,0,0]=3 1488 B8R0.23 CC(C)C[C@H](Br)C(N)=O Amb28197754 [0,0,1,0,0,0|3,0,0]=4 1489 B8R0.23 CC(C)C[C@H](C)C(=O)O Amb10844071 [0,0,1,0,0,0|2,0,0]=3 1490 B8R0.23 CC(C)C[C@H](Cl)C(=O)Cl Amb27657532 [0,0,1,0,0,0|3,0,0]=4 1491 B8R0.23 CC(C)C[C@H](Cl)C(=O)O Amb22388637 [0,0,1,0,0,0|2,0,0]=3 1492 B8R0.23 CC(C)C[C@H](F)C(=O)O Amb10841083 [0,0,1,0,0,0|2,0,0]=3 1493 B8R0.23 CC(C)C[C@H](N)B(O)O Amb24578467 [0,0,1,0,0,0|2,0,1]=4 1494 B8R0.23 CC(C)C[C@H](N)C(=O)O Amb3499446 [0,0,1,0,0,0|1,0,0]=2 1495 B8R0.23 CC(C)C[C@H](N)C(=O)S Amb27810129 [0,0,1,0,0,0|1,1,0]=3 1496 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb10670112 [0,0,1,0,0,0|2,0,0]=3 1497 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb8515324 [0,0,1,0,0,0|2,0,0]=3 1498 B8R0.23 CC(C)C[C@H](N)C(N)=S Amb28285298 [0,0,1,0,0,0|2,1,0]=4 1499 B8R0.23 CC(C)C[C@H](O)C(=O)O Amb16232074 [0,0,1,0,0,0|2,0,0]=3 1500 B8R0.23 CC(C)NC(C)C(=O)O Amb10199874 [0,0,1,0,0,0|3,0,0]=4 1501 B8R0.23 CC(C)NC(C)C(=O)O Amb1110769 [0,0,1,0,0,0|3,0,0]=4 1502 B8R0.23 CC(C)N[C@H](C)C(=O)O Amb26409390 [0,0,1,0,0,0|3,0,0]=4 1503 B8R0.23 CC(C)OC(C)C(=O)O Amb10607866 [0,0,1,0,0,0|3,0,0]=4 1504 B8R0.23 CC(C)OC(F)C(=O)O Amb28045324 [0,0,1,0,0,0|3,0,0]=4 1505 B8R0.23 CC(C)SC(C)C(=O)O Amb6263656 [0,0,1,0,0,0|3,0,0]=4 1506 B8R0.23 CC(C)S[C@H](C)C(=O)O Amb27771567 [0,0,1,0,0,0|3,0,0]=4 1507 B8R0.23 CC(C)[C@H](N)C[C@H](C)O Amb27457995 [0,0,1,0,0,0|2,0,1]=4 1508 B8R0.23 CC(CC(=O)O)C(=O)O Amb1935053 [0,0,1,0,0,0|2,0,1]=4 1509 B8R0.23 CC(CC(F)F)C(=O)O Amb22896466 [0,0,1,0,0,0|3,0,0]=4 1510 B8R0.23 CC(CN(C)C)C(=O)O Amb8428203 [0,0,1,0,0,0|3,0,0]=4 1511 B8R0.23 CC(CN(C)C)C(=O)O Amb9173365 [0,0,1,0,0,0|3,0,0]=4 1512 B8R0.23 CC(CN(C)N)C(=O)O Amb28145156 [0,0,1,0,0,0|3,0,0]=4 1513 B8R0.23 CC(CS(=O)O)C(=O)O Amb28118949 [0,0,1,0,0,0|3,0,0]=4 1514 B8R0.23 CC(CS(C)=O)C(=O)O Amb18974546 [0,0,1,0,0,0|2,0,1]=4 1515 B8R0.23 CC(C[PH](=O)O)C(=O)O Amb27477749 [0,0,1,0,0,0|3,0,0]=4 1516 B8R0.23 CC(Cl)CC(N)C(=O)O Amb28325413 [0,0,1,0,0,0|1,0,0]=2 1517 B8R0.23 CC(N)CC(N)C(=O)O Amb28144636 [0,0,1,0,0,0|1,0,0]=2 1518 B8R0.23 CC(N)CC(O)C(=O)O Amb27975686 [0,0,1,0,0,0|2,0,0]=3 1519 B8R0.23 CC(O)CC(=O)C(=O)O Amb25789747 [0,0,1,0,0,0|1,0,1]=3 1520 B8R0.23 CC(O)CC(N)C(=O)O Amb18642918 [0,0,1,0,0,0|0,0,0]=1 1521 B8R0.23 CC(O)CC(N)C(C)C Amb27956567 [0,0,1,0,0,0|2,0,1]=4 1522 B8R0.23 CC(O)CC(N)C(N)=O Amb33065888 [0,0,1,0,0,0|1,0,0]=2 1523 B8R0.23 CC(O)C[C@@H](N)C(=O)O Amb26985188 [0,0,1,0,0,0|0,0,0]=1 1524 B8R0.23 CC(O)C[C@H](N)C(=O)O Amb27185464 [0,0,1,0,0,0|0,0,0]=1 1525 B8R0.23 CN(C)CC(N)C(=O)O Amb23558085 [0,0,1,0,0,0|2,0,0]=3 1526 B8R0.23 CN(C)CC(N)C(=O)O Amb32644516 [0,0,1,0,0,0|2,0,0]=3 1527 B8R0.23 CN(C)CC(N)C(=O)O Amb33756799 [0,0,1,0,0,0|2,0,0]=3 1528 B8R0.23 CN(C)CC(N)C(N)=O Amb18984335 [0,0,1,0,0,0|3,0,0]=4 1529 B8R0.23 CN(C)CC(O)C(=O)O Amb27856754 [0,0,1,0,0,0|3,0,0]=4 1530 B8R0.23 CN(C)C[C@@H](N)C(=O)O Amb19889770 [0,0,1,0,0,0|2,0,0]=3 1531 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb24078627 [0,0,1,0,0,0|2,0,0]=3 1532 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb8515079 [0,0,1,0,0,0|2,0,0]=3 1533 B8R0.23 CN(C)C[C@H](O)C(=O)O Amb24372674 [0,0,1,0,0,0|3,0,0]=4 1534 B8R0.23 CS(=N)C[C@H](N)C(=O)O Amb27838573 [0,0,1,0,0,0|2,0,0]=3 1535 B8R0.23 CS(=O)CC(N)C(=O)O Amb18125279 [0,0,1,0,0,0|1,0,1]=3 1536 B8R0.23 CS(=O)CC(N)C(N)=O Amb27608115 [0,0,1,0,0,0|2,0,1]=4 1537 B8R0.23 CS(=O)C[C@@H](N)C(=O)O Amb22745418 [0,0,1,0,0,0|1,0,1]=3 1538 B8R0.23 CS(=O)C[C@H](N)C(=O)O Amb16232229 [0,0,1,0,0,0|1,0,1]=3 1539 B8R0.23 C[C@@H](CC(=O)O)C(=O)O Amb22226742 [0,0,1,0,0,0|2,0,1]=4 1540 B8R0.23 C[C@@H](CC(F)F)C(=O)O Amb33749533 [0,0,1,0,0,0|3,0,0]=4 1541 B8R0.23 C[C@@H](Cl)C[C@H](N)C(=O)O Amb27863035 [0,0,1,0,0,0|1,0,0]=2 1542 B8R0.23 C[C@@H](O)C[C@@H](N)C(=O)O Amb27254158 [0,0,1,0,0,0|0,0,0]=1 1543 B8R0.23 C[C@H](CC(=O)O)C(=O)O Amb22225399 [0,0,1,0,0,0|2,0,1]=4 1544 B8R0.23 C[C@H](CC(F)F)C(=O)O Amb33727762 [0,0,1,0,0,0|3,0,0]=4 1545 B8R0.23 C[C@H](N)C[C@@H](O)C(=O)O Amb27231129 [0,0,1,0,0,0|2,0,0]=3 1546 B8R0.23 C[C@H](N)C[C@H](N)C(=O)O Amb27815088 [0,0,1,0,0,0|1,0,0]=2 1547 B8R0.23 C[C@H](N)C[C@H](O)C(=O)O Amb27180466 [0,0,1,0,0,0|2,0,0]=3 1548 B8R0.23 C[S@@](=O)C[C@H](N)C(=O)O Amb35789128 [0,0,1,0,0,0|1,0,1]=3 1549 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb33756818 [0,0,1,0,0,0|1,0,1]=3 1550 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb35788678 [0,0,1,0,0,0|1,0,1]=3 1551 B8R0.23 NC(=O)C(N)CC(=O)O Amb18124347 [0,0,1,0,0,0|2,0,1]=4 1552 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666212 [0,0,1,0,0,0|2,0,1]=4 1553 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666239 [0,0,1,0,0,0|2,0,1]=4 1554 B8R0.23 NC(=O)C(N)CC(F)F Amb27409676 [0,0,1,0,0,0|3,0,0]=4 1555 B8R0.23 NC(=O)CC(N)C(=O)O Amb2725509 [0,0,1,0,0,0|1,0,2]=4 1556 B8R0.23 NC(=O)CC(N)C(=O)O Amb3940878 [0,0,1,0,0,0|1,0,2]=4 1557 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb10071271 [0,0,1,0,0,0|1,0,2]=4 1558 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb17749060 [0,0,1,0,0,0|1,0,2]=4 1559 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb3940760 [0,0,1,0,0,0|1,0,2]=4 1560 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb8513755 [0,0,1,0,0,0|1,0,2]=4 1561 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb19334954 [0,0,1,0,0,0|2,0,1]=4 1562 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb31291739 [0,0,1,0,0,0|2,0,1]=4 1563 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb32652393 [0,0,1,0,0,0|2,0,1]=4 1564 B8R0.23 NC(=O)[C@H](N)CC(=O)O Amb27768775 [0,0,1,0,0,0|2,0,1]=4 1565 B8R0.23 NC(=O)[C@H](N)CC(F)F Amb27163215 [0,0,1,0,0,0|3,0,0]=4 1566 B8R0.23 NC(=S)C[C@H](N)C(=O)O Amb28410343 [0,0,1,0,0,0|1,1,1]=4 1567 B8R0.23 NC(CB(O)O)C(=O)O Amb28285179 [0,0,1,0,0,0|2,0,0]=3 1568 B8R0.23 NC(CB(O)O)C(=O)O Amb33803309 [0,0,1,0,0,0|2,0,0]=3 1569 B8R0.23 NC(CC(=O)O)C(=O)O Amb9702780 [0,0,1,0,0,0|1,0,1]=3 1570 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22167994 [0,0,1,0,0,0|1,0,2]=4 1571 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22337568 [0,0,1,0,0,0|1,0,2]=4 1572 B8R0.23 NC(CC(Cl)Cl)C(=O)O Amb27791749 [0,0,1,0,0,0|2,0,0]=3 1573 B8R0.23 NC(CC(F)F)C(=O)O Amb13952714 [0,0,1,0,0,0|2,0,0]=3 1574 B8R0.23 NC(CC(F)F)C(=O)O Amb33546007 [0,0,1,0,0,0|2,0,0]=3 1575 B8R0.23 NC(CS(=O)O)C(=O)O Amb541272 [0,0,1,0,0,0|2,0,0]=3 1576 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb34163080 [0,0,1,0,0,0|1,0,1]=3 1577 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb3940320 [0,0,1,0,0,0|1,0,1]=3 1578 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] Amb22801032 [0,0,1,0,0,0|1,0,2]=4 1579 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb20240565 [0,0,1,0,0,0|1,0,2]=4 1580 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb22748769 [0,0,1,0,0,0|1,0,2]=4 1581 B8R0.23 N[C@@H](CC(F)F)C(=O)O Amb26944439 [0,0,1,0,0,0|2,0,0]=3 1582 B8R0.23 N[C@@H](CC(F)F)C(=O)O Amb33482837 [0,0,1,0,0,0|2,0,0]=3 1583 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb6600148 [0,0,1,0,0,0|2,0,0]=3 1584 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb9809803 [0,0,1,0,0,0|2,0,0]=3 1585 B8R0.23 N[C@@H](C[SH](=O)=O)C(=O)O Amb27858626 [0,0,1,0,0,0|2,0,1]=4 1586 B8R0.23 N[C@H](CC(=O)O)C(=O)O Amb6599992 [0,0,1,0,0,0|1,0,1]=3 1587 B8R0.23 N[C@H](CC(F)F)C(=O)O Amb25117310 [0,0,1,0,0,0|2,0,0]=3 1588 B8R0.23 N[C@H](CC(F)F)C(=O)O Amb33743521 [0,0,1,0,0,0|2,0,0]=3 1589 B8R0.23 O=C(O)C(O)CC(F)F Amb25274709 [0,0,1,0,0,0|3,0,0]=4 1590 B8R0.23 O=C(O)C(O)CC(O)O Amb28397948 [0,0,1,0,0,0|2,0,0]=3 1591 B8R0.23 O=C(O)CC(Br)C(=O)O Amb3941503 [0,0,1,0,0,0|2,0,1]=4 1592 B8R0.23 O=C(O)CC(Cl)C(=O)O Amb9825869 [0,0,1,0,0,0|2,0,1]=4 1593 B8R0.23 O=C(O)CC(O)C(=O)O Amb8513238 [0,0,1,0,0,0|2,0,1]=4 1594 B8R0.23 O=C(O)CC(S)C(=O)O Amb2779994 [0,0,1,0,0,0|2,0,1]=4 1595 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O Amb22504149 [0,0,1,0,0,0|2,0,1]=4 1596 B8R0.23 O=C(O)C[C@@H](Cl)C(=O)O Amb20242424 [0,0,1,0,0,0|2,0,1]=4 1597 B8R0.23 O=C(O)C[C@@H](F)C(=O)O Amb27173500 [0,0,1,0,0,0|2,0,1]=4 1598 B8R0.23 O=C(O)C[C@@H](O)C(=O)O Amb4166311 [0,0,1,0,0,0|2,0,1]=4 1599 B8R0.23 O=C(O)C[C@H](Br)C(=O)O Amb8629197 [0,0,1,0,0,0|2,0,1]=4 1600 B8R0.23 O=C(O)C[C@H](Cl)C(=O)O Amb20242425 [0,0,1,0,0,0|2,0,1]=4 1601 B8R0.23 O=C(O)C[C@H](F)C(=O)O Amb27167819 [0,0,1,0,0,0|2,0,1]=4 1602 B8R0.23 O=C(O)C[C@H](O)C(=O)O Amb6599993 [0,0,1,0,0,0|2,0,1]=4 1603 B8R0.23 O=C(O)[C@H](Cl)CC(Cl)Cl Amb27831354 [0,0,1,0,0,0|3,0,0]=4 1604 B8R0.28 C=C(Br)CNC[C@@H](C)O Amb28285300 [0,0,1,0,0,0|2,0,0]=3 1605 B8R0.28 C=C(Br)CNC[C@H](C)O Amb27184417 [0,0,1,0,0,0|2,0,0]=3 1606 B8R0.28 C=C(C)CCCC(=O)O Amb2699907 [0,0,1,0,0,0|2,0,1]=4 1607 B8R0.28 C=C(C)CNCC(C)C Amb17308640 [0,0,1,0,0,0|3,0,0]=4 1608 B8R0.28 C=C(C)CNC[C@H](C)O Amb27852384 [0,0,1,0,0,0|2,0,0]=3 1609 B8R0.28 C=C(C)CSCC(=O)O Amb6280447 [0,0,1,0,0,0|2,0,1]=4 1610 B8R0.28 C=C(Cl)CNC[C@H](C)O Amb27642026 [0,0,1,0,0,0|2,0,0]=3 1611 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [0,0,1,0,0,0|1,0,2]=4 1612 B8R0.28 CC(=O)CCCC(C)C Amb33532191 [0,0,1,0,0,0|3,0,0]=4 1613 B8R0.28 CC(=O)CCCC(C)N Amb27483216 [0,0,1,0,0,0|3,0,0]=4 1614 B8R0.28 CC(=O)CNCC(C)C Amb25067661 [0,0,1,0,0,0|2,0,0]=3 1615 B8R0.28 CC(=O)CNCC(C)C Amb32663767 [0,0,1,0,0,0|2,0,0]=3 1616 B8R0.28 CC(=O)CNCC(C)O Amb24589662 [0,0,1,0,0,0|1,0,0]=2 1617 B8R0.28 CC(=O)CSCC(=O)O Amb26415891 [0,0,1,0,0,0|1,0,2]=4 1618 B8R0.28 CC(=O)CSCC(C)C Amb9269384 [0,0,1,0,0,0|3,0,0]=4 1619 B8R0.28 CC(=O)CSCC(C)F Amb28135753 [0,0,1,0,0,0|3,0,0]=4 1620 B8R0.28 CC(=O)CSCC(C)O Amb27215204 [0,0,1,0,0,0|2,0,0]=3 1621 B8R0.28 CC(=O)C\C=C\C(C)O Amb26528351 [0,0,1,0,0,0|2,0,1]=4 1622 B8R0.28 CC(=O)OCCC(C)O Amb26357497 [0,0,1,0,0,0|3,0,0]=4 1623 B8R0.28 CC(=O)OCC[C@H](C)O Amb28192682 [0,0,1,0,0,0|3,0,0]=4 1624 B8R0.28 CC(C)=NNCC(=O)O Amb27958222 [0,0,1,0,0,0|2,0,1]=4 1625 B8R0.28 CC(C)C#CCC(=O)O Amb26516061 [0,0,1,0,0,0|2,0,1]=4 1626 B8R0.28 CC(C)CC#CC(=O)O Amb28398479 [0,0,1,0,0,0|2,0,1]=4 1627 B8R0.28 CC(C)CCCC(=O)O Amb3941255 [0,0,1,0,0,0|2,0,0]=3 1628 B8R0.28 CC(C)CNCC(=O)O Amb19373106 [0,0,1,0,0,0|1,0,0]=2 1629 B8R0.28 CC(C)CNCC(=O)O Amb7766417 [0,0,1,0,0,0|1,0,0]=2 1630 B8R0.28 CC(C)CNCC(C)O Amb534459 [0,0,1,0,0,0|2,0,1]=4 1631 B8R0.28 CC(C)CNCC(N)=O Amb1118171 [0,0,1,0,0,0|2,0,0]=3 1632 B8R0.28 CC(C)CNCC(N)=O Amb6892556 [0,0,1,0,0,0|2,0,0]=3 1633 B8R0.28 CC(C)COCC(=O)O Amb2608476 [0,0,1,0,0,0|2,0,0]=3 1634 B8R0.28 CC(C)CSCC(=O)O Amb1134811 [0,0,1,0,0,0|2,0,0]=3 1635 B8R0.28 CC(C)C\C=C\C(=O)O Amb8392407 [0,0,1,0,0,0|2,0,1]=4 1636 B8R0.28 CC(C)NCCC(=O)O Amb1106349 [0,0,1,0,0,0|3,0,0]=4 1637 B8R0.28 CC(C)NCCC(=O)O Amb528114 [0,0,1,0,0,0|3,0,0]=4 1638 B8R0.28 CC(C)OCCC(=O)O Amb6260272 [0,0,1,0,0,0|3,0,0]=4 1639 B8R0.28 CC(C)SCCC(=O)O Amb6267279 [0,0,1,0,0,0|3,0,0]=4 1640 B8R0.28 CC(C)\C=C\CC(=O)O Amb17844074 [0,0,1,0,0,0|2,0,1]=4 1641 B8R0.28 CC(Cl)CCCC(=O)Cl Amb26491427 [0,0,1,0,0,0|3,0,0]=4 1642 B8R0.28 CC(Cl)CCCC(N)=O Amb27869185 [0,0,1,0,0,0|3,0,0]=4 1643 B8R0.28 CC(F)CCCC(=O)O Amb28144031 [0,0,1,0,0,0|2,0,0]=3 1644 B8R0.28 CC(N)CCCC(=O)O Amb22059416 [0,0,1,0,0,0|2,0,0]=3 1645 B8R0.28 CC(N)CCCC(=O)O Amb28934990 [0,0,1,0,0,0|2,0,0]=3 1646 B8R0.28 CC(N)CSCC(=O)O Amb27221487 [0,0,1,0,0,0|2,0,0]=3 1647 B8R0.28 CC(N)C\C=C\C(=O)O Amb27863954 [0,0,1,0,0,0|2,0,1]=4 1648 B8R0.28 CC(O)CCCB(O)O Amb24389636 [0,0,1,0,0,0|2,0,1]=4 1649 B8R0.28 CC(O)CCCC(=O)O Amb2371277 [0,0,1,0,0,0|1,0,0]=2 1650 B8R0.28 CC(O)CCCC(=O)[O-] Amb17615415 [0,0,1,0,0,0|1,0,1]=3 1651 B8R0.28 CC(O)CCCC(N)=S Amb27265713 [0,0,1,0,0,0|2,1,0]=4 1652 B8R0.28 CC(O)CNCC(=O)O Amb9359979 [0,0,1,0,0,0|0,0,0]=1 1653 B8R0.28 CC(O)CNCC(=O)[O-] Amb35789181 [0,0,1,0,0,0|0,0,1]=2 1654 B8R0.28 CC(O)CNCC(C)O Amb4036799 [0,0,1,0,0,0|1,0,1]=3 1655 B8R0.28 CC(O)CNCC(F)F Amb27963419 [0,0,1,0,0,0|2,0,1]=4 1656 B8R0.28 CC(O)CNC[C@H](C)O Amb27236687 [0,0,1,0,0,0|1,0,1]=3 1657 B8R0.28 CC(O)COCC(=O)O Amb27968624 [0,0,1,0,0,0|1,0,0]=2 1658 B8R0.28 CC(O)COCC(C)O Amb8516611 [0,0,1,0,0,0|2,0,1]=4 1659 B8R0.28 CC(O)COCC(N)=O Amb27216633 [0,0,1,0,0,0|2,0,0]=3 1660 B8R0.28 CC(O)COC[C@H](C)O Amb27470308 [0,0,1,0,0,0|2,0,1]=4 1661 B8R0.28 CC(O)CSCC(=O)O Amb19005278 [0,0,1,0,0,0|1,0,0]=2 1662 B8R0.28 CN(C)CCCC(=O)O Amb2716225 [0,0,1,0,0,0|3,0,0]=4 1663 B8R0.28 CN(C)CCCC(=O)O Amb9176338 [0,0,1,0,0,0|3,0,0]=4 1664 B8R0.28 C[C@@H](O)CCC[C@@H](C)O Amb4166306 [0,0,1,0,0,0|2,0,1]=4 1665 B8R0.28 C[C@H](N)C\C=C\C(=O)O Amb27784845 [0,0,1,0,0,0|2,0,1]=4 1666 B8R0.28 C[C@H](N)\C=C\CC(=O)O Amb28044026 [0,0,1,0,0,0|2,0,1]=4 1667 B8R0.28 C[C@H](O)CNCC(F)F Amb27448423 [0,0,1,0,0,0|2,0,1]=4 1668 B8R0.28 C[C@H](O)CNCC(N)=O Amb27879357 [0,0,1,0,0,0|1,0,0]=2 1669 B8R0.28 C[C@H](O)COC[C@H](C)O Amb27662102 [0,0,1,0,0,0|2,0,1]=4 1670 B8R0.28 C[C@H](O)CSC[C@H](C)O Amb27603289 [0,0,1,0,0,0|2,0,1]=4 1671 B8R0.28 C[C@H](O)C\C=C\C(=O)O Amb27812394 [0,0,1,0,0,0|1,0,1]=3 1672 B8R0.28 C[NH+](C)CCCC(=O)O Amb9786711 [0,0,1,0,0,0|3,0,0]=4 1673 B8R0.28 O=C(O)CCCC(=O)O Amb4037276 [0,0,1,0,0,0|2,0,1]=4 1674 B8R0.28 O=C(O)CCCC(F)F Amb24117996 [0,0,1,0,0,0|3,0,0]=4 1675 B8R0.28 O=C(O)CNCC(=O)O Amb3940364 [0,0,1,0,0,0|1,0,1]=3 1676 B8R0.28 O=C(O)COCC(=O)O Amb4433967 [0,0,1,0,0,0|2,0,1]=4 1677 B8R0.28 O=C(O)COCC(F)F Amb27218102 [0,0,1,0,0,0|3,0,0]=4 1678 B8R0.28 O=C(O)CSCC(=O)O Amb6608738 [0,0,1,0,0,0|2,0,1]=4 1679 B8R0.28 O=C(O)CSCC(F)F Amb18791606 [0,0,1,0,0,0|3,0,0]=4 1680 B10R2.14 OC1CNC(C2CC2)C1 Amb25887204 [0,0,0,1,0,0|2,0,1]=4 1681 B10R2.14 OC1CNC(C2CC2)C1 Amb30585173 [0,0,0,1,0,0|2,0,1]=4 1682 B10R2.14 O[C@H]1CN[C@@H](C2CC2)C1 Amb32679315 [0,0,0,1,0,0|2,0,1]=4 1683 B10R2.14 O[C@H]1CN[C@@H](C2CC2)C1 Amb32679316 [0,0,0,1,0,0|2,0,1]=4 1684 B10R2.30 CC1=C[C@@H]2[C@@H](O)CC[C@H]12 Amb27483143 [0,0,0,1,0,0|3,0,0]=4 1685 B10R2.30 CC1=C[C@H]2[C@@H]1CC[C@H]2O Amb27631874 [0,0,0,1,0,0|3,0,0]=4 1686 B10R2.30 CC1COC2C(=O)CC12 Amb28202166 [0,0,0,1,0,0|3,0,0]=4 1687 B10R2.60 CC1=CC2CC1CC2O Amb27972412 [0,0,0,1,0,0|3,0,0]=4 1688 B10R2.60 CC1CC2CC1CC2=O Amb25130308 [0,0,0,1,0,0|3,0,0]=4 1689 B10R2.60 C[C@H]1C[C@H]2C[C@@H]1CC2=O Amb28324379 [0,0,0,1,0,0|3,0,0]=4 1690 B10R2.60 C[C@H]1C[C@H]2C[C@H]1CC2=O Amb28351611 [0,0,0,1,0,0|3,0,0]=4 1691 B10R2.60 O=C1CC2CC1CC2F Amb33482930 [0,0,0,1,0,0|3,0,0]=4 1692 B10R2.60 O=C1C[C@@H]2C[C@H]1C[C@H]2F Amb33620853 [0,0,0,1,0,0|3,0,0]=4 1693 B10R2.60 O=C1C[C@H]2C[C@@H]1C[C@H]2O Amb28057451 [0,0,0,1,0,0|2,0,0]=3 1694 B10R2.60 O=C1C[C@H]2O[C@@H]1C[C@H]2Br Amb28051850 [0,0,0,1,0,0|3,0,0]=4 1695 B10R2.60 O=C1C[C@H]2O[C@@H]1C[C@H]2Cl Amb27433960 [0,0,0,1,0,0|3,0,0]=4 1696 B10R2.60 O=C1N[C@@H]2C[C@H]1C[C@H]2F Amb27473299 [0,0,0,1,0,0|3,0,0]=4 1697 B10R2.60 O=C1N[C@H]2C[C@@H]1C[C@@H]2F Amb27202854 [0,0,0,1,0,0|3,0,0]=4 1698 B10R2.60 OC1CC2CC1CC2O Amb28279986 [0,0,0,1,0,0|2,0,1]=4 1699 B10R2.60 OC1CC2OC1C=C2Cl Amb27829911 [0,0,0,1,0,0|3,0,0]=4 1700 B10R2.60 O[C@@H]1C[C@@H]2C[C@H]1C[C@H]2O Amb28131657 [0,0,0,1,0,0|2,0,1]=4 1701 B10R2.60 O[C@@H]1C[C@H]2O[C@@H]1C=C2Br Amb27431340 [0,0,0,1,0,0|3,0,0]=4 1702 B10R2.60 O[C@@H]1C[C@H]2O[C@@H]1C=C2Cl Amb28455052 [0,0,0,1,0,0|3,0,0]=4 1703 B10R2.60 O[C@H]1C[C@@H]2C[C@H]1C[C@@H]2O Amb27779775 [0,0,0,1,0,0|2,0,1]=4 1704 B10R2.60 O[C@H]1C[C@H]2C[C@@H]1C[C@@H]2O Amb27470397 [0,0,0,1,0,0|2,0,1]=4 1705 B10R2.60 O[C@H]1C[C@H]2O[C@@H]1C=C2Cl Amb27420512 [0,0,0,1,0,0|3,0,0]=4 1706 B10R2.64 O=C1CC2CC(O)CC12 Amb28065465 [0,0,0,1,0,0|2,0,0]=3 1707 B10R2.64 O=C1C[C@@H]2C(=O)O[C@@H]2C1 Amb26034562 [0,0,0,1,0,0|1,0,2]=4 1708 B10R2.64 O=C1C[C@@H]2OC(=O)[C@@H]2C1 Amb27793026 [0,0,0,1,0,0|1,0,2]=4 1709 B10R2.64 O=C1O[C@@H]2C[C@H](O)C[C@H]12 Amb27199685 [0,0,0,1,0,0|1,0,0]=2 1710 B10R2.64 O[C@H]1C[C@H]2C[C@@H](O)C[C@@H]12 Amb27852469 [0,0,0,1,0,0|2,0,1]=4 1711 B10R2.115 CC12CO[C@@H](C1)C(=O)C2 Amb28253827 [0,0,0,1,0,0|3,0,0]=4 1712 B10R2.115 C[C@]12CCC(C1)C(=O)C2 Amb27226762 [0,0,0,1,0,0|3,0,0]=4 1713 B10R2.115 O=C1CC2(Cl)CCC1C2 Amb27838804 [0,0,0,1,0,0|3,0,0]=4 1714 B10R2.178 O=C1C=CC2CCC1C2 Amb22356392 [0,0,0,1,0,0|3,0,0]=4 1715 B10R2.178 O=C1C=C[C@H]2CC[C@H]1C2 Amb28131965 [0,0,0,1,0,0|3,0,0]=4 1716 B10R2.178 O=C1CCC2CCC1C2 Amb2778685 [0,0,0,1,0,0|3,0,0]=4 1717 B10R2.178 O=C1CCC2CNC1C2 Amb27838542 [0,0,0,1,0,0|2,0,0]=3 1718 B10R2.178 O=C1CC[C@H]2CC[C@@H]1C2 Amb25989988 [0,0,0,1,0,0|3,0,0]=4 1719 B10R2.178 O=C1NCC2CCC1C2 Amb26863795 [0,0,0,1,0,0|3,0,0]=4 1720 B10R2.178 O=C1NC[C@@H]2CC[C@H]1C2 Amb27961033 [0,0,0,1,0,0|3,0,0]=4 1721 B10R2.178 O=C1NC[C@@H]2CNC1C2 Amb32412011 [0,0,0,1,0,0|2,0,0]=3 1722 B10R2.308 C[C@@H]1C[C@@]2(C(=O)O)C[C@@H]12 Amb33802827 [0,0,0,1,0,0|2,0,0]=3 1723 B10R2.308 C[C@@H]1C[C@]2(C(=O)O)C[C@H]12 Amb33733821 [0,0,0,1,0,0|2,0,0]=3 1724 B10R2.308 N[C@@H]1C[C@@]2(C(=O)O)C[C@@H]12 Amb33620542 [0,0,0,1,0,0|2,0,0]=3 1725 B10R2.308 N[C@@H]1C[C@@]2(C(=O)O)C[C@@H]12 Amb33747107 [0,0,0,1,0,0|2,0,0]=3 1726 B10R2.308 N[C@@H]1C[C@]2(C(=O)O)C[C@H]12 Amb33743551 [0,0,0,1,0,0|2,0,0]=3 1727 B10R2.308 N[C@@H]1C[C@]2(C(=O)O)C[C@H]12 Amb33743606 [0,0,0,1,0,0|2,0,0]=3 1728 B10R2.308 O=C(O)[C@@]12C[C@@H](Br)[C@@H]1C2 Amb33802666 [0,0,0,1,0,0|2,0,0]=3 1729 B10R2.308 O=C(O)[C@@]12C[C@@H](O)[C@@H]1C2 Amb33620686 [0,0,0,1,0,0|1,0,0]=2 1730 B10R2.308 O=C(O)[C@]12C[C@H](F)[C@H]1C2 Amb33484082 [0,0,0,1,0,0|2,0,0]=3 1731 B10R2.346 O=C(O)C1NC2CC1C2 Amb25911733 [0,0,0,1,0,0|3,0,0]=4 1732 B10R2.346 O=C(O)[C@@H]1NC2CC1C2 Amb34141405 [0,0,0,1,0,0|3,0,0]=4 1733 B10R2.346 O=C(O)[C@H]1NC2CC1C2 Amb34141348 [0,0,0,1,0,0|3,0,0]=4 1734 B10R2.348 CC(=O)C12CC(CN1)C2 Amb35647788 [0,0,0,1,0,0|2,0,0]=3 1735 B10R2.348 CC(O)C12CC(CN1)C2 Amb35588542 [0,0,0,1,0,0|2,0,1]=4 1736 B10R2.348 NC(=O)C12CC(CN1)C2 Amb28051751 [0,0,0,1,0,0|2,0,0]=3 1737 B10R2.348 O=C(O)C12CC(CN1)C2 Amb2371884 [0,0,0,1,0,0|1,0,0]=2 1738 B10R2.348 O=C(O)C12CC(CN1)C2 Amb475056 [0,0,0,1,0,0|1,0,0]=2 1739 B10R2.348 O=C(O)C12CC(CO1)C2 Amb33482563 [0,0,0,1,0,0|2,0,0]=3 1740 B10R2.348 O=C(O)C12CCC(C1)C2 Amb17593309 [0,0,0,1,0,0|2,0,0]=3 1741 B10R2.348 O=C(O)C12CNC(C1)C2 Amb26446058 [0,0,0,1,0,0|3,0,0]=4 1742 B10R2.348 O=C(O)C12CNC(C1)C2 Amb35789732 [0,0,0,1,0,0|3,0,0]=4 1743 B10R2.348 O=C(O)C12COC(C1)C2 Amb25963787 [0,0,0,1,0,0|3,0,0]=4 1744 B10R2.355 CC(=O)C1CCC2CC21 Amb25312943 [0,0,0,1,0,0|3,0,0]=4 1745 B10R2.355 O=C(O)C1CCC2CC21 Amb27756554 [0,0,0,1,0,0|2,0,0]=3 1746 B10R2.355 O=C(O)C1CNC2CC21 Amb35789670 [0,0,0,1,0,0|3,0,0]=4 1747 B10R2.355 O=C(O)C1NCC2CC21 Amb2444163 [0,0,0,1,0,0|1,0,0]=2 1748 B10R2.355 O=C(O)C1NCC2CC21 Amb30869339 [0,0,0,1,0,0|1,0,0]=2 1749 B10R2.355 O=C(O)C1NC[C@@H]2C[C@H]12 Amb27474270 [0,0,0,1,0,0|1,0,0]=2 1750 B10R2.355 O=C(O)C1SCC2CC21 Amb18202403 [0,0,0,1,0,0|2,0,0]=3 1751 B10R2.355 O=C(O)[C@@H]1CC[C@@H]2C[C@@H]21 Amb33734642 [0,0,0,1,0,0|2,0,0]=3 1752 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2C[C@@H]21 Amb22737256 [0,0,0,1,0,0|1,0,0]=2 1753 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2C[C@@H]21 Amb30869362 [0,0,0,1,0,0|1,0,0]=2 1754 B10R2.355 O=C(O)[C@@H]1NC[C@H]2C[C@H]21 Amb18792526 [0,0,0,1,0,0|1,0,0]=2 1755 B10R2.355 O=C(O)[C@@H]1NC[C@H]2C[C@H]21 Amb23440593 [0,0,0,1,0,0|1,0,0]=2 1756 B10R2.355 O=C(O)[C@H]1NC[C@@H]2CC12 Amb25924032 [0,0,0,1,0,0|1,0,0]=2 1757 B10R2.355 O=C(O)[C@H]1NC[C@@H]2C[C@@H]12 Amb27655855 [0,0,0,1,0,0|1,0,0]=2 1758 B10R2.355 O=C(O)[C@H]1NC[C@@H]2C[C@H]12 Amb17913042 [0,0,0,1,0,0|1,0,0]=2 1759 B10R2.355 O=C(O)[C@H]1NC[C@@H]2C[C@H]12 Amb2372045 [0,0,0,1,0,0|1,0,0]=2 1760 B10R2.355 O=C(O)[C@H]1NC[C@H]2C[C@H]21 Amb2372044 [0,0,0,1,0,0|1,0,0]=2 1761 B10R2.355 O=C(O)[C@H]1NC[C@H]2C[C@H]21 Amb33801121 [0,0,0,1,0,0|1,0,0]=2 1762 B10R2.357 CC(=O)C1CC2CC2C1 Amb27469544 [0,0,0,1,0,0|3,0,0]=4 1763 B10R2.357 CC(=O)N1CC2OC2C1 Amb25921163 [0,0,0,1,0,0|3,0,0]=4 1764 B10R2.357 CC(=O)[C@@H]1C[C@@H]2C[C@@H]2C1 Amb35742013 [0,0,0,1,0,0|3,0,0]=4 1765 B10R2.357 NC(=O)C1CC2CC2C1 Amb27462767 [0,0,0,1,0,0|3,0,0]=4 1766 B10R2.357 NC(=O)C1CC2CC2N1 Amb25066699 [0,0,0,1,0,0|2,0,0]=3 1767 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2C1 Amb35624970 [0,0,0,1,0,0|3,0,0]=4 1768 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb22504301 [0,0,0,1,0,0|2,0,0]=3 1769 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb22746576 [0,0,0,1,0,0|2,0,0]=3 1770 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb22746662 [0,0,0,1,0,0|2,0,0]=3 1771 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb22746663 [0,0,0,1,0,0|2,0,0]=3 1772 B10R2.357 NC(=O)[C@@H]1C[C@H]2C[C@H]2N1 Amb22745970 [0,0,0,1,0,0|2,0,0]=3 1773 B10R2.357 NC(=O)[C@@H]1C[C@H]2C[C@H]2N1 Amb22755779 [0,0,0,1,0,0|2,0,0]=3 1774 B10R2.357 NC(=O)[C@@H]1C[C@H]2C[C@H]2N1 Amb26843644 [0,0,0,1,0,0|2,0,0]=3 1775 B10R2.357 O=C(Cl)[C@@H]1C[C@@H]2C[C@@H]2C1 Amb35741997 [0,0,0,1,0,0|3,0,0]=4 1776 B10R2.357 O=C(O)C1CC2CC2C1 Amb23439567 [0,0,0,1,0,0|2,0,0]=3 1777 B10R2.357 O=C(O)C1CC2CC2N1 Amb18203281 [0,0,0,1,0,0|1,0,0]=2 1778 B10R2.357 O=C(O)C1CC2CC2N1 Amb505664 [0,0,0,1,0,0|1,0,0]=2 1779 B10R2.357 O=C(O)C1CC2CC2S1 Amb18202402 [0,0,0,1,0,0|2,0,0]=3 1780 B10R2.357 O=C(O)C1C[C@@H]2C[C@@H]2C1 Amb26370565 [0,0,0,1,0,0|2,0,0]=3 1781 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2C1 Amb25887429 [0,0,0,1,0,0|2,0,0]=3 1782 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb18792527 [0,0,0,1,0,0|1,0,0]=2 1783 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb23439721 [0,0,0,1,0,0|1,0,0]=2 1784 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb2372541 [0,0,0,1,0,0|1,0,0]=2 1785 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 Amb17719277 [0,0,0,1,0,0|1,0,0]=2 1786 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 Amb2372046 [0,0,0,1,0,0|1,0,0]=2 1787 B10R2.357 O=C(O)[C@H]1C[C@@H]2O[C@@H]2C1 Amb28423513 [0,0,0,1,0,0|1,0,0]=2 1788 B10R2.357 O=C(O)[C@H]1C[C@H]2C[C@H]2N1 Amb33801107 [0,0,0,1,0,0|1,0,0]=2 1789 B8R1.23 C=C1CC(C(=O)Cl)C1 Amb10071441 [0,0,0,0,1,0|2,0,1]=4 1790 B8R1.23 C=C1CC(C(=O)O)C1 Amb613197 [0,0,0,0,1,0|1,0,1]=3 1791 B8R1.23 C=C1CC(C(C)=O)C1 Amb26547728 [0,0,0,0,1,0|2,0,1]=4 1792 B8R1.23 C=C1CC(C(N)=O)C1 Amb22896664 [0,0,0,0,1,0|2,0,1]=4 1793 B8R1.23 CC(=O)C1CC(=N)C1 Amb27636166 [0,0,0,0,1,0|2,0,1]=4 1794 B8R1.23 CC(=O)C1CC(C)C1 Amb23590280 [0,0,0,0,1,0|2,0,0]=3 1795 B8R1.23 CC(=O)C1CC(N)C1 Amb29880102 [0,0,0,0,1,0|2,0,0]=3 1796 B8R1.23 CC(=O)C1CC(O)C1 Amb25718423 [0,0,0,0,1,0|1,0,0]=2 1797 B8R1.23 CC(=O)N1CC(N)C1 Amb19329932 [0,0,0,0,1,0|3,0,0]=4 1798 B8R1.23 CC(=O)N1CC(N)C1 Amb22406088 [0,0,0,0,1,0|3,0,0]=4 1799 B8R1.23 CC(=O)N1CC(N)C1 Amb33339040 [0,0,0,0,1,0|3,0,0]=4 1800 B8R1.23 CC(=O)N1CC(O)C1 Amb17935746 [0,0,0,0,1,0|2,0,0]=3 1801 B8R1.23 CC(=O)N1CC(S)C1 Amb27433776 [0,0,0,0,1,0|2,1,0]=4 1802 B8R1.23 CC(=O)[C@H]1C[C@@H](C)C1 Amb28253646 [0,0,0,0,1,0|2,0,0]=3 1803 B8R1.23 CC(C)[C@H]1C[C@@H](O)C1 Amb27946929 [0,0,0,0,1,0|2,0,1]=4 1804 B8R1.23 CC(N)C1CC(O)C1 Amb34164942 [0,0,0,0,1,0|2,0,1]=4 1805 B8R1.23 CC(O)C1CC(N)C1 Amb35625271 [0,0,0,0,1,0|2,0,1]=4 1806 B8R1.23 CC1CC(C(=O)O)C1 Amb19515989 [0,0,0,0,1,0|1,0,0]=2 1807 B8R1.23 CC1CC(C(=O)O)N1 Amb27816510 [0,0,0,0,1,0|1,0,0]=2 1808 B8R1.23 CC1CC(C(=O)O)N1 Amb33482923 [0,0,0,0,1,0|1,0,0]=2 1809 B8R1.23 CC1CC(C(C)O)C1 Amb23590278 [0,0,0,0,1,0|2,0,1]=4 1810 B8R1.23 CC1CC(C(N)=O)C1 Amb27954948 [0,0,0,0,1,0|2,0,0]=3 1811 B8R1.23 CC1CN(C(=O)Cl)C1 Amb35667757 [0,0,0,0,1,0|3,0,0]=4 1812 B8R1.23 CC1CN(C(N)=O)C1 Amb30039472 [0,0,0,0,1,0|3,0,0]=4 1813 B8R1.23 CN(C)C1CC(O)C1 Amb26612733 [0,0,0,0,1,0|3,0,0]=4 1814 B8R1.23 CN(C)C1CC(O)C1 Amb32410247 [0,0,0,0,1,0|3,0,0]=4 1815 B8R1.23 CN(C)[C@H]1C[C@@H](O)C1 Amb26069569 [0,0,0,0,1,0|3,0,0]=4 1816 B8R1.23 CN(C)[C@H]1C[C@@H](O)C1 Amb32653404 [0,0,0,0,1,0|3,0,0]=4 1817 B8R1.23 CN(C)[C@H]1C[C@H](O)C1 Amb27950158 [0,0,0,0,1,0|3,0,0]=4 1818 B8R1.23 CN(C)[C@H]1C[C@H](O)C1 Amb33204495 [0,0,0,0,1,0|3,0,0]=4 1819 B8R1.23 CN1CC(C(=O)Cl)C1 Amb35781982 [0,0,0,0,1,0|3,0,0]=4 1820 B8R1.23 CN1CC(C(=O)O)C1 Amb19958116 [0,0,0,0,1,0|2,0,0]=3 1821 B8R1.23 C[C@@H](N)C1CC(O)C1 Amb34912829 [0,0,0,0,1,0|2,0,1]=4 1822 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483898 [0,0,0,0,1,0|1,0,0]=2 1823 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483920 [0,0,0,0,1,0|1,0,0]=2 1824 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483819 [0,0,0,0,1,0|1,0,0]=2 1825 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483820 [0,0,0,0,1,0|1,0,0]=2 1826 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 Amb22746374 [0,0,0,0,1,0|1,0,0]=2 1827 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 Amb22746375 [0,0,0,0,1,0|1,0,0]=2 1828 B8R1.23 N=C(N)C1CC(F)C1 Amb26358514 [0,0,0,0,1,0|3,0,0]=4 1829 B8R1.23 NC(=O)C1CC(=O)N1 Amb27214249 [0,0,0,0,1,0|1,0,2]=4 1830 B8R1.23 NC(=O)C1CC(Cl)C1 Amb27424316 [0,0,0,0,1,0|2,0,0]=3 1831 B8R1.23 NC(=O)C1CC(F)C1 Amb27946575 [0,0,0,0,1,0|2,0,0]=3 1832 B8R1.23 NC(=O)C1CC(N)C1 Amb20622654 [0,0,0,0,1,0|2,0,0]=3 1833 B8R1.23 NC(=O)C1CC(N)C1 Amb32664988 [0,0,0,0,1,0|2,0,0]=3 1834 B8R1.23 NC(=O)N1CC(N)C1 Amb27632971 [0,0,0,0,1,0|3,0,0]=4 1835 B8R1.23 NC(=O)N1CC(N)C1 Amb33483188 [0,0,0,0,1,0|3,0,0]=4 1836 B8R1.23 NC(=O)N1CC(O)C1 Amb28068660 [0,0,0,0,1,0|2,0,0]=3 1837 B8R1.23 NC(=O)[C@H]1C[C@@H](Cl)C1 Amb27882303 [0,0,0,0,1,0|2,0,0]=3 1838 B8R1.23 NC(=O)[C@H]1C[C@@H](N)C1 Amb22896793 [0,0,0,0,1,0|2,0,0]=3 1839 B8R1.23 NC(=O)[C@H]1C[C@@H](N)C1 Amb32664685 [0,0,0,0,1,0|2,0,0]=3 1840 B8R1.23 NC(=O)[C@H]1C[C@H](Cl)C1 Amb27882281 [0,0,0,0,1,0|2,0,0]=3 1841 B8R1.23 NC(=O)[C@H]1C[C@H](N)C1 Amb22896794 [0,0,0,0,1,0|2,0,0]=3 1842 B8R1.23 NC(=O)[C@H]1C[C@H](N)C1 Amb32668185 [0,0,0,0,1,0|2,0,0]=3 1843 B8R1.23 NC(=S)[C@H]1C[C@H](Cl)C1 Amb35789073 [0,0,0,0,1,0|2,1,0]=4 1844 B8R1.23 NC1CC(C(=O)O)C1 Amb10610660 [0,0,0,0,1,0|1,0,0]=2 1845 B8R1.23 NC1CC(C(=O)O)C1 Amb33533143 [0,0,0,0,1,0|1,0,0]=2 1846 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb10604131 [0,0,0,0,1,0|1,0,0]=2 1847 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb6893769 [0,0,0,0,1,0|1,0,0]=2 1848 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb19514893 [0,0,0,0,1,0|1,0,0]=2 1849 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb33524058 [0,0,0,0,1,0|1,0,0]=2 1850 B8R1.23 O=C(Cl)C1CC(Cl)C1 Amb24739809 [0,0,0,0,1,0|2,0,0]=3 1851 B8R1.23 O=C(Cl)C1CC(F)C1 Amb28049013 [0,0,0,0,1,0|2,0,0]=3 1852 B8R1.23 O=C(Cl)N1CC(F)C1 Amb33803382 [0,0,0,0,1,0|3,0,0]=4 1853 B8R1.23 O=C(O)C1CC(Br)C1 Amb25889305 [0,0,0,0,1,0|1,0,0]=2 1854 B8R1.23 O=C(O)C1CC(Cl)C1 Amb16233600 [0,0,0,0,1,0|1,0,0]=2 1855 B8R1.23 O=C(O)C1CC(F)C1 Amb20621267 [0,0,0,0,1,0|1,0,0]=2 1856 B8R1.23 O=C(O)C1CC(O)C1 Amb8011535 [0,0,0,0,1,0|0,0,0]=1 1857 B8R1.23 O=C(O)C1CS(=O)C1 Amb26056015 [0,0,0,0,1,0|1,0,1]=3 1858 B8R1.23 O=C(O)[C@H]1C[C@@H](Br)C1 Amb35751665 [0,0,0,0,1,0|1,0,0]=2 1859 B8R1.23 O=C(O)[C@H]1C[C@@H](Cl)C1 Amb28119343 [0,0,0,0,1,0|1,0,0]=2 1860 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 Amb27974528 [0,0,0,0,1,0|1,0,0]=2 1861 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 Amb19516179 [0,0,0,0,1,0|0,0,0]=1 1862 B8R1.23 O=C(O)[C@H]1C[C@H](Br)C1 Amb24339433 [0,0,0,0,1,0|1,0,0]=2 1863 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 Amb25883786 [0,0,0,0,1,0|1,0,0]=2 1864 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 Amb27883529 [0,0,0,0,1,0|1,0,0]=2 1865 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 Amb19516178 [0,0,0,0,1,0|0,0,0]=1 1866 B8R1.23 O=C1CC(C(=O)Cl)C1 Amb16230813 [0,0,0,0,1,0|1,0,2]=4 1867 B8R1.23 O=C1CC(C(=O)O)C1 Amb33544325 [0,0,0,0,1,0|0,0,2]=3 1868 B8R1.23 O=C1CC(C(=O)O)N1 Amb16232079 [0,0,0,0,1,0|0,0,2]=3 1869 B8R1.23 O=C1CC(C(=O)O)O1 Amb26887454 [0,0,0,0,1,0|1,0,2]=4 1870 B8R1.23 O=C1CC(S(=O)O)N1 Amb27595618 [0,0,0,0,1,0|1,0,2]=4 1871 B8R1.23 O=C1C[C@@H](C(=O)O)N1 Amb22367070 [0,0,0,0,1,0|0,0,2]=3 1872 B8R1.23 O=C1C[C@H](C(=O)O)N1 Amb26975061 [0,0,0,0,1,0|0,0,2]=3 1873 B8R1.23 OC1CC(C(F)F)C1 Amb33330515 [0,0,0,0,1,0|2,0,1]=4 1874 B8R1.31 C=C(C)C1CCC1O Amb25993078 [0,0,0,0,1,0|3,0,0]=4 1875 B8R1.31 C=C1CCC1C(=O)O Amb28281144 [0,0,0,0,1,0|2,0,1]=4 1876 B8R1.31 CC(=O)C1CCC1O Amb33213172 [0,0,0,0,1,0|2,0,0]=3 1877 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C Amb26866992 [0,0,0,0,1,0|3,0,0]=4 1878 B8R1.31 CC(=O)[C@H]1CC[C@H]1C Amb26361346 [0,0,0,0,1,0|3,0,0]=4 1879 B8R1.31 CC1CCC1C(=O)O Amb21857447 [0,0,0,0,1,0|2,0,0]=3 1880 B8R1.31 CC1NCC1C(=O)O Amb26984410 [0,0,0,0,1,0|3,0,0]=4 1881 B8R1.31 CN1CCC1C(=O)O Amb22011586 [0,0,0,0,1,0|3,0,0]=4 1882 B8R1.31 CN1CC[C@@H]1C(=O)O Amb24183372 [0,0,0,0,1,0|3,0,0]=4 1883 B8R1.31 CN1CC[C@H]1C(=O)O Amb24699921 [0,0,0,0,1,0|3,0,0]=4 1884 B8R1.31 C[C@@H]1CC[C@@H]1C(=O)O Amb28203929 [0,0,0,0,1,0|2,0,0]=3 1885 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb24597629 [0,0,0,0,1,0|1,0,0]=2 1886 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb33620541 [0,0,0,0,1,0|1,0,0]=2 1887 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O Amb34913092 [0,0,0,0,1,0|3,0,0]=4 1888 B8R1.31 C[C@H]1CC[C@H]1C(N)=O Amb27237000 [0,0,0,0,1,0|3,0,0]=4 1889 B8R1.31 NC(=O)C1CCC1F Amb32943793 [0,0,0,0,1,0|3,0,0]=4 1890 B8R1.31 NC(=O)C1CCC1N Amb20248288 [0,0,0,0,1,0|3,0,0]=4 1891 B8R1.31 NC(=O)[C@@H]1CC[C@H]1N Amb27225132 [0,0,0,0,1,0|3,0,0]=4 1892 B8R1.31 NC1CCC1C(=O)O Amb26979562 [0,0,0,0,1,0|2,0,0]=3 1893 B8R1.31 NC1COC1C(=O)O Amb28428430 [0,0,0,0,1,0|2,0,0]=3 1894 B8R1.31 NN1CC[C@H]1C(=O)O Amb27261518 [0,0,0,0,1,0|3,0,0]=4 1895 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24117048 [0,0,0,0,1,0|2,0,0]=3 1896 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24183584 [0,0,0,0,1,0|2,0,0]=3 1897 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb25976891 [0,0,0,0,1,0|2,0,0]=3 1898 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb31291972 [0,0,0,0,1,0|2,0,0]=3 1899 B8R1.31 N[C@@H]1CO[C@H]1C(=O)O Amb24681491 [0,0,0,0,1,0|2,0,0]=3 1900 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb27187220 [0,0,0,0,1,0|2,0,0]=3 1901 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb33805288 [0,0,0,0,1,0|2,0,0]=3 1902 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb25911896 [0,0,0,0,1,0|2,0,0]=3 1903 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb33801366 [0,0,0,0,1,0|2,0,0]=3 1904 B8R1.31 N[C@H]1CO[C@@H]1C(=O)O Amb25324265 [0,0,0,0,1,0|2,0,0]=3 1905 B8R1.31 N[C@H]1CO[C@H]1C(=O)O Amb25929776 [0,0,0,0,1,0|2,0,0]=3 1906 B8R1.31 O=C(O)C1C=CC1Br Amb27220099 [0,0,0,0,1,0|2,0,1]=4 1907 B8R1.31 O=C(O)C1C=CC1O Amb27475863 [0,0,0,0,1,0|1,0,1]=3 1908 B8R1.31 O=C(O)C1CCC1Cl Amb27490061 [0,0,0,0,1,0|2,0,0]=3 1909 B8R1.31 O=C(O)C1CCC1F Amb27835547 [0,0,0,0,1,0|2,0,0]=3 1910 B8R1.31 O=C(O)C1CCC1O Amb24481384 [0,0,0,0,1,0|1,0,0]=2 1911 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O Amb27619188 [0,0,0,0,1,0|1,0,0]=2 1912 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O Amb34913090 [0,0,0,0,1,0|1,0,0]=2 1913 B10R1.13 C=C(C)C1CCC(O)CC1 Amb27219025 [0,0,0,0,0,1|3,0,0]=4 1914 B10R1.13 C=C1CCC(C(=O)O)CC1 Amb15695314 [0,0,0,0,0,1|2,0,1]=4 1915 B10R1.13 CC(=O)C1=CCC(O)CC1 Amb17593547 [0,0,0,0,0,1|2,0,1]=4 1916 B10R1.13 CC(=O)C1CCC(C)CC1 Amb24518062 [0,0,0,0,0,1|3,0,0]=4 1917 B10R1.13 CC(=O)C1CCC(C)NC1 Amb28067890 [0,0,0,0,0,1|3,0,0]=4 1918 B10R1.13 CC(=O)C1CCC(C)OC1 Amb35732771 [0,0,0,0,0,1|3,0,0]=4 1919 B10R1.13 CC(=O)C1CCC(Cl)CC1 Amb24433457 [0,0,0,0,0,1|3,0,0]=4 1920 B10R1.13 CC(=O)C1CCC(F)CC1 Amb25127678 [0,0,0,0,0,1|3,0,0]=4 1921 B10R1.13 CC(=O)C1CCC(N)CC1 Amb27404739 [0,0,0,0,0,1|3,0,0]=4 1922 B10R1.13 CC(=O)C1CCC(O)CC1 Amb26910730 [0,0,0,0,0,1|2,0,0]=3 1923 B10R1.13 CC(=O)N1CCC(O)CC1 Amb9245319 [0,0,0,0,0,1|3,0,0]=4 1924 B10R1.13 CC(=O)[C@H]1CC[C@@H](N)CC1 Amb33132950 [0,0,0,0,0,1|3,0,0]=4 1925 B10R1.13 CC(=O)[C@H]1CC[C@H](N)CC1 Amb28055932 [0,0,0,0,0,1|3,0,0]=4 1926 B10R1.13 CC(=O)[C@H]1CC[C@H](N)CC1 Amb30584740 [0,0,0,0,0,1|3,0,0]=4 1927 B10R1.13 CC(O)[C@H]1CC[C@H](O)CC1 Amb27835907 [0,0,0,0,0,1|2,0,1]=4 1928 B10R1.13 CC1=CCC(C(=O)O)CC1 Amb18124574 [0,0,0,0,0,1|2,0,1]=4 1929 B10R1.13 CC1CC=C(C(=O)O)CC1 Amb18124589 [0,0,0,0,0,1|2,0,1]=4 1930 B10R1.13 CC1CC=C(C(=O)O)CN1 Amb18831771 [0,0,0,0,0,1|2,0,1]=4 1931 B10R1.13 CC1CC=C(C(=O)O)OC1 Amb28050118 [0,0,0,0,0,1|2,0,1]=4 1932 B10R1.13 CC1CCC(C(=O)Cl)CC1 Amb28342369 [0,0,0,0,0,1|3,0,0]=4 1933 B10R1.13 CC1CCC(C(=O)O)CC1 Amb6456606 [0,0,0,0,0,1|2,0,0]=3 1934 B10R1.13 CC1CCC(C(=O)O)CN1 Amb18643999 [0,0,0,0,0,1|2,0,0]=3 1935 B10R1.13 CC1CCC(C(=O)O)CN1 Amb33329255 [0,0,0,0,0,1|2,0,0]=3 1936 B10R1.13 CC1CCC(C(=O)O)CO1 Amb29860383 [0,0,0,0,0,1|2,0,0]=3 1937 B10R1.13 CC1CCC(C(=O)O)NC1 Amb25324436 [0,0,0,0,0,1|1,0,0]=2 1938 B10R1.13 CC1CCC(C(=O)O)NC1 Amb33482831 [0,0,0,0,0,1|1,0,0]=2 1939 B10R1.13 CC1CCC(C(=O)O)OC1 Amb27832232 [0,0,0,0,0,1|2,0,0]=3 1940 B10R1.13 CC1CCC(C(C)O)NC1 Amb27435600 [0,0,0,0,0,1|2,0,1]=4 1941 B10R1.13 CC1CCC(C(N)=O)CC1 Amb27154534 [0,0,0,0,0,1|3,0,0]=4 1942 B10R1.13 CC1CCC(C(N)=O)CN1 Amb6256393 [0,0,0,0,0,1|3,0,0]=4 1943 B10R1.13 CC1CCC(C(N)=O)NC1 Amb33495759 [0,0,0,0,0,1|2,0,0]=3 1944 B10R1.13 CC1CCC(S(=O)O)CC1 Amb35683277 [0,0,0,0,0,1|3,0,0]=4 1945 B10R1.13 CC1CNC(C(=O)O)CN1 Amb28049378 [0,0,0,0,0,1|1,0,0]=2 1946 B10R1.13 CC1CNC(C(=O)O)CO1 Amb26356239 [0,0,0,0,0,1|1,0,0]=2 1947 B10R1.13 CC1CNC(C(=O)O)CO1 Amb32653486 [0,0,0,0,0,1|1,0,0]=2 1948 B10R1.13 CC1CNC(C(N)=O)CO1 Amb27266230 [0,0,0,0,0,1|2,0,0]=3 1949 B10R1.13 CC1COC(C(=O)O)OC1 Amb28067611 [0,0,0,0,0,1|2,0,0]=3 1950 B10R1.13 CC1COC(C(N)=O)CN1 Amb27475745 [0,0,0,0,0,1|3,0,0]=4 1951 B10R1.13 CC1OCC(C(=O)O)CO1 Amb25723862 [0,0,0,0,0,1|3,0,0]=4 1952 B10R1.13 CN1CCC(C(=O)O)CC1 Amb2236137 [0,0,0,0,0,1|3,0,0]=4 1953 B10R1.13 CN1CCC(C(=O)O)CC1 Amb2237314 [0,0,0,0,0,1|3,0,0]=4 1954 B10R1.13 C[C@@H]1CC[C@@H](C(=O)O)CN1 Amb26919968 [0,0,0,0,0,1|2,0,0]=3 1955 B10R1.13 C[C@@H]1CC[C@@H](C(=O)O)NC1 Amb33017682 [0,0,0,0,0,1|1,0,0]=2 1956 B10R1.13 C[C@@H]1CC[C@@H](C(=O)O)NC1 Amb33299403 [0,0,0,0,0,1|1,0,0]=2 1957 B10R1.13 C[C@@H]1CC[C@H](C(=O)O)CN1 Amb24620510 [0,0,0,0,0,1|2,0,0]=3 1958 B10R1.13 C[C@@H]1CC[C@H](C(=O)O)CN1 Amb35788844 [0,0,0,0,0,1|2,0,0]=3 1959 B10R1.13 C[C@@H]1CC[C@H](C(=O)O)NC1 Amb33804580 [0,0,0,0,0,1|1,0,0]=2 1960 B10R1.13 C[C@@H]1CC[C@H](C(N)=O)CN1 Amb33290243 [0,0,0,0,0,1|3,0,0]=4 1961 B10R1.13 C[C@@H]1CC[C@H](C(N)=O)CN1 Amb33483115 [0,0,0,0,0,1|3,0,0]=4 1962 B10R1.13 C[C@@H]1CN[C@@H](C(=O)O)CO1 Amb25949341 [0,0,0,0,0,1|1,0,0]=2 1963 B10R1.13 C[C@@H]1CN[C@@H](C(=O)O)CO1 Amb31156297 [0,0,0,0,0,1|1,0,0]=2 1964 B10R1.13 C[C@@H]1CN[C@H](C(=O)O)CO1 Amb24694579 [0,0,0,0,0,1|1,0,0]=2 1965 B10R1.13 C[C@@H]1CN[C@H](C(=O)O)CO1 Amb32661059 [0,0,0,0,0,1|1,0,0]=2 1966 B10R1.13 C[C@H]1CC[C@@H](C(=O)O)CC1 Amb10843977 [0,0,0,0,0,1|2,0,0]=3 1967 B10R1.13 C[C@H]1CC[C@@H](C(=O)O)CN1 Amb24580654 [0,0,0,0,0,1|2,0,0]=3 1968 B10R1.13 C[C@H]1CC[C@@H](C(=O)O)ON1 Amb27881757 [0,0,0,0,0,1|3,0,0]=4 1969 B10R1.13 C[C@H]1CC[C@@H](C(N)=O)CN1 Amb28429822 [0,0,0,0,0,1|3,0,0]=4 1970 B10R1.13 C[C@H]1CC[C@H](C(=O)Cl)CC1 Amb24052918 [0,0,0,0,0,1|3,0,0]=4 1971 B10R1.13 C[C@H]1CC[C@H](C(=O)O)CC1 Amb3939943 [0,0,0,0,0,1|2,0,0]=3 1972 B10R1.13 C[C@H]1CC[C@H](C(N)=O)CC1 Amb27874416 [0,0,0,0,0,1|3,0,0]=4 1973 B10R1.13 C[C@H]1CC[C@H](C(N)=O)CN1 Amb27214664 [0,0,0,0,0,1|3,0,0]=4 1974 B10R1.13 C[C@H]1CN[C@@H](C(=O)O)CO1 Amb28367492 [0,0,0,0,0,1|1,0,0]=2 1975 B10R1.13 C[C@H]1CN[C@H](C(=O)O)CO1 Amb35746793 [0,0,0,0,0,1|1,0,0]=2 1976 B10R1.13 NC(=O)C1CC=C(O)CC1 Amb27170137 [0,0,0,0,0,1|2,0,1]=4 1977 B10R1.13 NC(=O)C1CCC(Br)CC1 Amb28315658 [0,0,0,0,0,1|3,0,0]=4 1978 B10R1.13 NC(=O)C1CCC(F)CC1 Amb32943786 [0,0,0,0,0,1|3,0,0]=4 1979 B10R1.13 NC(=O)C1CCC(N)CC1 Amb1136988 [0,0,0,0,0,1|3,0,0]=4 1980 B10R1.13 NC(=O)C1CCC(N)CC1 Amb19514796 [0,0,0,0,0,1|3,0,0]=4 1981 B10R1.13 NC(=O)C1CCC(O)CC1 Amb13951716 [0,0,0,0,0,1|2,0,0]=3 1982 B10R1.13 NC(=O)C1CCC(S)CC1 Amb25288304 [0,0,0,0,0,1|2,1,0]=4 1983 B10R1.13 NC(=O)C1CNC(=O)CN1 Amb26400442 [0,0,0,0,0,1|1,0,2]=4 1984 B10R1.13 NC(=O)C1CNC(=O)CN1 Amb33482851 [0,0,0,0,0,1|1,0,2]=4 1985 B10R1.13 NC(=O)N1CCC(O)CC1 Amb9248132 [0,0,0,0,0,1|3,0,0]=4 1986 B10R1.13 NC(=O)[C@@H]1CC[C@@H](N)CO1 Amb27449248 [0,0,0,0,0,1|3,0,0]=4 1987 B10R1.13 NC(=O)[C@H]1CC[C@@H](N)CC1 Amb27596404 [0,0,0,0,0,1|3,0,0]=4 1988 B10R1.13 NC(=O)[C@H]1CC[C@@H](O)CC1 Amb26569223 [0,0,0,0,0,1|2,0,0]=3 1989 B10R1.13 NC(=O)[C@H]1CC[C@H](N)CC1 Amb28047201 [0,0,0,0,0,1|3,0,0]=4 1990 B10R1.13 NC(=O)[C@H]1CC[C@H](O)CC1 Amb24351197 [0,0,0,0,0,1|2,0,0]=3 1991 B10R1.13 NC1=NCC(C(=O)O)CC1 Amb27760065 [0,0,0,0,0,1|2,0,1]=4 1992 B10R1.13 NC1=NCC(C(=O)O)CC1 Amb28555528 [0,0,0,0,0,1|2,0,1]=4 1993 B10R1.13 NC1CCC(C(=O)Cl)CC1 Amb27645321 [0,0,0,0,0,1|3,0,0]=4 1994 B10R1.13 NC1CCC(C(=O)O)CC1 Amb2699182 [0,0,0,0,0,1|2,0,0]=3 1995 B10R1.13 NC1CCC(C(=O)O)CC1 Amb6739811 [0,0,0,0,0,1|2,0,0]=3 1996 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 Amb10070763 [0,0,0,0,0,1|2,0,0]=3 1997 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 Amb33524039 [0,0,0,0,0,1|2,0,0]=3 1998 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 Amb33524062 [0,0,0,0,0,1|2,0,0]=3 1999 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 Amb8631309 [0,0,0,0,0,1|2,0,0]=3 2000 B10R1.13 O=C(Cl)C1CCC(Cl)CC1 Amb27425034 [0,0,0,0,0,1|3,0,0]=4 2001 B10R1.13 O=C(Cl)C1CCC(O)CC1 Amb21961740 [0,0,0,0,0,1|2,0,0]=3 2002 B10R1.13 O=C(Cl)[C@H]1CC[C@H](O)CC1 Amb27833620 [0,0,0,0,0,1|2,0,0]=3 2003 B10R1.13 O=C(O)C1=CCC(O)CC1 Amb27860175 [0,0,0,0,0,1|1,0,1]=3 2004 B10R1.13 O=C(O)C1C=CC(Br)CC1 Amb26330074 [0,0,0,0,0,1|2,0,1]=4 2005 B10R1.13 O=C(O)C1C=CC(Cl)CC1 Amb18645431 [0,0,0,0,0,1|2,0,1]=4 2006 B10R1.13 O=C(O)C1C=CC(O)CC1 Amb27455236 [0,0,0,0,0,1|1,0,1]=3 2007 B10R1.13 O=C(O)C1CC=C(Br)CC1 Amb26015030 [0,0,0,0,0,1|2,0,1]=4 2008 B10R1.13 O=C(O)C1CC=C(F)CC1 Amb27628828 [0,0,0,0,0,1|2,0,1]=4 2009 B10R1.13 O=C(O)C1CCC(Br)CC1 Amb27239245 [0,0,0,0,0,1|2,0,0]=3 2010 B10R1.13 O=C(O)C1CCC(Cl)CC1 Amb18126347 [0,0,0,0,0,1|2,0,0]=3 2011 B10R1.13 O=C(O)C1CCC(F)CC1 Amb20670645 [0,0,0,0,0,1|2,0,0]=3 2012 B10R1.13 O=C(O)C1CCC(I)CC1 Amb27443730 [0,0,0,0,0,1|2,0,0]=3 2013 B10R1.13 O=C(O)C1CCC(O)CC1 Amb2720801 [0,0,0,0,0,1|1,0,0]=2 2014 B10R1.13 O=C(O)C1CCC(O)CN1 Amb22034512 [0,0,0,0,0,1|0,0,0]=1 2015 B10R1.13 O=C(O)C1CCC(O)CN1 Amb5719819 [0,0,0,0,0,1|0,0,0]=1 2016 B10R1.13 O=C(O)C1CCC(O)CO1 Amb23596937 [0,0,0,0,0,1|1,0,0]=2 2017 B10R1.13 O=C(O)C1CCC(S)CC1 Amb26844518 [0,0,0,0,0,1|1,1,0]=3 2018 B10R1.13 O=C(O)C1CCN(Cl)CC1 Amb28458328 [0,0,0,0,0,1|3,0,0]=4 2019 B10R1.13 O=C(O)C1CCS(=O)CC1 Amb25295426 [0,0,0,0,0,1|2,0,1]=4 2020 B10R1.13 O=C(O)C1CNC(O)CN1 Amb25332404 [0,0,0,0,0,1|0,0,0]=1 2021 B10R1.13 O=C(O)[C@@H]1CC[C@@H](F)CN1 Amb24763804 [0,0,0,0,0,1|1,0,0]=2 2022 B10R1.13 O=C(O)[C@@H]1CC[C@@H](F)CN1 Amb35752872 [0,0,0,0,0,1|1,0,0]=2 2023 B10R1.13 O=C(O)[C@@H]1CC[C@@H](O)CN1 Amb24120629 [0,0,0,0,0,1|0,0,0]=1 2024 B10R1.13 O=C(O)[C@@H]1CC[C@@H](O)CN1 Amb2697173 [0,0,0,0,0,1|0,0,0]=1 2025 B10R1.13 O=C(O)[C@@H]1CC[C@@H](O)CO1 Amb27758209 [0,0,0,0,0,1|1,0,0]=2 2026 B10R1.13 O=C(O)[C@@H]1CC[C@H](O)CN1 Amb28132662 [0,0,0,0,0,1|0,0,0]=1 2027 B10R1.13 O=C(O)[C@@H]1CC[C@H](O)CN1 Amb33726118 [0,0,0,0,0,1|0,0,0]=1 2028 B10R1.13 O=C(O)[C@H]1CC[C@@H](F)CC1 Amb28042515 [0,0,0,0,0,1|2,0,0]=3 2029 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CC1 Amb22387642 [0,0,0,0,0,1|1,0,0]=2 2030 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CN1 Amb23440007 [0,0,0,0,0,1|0,0,0]=1 2031 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CN1 Amb23440183 [0,0,0,0,0,1|0,0,0]=1 2032 B10R1.13 O=C(O)[C@H]1CC[C@H](F)CC1 Amb27786373 [0,0,0,0,0,1|2,0,0]=3 2033 B10R1.13 O=C(O)[C@H]1CC[C@H](O)CC1 Amb22387641 [0,0,0,0,0,1|1,0,0]=2 2034 B10R1.13 O=C(O)[C@H]1CC[C@H](O)CN1 Amb26401050 [0,0,0,0,0,1|0,0,0]=1 2035 B10R1.13 O=C1CCC(C(=O)O)CC1 Amb5719059 [0,0,0,0,0,1|1,0,2]=4 2036 B10R1.13 O=C1CCC(C(=O)O)CN1 Amb8503400 [0,0,0,0,0,1|1,0,2]=4 2037 B10R1.13 O=C1CCC(C(=O)O)CN1 Amb9721708 [0,0,0,0,0,1|1,0,2]=4 2038 B10R1.13 O=C1CCC(C(=O)O)NC1 Amb21960863 [0,0,0,0,0,1|0,0,2]=3 2039 B10R1.13 O=C1CCC(C(=O)O)NC1 Amb5719827 [0,0,0,0,0,1|0,0,2]=3 2040 B10R1.13 O=C1CCC(C(=O)O)NN1 Amb23441127 [0,0,0,0,0,1|1,0,2]=4 2041 B10R1.13 O=C1CCC(C(=O)O)SC1 Amb23596925 [0,0,0,0,0,1|1,0,2]=4 2042 B10R1.13 O=C1CC[C@@H](C(=O)O)CN1 Amb26878933 [0,0,0,0,0,1|1,0,2]=4 2043 B10R1.13 O=C1CC[C@@H](C(=O)O)NC1 Amb24655763 [0,0,0,0,0,1|0,0,2]=3 2044 B10R1.13 O=C1CC[C@@H](C(=O)O)NC1 Amb31291189 [0,0,0,0,0,1|0,0,2]=3 2045 B10R1.13 O=C1CC[C@H](C(=O)O)CN1 Amb26515676 [0,0,0,0,0,1|1,0,2]=4 2046 B10R1.13 O=C1CC[C@H](C(=O)O)NC1 Amb27648107 [0,0,0,0,0,1|0,0,2]=3 2047 B10R1.13 O=C1CC[C@H](C(=O)O)NC1 Amb31291190 [0,0,0,0,0,1|0,0,2]=3 2048 B10R1.13 O=C1CNC(C(=O)O)CN1 Amb22235954 [0,0,0,0,0,1|0,0,2]=3 2049 B10R1.13 O=C1CNC(C(=O)O)CN1 Amb22641428 [0,0,0,0,0,1|0,0,2]=3 2050 B10R1.13 O=C1CN[C@@H](C(=O)O)CN1 Amb24423079 [0,0,0,0,0,1|0,0,2]=3 2051 B10R1.13 O=C1CN[C@H](C(=O)O)CN1 Amb22756547 [0,0,0,0,0,1|0,0,2]=3 2052 B10R1.13 O=C1COC(C(=O)O)CN1 Amb27872662 [0,0,0,0,0,1|1,0,2]=4 2053 B10R1.54 C=C(C)CC1CCC(O)C1 Amb27805881 [0,0,0,0,0,1|3,0,0]=4 2054 B10R1.54 CC(=O)CC1CC(C)CO1 Amb27776049 [0,0,0,0,0,1|3,0,0]=4 2055 B10R1.54 CC(=O)CC1CCC(N)C1 Amb24661839 [0,0,0,0,0,1|3,0,0]=4 2056 B10R1.54 CC(=O)C[C@@H]1CC[C@H](N)C1 Amb33307983 [0,0,0,0,0,1|3,0,0]=4 2057 B10R1.54 CC(=O)NC1CCC(F)C1 Amb27766979 [0,0,0,0,0,1|3,0,0]=4 2058 B10R1.54 CC(=O)NC1CCC(N)C1 Amb28397205 [0,0,0,0,0,1|3,0,0]=4 2059 B10R1.54 CC(=O)NC1COC(O)C1 Amb27863959 [0,0,0,0,0,1|3,0,0]=4 2060 B10R1.54 CC(=O)N[C@@H]1C=C[C@H](O)C1 Amb27780135 [0,0,0,0,0,1|2,0,1]=4 2061 B10R1.54 CC(=O)N[C@@H]1CC[C@H](N)C1 Amb32685673 [0,0,0,0,0,1|3,0,0]=4 2062 B10R1.54 CC(=O)N[C@H]1C=C[C@@H](O)C1 Amb27446852 [0,0,0,0,0,1|2,0,1]=4 2063 B10R1.54 CC(=O)N[C@H]1CC[C@@H](O)C1 Amb27212145 [0,0,0,0,0,1|2,0,0]=3 2064 B10R1.54 CC(=O)OC1C=CC(O)C1 Amb28320380 [0,0,0,0,0,1|2,0,1]=4 2065 B10R1.54 CC(=O)OC1C=C[C@@H](O)C1 Amb27249761 [0,0,0,0,0,1|2,0,1]=4 2066 B10R1.54 CC(=O)O[C@@H]1C=CC(O)C1 Amb28050641 [0,0,0,0,0,1|2,0,1]=4 2067 B10R1.54 CC(=O)O[C@@H]1C=C[C@H](O)C1 Amb22363102 [0,0,0,0,0,1|2,0,1]=4 2068 B10R1.54 CC(=O)O[C@@H]1CC[C@H](O)C1 Amb26070893 [0,0,0,0,0,1|2,0,0]=3 2069 B10R1.54 CC(=O)O[C@H]1C=C[C@@H](O)C1 Amb8385585 [0,0,0,0,0,1|2,0,1]=4 2070 B10R1.54 CC(=O)O[C@H]1C=C[C@H](O)C1 Amb27450768 [0,0,0,0,0,1|2,0,1]=4 2071 B10R1.54 CC1CC(CC(=O)O)CO1 Amb29866066 [0,0,0,0,0,1|3,0,0]=4 2072 B10R1.54 CC1CC(CC(=O)O)CS1 Amb28318997 [0,0,0,0,0,1|3,0,0]=4 2073 B10R1.54 CC1CCC(CC(=O)O)C1 Amb18643912 [0,0,0,0,0,1|2,0,0]=3 2074 B10R1.54 CC1CCC(CC(=O)O)N1 Amb8387923 [0,0,0,0,0,1|3,0,0]=4 2075 B10R1.54 CC1CCC(CC(=O)O)O1 Amb24715878 [0,0,0,0,0,1|3,0,0]=4 2076 B10R1.54 CC1CCC(NC(=O)Cl)C1 Amb35633303 [0,0,0,0,0,1|3,0,0]=4 2077 B10R1.54 CC1CCC(NC(N)=O)C1 Amb27460927 [0,0,0,0,0,1|3,0,0]=4 2078 B10R1.54 CC1CCN(CC(=O)O)C1 Amb18281107 [0,0,0,0,0,1|3,0,0]=4 2079 B10R1.54 CC1CCN(CC(=O)O)C1 Amb28555433 [0,0,0,0,0,1|3,0,0]=4 2080 B10R1.54 CC1CC\C(=C/C(=O)O)C1 Amb20667750 [0,0,0,0,0,1|2,0,1]=4 2081 B10R1.54 CC1CNC(CC(=O)O)C1 Amb8387922 [0,0,0,0,0,1|1,0,0]=2 2082 B10R1.54 CC1CNC(CC(N)=O)S1 Amb27837900 [0,0,0,0,0,1|3,0,0]=4 2083 B10R1.54 CN(C)CC1CC(O)CN1 Amb28069902 [0,0,0,0,0,1|3,0,0]=4 2084 B10R1.54 CN1CCC(CC(=O)O)C1 Amb33550954 [0,0,0,0,0,1|3,0,0]=4 2085 B10R1.54 CN1CCC(CC(=O)O)C1 Amb8009899 [0,0,0,0,0,1|3,0,0]=4 2086 B10R1.54 C[C@@H]1CCC(CC(=O)O)C1 Amb27436927 [0,0,0,0,0,1|2,0,0]=3 2087 B10R1.54 C[C@@H]1CCC(CC(=O)O)O1 Amb33423873 [0,0,0,0,0,1|3,0,0]=4 2088 B10R1.54 C[C@@H]1CC[C@H](CC(=O)O)O1 Amb27969185 [0,0,0,0,0,1|3,0,0]=4 2089 B10R1.54 NC(=O)CC1CCC(N)C1 Amb27654812 [0,0,0,0,0,1|3,0,0]=4 2090 B10R1.54 NC(=O)CN1CC(O)CO1 Amb27663030 [0,0,0,0,0,1|3,0,0]=4 2091 B10R1.54 NC(=O)CN1CC[C@H](O)C1 Amb27667246 [0,0,0,0,0,1|3,0,0]=4 2092 B10R1.54 NC(=O)CN1C[C@@H](O)CO1 Amb28251531 [0,0,0,0,0,1|3,0,0]=4 2093 B10R1.54 NC(=O)C[C@H]1C[C@H](O)CN1 Amb27473504 [0,0,0,0,0,1|1,0,0]=2 2094 B10R1.54 NC(=O)N[C@H]1CC[C@@H](O)C1 Amb27842440 [0,0,0,0,0,1|2,0,0]=3 2095 B10R1.54 NC1CCN(CC(=O)O)C1 Amb2699150 [0,0,0,0,0,1|3,0,0]=4 2096 B10R1.54 N[C@@H]1CCN(CC(=O)O)C1 Amb2699149 [0,0,0,0,0,1|3,0,0]=4 2097 B10R1.54 N[C@@H]1CC[C@@H](CC(=O)O)C1 Amb10066890 [0,0,0,0,0,1|2,0,0]=3 2098 B10R1.54 N[C@@H]1CC[C@H](CC(=O)O)C1 Amb10066892 [0,0,0,0,0,1|2,0,0]=3 2099 B10R1.54 N[C@@H]1CC[C@H](CC(=O)O)C1 Amb35745836 [0,0,0,0,0,1|2,0,0]=3 2100 B10R1.54 N[C@H]1CC[C@@H](CC(=O)O)C1 Amb10066912 [0,0,0,0,0,1|2,0,0]=3 2101 B10R1.54 O=C(O)CC1C=CC(O)C1 Amb27175394 [0,0,0,0,0,1|1,0,1]=3 2102 B10R1.54 O=C(O)CC1CC(=O)CN1 Amb27860610 [0,0,0,0,0,1|0,0,2]=3 2103 B10R1.54 O=C(O)CC1CC(O)CN1 Amb25082530 [0,0,0,0,0,1|0,0,0]=1 2104 B10R1.54 O=C(O)CC1CCC(=O)C1 Amb18643816 [0,0,0,0,0,1|1,0,2]=4 2105 B10R1.54 O=C(O)CC1CCC(F)C1 Amb24679226 [0,0,0,0,0,1|2,0,0]=3 2106 B10R1.54 O=C(O)CC1CCC(O)C1 Amb33545095 [0,0,0,0,0,1|1,0,0]=2 2107 B10R1.54 O=C(O)CC1C[C@@H](O)CN1 Amb32990253 [0,0,0,0,0,1|0,0,0]=1 2108 B10R1.54 O=C(O)CC1C[C@H](O)CN1 Amb32990254 [0,0,0,0,0,1|0,0,0]=1 2109 B10R1.54 O=C(O)CN1CC(O)CO1 Amb27763196 [0,0,0,0,0,1|2,0,0]=3 2110 B10R1.54 O=C(O)CN1CCC(F)C1 Amb35614253 [0,0,0,0,0,1|3,0,0]=4 2111 B10R1.54 O=C(O)CN1CCC(O)C1 Amb22001816 [0,0,0,0,0,1|2,0,0]=3 2112 B10R1.54 O=C(O)CN1CCC(O)C1 Amb2699841 [0,0,0,0,0,1|2,0,0]=3 2113 B10R1.54 O=C(O)CN1CC[C@@H](O)C1 Amb2697169 [0,0,0,0,0,1|2,0,0]=3 2114 B10R1.54 O=C(O)CN1C[C@@H](O)CO1 Amb27852498 [0,0,0,0,0,1|2,0,0]=3 2115 B10R1.54 O=C(O)C[C@@H]1CC(O)CN1 Amb34915761 [0,0,0,0,0,1|0,0,0]=1 2116 B10R1.54 O=C(O)C[C@@H]1CCC(=O)C1 Amb24480441 [0,0,0,0,0,1|1,0,2]=4 2117 B10R1.54 O=C(O)C[C@@H]1CC[C@@H](O)C1 Amb33716084 [0,0,0,0,0,1|1,0,0]=2 2118 B10R1.54 O=C(O)C[C@@H]1CC[C@H](O)C1 Amb27654242 [0,0,0,0,0,1|1,0,0]=2 2119 B10R1.54 O=C(O)C[C@@H]1C[C@@H](F)CN1 Amb33329938 [0,0,0,0,0,1|1,0,0]=2 2120 B10R1.54 O=C(O)C[C@@H]1C[C@@H](F)CN1 Amb33457872 [0,0,0,0,0,1|1,0,0]=2 2121 B10R1.54 O=C(O)C[C@@H]1C[C@@H](O)CN1 Amb26930782 [0,0,0,0,0,1|0,0,0]=1 2122 B10R1.54 O=C(O)C[C@@H]1C[C@@H](O)CN1 Amb6754088 [0,0,0,0,0,1|0,0,0]=1 2123 B10R1.54 O=C(O)C[C@@H]1C[C@H](F)CN1 Amb33329502 [0,0,0,0,0,1|1,0,0]=2 2124 B10R1.54 O=C(O)C[C@@H]1C[C@H](F)CN1 Amb33330670 [0,0,0,0,0,1|1,0,0]=2 2125 B10R1.54 O=C(O)C[C@H]1C=C[C@@H](O)C1 Amb28429828 [0,0,0,0,0,1|1,0,1]=3 2126 B10R1.54 O=C(O)C[C@H]1CCC(=O)C1 Amb22898751 [0,0,0,0,0,1|1,0,2]=4 2127 B10R1.54 O=C(O)C[C@H]1CC[C@@H](O)C1 Amb28197757 [0,0,0,0,0,1|1,0,0]=2 2128 B10R1.54 O=C(O)C[C@H]1CC[C@H](O)C1 Amb27221654 [0,0,0,0,0,1|1,0,0]=2 2129 B10R1.54 O=C(O)C[C@H]1C[C@H](O)CN1 Amb22756736 [0,0,0,0,0,1|0,0,0]=1 2130 B10R1.113 CC(=O)C1=CCCC(O)C1 Amb28126618 [0,0,0,0,0,1|2,0,1]=4 2131 B10R1.113 CC(=O)C1CCCC(Br)C1 Amb27827804 [0,0,0,0,0,1|3,0,0]=4 2132 B10R1.113 CC(=O)C1CCCC(Cl)C1 Amb26457716 [0,0,0,0,0,1|3,0,0]=4 2133 B10R1.113 CC(=O)C1CCCC(N)C1 Amb25990513 [0,0,0,0,0,1|3,0,0]=4 2134 B10R1.113 CC(=O)C1CCCC(N)C1 Amb33447093 [0,0,0,0,0,1|3,0,0]=4 2135 B10R1.113 CC(=O)C1CCNC(C)C1 Amb33307710 [0,0,0,0,0,1|3,0,0]=4 2136 B10R1.113 CC(=O)C1CN(C)CCN1 Amb27618375 [0,0,0,0,0,1|3,0,0]=4 2137 B10R1.113 CC(=O)C1CNCC(C)C1 Amb28058463 [0,0,0,0,0,1|2,0,0]=3 2138 B10R1.113 CC(=O)N1CCCC(O)C1 Amb9272424 [0,0,0,0,0,1|3,0,0]=4 2139 B10R1.113 CC(=O)N1CCC[C@@H](O)C1 Amb22227493 [0,0,0,0,0,1|3,0,0]=4 2140 B10R1.113 CC(=O)N1CCC[C@H](O)C1 Amb22227529 [0,0,0,0,0,1|3,0,0]=4 2141 B10R1.113 CC(=O)[C@@H]1CC=C[C@H](O)C1 Amb27637607 [0,0,0,0,0,1|2,0,1]=4 2142 B10R1.113 CC(=O)[C@@H]1CCC[C@@H](N)C1 Amb33307837 [0,0,0,0,0,1|3,0,0]=4 2143 B10R1.113 CC(=O)[C@@H]1CCC[C@H](Cl)C1 Amb28051845 [0,0,0,0,0,1|3,0,0]=4 2144 B10R1.113 CC(=O)[C@@H]1CCC[C@H](N)C1 Amb33132804 [0,0,0,0,0,1|3,0,0]=4 2145 B10R1.113 CC(=O)[C@@H]1CCC[C@H](O)C1 Amb28457491 [0,0,0,0,0,1|2,0,0]=3 2146 B10R1.113 CC(=O)[C@@H]1CCN[C@H](C)C1 Amb33307715 [0,0,0,0,0,1|3,0,0]=4 2147 B10R1.113 CC(C)C1CC(O)CCN1 Amb22754665 [0,0,0,0,0,1|2,0,1]=4 2148 B10R1.113 CC1C=CCC(C(=O)O)C1 Amb24350925 [0,0,0,0,0,1|2,0,1]=4 2149 B10R1.113 CC1CC(C(=O)Cl)CCO1 Amb27267994 [0,0,0,0,0,1|3,0,0]=4 2150 B10R1.113 CC1CC(C(=O)O)CCN1 Amb18831574 [0,0,0,0,0,1|2,0,0]=3 2151 B10R1.113 CC1CC(C(=O)O)CCN1 Amb28555517 [0,0,0,0,0,1|2,0,0]=3 2152 B10R1.113 CC1CC(C(=O)O)CCO1 Amb33545304 [0,0,0,0,0,1|2,0,0]=3 2153 B10R1.113 CC1CC(C(=O)O)CCS1 Amb26442619 [0,0,0,0,0,1|2,0,0]=3 2154 B10R1.113 CC1CC(C(N)=O)CCN1 Amb27838161 [0,0,0,0,0,1|3,0,0]=4 2155 B10R1.113 CC1CC(C(N)=O)CCO1 Amb28126892 [0,0,0,0,0,1|3,0,0]=4 2156 B10R1.113 CC1CCC=C(C(=O)O)C1 Amb28050150 [0,0,0,0,0,1|2,0,1]=4 2157 B10R1.113 CC1CCCC(C(=O)Cl)C1 Amb25715458 [0,0,0,0,0,1|3,0,0]=4 2158 B10R1.113 CC1CCCC(C(=O)O)C1 Amb3939935 [0,0,0,0,0,1|2,0,0]=3 2159 B10R1.113 CC1CCCC(C(=O)O)N1 Amb19959953 [0,0,0,0,0,1|3,0,0]=4 2160 B10R1.113 CC1CCCC(C(=O)O)N1 Amb4314386 [0,0,0,0,0,1|3,0,0]=4 2161 B10R1.113 CC1CCCC(C(=O)O)O1 Amb24529278 [0,0,0,0,0,1|3,0,0]=4 2162 B10R1.113 CC1CCCC(S(=O)O)C1 Amb35683278 [0,0,0,0,0,1|3,0,0]=4 2163 B10R1.113 CC1CCC[C@H](C(=O)O)N1 Amb540211 [0,0,0,0,0,1|3,0,0]=4 2164 B10R1.113 CC1CCNC(C(=O)O)C1 Amb13886199 [0,0,0,0,0,1|1,0,0]=2 2165 B10R1.113 CC1CCNC(C(=O)O)C1 Amb19375550 [0,0,0,0,0,1|1,0,0]=2 2166 B10R1.113 CC1CCNC(C(=O)O)O1 Amb25702339 [0,0,0,0,0,1|2,0,0]=3 2167 B10R1.113 CC1CCNC(C(C)O)C1 Amb33545321 [0,0,0,0,0,1|2,0,1]=4 2168 B10R1.113 CC1CCNC(C(N)=O)C1 Amb27590357 [0,0,0,0,0,1|2,0,0]=3 2169 B10R1.113 CC1CCOC(C(=O)O)C1 Amb25266110 [0,0,0,0,0,1|2,0,0]=3 2170 B10R1.113 CC1CCOC(C(=O)O)N1 Amb33194311 [0,0,0,0,0,1|3,0,0]=4 2171 B10R1.113 CC1CNCC(C(=O)O)C1 Amb18643998 [0,0,0,0,0,1|1,0,0]=2 2172 B10R1.113 CC1CNCC(C(=O)O)N1 Amb32716215 [0,0,0,0,0,1|2,0,0]=3 2173 B10R1.113 CC1CNCC(C(=O)O)O1 Amb26021863 [0,0,0,0,0,1|2,0,0]=3 2174 B10R1.113 CC1CNCC(C(=O)O)O1 Amb32752555 [0,0,0,0,0,1|2,0,0]=3 2175 B10R1.113 CC1CNCC(C(C)O)C1 Amb35741697 [0,0,0,0,0,1|2,0,1]=4 2176 B10R1.113 CC1CNCC(C(N)=O)C1 Amb27876385 [0,0,0,0,0,1|2,0,0]=3 2177 B10R1.113 CC1CNCC(C(N)=O)C1 Amb33339041 [0,0,0,0,0,1|2,0,0]=3 2178 B10R1.113 CC1CNCC(C(N)=O)O1 Amb25351035 [0,0,0,0,0,1|3,0,0]=4 2179 B10R1.113 CC1COCC(C(=O)O)N1 Amb23585511 [0,0,0,0,0,1|3,0,0]=4 2180 B10R1.113 CC1COCC(C(=O)O)N1 Amb28555605 [0,0,0,0,0,1|3,0,0]=4 2181 B10R1.113 CC1CSCC(C(=O)O)N1 Amb18645533 [0,0,0,0,0,1|3,0,0]=4 2182 B10R1.113 CC1CSCC(C(=O)O)N1 Amb33456372 [0,0,0,0,0,1|3,0,0]=4 2183 B10R1.113 CC1CSC[C@@H](C(=O)O)N1 Amb27223064 [0,0,0,0,0,1|3,0,0]=4 2184 B10R1.113 CC1NC(C(=O)O)CCS1 Amb18278331 [0,0,0,0,0,1|3,0,0]=4 2185 B10R1.113 CN(C)[C@@H]1CNC[C@@H](O)C1 Amb27850592 [0,0,0,0,0,1|3,0,0]=4 2186 B10R1.113 CN(C)[C@@H]1CNC[C@H](O)C1 Amb27427972 [0,0,0,0,0,1|3,0,0]=4 2187 B10R1.113 CN1CC=CC(C(=O)O)C1 Amb28344213 [0,0,0,0,0,1|3,0,0]=4 2188 B10R1.113 CN1CCCC(C(=O)O)C1 Amb2689660 [0,0,0,0,0,1|3,0,0]=4 2189 B10R1.113 CN1CCCC(C(=O)O)C1 Amb9238836 [0,0,0,0,0,1|3,0,0]=4 2190 B10R1.113 CN1CCC[C@@H](C(=O)O)C1 Amb22751960 [0,0,0,0,0,1|3,0,0]=4 2191 B10R1.113 CN1CCC[C@H](C(=O)O)C1 Amb28428437 [0,0,0,0,0,1|3,0,0]=4 2192 B10R1.113 CN1CCNC(C(=O)O)C1 Amb10602764 [0,0,0,0,0,1|2,0,0]=3 2193 B10R1.113 CN1CCNC(C(=O)O)C1 Amb22587697 [0,0,0,0,0,1|2,0,0]=3 2194 B10R1.113 CN1CCNC(C(=O)O)C1 Amb22754371 [0,0,0,0,0,1|2,0,0]=3 2195 B10R1.113 CN1CCOC(C(=O)O)C1 Amb18946166 [0,0,0,0,0,1|3,0,0]=4 2196 B10R1.113 CN1CCOC(C(=O)O)C1 Amb19514725 [0,0,0,0,0,1|3,0,0]=4 2197 B10R1.113 CN1CCSC(C(=O)O)C1 Amb35603313 [0,0,0,0,0,1|3,0,0]=4 2198 B10R1.113 CS(=O)C1CCCC(O)C1 Amb32753656 [0,0,0,0,0,1|3,0,0]=4 2199 B10R1.113 C[C@@H]1CCC[C@@H](C(N)=O)C1 Amb28054502 [0,0,0,0,0,1|3,0,0]=4 2200 B10R1.113 C[C@@H]1CCC[C@H](C(=O)O)N1 Amb25168905 [0,0,0,0,0,1|3,0,0]=4 2201 B10R1.113 C[C@@H]1CCC[C@H](C(=O)O)N1 Amb32666562 [0,0,0,0,0,1|3,0,0]=4 2202 B10R1.113 C[C@@H]1CCN[C@@H](C(=O)O)C1 Amb8393477 [0,0,0,0,0,1|1,0,0]=2 2203 B10R1.113 C[C@@H]1CNCC(C(N)=O)O1 Amb27977144 [0,0,0,0,0,1|3,0,0]=4 2204 B10R1.113 C[C@@H]1CNC[C@@H](C(=O)O)C1 Amb28198256 [0,0,0,0,0,1|1,0,0]=2 2205 B10R1.113 C[C@@H]1CNC[C@@H](C(=O)O)O1 Amb33804088 [0,0,0,0,0,1|2,0,0]=3 2206 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)C1 Amb28186632 [0,0,0,0,0,1|1,0,0]=2 2207 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)C1 Amb35746974 [0,0,0,0,0,1|1,0,0]=2 2208 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)O1 Amb25378882 [0,0,0,0,0,1|2,0,0]=3 2209 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)O1 Amb32664812 [0,0,0,0,0,1|2,0,0]=3 2210 B10R1.113 C[C@@H]1COC[C@H](C(=O)O)N1 Amb25102766 [0,0,0,0,0,1|3,0,0]=4 2211 B10R1.113 C[C@@H]1COC[C@H](C(=O)O)N1 Amb32796271 [0,0,0,0,0,1|3,0,0]=4 2212 B10R1.113 C[C@@H]1C[C@H](C(=O)O)CCN1 Amb31147397 [0,0,0,0,0,1|2,0,0]=3 2213 B10R1.113 C[C@@H]1C[C@H](C(=O)O)CCN1 Amb32670817 [0,0,0,0,0,1|2,0,0]=3 2214 B10R1.113 C[C@@H]1C[C@H](C(=O)O)NCO1 Amb27618567 [0,0,0,0,0,1|1,0,0]=2 2215 B10R1.113 C[C@@H]1C[C@H](C(=O)O)OCO1 Amb28428440 [0,0,0,0,0,1|2,0,0]=3 2216 B10R1.113 C[C@H]1CCC[C@@H](C(=O)O)C1 Amb25919595 [0,0,0,0,0,1|2,0,0]=3 2217 B10R1.113 C[C@H]1CCC[C@@H](C(=O)O)N1 Amb28145011 [0,0,0,0,0,1|3,0,0]=4 2218 B10R1.113 C[C@H]1CCC[C@@H](C(=O)O)N1 Amb35746778 [0,0,0,0,0,1|3,0,0]=4 2219 B10R1.113 C[C@H]1CCN[C@H](C(=O)O)C1 Amb22744764 [0,0,0,0,0,1|1,0,0]=2 2220 B10R1.113 C[C@H]1CCN[C@H](C(=O)O)C1 Amb33330844 [0,0,0,0,0,1|1,0,0]=2 2221 B10R1.113 C[C@H]1CCOC(C(=O)O)C1 Amb26057818 [0,0,0,0,0,1|2,0,0]=3 2222 B10R1.113 C[C@H]1CCO[C@@H](C(=O)O)O1 Amb27815067 [0,0,0,0,0,1|3,0,0]=4 2223 B10R1.113 C[C@H]1CCO[C@H](C(=O)O)C1 Amb26565299 [0,0,0,0,0,1|2,0,0]=3 2224 B10R1.113 C[C@H]1CNC[C@@H](C(=O)O)C1 Amb26968513 [0,0,0,0,0,1|1,0,0]=2 2225 B10R1.113 C[C@H]1COC[C@@H](C(=O)O)N1 Amb26528283 [0,0,0,0,0,1|3,0,0]=4 2226 B10R1.113 C[C@H]1COC[C@@H](C(=O)O)N1 Amb35746779 [0,0,0,0,0,1|3,0,0]=4 2227 B10R1.113 C[C@H]1C[C@@H](C(=O)O)CCN1 Amb26405288 [0,0,0,0,0,1|2,0,0]=3 2228 B10R1.113 C[C@H]1C[C@@H](C(=O)O)CCN1 Amb33362296 [0,0,0,0,0,1|2,0,0]=3 2229 B10R1.113 C[C@H]1OCC[C@@H](C(=O)O)O1 Amb26918498 [0,0,0,0,0,1|3,0,0]=4 2230 B10R1.113 NC(=O)C1CC(=O)CCN1 Amb18202632 [0,0,0,0,0,1|1,0,2]=4 2231 B10R1.113 NC(=O)C1CCCC(F)C1 Amb32943801 [0,0,0,0,0,1|3,0,0]=4 2232 B10R1.113 NC(=O)C1CCCC(N)C1 Amb20669500 [0,0,0,0,0,1|3,0,0]=4 2233 B10R1.113 NC(=O)C1CCCC(N)C1 Amb9709433 [0,0,0,0,0,1|3,0,0]=4 2234 B10R1.113 NC(=O)C1CCCC(O)C1 Amb25067304 [0,0,0,0,0,1|2,0,0]=3 2235 B10R1.113 NC(=O)C1CNCC(O)C1 Amb27634008 [0,0,0,0,0,1|1,0,0]=2 2236 B10R1.113 NC(=O)[C@@H]1CCC[C@@H](N)C1 Amb10873178 [0,0,0,0,0,1|3,0,0]=4 2237 B10R1.113 NC(=O)[C@@H]1CCC[C@H](O)C1 Amb27433641 [0,0,0,0,0,1|2,0,0]=3 2238 B10R1.113 NC(=O)[C@H]1CCC[C@@H](N)C1 Amb33457595 [0,0,0,0,0,1|3,0,0]=4 2239 B10R1.113 NC(=O)[C@H]1CCC[C@@H](N)C1 Amb33457596 [0,0,0,0,0,1|3,0,0]=4 2240 B10R1.113 NC(=S)C1CCCC(O)C1 Amb33328384 [0,0,0,0,0,1|2,1,0]=4 2241 B10R1.113 NC1=NCCC(C(=O)O)C1 Amb28042963 [0,0,0,0,0,1|2,0,1]=4 2242 B10R1.113 NC1C=CCC(C(=O)O)C1 Amb27180527 [0,0,0,0,0,1|2,0,1]=4 2243 B10R1.113 NC1C=CCC(C(=O)O)C1 Amb32675210 [0,0,0,0,0,1|2,0,1]=4 2244 B10R1.113 NC1CCCC(C(=O)Cl)C1 Amb27861962 [0,0,0,0,0,1|3,0,0]=4 2245 B10R1.113 NC1CCCC(C(=O)O)C1 Amb32664151 [0,0,0,0,0,1|2,0,0]=3 2246 B10R1.113 NC1CCCC(C(=O)O)C1 Amb33545486 [0,0,0,0,0,1|2,0,0]=3 2247 B10R1.113 NC1CCOC(C(=O)O)C1 Amb26917330 [0,0,0,0,0,1|2,0,0]=3 2248 B10R1.113 NC1CCOC(C(=O)O)C1 Amb33338762 [0,0,0,0,0,1|2,0,0]=3 2249 B10R1.113 NC1COCC(C(=O)O)C1 Amb25088866 [0,0,0,0,0,1|2,0,0]=3 2250 B10R1.113 N[C@@H]1CCC[C@@H](C(=O)O)C1 Amb10873166 [0,0,0,0,0,1|2,0,0]=3 2251 B10R1.113 N[C@@H]1CCC[C@@H](C(=O)O)C1 Amb25989341 [0,0,0,0,0,1|2,0,0]=3 2252 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 Amb20241308 [0,0,0,0,0,1|2,0,0]=3 2253 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 Amb32643943 [0,0,0,0,0,1|2,0,0]=3 2254 B10R1.113 N[C@@H]1CNC[C@@H](C(=O)O)C1 Amb27186917 [0,0,0,0,0,1|1,0,0]=2 2255 B10R1.113 N[C@H]1C=CC[C@@H](C(=O)O)C1 Amb26568665 [0,0,0,0,0,1|2,0,1]=4 2256 B10R1.113 N[C@H]1C=CC[C@@H](C(=O)O)C1 Amb32675220 [0,0,0,0,0,1|2,0,1]=4 2257 B10R1.113 N[C@H]1C=CC[C@H](C(=O)O)C1 Amb26589126 [0,0,0,0,0,1|2,0,1]=4 2258 B10R1.113 N[C@H]1C=CC[C@H](C(=O)O)C1 Amb32679286 [0,0,0,0,0,1|2,0,1]=4 2259 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 Amb20241307 [0,0,0,0,0,1|2,0,0]=3 2260 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 Amb23439976 [0,0,0,0,0,1|2,0,0]=3 2261 B10R1.113 N[C@H]1CCC[C@H](C(=O)O)C1 Amb22746829 [0,0,0,0,0,1|2,0,0]=3 2262 B10R1.113 N[C@H]1CCC[C@H](C(=O)O)C1 Amb23439848 [0,0,0,0,0,1|2,0,0]=3 2263 B10R1.113 N[C@H]1CCO[C@H](C(=O)O)C1 Amb32992741 [0,0,0,0,0,1|2,0,0]=3 2264 B10R1.113 O=C(Cl)C1CCCC(Cl)C1 Amb28322791 [0,0,0,0,0,1|3,0,0]=4 2265 B10R1.113 O=C(Cl)N1CCCC(O)C1 Amb28326001 [0,0,0,0,0,1|3,0,0]=4 2266 B10R1.113 O=C(O)C1=CC(O)CCC1 Amb25889028 [0,0,0,0,0,1|1,0,2]=4 2267 B10R1.113 O=C(O)C1=C[C@H](O)CCC1 Amb27203167 [0,0,0,0,0,1|1,0,2]=4 2268 B10R1.113 O=C(O)C1CC(Cl)CNN1 Amb27837992 [0,0,0,0,0,1|1,0,0]=2 2269 B10R1.113 O=C(O)C1CC(F)CCN1 Amb24423965 [0,0,0,0,0,1|1,0,0]=2 2270 B10R1.113 O=C(O)C1CC(O)CCN1 Amb24117443 [0,0,0,0,0,1|0,0,0]=1 2271 B10R1.113 O=C(O)C1CC(O)CCO1 Amb28246597 [0,0,0,0,0,1|1,0,0]=2 2272 B10R1.113 O=C(O)C1CCCC(F)C1 Amb26004039 [0,0,0,0,0,1|2,0,0]=3 2273 B10R1.113 O=C(O)C1CCCC(O)C1 Amb33544783 [0,0,0,0,0,1|1,0,0]=2 2274 B10R1.113 O=C(O)C1CCCC(S)C1 Amb32788453 [0,0,0,0,0,1|1,1,0]=3 2275 B10R1.113 O=C(O)C1CNCC(O)C1 Amb2695137 [0,0,0,0,0,1|0,0,0]=1 2276 B10R1.113 O=C(O)C1CNCC(O)C1 Amb8630089 [0,0,0,0,0,1|0,0,0]=1 2277 B10R1.113 O=C(O)C1COCC(O)C1 Amb27810785 [0,0,0,0,0,1|1,0,0]=2 2278 B10R1.113 O=C(O)C1CS(=O)CCN1 Amb26024462 [0,0,0,0,0,1|1,0,1]=3 2279 B10R1.113 O=C(O)C1CS(=O)CCN1 Amb33038317 [0,0,0,0,0,1|1,0,1]=3 2280 B10R1.113 O=C(O)[C@@H]1CC=C[C@H](O)C1 Amb25960767 [0,0,0,0,0,1|1,0,1]=3 2281 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](O)C1 Amb22899464 [0,0,0,0,0,1|1,0,0]=2 2282 B10R1.113 O=C(O)[C@@H]1CCC[C@H](Br)C1 Amb28053594 [0,0,0,0,0,1|2,0,0]=3 2283 B10R1.113 O=C(O)[C@@H]1CCC[C@H](O)C1 Amb28059041 [0,0,0,0,0,1|1,0,0]=2 2284 B10R1.113 O=C(O)[C@@H]1CNC[C@@H](O)C1 Amb27186916 [0,0,0,0,0,1|0,0,0]=1 2285 B10R1.113 O=C(O)[C@@H]1CNC[C@H](F)C1 Amb27447199 [0,0,0,0,0,1|1,0,0]=2 2286 B10R1.113 O=C(O)[C@@H]1CNC[C@H](O)C1 Amb27188671 [0,0,0,0,0,1|0,0,0]=1 2287 B10R1.113 O=C(O)[C@@H]1CS(=O)CCN1 Amb27444621 [0,0,0,0,0,1|1,0,1]=3 2288 B10R1.113 O=C(O)[C@@H]1C[C@@H](O)CCN1 Amb22388540 [0,0,0,0,0,1|0,0,0]=1 2289 B10R1.113 O=C(O)[C@@H]1C[C@H](F)CCN1 Amb27786906 [0,0,0,0,0,1|1,0,0]=2 2290 B10R1.113 O=C(O)[C@@H]1C[C@H](O)CCN1 Amb22386828 [0,0,0,0,0,1|0,0,0]=1 2291 B10R1.113 O=C(O)[C@@H]1C[C@H](O)CNN1 Amb25949203 [0,0,0,0,0,1|0,0,0]=1 2292 B10R1.113 O=C(O)[C@H]1CCC[C@@H](Cl)C1 Amb28436868 [0,0,0,0,0,1|2,0,0]=3 2293 B10R1.113 O=C(O)[C@H]1CCC[C@@H](O)C1 Amb22899465 [0,0,0,0,0,1|1,0,0]=2 2294 B10R1.113 O=C(O)[C@H]1CCC[C@H](Cl)C1 Amb28385610 [0,0,0,0,0,1|2,0,0]=3 2295 B10R1.113 O=C(O)[C@H]1C[C@@H](O)CCN1 Amb20241913 [0,0,0,0,0,1|0,0,0]=1 2296 B10R1.113 O=C(O)[C@H]1C[C@H](O)CCN1 Amb22748263 [0,0,0,0,0,1|0,0,0]=1 2297 B10R1.113 O=C(O)[C@H]1C[C@H](O)CCN1 Amb30982057 [0,0,0,0,0,1|0,0,0]=1 2298 B10R1.113 O=C(O)[C@H]1C[C@H](O)CNN1 Amb27450594 [0,0,0,0,0,1|0,0,0]=1 2299 B10R1.113 O=C1CC(C(=O)O)CCN1 Amb33531218 [0,0,0,0,0,1|1,0,2]=4 2300 B10R1.113 O=C1CC(C(=O)O)CNN1 Amb22546429 [0,0,0,0,0,1|1,0,2]=4 2301 B10R1.113 O=C1CC(C(=O)O)CNN1 Amb28144294 [0,0,0,0,0,1|1,0,2]=4 2302 B10R1.113 O=C1CCCC(C(=O)O)C1 Amb6305244 [0,0,0,0,0,1|1,0,2]=4 2303 B10R1.113 O=C1CCC[C@@H](C(=O)O)C1 Amb28050152 [0,0,0,0,0,1|1,0,2]=4 2304 B10R1.113 O=C1CCNC(C(=O)O)C1 Amb13889088 [0,0,0,0,0,1|0,0,2]=3 2305 B10R1.113 O=C1CCNC(C(=O)O)C1 Amb13889089 [0,0,0,0,0,1|0,0,2]=3 2306 B10R1.113 O=C1CCN[C@@H](C(=O)O)C1 Amb27977165 [0,0,0,0,0,1|0,0,2]=3 2307 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 Amb13889084 [0,0,0,0,0,1|0,0,2]=3 2308 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 Amb2699956 [0,0,0,0,0,1|0,0,2]=3 2309 B10R1.113 O=C1CCOC(C(=O)O)C1 Amb22496784 [0,0,0,0,0,1|1,0,2]=4 2310 B10R1.113 O=C1CNCC(C(=O)O)C1 Amb27244770 [0,0,0,0,0,1|0,0,2]=3 2311 B10R1.113 O=C1CNC[C@H](C(=O)O)N1 Amb27398104 [0,0,0,0,0,1|1,0,2]=4 2312 B10R1.113 O=[PH](O)C1CCCC(Cl)C1 Amb27760848 [0,0,0,0,0,1|3,0,0]=4 2313 B7R0.3 C#CCCC(O)CN Amb24483292 [1,0,1,0,0,0|1,0,1]=4 2314 B7R0.3 C=CC(C)CCCO Amb22641468 [1,0,1,0,0,0|2,0,0]=4 2315 B7R0.3 C=CC(C)NCCO Amb27175505 [1,0,1,0,0,0|1,0,0]=3 2316 B7R0.3 C=CCCC(C)CN Amb25189032 [1,0,1,0,0,0|2,0,0]=4 2317 B7R0.3 C=CCCC(C)CN Amb33611653 [1,0,1,0,0,0|2,0,0]=4 2318 B7R0.3 C=CCCC(N)CN Amb20667712 [1,0,1,0,0,0|2,0,0]=4 2319 B7R0.3 C=CCCC(N)CN Amb27267278 [1,0,1,0,0,0|2,0,0]=4 2320 B7R0.3 C=CCCC(O)CC Amb22052608 [1,0,1,0,0,0|2,0,0]=4 2321 B7R0.3 C=CCCC(O)CN Amb8630191 [1,0,1,0,0,0|1,0,0]=3 2322 B7R0.3 C=CCCC(O)CO Amb10071251 [1,0,1,0,0,0|2,0,0]=4 2323 B7R0.3 C=CCC[C@@H](O)CO Amb27405919 [1,0,1,0,0,0|2,0,0]=4 2324 B7R0.3 C=CCC[C@H](O)CC Amb27946057 [1,0,1,0,0,0|2,0,0]=4 2325 B7R0.3 CC(C#N)NCCO Amb17044845 [1,0,1,0,0,0|1,0,1]=4 2326 B7R0.3 CC(C=O)CCCBr Amb26526795 [1,0,1,0,0,0|2,0,0]=4 2327 B7R0.3 CC(C=O)SCCO Amb27827864 [1,0,1,0,0,0|1,0,0]=3 2328 B7R0.3 CC(CN)CCC=N Amb27640087 [1,0,1,0,0,0|2,0,0]=4 2329 B7R0.3 CC(CN)CCCO Amb17569906 [1,0,1,0,0,0|1,0,1]=4 2330 B7R0.3 CC(CN)CCCO Amb28934846 [1,0,1,0,0,0|1,0,1]=4 2331 B7R0.3 CC(CN)NCCO Amb24738477 [1,0,1,0,0,0|1,0,1]=4 2332 B7R0.3 CC(CO)CCCO Amb25098490 [1,0,1,0,0,0|1,0,1]=4 2333 B7R0.3 CC(CO)NCCN Amb27805491 [1,0,1,0,0,0|1,0,1]=4 2334 B7R0.3 CC(CO)NCCO Amb9360025 [1,0,1,0,0,0|0,0,1]=3 2335 B7R0.3 CC(CO)OCCO Amb27594177 [1,0,1,0,0,0|1,0,1]=4 2336 B7R0.3 CC(CO)SCCO Amb27440688 [1,0,1,0,0,0|1,0,1]=4 2337 B7R0.3 CCC(C)NCCO Amb6707239 [1,0,1,0,0,0|1,0,1]=4 2338 B7R0.3 CCC(Cl)CCC=O Amb27637733 [1,0,1,0,0,0|2,0,0]=4 2339 B7R0.3 CCC(N)CCC=O Amb33036216 [1,0,1,0,0,0|2,0,0]=4 2340 B7R0.3 CCC(O)CCCO Amb17593216 [1,0,1,0,0,0|1,0,1]=4 2341 B7R0.3 CCCCC(C)C=O Amb17593191 [1,0,1,0,0,0|2,0,0]=4 2342 B7R0.3 CCCCC(O)CN Amb8630130 [1,0,1,0,0,0|1,0,1]=4 2343 B7R0.3 CCCC[C@@H](O)CN Amb33428417 [1,0,1,0,0,0|1,0,1]=4 2344 B7R0.3 CCCC[C@H](C)C=O Amb26587628 [1,0,1,0,0,0|2,0,0]=4 2345 B7R0.3 CCCC[C@H](O)CN Amb33428416 [1,0,1,0,0,0|1,0,1]=4 2346 B7R0.3 CCCNC(C)CO Amb9359690 [1,0,1,0,0,0|1,0,1]=4 2347 B7R0.3 CCCSC(C)C=O Amb18124367 [1,0,1,0,0,0|2,0,0]=4 2348 B7R0.3 CC[C@@H](C)CCC=O Amb27949584 [1,0,1,0,0,0|2,0,0]=4 2349 B7R0.3 CN(C=O)CCCO Amb17593211 [1,0,1,0,0,0|2,0,0]=4 2350 B7R0.3 CNCCC(O)CN Amb27881647 [1,0,1,0,0,0|2,0,0]=4 2351 B7R0.3 COCCC(O)CN Amb27966623 [1,0,1,0,0,0|2,0,0]=4 2352 B7R0.3 COCC[C@@H](O)CN Amb33377809 [1,0,1,0,0,0|2,0,0]=4 2353 B7R0.3 COCC[C@H](O)CN Amb33377791 [1,0,1,0,0,0|2,0,0]=4 2354 B7R0.3 CSCCC(O)CN Amb25785761 [1,0,1,0,0,0|2,0,0]=4 2355 B7R0.3 CSCC[C@@H](O)CN Amb26515632 [1,0,1,0,0,0|2,0,0]=4 2356 B7R0.3 CSCC[C@H](O)CN Amb33198735 [1,0,1,0,0,0|2,0,0]=4 2357 B7R0.3 C[C@@H](CN)CCCO Amb27947738 [1,0,1,0,0,0|1,0,1]=4 2358 B7R0.3 C[C@@H](CO)CCCO Amb27664197 [1,0,1,0,0,0|1,0,1]=4 2359 B7R0.3 C[C@@H](CO)NCCO Amb27881216 [1,0,1,0,0,0|0,0,1]=3 2360 B7R0.3 C[C@@H](CO)OCCO Amb28461084 [1,0,1,0,0,0|1,0,1]=4 2361 B7R0.3 C[C@H](CN)NCCO Amb28049033 [1,0,1,0,0,0|1,0,1]=4 2362 B7R0.3 C[C@H](CO)NCCO Amb27173258 [1,0,1,0,0,0|0,0,1]=3 2363 B7R0.3 C\C(C=O)=C/CCO Amb28255738 [1,0,1,0,0,0|1,0,1]=4 2364 B7R0.3 NCC(O)CCC=O Amb27855481 [1,0,1,0,0,0|0,0,0]=2 2365 B7R0.3 NCC(O)CCCF Amb33196094 [1,0,1,0,0,0|1,0,1]=4 2366 B7R0.3 NCC(O)OCCO Amb28341718 [1,0,1,0,0,0|1,0,1]=4 2367 B7R0.3 NC[C@H](O)CCCO Amb27632965 [1,0,1,0,0,0|0,0,1]=3 2368 B7R0.3 O=CC(Cl)CCCO Amb27831369 [1,0,1,0,0,0|2,0,0]=4 2369 B7R0.3 O=C[C@H](O)CCCO Amb27164637 [1,0,1,0,0,0|2,0,0]=4 2370 B7R0.3 OCCCC(O)CO Amb17593225 [1,0,1,0,0,0|1,0,1]=4 2371 B7R0.3 OCCC[C@@H](O)CO Amb27213939 [1,0,1,0,0,0|1,0,1]=4 2372 B7R0.4 C#CCCCC(=O)O Amb2721705 [1,0,1,0,0,0|1,0,1]=4 2373 B7R0.4 C#CCNCC(=O)O Amb33551387 [1,0,1,0,0,0|0,0,2]=4 2374 B7R0.4 C#CCNCC(=O)O Amb6740302 [1,0,1,0,0,0|0,0,2]=4 2375 B7R0.4 C#CCNCC(C)O Amb17308672 [1,0,1,0,0,0|1,0,1]=4 2376 B7R0.4 C#CCNC[C@H](C)O Amb28344602 [1,0,1,0,0,0|1,0,1]=4 2377 B7R0.4 C=C(C)CNCCC Amb17308631 [1,0,1,0,0,0|2,0,0]=4 2378 B7R0.4 C=C(Cl)CNCCC Amb19004838 [1,0,1,0,0,0|2,0,0]=4 2379 B7R0.4 C=CCCCC(=O)O Amb3941675 [1,0,1,0,0,0|1,0,1]=4 2380 B7R0.4 C=CCCCC(C)O Amb22059432 [1,0,1,0,0,0|2,0,0]=4 2381 B7R0.4 C=CCNCC(=O)O Amb7766404 [1,0,1,0,0,0|0,0,2]=4 2382 B7R0.4 C=CCNCC(=O)O Amb8631497 [1,0,1,0,0,0|0,0,2]=4 2383 B7R0.4 C=CCNCC(C)C Amb6683812 [1,0,1,0,0,0|2,0,0]=4 2384 B7R0.4 C=CCNCC(C)Cl Amb27658629 [1,0,1,0,0,0|2,0,0]=4 2385 B7R0.4 C=CCNCC(C)O Amb17138365 [1,0,1,0,0,0|1,0,0]=3 2386 B7R0.4 C=CCNC[C@H](C)O Amb27950182 [1,0,1,0,0,0|1,0,0]=3 2387 B7R0.4 C=CCOCC(C)O Amb22733640 [1,0,1,0,0,0|2,0,0]=4 2388 B7R0.4 C=CCOC[C@@H](C)O Amb27780603 [1,0,1,0,0,0|2,0,0]=4 2389 B7R0.4 C=CCSCC(C)O Amb28065376 [1,0,1,0,0,0|2,0,0]=4 2390 B7R0.4 C=CCSC[C@H](C)O Amb27220310 [1,0,1,0,0,0|2,0,0]=4 2391 B7R0.4 CC(=O)CCCCBr Amb16234126 [1,0,1,0,0,0|2,0,0]=4 2392 B7R0.4 CC(=O)CCCCCl Amb3941549 [1,0,1,0,0,0|2,0,0]=4 2393 B7R0.4 CC(=O)CCCCF Amb27490855 [1,0,1,0,0,0|2,0,0]=4 2394 B7R0.4 CC(=O)CCCCN Amb27401218 [1,0,1,0,0,0|1,0,0]=3 2395 B7R0.4 CC(=O)CCCCO Amb10603864 [1,0,1,0,0,0|2,0,0]=4 2396 B7R0.4 CC(=O)CNOCO Amb27244723 [1,0,1,0,0,0|2,0,0]=4 2397 B7R0.4 CC(=O)COCCO Amb28122841 [1,0,1,0,0,0|2,0,0]=4 2398 B7R0.4 CC(=O)CSCCN Amb17500454 [1,0,1,0,0,0|2,0,0]=4 2399 B7R0.4 CC(=O)CSCCO Amb4165952 [1,0,1,0,0,0|2,0,0]=4 2400 B7R0.4 CC(=O)NCCCN Amb10610286 [1,0,1,0,0,0|2,0,0]=4 2401 B7R0.4 CC(=O)NCCCN Amb6664982 [1,0,1,0,0,0|2,0,0]=4 2402 B7R0.4 CC(C)CCCC=O Amb17940235 [1,0,1,0,0,0|2,0,0]=4 2403 B7R0.4 CC(C)CNCCO Amb22587152 [1,0,1,0,0,0|1,0,1]=4 2404 B7R0.4 CC(C)CNCCO Amb6707299 [1,0,1,0,0,0|1,0,1]=4 2405 B7R0.4 CC(Cl)CCCC=O Amb27983674 [1,0,1,0,0,0|2,0,0]=4 2406 B7R0.4 CC(O)CCCC=O Amb18641887 [1,0,1,0,0,0|1,0,0]=3 2407 B7R0.4 CC(O)CCCCN Amb17569903 [1,0,1,0,0,0|1,0,1]=4 2408 B7R0.4 CC(O)CCCCO Amb22227757 [1,0,1,0,0,0|1,0,1]=4 2409 B7R0.4 CC(O)CNCCN Amb4034606 [1,0,1,0,0,0|1,0,1]=4 2410 B7R0.4 CC(O)CNCCO Amb4020001 [1,0,1,0,0,0|0,0,1]=3 2411 B7R0.4 CC(O)CNCCS Amb27838396 [1,0,1,0,0,0|0,1,1]=4 2412 B7R0.4 CC(O)CSCCO Amb22055428 [1,0,1,0,0,0|1,0,1]=4 2413 B7R0.4 CCC#CCC(=O)O Amb26515701 [1,0,1,0,0,0|1,0,1]=4 2414 B7R0.4 CCCC#CC(=O)O Amb2721706 [1,0,1,0,0,0|1,0,1]=4 2415 B7R0.4 CCCCCC(=O)F Amb26061517 [1,0,1,0,0,0|2,0,0]=4 2416 B7R0.4 CCCCCC(=O)O Amb3939846 [1,0,1,0,0,0|1,0,0]=3 2417 B7R0.4 CCCCCC(=O)[O-] Amb22337624 [1,0,1,0,0,0|1,0,1]=4 2418 B7R0.4 CCCCCC(C)=O Amb6608885 [1,0,1,0,0,0|2,0,0]=4 2419 B7R0.4 CCCNCC(=O)O Amb10609640 [1,0,1,0,0,0|0,0,0]=2 2420 B7R0.4 CCCNCC(=O)O Amb1110628 [1,0,1,0,0,0|0,0,0]=2 2421 B7R0.4 CCCNCC(C)=O Amb26954588 [1,0,1,0,0,0|1,0,0]=3 2422 B7R0.4 CCCNCC(C)O Amb9359420 [1,0,1,0,0,0|1,0,1]=4 2423 B7R0.4 CCCNCC(N)=O Amb1124632 [1,0,1,0,0,0|1,0,0]=3 2424 B7R0.4 CCCNCC(N)=O Amb28934788 [1,0,1,0,0,0|1,0,0]=3 2425 B7R0.4 CCCNNC(N)=O Amb27405031 [1,0,1,0,0,0|2,0,0]=4 2426 B7R0.4 CCCOCC(=O)Cl Amb27260778 [1,0,1,0,0,0|2,0,0]=4 2427 B7R0.4 CCCOCC(=O)O Amb8874504 [1,0,1,0,0,0|1,0,0]=3 2428 B7R0.4 CCCOCC(N)=O Amb27844884 [1,0,1,0,0,0|2,0,0]=4 2429 B7R0.4 CCCSCC(=O)O Amb1137113 [1,0,1,0,0,0|1,0,0]=3 2430 B7R0.4 CCCSCC(C)=O Amb9668676 [1,0,1,0,0,0|2,0,0]=4 2431 B7R0.4 CCCSCC(N)=O Amb27424658 [1,0,1,0,0,0|2,0,0]=4 2432 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [1,0,1,0,0,0|1,0,1]=4 2433 B7R0.4 CCNCCC(=O)O Amb28934794 [1,0,1,0,0,0|2,0,0]=4 2434 B7R0.4 CCNCCC(=O)O Amb7766402 [1,0,1,0,0,0|2,0,0]=4 2435 B7R0.4 CCNNCC(=O)O Amb28326075 [1,0,1,0,0,0|1,0,0]=3 2436 B7R0.4 CCOCCC(=O)O Amb3939859 [1,0,1,0,0,0|2,0,0]=4 2437 B7R0.4 CCSCCC(=O)O Amb6273140 [1,0,1,0,0,0|2,0,0]=4 2438 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [1,0,1,0,0,0|1,0,1]=4 2439 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [1,0,1,0,0,0|1,0,1]=4 2440 B7R0.4 CNCCCC(=O)O Amb1153115 [1,0,1,0,0,0|2,0,0]=4 2441 B7R0.4 CNCCCC(=O)O Amb4521435 [1,0,1,0,0,0|2,0,0]=4 2442 B7R0.4 COCCCC(=O)O Amb6275629 [1,0,1,0,0,0|2,0,0]=4 2443 B7R0.4 COCOCC(=O)O Amb28059312 [1,0,1,0,0,0|2,0,0]=4 2444 B7R0.4 COCSCC(=O)O Amb27466837 [1,0,1,0,0,0|2,0,0]=4 2445 B7R0.4 CS(=O)CCCCN Amb17617794 [1,0,1,0,0,0|2,0,0]=4 2446 B7R0.4 CSCCCC(=O)O Amb17503622 [1,0,1,0,0,0|2,0,0]=4 2447 B7R0.4 CSCSCC(=O)O Amb27858824 [1,0,1,0,0,0|2,0,0]=4 2448 B7R0.4 C[C@@H](O)CCCCN Amb27789987 [1,0,1,0,0,0|1,0,1]=4 2449 B7R0.4 C[C@@H](O)CNCCF Amb27486911 [1,0,1,0,0,0|1,0,1]=4 2450 B7R0.4 C[C@H](O)CCCCO Amb28381637 [1,0,1,0,0,0|1,0,1]=4 2451 B7R0.4 N#CCCCC(=O)O Amb33542831 [1,0,1,0,0,0|0,0,2]=4 2452 B7R0.4 N=C(N)CCCCN Amb25714813 [1,0,1,0,0,0|2,0,0]=4 2453 B7R0.4 N=C(N)CCCCN Amb33299438 [1,0,1,0,0,0|2,0,0]=4 2454 B7R0.4 NC(=O)CCCCBr Amb27875083 [1,0,1,0,0,0|2,0,0]=4 2455 B7R0.4 NC(=O)CCCCCl Amb7782532 [1,0,1,0,0,0|2,0,0]=4 2456 B7R0.4 NC(=O)CCCCO Amb3939470 [1,0,1,0,0,0|2,0,0]=4 2457 B7R0.4 NC(=O)CCCCS Amb27839239 [1,0,1,0,0,0|2,0,0]=4 2458 B7R0.4 NC(=O)CNCCO Amb6714605 [1,0,1,0,0,0|1,0,0]=3 2459 B7R0.4 NC(=O)CSCCO Amb6754148 [1,0,1,0,0,0|2,0,0]=4 2460 B7R0.4 NCC#CCC(=O)O Amb27976019 [1,0,1,0,0,0|0,0,2]=4 2461 B7R0.4 NCCC#CC(=O)O Amb32656225 [1,0,1,0,0,0|0,0,2]=4 2462 B7R0.4 NCCCCB(O)O Amb27436221 [1,0,1,0,0,0|1,0,1]=4 2463 B7R0.4 NCCCCC(=O)Cl Amb26599615 [1,0,1,0,0,0|1,0,0]=3 2464 B7R0.4 NCCCCC(=O)O Amb2780021 [1,0,1,0,0,0|0,0,0]=2 2465 B7R0.4 NCCCCC(=O)O Amb3941646 [1,0,1,0,0,0|0,0,0]=2 2466 B7R0.4 NCCCCC(=O)O Amb9825855 [1,0,1,0,0,0|0,0,0]=2 2467 B7R0.4 NCCCCC(N)=O Amb18641897 [1,0,1,0,0,0|1,0,0]=3 2468 B7R0.4 NCCCCC(N)=O Amb33552086 [1,0,1,0,0,0|1,0,0]=3 2469 B7R0.4 NCCCCS(=O)O Amb27882127 [1,0,1,0,0,0|1,0,0]=3 2470 B7R0.4 NCCCNC(=O)O Amb24093884 [1,0,1,0,0,0|1,0,0]=3 2471 B7R0.4 NCCCNC(=O)S Amb27839485 [1,0,1,0,0,0|1,1,0]=4 2472 B7R0.4 NCCCNC(N)=O Amb18296186 [1,0,1,0,0,0|2,0,0]=4 2473 B7R0.4 NCCCNC(N)=O Amb20622408 [1,0,1,0,0,0|2,0,0]=4 2474 B7R0.4 NCCCOC(N)=O Amb26334419 [1,0,1,0,0,0|2,0,0]=4 2475 B7R0.4 NCCCOC(N)=O Amb33299259 [1,0,1,0,0,0|2,0,0]=4 2476 B7R0.4 NCCCOS(=O)O Amb26007874 [1,0,1,0,0,0|2,0,0]=4 2477 B7R0.4 NCCNCC(=O)O Amb17608063 [1,0,1,0,0,0|1,0,0]=3 2478 B7R0.4 NCCNCC(=O)O Amb33339058 [1,0,1,0,0,0|1,0,0]=3 2479 B7R0.4 NCCNCC(N)=O Amb28388338 [1,0,1,0,0,0|2,0,0]=4 2480 B7R0.4 NCCOCC(=O)O Amb18630146 [1,0,1,0,0,0|1,0,0]=3 2481 B7R0.4 NCCOCC(=O)O Amb33550947 [1,0,1,0,0,0|1,0,0]=3 2482 B7R0.4 NCCOCC(N)=O Amb18523830 [1,0,1,0,0,0|2,0,0]=4 2483 B7R0.4 NCCOCC(N)=O Amb33549549 [1,0,1,0,0,0|2,0,0]=4 2484 B7R0.4 NCCSCC(=O)O Amb17500446 [1,0,1,0,0,0|1,0,0]=3 2485 B7R0.4 NCCSCC(=O)O Amb20622325 [1,0,1,0,0,0|1,0,0]=3 2486 B7R0.4 NCCSCC(N)=O Amb6266329 [1,0,1,0,0,0|2,0,0]=4 2487 B7R0.4 NCC\C=C/C(=O)O Amb27201417 [1,0,1,0,0,0|0,0,2]=4 2488 B7R0.4 NOCCCC(=O)O Amb10975956 [1,0,1,0,0,0|1,0,0]=3 2489 B7R0.4 NOCCCC(=O)O Amb22011795 [1,0,1,0,0,0|1,0,0]=3 2490 B7R0.4 NOCCCC(=O)O Amb31283653 [1,0,1,0,0,0|1,0,0]=3 2491 B7R0.4 O=C(Cl)CCCCBr Amb2685557 [1,0,1,0,0,0|2,0,0]=4 2492 B7R0.4 O=C(Cl)CCCCCl Amb6296596 [1,0,1,0,0,0|2,0,0]=4 2493 B7R0.4 O=C(O)C#CCCO Amb25844914 [1,0,1,0,0,0|1,0,1]=4 2494 B7R0.4 O=C(O)CCCCBr Amb6608763 [1,0,1,0,0,0|1,0,0]=3 2495 B7R0.4 O=C(O)CCCCCl Amb3940369 [1,0,1,0,0,0|1,0,0]=3 2496 B7R0.4 O=C(O)CCCCF Amb26639920 [1,0,1,0,0,0|1,0,0]=3 2497 B7R0.4 O=C(O)CCCCO Amb9214971 [1,0,1,0,0,0|1,0,0]=3 2498 B7R0.4 O=C(O)CCCCS Amb17503767 [1,0,1,0,0,0|1,0,0]=3 2499 B7R0.4 O=C(O)CCCNCl Amb27173950 [1,0,1,0,0,0|2,0,0]=4 2500 B7R0.4 O=C(O)CNCCF Amb28076282 [1,0,1,0,0,0|1,0,0]=3 2501 B7R0.4 O=C(O)CNCCO Amb9325653 [1,0,1,0,0,0|0,0,0]=2 2502 B7R0.4 O=C(O)COCCCl Amb21857870 [1,0,1,0,0,0|2,0,0]=4 2503 B7R0.4 O=C(O)COCCF Amb27866609 [1,0,1,0,0,0|2,0,0]=4 2504 B7R0.4 O=C(O)COCCO Amb6680914 [1,0,1,0,0,0|1,0,0]=3 2505 B7R0.4 O=C(O)CSCCCl Amb18644703 [1,0,1,0,0,0|2,0,0]=4 2506 B7R0.4 O=C(O)C\C=C\CO Amb28429811 [1,0,1,0,0,0|1,0,1]=4 2507 B7R0.4 O=C([O-])CCCCF Amb33527827 [1,0,1,0,0,0|1,0,1]=4 2508 B7R0.4 O=C([O-])CCCCO Amb13952763 [1,0,1,0,0,0|1,0,1]=4 2509 B7R0.4 O=C([O-])CCCCO Amb22749314 [1,0,1,0,0,0|1,0,1]=4 2510 B7R0.4 O=C([O-])COCCO Amb33553026 [1,0,1,0,0,0|1,0,1]=4 2511 B7R0.4 O=CCCCC(=O)O Amb17593198 [1,0,1,0,0,0|1,0,1]=4 2512 B7R0.4 O=CCCCC(O)O Amb25889261 [1,0,1,0,0,0|2,0,0]=4 2513 B7R0.5 C#CCC(C)C(=O)O Amb18633959 [1,0,1,0,0,0|1,0,1]=4 2514 B7R0.5 C#CCC(N)C(=O)O Amb19944472 [1,0,1,0,0,0|0,0,2]=4 2515 B7R0.5 C#CCC(N)C(=O)O Amb9721758 [1,0,1,0,0,0|0,0,2]=4 2516 B7R0.5 C#CC[C@@H](N)C(=O)O Amb16183954 [1,0,1,0,0,0|0,0,2]=4 2517 B7R0.5 C#CC[C@@H](N)C(=O)O Amb22748688 [1,0,1,0,0,0|0,0,2]=4 2518 B7R0.5 C#CC[C@H](C)C(=O)O Amb10844036 [1,0,1,0,0,0|1,0,1]=4 2519 B7R0.5 C#CC[C@H](N)C(=O)O Amb8396606 [1,0,1,0,0,0|0,0,2]=4 2520 B7R0.5 C=C(C)C(C)CCO Amb27766618 [1,0,1,0,0,0|2,0,0]=4 2521 B7R0.5 C=C(C)C(N)CCO Amb27391185 [1,0,1,0,0,0|2,0,0]=4 2522 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [1,0,1,0,0,0|1,0,1]=4 2523 B7R0.5 C=C(CCO)C(=O)O Amb27173904 [1,0,1,0,0,0|0,0,2]=4 2524 B7R0.5 C=CCC(C)C(=O)O Amb33545044 [1,0,1,0,0,0|1,0,1]=4 2525 B7R0.5 C=CCC(N)C(=O)O Amb21856826 [1,0,1,0,0,0|0,0,2]=4 2526 B7R0.5 C=CCC(N)C(=O)O Amb9729145 [1,0,1,0,0,0|0,0,2]=4 2527 B7R0.5 C=CC[C@@H](N)C(=O)O Amb22745310 [1,0,1,0,0,0|0,0,2]=4 2528 B7R0.5 C=CC[C@@H](N)C(=O)O Amb8389451 [1,0,1,0,0,0|0,0,2]=4 2529 B7R0.5 C=CC[C@H](N)C(=O)O Amb10982568 [1,0,1,0,0,0|0,0,2]=4 2530 B7R0.5 C=CC[C@H](N)C(=O)O Amb2699115 [1,0,1,0,0,0|0,0,2]=4 2531 B7R0.5 CC#CC(C)C(=O)O Amb22748425 [1,0,1,0,0,0|1,0,1]=4 2532 B7R0.5 CC(=O)C(Br)CCO Amb27858653 [1,0,1,0,0,0|2,0,0]=4 2533 B7R0.5 CC(=O)C(C)CCBr Amb26849777 [1,0,1,0,0,0|2,0,0]=4 2534 B7R0.5 CC(=O)C(C)CCCl Amb26326637 [1,0,1,0,0,0|2,0,0]=4 2535 B7R0.5 CC(=O)C(C)CCO Amb13881368 [1,0,1,0,0,0|1,0,0]=3 2536 B7R0.5 CC(=O)C(Cl)CCO Amb4017890 [1,0,1,0,0,0|2,0,0]=4 2537 B7R0.5 CC(=O)C(N)CCO Amb25087112 [1,0,1,0,0,0|1,0,0]=3 2538 B7R0.5 CC(=O)C(S)CCO Amb25831127 [1,0,1,0,0,0|2,0,0]=4 2539 B7R0.5 CC(=O)N(C)CCO Amb5797447 [1,0,1,0,0,0|2,0,0]=4 2540 B7R0.5 CC(=O)[C@@H](N)CCO Amb28410323 [1,0,1,0,0,0|1,0,0]=3 2541 B7R0.5 CC(CC#N)C(=O)O Amb17334056 [1,0,1,0,0,0|1,0,1]=4 2542 B7R0.5 CC(CC=O)C(=O)O Amb27952476 [1,0,1,0,0,0|0,0,2]=4 2543 B7R0.5 CC(CCBr)C(=O)Br Amb27948455 [1,0,1,0,0,0|2,0,0]=4 2544 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [1,0,1,0,0,0|1,0,0]=3 2545 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [1,0,1,0,0,0|2,0,0]=4 2546 B7R0.5 CC(CCF)C(=O)O Amb24678386 [1,0,1,0,0,0|1,0,0]=3 2547 B7R0.5 CC(CCN)C(=O)O Amb20667970 [1,0,1,0,0,0|1,0,0]=3 2548 B7R0.5 CC(CCN)C(=O)O Amb538221 [1,0,1,0,0,0|1,0,0]=3 2549 B7R0.5 CC(CCO)C(=O)O Amb18641949 [1,0,1,0,0,0|0,0,0]=2 2550 B7R0.5 CC(CCO)C(=O)[O-] Amb33330478 [1,0,1,0,0,0|0,0,1]=3 2551 B7R0.5 CC(CCO)C(N)=O Amb28280962 [1,0,1,0,0,0|1,0,0]=3 2552 B7R0.5 CC(CCO)S(=O)[O-] Amb28315550 [1,0,1,0,0,0|1,0,1]=4 2553 B7R0.5 CC(CNO)C(=O)O Amb28315956 [1,0,1,0,0,0|1,0,0]=3 2554 B7R0.5 CC(CSS)C(=O)O Amb27437183 [1,0,1,0,0,0|1,1,0]=4 2555 B7R0.5 CC(NC=O)C(=O)O Amb1144629 [1,0,1,0,0,0|0,0,2]=4 2556 B7R0.5 CC(NCO)C(=O)O Amb27468253 [1,0,1,0,0,0|0,0,0]=2 2557 B7R0.5 CC(\N=N\O)C(=O)O Amb28251041 [1,0,1,0,0,0|1,0,1]=4 2558 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [1,0,1,0,0,0|1,0,1]=4 2559 B7R0.5 CCCC(Br)C(=O)Cl Amb17569837 [1,0,1,0,0,0|2,0,0]=4 2560 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [1,0,1,0,0,0|1,0,0]=3 2561 B7R0.5 CCCC(Br)C(C)=O Amb26870127 [1,0,1,0,0,0|2,0,0]=4 2562 B7R0.5 CCCC(C)C(=O)Cl Amb2689582 [1,0,1,0,0,0|2,0,0]=4 2563 B7R0.5 CCCC(C)C(=O)O Amb3938958 [1,0,1,0,0,0|1,0,0]=3 2564 B7R0.5 CCCC(C)C(C)=O Amb4034597 [1,0,1,0,0,0|2,0,0]=4 2565 B7R0.5 CCCC(C)C(N)=O Amb3886535 [1,0,1,0,0,0|2,0,0]=4 2566 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [1,0,1,0,0,0|1,0,0]=3 2567 B7R0.5 CCCC(F)C(=O)O Amb25842008 [1,0,1,0,0,0|1,0,0]=3 2568 B7R0.5 CCCC(F)C(C)=O Amb28316211 [1,0,1,0,0,0|2,0,0]=4 2569 B7R0.5 CCCC(F)C(N)=O Amb28127390 [1,0,1,0,0,0|2,0,0]=4 2570 B7R0.5 CCCC(N)C(=N)N Amb27222841 [1,0,1,0,0,0|2,0,0]=4 2571 B7R0.5 CCCC(N)C(=O)O Amb6262055 [1,0,1,0,0,0|0,0,0]=2 2572 B7R0.5 CCCC(N)C(C)=O Amb27838289 [1,0,1,0,0,0|1,0,0]=3 2573 B7R0.5 CCCC(N)C(N)=O Amb22284825 [1,0,1,0,0,0|1,0,0]=3 2574 B7R0.5 CCCC(N)C(N)=O Amb9514970 [1,0,1,0,0,0|1,0,0]=3 2575 B7R0.5 CCCC(N)C(N)=S Amb28121515 [1,0,1,0,0,0|1,1,0]=4 2576 B7R0.5 CCCC(O)C(=O)O Amb2818222 [1,0,1,0,0,0|1,0,0]=3 2577 B7R0.5 CCCC(O)C(C)=O Amb22495823 [1,0,1,0,0,0|2,0,0]=4 2578 B7R0.5 CCCC(O)C(N)=O Amb24116553 [1,0,1,0,0,0|2,0,0]=4 2579 B7R0.5 CCCC(S)C(=O)O Amb18124440 [1,0,1,0,0,0|1,0,0]=3 2580 B7R0.5 CCCN(N)C(C)=O Amb18641903 [1,0,1,0,0,0|2,0,0]=4 2581 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [1,0,1,0,0,0|1,0,0]=3 2582 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [1,0,1,0,0,0|1,0,0]=3 2583 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [1,0,1,0,0,0|0,0,0]=2 2584 B7R0.5 CCC[C@@H](N)C(C)=O Amb35659946 [1,0,1,0,0,0|1,0,0]=3 2585 B7R0.5 CCC[C@@H](N)C(C)O Amb29849610 [1,0,1,0,0,0|1,0,1]=4 2586 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [1,0,1,0,0,0|1,0,0]=3 2587 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [1,0,1,0,0,0|1,0,0]=3 2588 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [1,0,1,0,0,0|1,0,0]=3 2589 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [1,0,1,0,0,0|1,0,0]=3 2590 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [1,0,1,0,0,0|1,0,0]=3 2591 B7R0.5 CCC[C@H](C)C(C)=O Amb27463637 [1,0,1,0,0,0|2,0,0]=4 2592 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [1,0,1,0,0,0|1,0,0]=3 2593 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [1,0,1,0,0,0|0,0,0]=2 2594 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [1,0,1,0,0,0|0,0,0]=2 2595 B7R0.5 CCC[C@H](N)C(C)=O Amb35662324 [1,0,1,0,0,0|1,0,0]=3 2596 B7R0.5 CCC[C@H](N)C(C)O Amb35664016 [1,0,1,0,0,0|1,0,1]=4 2597 B7R0.5 CCC[C@H](N)C(N)=O Amb26916392 [1,0,1,0,0,0|1,0,0]=3 2598 B7R0.5 CCC[C@H](N)C(N)=O Amb33813498 [1,0,1,0,0,0|1,0,0]=3 2599 B7R0.5 CCC[C@H](N)[C@H](C)O Amb27883481 [1,0,1,0,0,0|1,0,1]=4 2600 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [1,0,1,0,0,0|1,0,0]=3 2601 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [1,0,1,0,0,0|2,0,0]=4 2602 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [1,0,1,0,0,0|1,0,0]=3 2603 B7R0.5 CCNC(=O)C(=O)O Amb9303800 [1,0,1,0,0,0|1,0,1]=4 2604 B7R0.5 CCNC(C)C(=O)O Amb33527634 [1,0,1,0,0,0|0,0,0]=2 2605 B7R0.5 CCNC(C)C(=O)O Amb9326962 [1,0,1,0,0,0|0,0,0]=2 2606 B7R0.5 CCNC(C)C(N)=O Amb21959648 [1,0,1,0,0,0|1,0,0]=3 2607 B7R0.5 CCNC(C)C(N)=O Amb7758139 [1,0,1,0,0,0|1,0,0]=3 2608 B7R0.5 CCNC(O)C(=O)O Amb27259098 [1,0,1,0,0,0|1,0,0]=3 2609 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [1,0,1,0,0,0|0,0,0]=2 2610 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [1,0,1,0,0,0|0,0,0]=2 2611 B7R0.5 CCOC(C)C(=O)O Amb9725271 [1,0,1,0,0,0|1,0,0]=3 2612 B7R0.5 CCOC(C)C(C)=O Amb9666103 [1,0,1,0,0,0|2,0,0]=4 2613 B7R0.5 CCOC(C)C(N)=O Amb19960053 [1,0,1,0,0,0|2,0,0]=4 2614 B7R0.5 CCOC(F)C(=O)O Amb27210743 [1,0,1,0,0,0|2,0,0]=4 2615 B7R0.5 CCSC(C)C(=O)O Amb9721554 [1,0,1,0,0,0|1,0,0]=3 2616 B7R0.5 CCSC(C)C(N)=O Amb27830179 [1,0,1,0,0,0|2,0,0]=4 2617 B7R0.5 CC\C=C(/C)C(=O)O Amb2689584 [1,0,1,0,0,0|1,0,1]=4 2618 B7R0.5 CC\C=C(\C)C(=O)O Amb27233430 [1,0,1,0,0,0|1,0,1]=4 2619 B7R0.5 CNCC(C)C(=O)O Amb13952364 [1,0,1,0,0,0|2,0,0]=4 2620 B7R0.5 CNCC(C)C(=O)O Amb9400281 [1,0,1,0,0,0|2,0,0]=4 2621 B7R0.5 CNCC(N)C(=O)O Amb10845350 [1,0,1,0,0,0|1,0,0]=3 2622 B7R0.5 CNCC(O)C(=O)O Amb26894610 [1,0,1,0,0,0|2,0,0]=4 2623 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [1,0,1,0,0,0|1,0,0]=3 2624 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [1,0,1,0,0,0|1,0,0]=3 2625 B7R0.5 COCC(Br)C(=O)O Amb17594709 [1,0,1,0,0,0|2,0,0]=4 2626 B7R0.5 COCC(C)C(=O)O Amb33545090 [1,0,1,0,0,0|2,0,0]=4 2627 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [1,0,1,0,0,0|2,0,0]=4 2628 B7R0.5 COCC(N)C(=O)O Amb33551350 [1,0,1,0,0,0|1,0,0]=3 2629 B7R0.5 COCC(N)C(=O)O Amb6752055 [1,0,1,0,0,0|1,0,0]=3 2630 B7R0.5 COCC(N)C(C)=O Amb27468401 [1,0,1,0,0,0|2,0,0]=4 2631 B7R0.5 COCC(N)C(N)=O Amb18984372 [1,0,1,0,0,0|2,0,0]=4 2632 B7R0.5 COCC(N)C(N)=O Amb32693410 [1,0,1,0,0,0|2,0,0]=4 2633 B7R0.5 COCC(O)C(=O)O Amb18124273 [1,0,1,0,0,0|2,0,0]=4 2634 B7R0.5 COCC(S)C(=O)O Amb27763656 [1,0,1,0,0,0|2,0,0]=4 2635 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [1,0,1,0,0,0|2,0,0]=4 2636 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [1,0,1,0,0,0|1,0,0]=3 2637 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [1,0,1,0,0,0|1,0,0]=3 2638 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [1,0,1,0,0,0|2,0,0]=4 2639 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [1,0,1,0,0,0|1,0,0]=3 2640 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [1,0,1,0,0,0|1,0,0]=3 2641 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [1,0,1,0,0,0|2,0,0]=4 2642 B7R0.5 CONC(C)C(N)=O Amb27657313 [1,0,1,0,0,0|2,0,0]=4 2643 B7R0.5 CON[C@@H](C)C(=O)O Amb27862116 [1,0,1,0,0,0|1,0,0]=3 2644 B7R0.5 CSCC(C)C(=O)O Amb18967825 [1,0,1,0,0,0|2,0,0]=4 2645 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [1,0,1,0,0,0|2,0,0]=4 2646 B7R0.5 CSCC(N)C(=O)O Amb33804791 [1,0,1,0,0,0|1,0,0]=3 2647 B7R0.5 CSCC(N)C(=O)O Amb6280829 [1,0,1,0,0,0|1,0,0]=3 2648 B7R0.5 CSCC(O)C(=O)O Amb25131873 [1,0,1,0,0,0|2,0,0]=4 2649 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [1,0,1,0,0,0|2,0,0]=4 2650 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [1,0,1,0,0,0|1,0,0]=3 2651 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [1,0,1,0,0,0|1,0,0]=3 2652 B7R0.5 CSC[C@H](N)C(N)=O Amb27607700 [1,0,1,0,0,0|2,0,0]=4 2653 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [1,0,1,0,0,0|1,0,0]=3 2654 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [1,0,1,0,0,0|1,0,0]=3 2655 B7R0.5 C[C@@H](NC#N)C(=O)O Amb35634494 [1,0,1,0,0,0|1,0,1]=4 2656 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [1,0,1,0,0,0|1,0,0]=3 2657 B7R0.5 C[C@H](NC#N)C(=O)O Amb30031667 [1,0,1,0,0,0|1,0,1]=4 2658 B7R0.5 C[C@H](NC=O)C(=O)O Amb28323701 [1,0,1,0,0,0|0,0,2]=4 2659 B7R0.5 C[C@H](NCO)C(=O)O Amb24401217 [1,0,1,0,0,0|0,0,0]=2 2660 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [1,0,1,0,0,0|1,0,0]=3 2661 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [1,0,1,0,0,0|1,0,0]=3 2662 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [1,0,1,0,0,0|0,0,2]=4 2663 B7R0.5 N#CCC(N)C(=O)O Amb18641766 [1,0,1,0,0,0|1,0,1]=4 2664 B7R0.5 N#CC[C@@H](N)C(=O)O Amb26397494 [1,0,1,0,0,0|1,0,1]=4 2665 B7R0.5 N#CC[C@H](N)C(=O)O Amb16183916 [1,0,1,0,0,0|1,0,1]=4 2666 B7R0.5 NC(=O)C(N)CCF Amb24391278 [1,0,1,0,0,0|2,0,0]=4 2667 B7R0.5 NC(=O)C(N)CCO Amb24481392 [1,0,1,0,0,0|1,0,0]=3 2668 B7R0.5 NC(=O)C(N)CNO Amb27396201 [1,0,1,0,0,0|2,0,0]=4 2669 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [1,0,1,0,0,0|1,0,0]=3 2670 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [1,0,1,0,0,0|1,0,0]=3 2671 B7R0.5 NC(CCF)C(=O)O Amb25889337 [1,0,1,0,0,0|1,0,0]=3 2672 B7R0.5 NC(CCF)C(=O)O Amb28934889 [1,0,1,0,0,0|1,0,0]=3 2673 B7R0.5 NC(CCO)C(=O)O Amb8514287 [1,0,1,0,0,0|0,0,0]=2 2674 B7R0.5 NC(CCS)C(=O)O Amb19267093 [1,0,1,0,0,0|0,1,0]=3 2675 B7R0.5 NC(CCS)C(=O)O Amb3499433 [1,0,1,0,0,0|0,1,0]=3 2676 B7R0.5 NC(CCS)[PH](=O)O Amb27409002 [1,0,1,0,0,0|1,1,0]=4 2677 B7R0.5 NC(CNO)C(=O)O Amb4092732 [1,0,1,0,0,0|1,0,0]=3 2678 B7R0.5 NC(CO[SiH3])C(=O)O Amb27461306 [1,0,1,0,0,0|1,1,0]=4 2679 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [1,0,1,0,0,0|2,0,0]=4 2680 B7R0.5 NCCC(F)C(=O)O Amb10838221 [1,0,1,0,0,0|2,0,0]=4 2681 B7R0.5 NCCC(F)C(=O)O Amb22229524 [1,0,1,0,0,0|2,0,0]=4 2682 B7R0.5 NCCC(N)C(=O)O Amb2697841 [1,0,1,0,0,0|1,0,0]=3 2683 B7R0.5 NCCC(N)C(=O)O Amb8514694 [1,0,1,0,0,0|1,0,0]=3 2684 B7R0.5 NCCC(O)C(=O)O Amb16232090 [1,0,1,0,0,0|2,0,0]=4 2685 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [1,0,1,0,0,0|2,0,0]=4 2686 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [1,0,1,0,0,0|1,0,0]=3 2687 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [1,0,1,0,0,0|1,0,0]=3 2688 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [1,0,1,0,0,0|1,0,0]=3 2689 B7R0.5 NCC[C@@H](N)C(N)=O Amb31031077 [1,0,1,0,0,0|2,0,0]=4 2690 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [1,0,1,0,0,0|2,0,0]=4 2691 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [1,0,1,0,0,0|2,0,0]=4 2692 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [1,0,1,0,0,0|1,0,0]=3 2693 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [1,0,1,0,0,0|1,0,0]=3 2694 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [1,0,1,0,0,0|1,0,0]=3 2695 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [1,0,1,0,0,0|1,0,0]=3 2696 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [1,0,1,0,0,0|2,0,0]=4 2697 B7R0.5 NOCC(N)C(=O)O Amb24184086 [1,0,1,0,0,0|2,0,0]=4 2698 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [1,0,1,0,0,0|1,0,0]=3 2699 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [1,0,1,0,0,0|1,0,0]=3 2700 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [1,0,1,0,0,0|0,0,0]=2 2701 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [1,0,1,0,0,0|0,0,0]=2 2702 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [1,0,1,0,0,0|0,1,0]=3 2703 B7R0.5 N[C@@H](OCS)C(=O)O Amb27591629 [1,0,1,0,0,0|1,1,0]=4 2704 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [1,0,1,0,0,0|0,0,2]=4 2705 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [1,0,1,0,0,0|1,0,0]=3 2706 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [1,0,1,0,0,0|1,0,0]=3 2707 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [1,0,1,0,0,0|0,0,0]=2 2708 B7R0.5 N[C@H](C[SH]=O)C(=O)O Amb27596028 [1,0,1,0,0,0|1,0,1]=4 2709 B7R0.5 O=C(O)C(=O)CCO Amb25677024 [1,0,1,0,0,0|1,0,1]=4 2710 B7R0.5 O=C(O)C(Br)CCBr Amb19889695 [1,0,1,0,0,0|2,0,0]=4 2711 B7R0.5 O=C(O)C(Br)CCO Amb28325416 [1,0,1,0,0,0|1,0,0]=3 2712 B7R0.5 O=C(O)C(Cl)CCCl Amb18126030 [1,0,1,0,0,0|2,0,0]=4 2713 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [1,0,1,0,0,0|2,0,0]=4 2714 B7R0.5 O=C(O)C(O)CCF Amb28071189 [1,0,1,0,0,0|2,0,0]=4 2715 B7R0.5 O=C(O)C(O)CCO Amb24689942 [1,0,1,0,0,0|1,0,0]=3 2716 B7R0.5 O=C(O)C(O)CNO Amb27405525 [1,0,1,0,0,0|2,0,0]=4 2717 B7R0.5 O=C(O)C(S)CCS Amb27634893 [1,0,1,0,0,0|1,1,0]=4 2718 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [1,0,1,0,0,0|2,0,0]=4 2719 B7R0.6 C=C(C)CCC(=O)O Amb18641793 [1,0,1,0,0,0|1,0,1]=4 2720 B7R0.6 C=C(C)CCC(C)O Amb24062974 [1,0,1,0,0,0|2,0,0]=4 2721 B7R0.6 C=C(C)CC[C@@H](C)O Amb22896943 [1,0,1,0,0,0|2,0,0]=4 2722 B7R0.6 C=C(C)CC[C@H](C)O Amb26446405 [1,0,1,0,0,0|2,0,0]=4 2723 B7R0.6 C=C(N)CCC(=O)O Amb27629351 [1,0,1,0,0,0|1,0,1]=4 2724 B7R0.6 CC(=O)CCC(=O)O Amb534169 [1,0,1,0,0,0|0,0,2]=4 2725 B7R0.6 CC(=O)CCC(C)Br Amb27424770 [1,0,1,0,0,0|2,0,0]=4 2726 B7R0.6 CC(=O)CCC(C)C Amb4605991 [1,0,1,0,0,0|2,0,0]=4 2727 B7R0.6 CC(=O)CCC(C)O Amb25829594 [1,0,1,0,0,0|1,0,0]=3 2728 B7R0.6 CC(=O)CC[C@@H](C)O Amb22351150 [1,0,1,0,0,0|1,0,0]=3 2729 B7R0.6 CC(=O)NCC(C)O Amb9276316 [1,0,1,0,0,0|2,0,0]=4 2730 B7R0.6 CC(=O)OCC(C)O Amb24056158 [1,0,1,0,0,0|2,0,0]=4 2731 B7R0.6 CC(=O)OC[C@H](C)O Amb28315156 [1,0,1,0,0,0|2,0,0]=4 2732 B7R0.6 CC(=O)SCC(C)O Amb27801534 [1,0,1,0,0,0|2,0,0]=4 2733 B7R0.6 CC(Br)CCC(=O)O Amb18124528 [1,0,1,0,0,0|1,0,0]=3 2734 B7R0.6 CC(C)CCC(=O)Cl Amb3941047 [1,0,1,0,0,0|2,0,0]=4 2735 B7R0.6 CC(C)CCC(=O)O Amb1153016 [1,0,1,0,0,0|1,0,0]=3 2736 B7R0.6 CC(C)CCC(N)=O Amb8997711 [1,0,1,0,0,0|2,0,0]=4 2737 B7R0.6 CC(C)NCC(=O)O Amb2372347 [1,0,1,0,0,0|2,0,0]=4 2738 B7R0.6 CC(C)NCC(=O)O Amb6892753 [1,0,1,0,0,0|2,0,0]=4 2739 B7R0.6 CC(C)OCC(=O)O Amb6275796 [1,0,1,0,0,0|2,0,0]=4 2740 B7R0.6 CC(C)SCC(=O)O Amb1128460 [1,0,1,0,0,0|2,0,0]=4 2741 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [1,0,1,0,0,0|2,0,0]=4 2742 B7R0.6 CC(I)CCC(=O)O Amb25938596 [1,0,1,0,0,0|1,0,0]=3 2743 B7R0.6 CC(N)CCC(=O)O Amb17593212 [1,0,1,0,0,0|1,0,0]=3 2744 B7R0.6 CC(N)CCC(=O)O Amb19515603 [1,0,1,0,0,0|1,0,0]=3 2745 B7R0.6 CC(N)CCS(=O)O Amb27839082 [1,0,1,0,0,0|2,0,0]=4 2746 B7R0.6 CC(N)CC[PH](=O)O Amb27221659 [1,0,1,0,0,0|2,0,0]=4 2747 B7R0.6 CC(N)SCC(=O)O Amb27401691 [1,0,1,0,0,0|2,0,0]=4 2748 B7R0.6 CC(O)C#CC(=O)O Amb27803065 [1,0,1,0,0,0|0,0,2]=4 2749 B7R0.6 CC(O)CCB(O)O Amb24594819 [1,0,1,0,0,0|1,0,1]=4 2750 B7R0.6 CC(O)CCC(=N)N Amb29849256 [1,0,1,0,0,0|2,0,0]=4 2751 B7R0.6 CC(O)CCC(=O)O Amb18294804 [1,0,1,0,0,0|0,0,0]=2 2752 B7R0.6 CC(O)CCC(=O)[O-] Amb32729478 [1,0,1,0,0,0|0,0,1]=3 2753 B7R0.6 CC(O)CCC(C)O Amb2688714 [1,0,1,0,0,0|1,0,1]=4 2754 B7R0.6 CC(O)CCC(N)=S Amb28078352 [1,0,1,0,0,0|1,1,0]=4 2755 B7R0.6 CC(O)CCS(=O)[O-] Amb27662317 [1,0,1,0,0,0|1,0,1]=4 2756 B7R0.6 CC(O)COC(N)=O Amb26359577 [1,0,1,0,0,0|2,0,0]=4 2757 B7R0.6 CC(S)CCC(=O)O Amb8471198 [1,0,1,0,0,0|0,1,0]=3 2758 B7R0.6 CC(S)CCC(N)=O Amb28399630 [1,0,1,0,0,0|1,1,0]=4 2759 B7R0.6 CN(C)CCC(=O)O Amb19888182 [1,0,1,0,0,0|2,0,0]=4 2760 B7R0.6 CN(C)CCC(=O)O Amb6633385 [1,0,1,0,0,0|2,0,0]=4 2761 B7R0.6 CN(N)CCC(=O)O Amb2698078 [1,0,1,0,0,0|2,0,0]=4 2762 B7R0.6 CN(O)CCC(N)=O Amb27390605 [1,0,1,0,0,0|2,0,0]=4 2763 B7R0.6 CS(=O)CCC(=O)O Amb18523762 [1,0,1,0,0,0|1,0,1]=4 2764 B7R0.6 C[C@@H](N)CCC(=O)O Amb25960628 [1,0,1,0,0,0|1,0,0]=3 2765 B7R0.6 C[C@@H](N)CCC(=O)O Amb35753110 [1,0,1,0,0,0|1,0,0]=3 2766 B7R0.6 C[C@@H](O)CC[C@@H](C)O Amb4166310 [1,0,1,0,0,0|1,0,1]=4 2767 B7R0.6 C[C@@H](O)CNC(N)=O Amb28315793 [1,0,1,0,0,0|2,0,0]=4 2768 B7R0.6 C[C@H](N)CCC(=O)O Amb25047328 [1,0,1,0,0,0|1,0,0]=3 2769 B7R0.6 C[C@H](N)CCC(=O)O Amb35752545 [1,0,1,0,0,0|1,0,0]=3 2770 B7R0.6 C[C@H](O)CCC(=O)O Amb27656596 [1,0,1,0,0,0|0,0,0]=2 2771 B7R0.6 C[C@H](O)CC[C@@H](C)O Amb26407371 [1,0,1,0,0,0|1,0,1]=4 2772 B7R0.6 C[C@H](O)CC[C@H](C)O Amb4166315 [1,0,1,0,0,0|1,0,1]=4 2773 B7R0.6 C[C@H](S)CCC(=O)O Amb27170326 [1,0,1,0,0,0|0,1,0]=3 2774 B7R0.6 C[S+](C)CCC(=O)O Amb8390782 [1,0,1,0,0,0|2,0,0]=4 2775 B7R0.6 NC(=O)CCC(=O)O Amb2967294 [1,0,1,0,0,0|0,0,2]=4 2776 B7R0.6 NC(=O)CCC(O)O Amb27254204 [1,0,1,0,0,0|2,0,0]=4 2777 B7R0.6 NC(=S)CCC(=O)O Amb18102382 [1,0,1,0,0,0|0,1,1]=4 2778 B7R0.6 O=C(O)CCB(O)O Amb24640288 [1,0,1,0,0,0|2,0,0]=4 2779 B7R0.6 O=C(O)CCC(=O)O Amb22168124 [1,0,1,0,0,0|1,0,1]=4 2780 B7R0.6 O=C(O)CCC(=O)O Amb2792874 [1,0,1,0,0,0|1,0,1]=4 2781 B7R0.6 O=C(O)CCC(Cl)Cl Amb25059214 [1,0,1,0,0,0|2,0,0]=4 2782 B7R0.6 O=C(O)CCC(F)F Amb20623135 [1,0,1,0,0,0|2,0,0]=4 2783 B7R0.6 O=C(O)CCP(O)O Amb27424479 [1,0,1,0,0,0|2,0,0]=4 2784 B7R0.6 O=C(O)CCS(=O)O Amb27144832 [1,0,1,0,0,0|2,0,0]=4 2785 B7R0.12 C=CC(CCO)OC Amb28069663 [1,0,1,0,0,0|2,0,0]=4 2786 B7R0.12 C=C[C@H](CC)CCO Amb27812473 [1,0,1,0,0,0|2,0,0]=4 2787 B7R0.12 CCCC(C=O)OC Amb25290248 [1,0,1,0,0,0|2,0,0]=4 2788 B7R0.12 CCC[C@H](C=O)SC Amb28287171 [1,0,1,0,0,0|2,0,0]=4 2789 B7R0.12 CNC(C#N)CCO Amb35714422 [1,0,1,0,0,0|1,0,1]=4 2790 B7R0.12 COC(CO)CCO Amb28066154 [1,0,1,0,0,0|1,0,1]=4 2791 B7R0.12 CO[C@@H](CO)CCO Amb27764792 [1,0,1,0,0,0|1,0,1]=4 2792 B7R0.15 C=C(C)C(CC)NC Amb27400414 [1,0,1,0,0,0|2,0,0]=4 2793 B7R0.15 C=CC(CC)C(=O)O Amb28119400 [1,0,1,0,0,0|1,0,1]=4 2794 B7R0.15 CCC(C#N)C(=O)O Amb17210513 [1,0,1,0,0,0|2,0,0]=4 2795 B7R0.15 CCC(C=O)C(=O)O Amb28410235 [1,0,1,0,0,0|2,0,0]=4 2796 B7R0.15 CCC(CC)C(=O)Cl Amb3939475 [1,0,1,0,0,0|2,0,0]=4 2797 B7R0.15 CCC(CC)C(=O)O Amb4605826 [1,0,1,0,0,0|1,0,0]=3 2798 B7R0.15 CCC(CC)C(=O)[O-] Amb22585838 [1,0,1,0,0,0|1,0,1]=4 2799 B7R0.15 CCC(CC)C(C)=O Amb33536259 [1,0,1,0,0,0|2,0,0]=4 2800 B7R0.15 CCC(CC)C(N)=O Amb33550498 [1,0,1,0,0,0|2,0,0]=4 2801 B7R0.15 CCC(CCl)C(=O)O Amb27424156 [1,0,1,0,0,0|2,0,0]=4 2802 B7R0.15 CCC(CF)C(=O)O Amb27625346 [1,0,1,0,0,0|2,0,0]=4 2803 B7R0.15 CCC(CN)C(=O)O Amb18987934 [1,0,1,0,0,0|2,0,0]=4 2804 B7R0.15 CCC(CN)C(=O)O Amb19514932 [1,0,1,0,0,0|2,0,0]=4 2805 B7R0.15 CCC(CO)C(=O)O Amb18641947 [1,0,1,0,0,0|1,0,0]=3 2806 B7R0.15 CCC(CO)C(=O)[O-] Amb28934895 [1,0,1,0,0,0|1,0,1]=4 2807 B7R0.15 CCC(CO)C(N)=O Amb28314312 [1,0,1,0,0,0|2,0,0]=4 2808 B7R0.15 CCC(NC)C(=O)O Amb10610245 [1,0,1,0,0,0|0,0,0]=2 2809 B7R0.15 CCC(NC)C(=O)O Amb9619833 [1,0,1,0,0,0|0,0,0]=2 2810 B7R0.15 CCC(NC)C(C)=O Amb28049011 [1,0,1,0,0,0|1,0,0]=3 2811 B7R0.15 CCC(NC)C(C)O Amb27253936 [1,0,1,0,0,0|1,0,1]=4 2812 B7R0.15 CCC(NC)C(N)=O Amb15701261 [1,0,1,0,0,0|1,0,0]=3 2813 B7R0.15 CCC(NCl)C(=O)O Amb28387574 [1,0,1,0,0,0|1,0,0]=3 2814 B7R0.15 CCC(NN)C(=O)O Amb18641955 [1,0,1,0,0,0|1,0,0]=3 2815 B7R0.15 CCC(NO)C(=O)O Amb4019788 [1,0,1,0,0,0|1,0,0]=3 2816 B7R0.15 CCC(OC)C(=O)O Amb8472685 [1,0,1,0,0,0|1,0,0]=3 2817 B7R0.15 CCC(OC)C(C)=O Amb26004835 [1,0,1,0,0,0|2,0,0]=4 2818 B7R0.15 CCC(OC)C(N)=O Amb2027289 [1,0,1,0,0,0|2,0,0]=4 2819 B7R0.15 CCC(SC)C(=O)O Amb17501348 [1,0,1,0,0,0|1,0,0]=3 2820 B7R0.15 CCC(SC)C(C)=O Amb28460748 [1,0,1,0,0,0|2,0,0]=4 2821 B7R0.15 CC[C@@H](CN)C(=O)O Amb27838297 [1,0,1,0,0,0|2,0,0]=4 2822 B7R0.15 CC[C@@H](CO)C(=O)O Amb22745321 [1,0,1,0,0,0|1,0,0]=3 2823 B7R0.15 CC[C@@H](NC)C(=O)O Amb28315876 [1,0,1,0,0,0|0,0,0]=2 2824 B7R0.15 CC[C@H](CN)C(=O)O Amb25790771 [1,0,1,0,0,0|2,0,0]=4 2825 B7R0.15 CC[C@H](CO)C(=O)O Amb16232065 [1,0,1,0,0,0|1,0,0]=3 2826 B7R0.15 CC[C@H](NC)C(=O)O Amb24505225 [1,0,1,0,0,0|0,0,0]=2 2827 B7R0.15 CC[C@H](NCl)C(=O)O Amb28193501 [1,0,1,0,0,0|1,0,0]=3 2828 B7R0.15 CC[C@H](NN)C(=O)O Amb28289412 [1,0,1,0,0,0|1,0,0]=3 2829 B7R0.15 CC[C@H](OC)C(C)=O Amb27243431 [1,0,1,0,0,0|2,0,0]=4 2830 B7R0.15 CNC(CN)C(=O)O Amb23515020 [1,0,1,0,0,0|1,0,0]=3 2831 B7R0.15 CNC(CN)C(=O)O Amb28934876 [1,0,1,0,0,0|1,0,0]=3 2832 B7R0.15 CNC(CO)C(=O)O Amb26068513 [1,0,1,0,0,0|0,0,0]=2 2833 B7R0.15 CNC(CO)C(C)O Amb27794828 [1,0,1,0,0,0|1,0,1]=4 2834 B7R0.15 CNC(CO)C(N)=O Amb18641957 [1,0,1,0,0,0|1,0,0]=3 2835 B7R0.15 CNC(CS)C(=O)O Amb2781760 [1,0,1,0,0,0|0,1,0]=3 2836 B7R0.15 CN[C@@H](CO)C(=O)O Amb16183860 [1,0,1,0,0,0|0,0,0]=2 2837 B7R0.15 CN[C@@H](CO)C(C)=O Amb26476298 [1,0,1,0,0,0|1,0,0]=3 2838 B7R0.15 CN[C@@H](CS)C(=O)O Amb27630049 [1,0,1,0,0,0|0,1,0]=3 2839 B7R0.15 CN[C@@H](CS)C(=O)O Amb33875997 [1,0,1,0,0,0|0,1,0]=3 2840 B7R0.15 CN[C@H](CO)C(=O)O Amb26948665 [1,0,1,0,0,0|0,0,0]=2 2841 B7R0.15 CN[C@H](CO)[C@@H](C)O Amb27239292 [1,0,1,0,0,0|1,0,1]=4 2842 B7R0.15 CN\C(CO)=C(\C)O Amb25210013 [1,0,1,0,0,0|1,0,1]=4 2843 B7R0.15 COC(CN)C(=O)O Amb22059584 [1,0,1,0,0,0|2,0,0]=4 2844 B7R0.15 COC(CN)C(=O)O Amb24271092 [1,0,1,0,0,0|2,0,0]=4 2845 B7R0.15 COC(OC)C(=O)O Amb26446254 [1,0,1,0,0,0|2,0,0]=4 2846 B7R0.15 CO[C@@H](CN)C(=O)O Amb32679591 [1,0,1,0,0,0|2,0,0]=4 2847 B7R0.15 CO[C@@H](CN)C(=O)O Amb32679853 [1,0,1,0,0,0|2,0,0]=4 2848 B7R0.15 CO[C@@H](CO)C(=O)O Amb27409917 [1,0,1,0,0,0|1,0,0]=3 2849 B7R0.15 CSC(CCl)C(=O)O Amb24526774 [1,0,1,0,0,0|2,0,0]=4 2850 B7R0.15 CSC(CN)C(=O)O Amb28346880 [1,0,1,0,0,0|2,0,0]=4 2851 B7R0.15 CSC(SC)C(=O)O Amb28245282 [1,0,1,0,0,0|2,0,0]=4 2852 B7R0.15 C\C=C(/CC)C(=O)O Amb18641780 [1,0,1,0,0,0|1,0,1]=4 2853 B7R0.15 C\C=C(\CO)C(=O)O Amb25306747 [1,0,1,0,0,0|1,0,1]=4 2854 B7R0.15 C\N=C(/NC)C(=O)O Amb28349086 [1,0,1,0,0,0|1,0,1]=4 2855 B7R0.15 N#CC(CO)C(=O)O Amb27246245 [1,0,1,0,0,0|2,0,0]=4 2856 B7R0.15 NC[C@H](CO)C(=O)O Amb26873333 [1,0,1,0,0,0|2,0,0]=4 2857 B7R0.15 NNC(CO)C(=O)O Amb27595622 [1,0,1,0,0,0|1,0,0]=3 2858 B7R0.15 NNC(CS)C(=O)O Amb24117863 [1,0,1,0,0,0|1,1,0]=4 2859 B7R0.15 NNC(CS)C(=O)O Amb27834344 [1,0,1,0,0,0|1,1,0]=4 2860 B7R0.15 NOC(CO)C(=O)O Amb27173883 [1,0,1,0,0,0|2,0,0]=4 2861 B7R0.15 O=C(O)C(CO)NCl Amb28120918 [1,0,1,0,0,0|1,0,0]=3 2862 B7R0.15 O=C(O)[C@H](CS)NS Amb27750416 [1,0,1,0,0,0|1,1,0]=4 2863 B7R0.2 C=CC(N)CC(C)C Amb25743094 [1,0,1,0,0,0|2,0,0]=4 2864 B7R0.2 C=C[C@@H](C)C[C@@H](C)O Amb28138655 [1,0,1,0,0,0|2,0,0]=4 2865 B7R0.2 C=C[C@@H](O)C[C@H](C)O Amb28318465 [1,0,1,0,0,0|2,0,0]=4 2866 B7R0.2 C=C[C@H](C)C[C@H](C)O Amb27221624 [1,0,1,0,0,0|2,0,0]=4 2867 B7R0.2 C=C[C@H](N)CC(C)C Amb27202733 [1,0,1,0,0,0|2,0,0]=4 2868 B7R0.2 CC(C)CC(C)C=O Amb18641813 [1,0,1,0,0,0|2,0,0]=4 2869 B7R0.2 CC(C)CC(N)CO Amb18015118 [1,0,1,0,0,0|1,0,1]=4 2870 B7R0.2 CC(C)CC(O)C=O Amb27250174 [1,0,1,0,0,0|2,0,0]=4 2871 B7R0.2 CC(C)C[C@@H](C)C=O Amb27164638 [1,0,1,0,0,0|2,0,0]=4 2872 B7R0.2 CC(C)C[C@@H](N)CO Amb22746869 [1,0,1,0,0,0|1,0,1]=4 2873 B7R0.2 CC(C)C[C@@H](N)CO Amb3939340 [1,0,1,0,0,0|1,0,1]=4 2874 B7R0.2 CC(C)C[C@H](N)C=O Amb26851754 [1,0,1,0,0,0|1,0,0]=3 2875 B7R0.2 CC(C)C[C@H](N)CO Amb22504556 [1,0,1,0,0,0|1,0,1]=4 2876 B7R0.2 CC(C)C[C@H](N)CO Amb3940063 [1,0,1,0,0,0|1,0,1]=4 2877 B7R0.2 CC(O)C[C@H](C)CO Amb27394893 [1,0,1,0,0,0|1,0,1]=4 2878 B7R0.2 CC(O)C[C@H](O)CO Amb27397070 [1,0,1,0,0,0|1,0,1]=4 2879 B7R0.2 CC(O)C\C(N)=N\O Amb33328422 [1,0,1,0,0,0|1,0,1]=4 2880 B7R0.2 CCC(N)CC(C)O Amb27604743 [1,0,1,0,0,0|1,0,1]=4 2881 B7R0.2 C[C@H](O)C[C@H](O)CO Amb27472671 [1,0,1,0,0,0|1,0,1]=4 2882 B7R0.2 NC(C=O)CC(=O)O Amb27669608 [1,0,1,0,0,0|1,0,1]=4 2883 B7R0.2 N[C@H](C=O)CC(=O)O Amb28428447 [1,0,1,0,0,0|1,0,1]=4 2884 B7R1.1 BrCC1CCCN1 Amb20618588 [2,0,0,0,0,0|1,0,1]=4 2885 B7R1.1 BrCC1CCCN1 Amb21962027 [2,0,0,0,0,0|1,0,1]=4 2886 B7R1.1 BrCC1CCCN1 Amb32411817 [2,0,0,0,0,0|1,0,1]=4 2887 B7R1.1 BrC[C@@H]1CCCN1 Amb25809414 [2,0,0,0,0,0|1,0,1]=4 2888 B7R1.1 BrC[C@@H]1CCCN1 Amb32668728 [2,0,0,0,0,0|1,0,1]=4 2889 B7R1.1 C#CC1CCCN1 Amb23598273 [2,0,0,0,0,0|1,0,1]=4 2890 B7R1.1 C#CC1CCCN1 Amb30584690 [2,0,0,0,0,0|1,0,1]=4 2891 B7R1.1 C#C[C@@H]1CCCN1 Amb24479840 [2,0,0,0,0,0|1,0,1]=4 2892 B7R1.1 C#C[C@H]1CCCN1 Amb26968270 [2,0,0,0,0,0|1,0,1]=4 2893 B7R1.1 C=CC1CCCC1 Amb17934190 [2,0,0,0,0,0|2,0,0]=4 2894 B7R1.1 C=CC1CCCN1 Amb23536605 [2,0,0,0,0,0|1,0,0]=3 2895 B7R1.1 C=CC1CCCN1 Amb24082686 [2,0,0,0,0,0|1,0,0]=3 2896 B7R1.1 C=CC1CCCO1 Amb28137321 [2,0,0,0,0,0|2,0,0]=4 2897 B7R1.1 C=CC1CCCS1 Amb33415623 [2,0,0,0,0,0|2,0,0]=4 2898 B7R1.1 CCC1CCCN1 Amb19515009 [2,0,0,0,0,0|1,0,1]=4 2899 B7R1.1 CCC1CCCN1 Amb3788096 [2,0,0,0,0,0|1,0,1]=4 2900 B7R1.1 CC[C@@H]1CCCN1 Amb22747053 [2,0,0,0,0,0|1,0,1]=4 2901 B7R1.1 CC[C@H]1CCCN1 Amb25822206 [2,0,0,0,0,0|1,0,1]=4 2902 B7R1.1 CO[C@@H]1CCCN1 Amb27948785 [2,0,0,0,0,0|2,0,0]=4 2903 B7R1.1 ClCC1CCCN1 Amb1102532 [2,0,0,0,0,0|1,0,1]=4 2904 B7R1.1 ClCC1CCCN1 Amb22228750 [2,0,0,0,0,0|1,0,1]=4 2905 B7R1.1 ClC[C@@H]1CCCN1 Amb22226498 [2,0,0,0,0,0|1,0,1]=4 2906 B7R1.1 ClC[C@@H]1CCCN1 Amb22232498 [2,0,0,0,0,0|1,0,1]=4 2907 B7R1.1 ClC[C@H]1CCCN1 Amb26577168 [2,0,0,0,0,0|1,0,1]=4 2908 B7R1.1 FCC1CCCN1 Amb13953136 [2,0,0,0,0,0|1,0,1]=4 2909 B7R1.1 FCC1CCCN1 Amb28827628 [2,0,0,0,0,0|1,0,1]=4 2910 B7R1.1 FC[C@@H]1CCCN1 Amb22405982 [2,0,0,0,0,0|1,0,1]=4 2911 B7R1.1 FC[C@@H]1CCCN1 Amb27973462 [2,0,0,0,0,0|1,0,1]=4 2912 B7R1.1 FC[C@H]1CCCN1 Amb27602129 [2,0,0,0,0,0|1,0,1]=4 2913 B7R1.1 FC[C@H]1CCCN1 Amb32409431 [2,0,0,0,0,0|1,0,1]=4 2914 B7R1.1 N#CC1CCCN1 Amb10069328 [2,0,0,0,0,0|1,0,1]=4 2915 B7R1.1 N#CC1CCCN1 Amb18198112 [2,0,0,0,0,0|1,0,1]=4 2916 B7R1.1 N#CC1CCCN1 Amb22405979 [2,0,0,0,0,0|1,0,1]=4 2917 B7R1.1 N#C[C@@H]1CCCN1 Amb17399785 [2,0,0,0,0,0|1,0,1]=4 2918 B7R1.1 N#C[C@@H]1CCCN1 Amb2690445 [2,0,0,0,0,0|1,0,1]=4 2919 B7R1.1 N#C[C@@H]1CCCN1 Amb30625709 [2,0,0,0,0,0|1,0,1]=4 2920 B7R1.1 N#C[C@H]1CCCN1 Amb22225409 [2,0,0,0,0,0|1,0,1]=4 2921 B7R1.1 N#C[C@H]1CCCN1 Amb2690444 [2,0,0,0,0,0|1,0,1]=4 2922 B7R1.1 N#C[C@H]1CCCN1 Amb31204640 [2,0,0,0,0,0|1,0,1]=4 2923 B7R1.1 NCC1CCCN1 Amb19516137 [2,0,0,0,0,0|1,0,1]=4 2924 B7R1.1 NCC1CCCN1 Amb4418336 [2,0,0,0,0,0|1,0,1]=4 2925 B7R1.1 NC[C@@H]1CCCN1 Amb22405933 [2,0,0,0,0,0|1,0,1]=4 2926 B7R1.1 NC[C@H]1CCCN1 Amb2699509 [2,0,0,0,0,0|1,0,1]=4 2927 B7R1.1 NC[C@H]1CCCN1 Amb30584681 [2,0,0,0,0,0|1,0,1]=4 2928 B7R1.1 O=CC1=CCCC1 Amb17138358 [2,0,0,0,0,0|1,0,1]=4 2929 B7R1.1 O=CC1C=CCC1 Amb27229924 [2,0,0,0,0,0|1,0,1]=4 2930 B7R1.1 O=CC1CCCC1 Amb31292855 [2,0,0,0,0,0|1,0,0]=3 2931 B7R1.1 O=CC1CCCC1 Amb4605847 [2,0,0,0,0,0|1,0,0]=3 2932 B7R1.1 O=CC1CCCC1 Amb6297186 [2,0,0,0,0,0|1,0,0]=3 2933 B7R1.1 O=CC1CCCO1 Amb3939388 [2,0,0,0,0,0|1,0,0]=3 2934 B7R1.1 O=CC1CCCS1 Amb27214645 [2,0,0,0,0,0|1,0,0]=3 2935 B7R1.1 O=CC1CCNC1 Amb18197564 [2,0,0,0,0,0|2,0,0]=4 2936 B7R1.1 O=CC1CCOC1 Amb6608994 [2,0,0,0,0,0|2,0,0]=4 2937 B7R1.1 O=CC1CCSC1 Amb18199140 [2,0,0,0,0,0|2,0,0]=4 2938 B7R1.1 O=CC1OCCO1 Amb27592967 [2,0,0,0,0,0|2,0,0]=4 2939 B7R1.1 O=CN1CCCC1 Amb2720947 [2,0,0,0,0,0|2,0,0]=4 2940 B7R1.1 O=C[C@@H]1CCCN1 Amb27261498 [2,0,0,0,0,0|0,0,0]=2 2941 B7R1.1 O=C[C@@H]1CCCS1 Amb28130403 [2,0,0,0,0,0|1,0,0]=3 2942 B7R1.1 O=C[C@@H]1CCOC1 Amb27801459 [2,0,0,0,0,0|2,0,0]=4 2943 B7R1.1 O=NC1CCCN1 Amb27488681 [2,0,0,0,0,0|1,0,0]=3 2944 B7R1.1 OCC1CCCC1 Amb2721271 [2,0,0,0,0,0|1,0,1]=4 2945 B7R1.1 OCC1CCCN1 Amb2237182 [2,0,0,0,0,0|0,0,1]=3 2946 B7R1.1 OCC1CCCO1 Amb3939084 [2,0,0,0,0,0|1,0,1]=4 2947 B7R1.1 OCC1CCCS1 Amb33545363 [2,0,0,0,0,0|1,0,1]=4 2948 B7R1.1 OCC1CCON1 Amb25888553 [2,0,0,0,0,0|1,0,1]=4 2949 B7R1.1 OCC1CCON1 Amb33483283 [2,0,0,0,0,0|1,0,1]=4 2950 B7R1.1 OCC1NCCS1 Amb25821150 [2,0,0,0,0,0|1,0,1]=4 2951 B7R1.1 OC[C@@H]1CCCN1 Amb22748614 [2,0,0,0,0,0|0,0,1]=3 2952 B7R1.1 OC[C@@H]1CCCN1 Amb3938965 [2,0,0,0,0,0|0,0,1]=3 2953 B7R1.1 OC[C@@H]1CCCO1 Amb10601543 [2,0,0,0,0,0|1,0,1]=4 2954 B7R1.1 OC[C@H]1CCCN1 Amb2235512 [2,0,0,0,0,0|0,0,1]=3 2955 B7R1.1 OC[C@H]1CCCN1 Amb30874072 [2,0,0,0,0,0|0,0,1]=3 2956 B7R1.1 OC[C@H]1CCCO1 Amb16185506 [2,0,0,0,0,0|1,0,1]=4 2957 B7R1.1 ONC1CCCC1 Amb27467457 [2,0,0,0,0,0|2,0,0]=4 2958 B7R1.1 ONC1CCCC1 Amb30625652 [2,0,0,0,0,0|2,0,0]=4 2959 B7R1.1 O\N=C1/CCCN1 Amb19769769 [2,0,0,0,0,0|1,0,1]=4 2960 B7R1.1 O\N=C1/CCCN1 Amb33309985 [2,0,0,0,0,0|1,0,1]=4 2961 B7R1.1 SCC1CCCN1 Amb25874415 [2,0,0,0,0,0|0,1,1]=4 2962 B7R1.1 SCC1CCCN1 Amb35752888 [2,0,0,0,0,0|0,1,1]=4 2963 B7R1.1 SC[C@H]1CCCN1 Amb29854514 [2,0,0,0,0,0|0,1,1]=4 2964 B7R1.1 [C-]#[N+]C1CCCN1 Amb27646808 [2,0,0,0,0,0|2,0,0]=4 2965 B7R1.2 CC1CC(Br)CN1 Amb27634494 [2,0,0,0,0,0|1,0,1]=4 2966 B7R1.2 CC1CC(Cl)CN1 Amb28455910 [2,0,0,0,0,0|1,0,1]=4 2967 B7R1.2 CC1CC(F)CN1 Amb25888440 [2,0,0,0,0,0|1,0,1]=4 2968 B7R1.2 CC1CC(F)CN1 Amb33803405 [2,0,0,0,0,0|1,0,1]=4 2969 B7R1.2 CC1CC(N)CN1 Amb27168248 [2,0,0,0,0,0|1,0,1]=4 2970 B7R1.2 CC1CC(O)CN1 Amb33329377 [2,0,0,0,0,0|0,0,1]=3 2971 B7R1.2 CC1CC(O)CN1 Amb33545349 [2,0,0,0,0,0|0,0,1]=3 2972 B7R1.2 CC1CC(O)CO1 Amb28430079 [2,0,0,0,0,0|1,0,1]=4 2973 B7R1.2 CC1CC(S)CN1 Amb32788618 [2,0,0,0,0,0|0,1,1]=4 2974 B7R1.2 CC1CCC(O)C1 Amb4605822 [2,0,0,0,0,0|1,0,1]=4 2975 B7R1.2 CC1CNC(=O)C1 Amb10608004 [2,0,0,0,0,0|1,0,1]=4 2976 B7R1.2 CC1CNC(C)C1 Amb17593077 [2,0,0,0,0,0|1,0,1]=4 2977 B7R1.2 CC1CNC(C)C1 Amb19335336 [2,0,0,0,0,0|1,0,1]=4 2978 B7R1.2 CC1COC(O)C1 Amb28050442 [2,0,0,0,0,0|2,0,0]=4 2979 B7R1.2 C[C@@H]1CC[C@H](O)C1 Amb27853110 [2,0,0,0,0,0|1,0,1]=4 2980 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [2,0,0,0,0,0|1,0,1]=4 2981 B7R1.2 C[C@@H]1CN[C@H](C)C1 Amb18195964 [2,0,0,0,0,0|1,0,1]=4 2982 B7R1.2 C[C@@H]1COC(O)C1 Amb27399504 [2,0,0,0,0,0|2,0,0]=4 2983 B7R1.2 C[C@@H]1CO[C@@H](O)C1 Amb27422487 [2,0,0,0,0,0|2,0,0]=4 2984 B7R1.2 C[C@@H]1C[C@@H](F)CN1 Amb22886338 [2,0,0,0,0,0|1,0,1]=4 2985 B7R1.2 C[C@@H]1C[C@@H](N)CN1 Amb27214176 [2,0,0,0,0,0|1,0,1]=4 2986 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22746400 [2,0,0,0,0,0|0,0,1]=3 2987 B7R1.2 C[C@@H]1C[C@H](F)CN1 Amb22886231 [2,0,0,0,0,0|1,0,1]=4 2988 B7R1.2 C[C@@H]1C[C@H](N)CN1 Amb27421394 [2,0,0,0,0,0|1,0,1]=4 2989 B7R1.2 C[C@@H]1C[C@H](O)CN1 Amb22886268 [2,0,0,0,0,0|0,0,1]=3 2990 B7R1.2 C[C@H]1CNC(=O)C1 Amb26584475 [2,0,0,0,0,0|1,0,1]=4 2991 B7R1.2 C[C@H]1C[C@@H](N)CN1 Amb26406117 [2,0,0,0,0,0|1,0,1]=4 2992 B7R1.2 C[C@H]1C[C@@H](O)CN1 Amb33872130 [2,0,0,0,0,0|0,0,1]=3 2993 B7R1.2 C[C@H]1C[C@@H](O)CO1 Amb28245786 [2,0,0,0,0,0|1,0,1]=4 2994 B7R1.2 C[C@H]1C[C@@H](O)CS1 Amb27662171 [2,0,0,0,0,0|1,0,1]=4 2995 B7R1.2 C[C@H]1C[C@H](O)CN1 Amb33801108 [2,0,0,0,0,0|0,0,1]=3 2996 B7R1.2 NC1CCC(O)C1 Amb18561405 [2,0,0,0,0,0|2,0,0]=4 2997 B7R1.2 NC1CCC(O)C1 Amb19958405 [2,0,0,0,0,0|2,0,0]=4 2998 B7R1.2 NC1CNC(=O)C1 Amb17760661 [2,0,0,0,0,0|1,0,1]=4 2999 B7R1.2 NC1CNC(=O)C1 Amb33544169 [2,0,0,0,0,0|1,0,1]=4 3000 B7R1.2 N[C@@H]1CC[C@@H](O)C1 Amb10066961 [2,0,0,0,0,0|2,0,0]=4 3001 B7R1.2 N[C@@H]1CC[C@@H](O)C1 Amb16233749 [2,0,0,0,0,0|2,0,0]=4 3002 B7R1.2 N[C@@H]1CC[C@H](O)C1 Amb10066973 [2,0,0,0,0,0|2,0,0]=4 3003 B7R1.2 N[C@@H]1CC[C@H](O)C1 Amb22406236 [2,0,0,0,0,0|2,0,0]=4 3004 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [2,0,0,0,0,0|1,0,1]=4 3005 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [2,0,0,0,0,0|1,0,1]=4 3006 B7R1.2 N[C@@H]1CNC(=O)C1 Amb33714529 [2,0,0,0,0,0|1,0,1]=4 3007 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb10066971 [2,0,0,0,0,0|2,0,0]=4 3008 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb22274622 [2,0,0,0,0,0|2,0,0]=4 3009 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb34916039 [2,0,0,0,0,0|2,0,0]=4 3010 B7R1.2 N[C@H]1CC[C@H](O)C1 Amb10066972 [2,0,0,0,0,0|2,0,0]=4 3011 B7R1.2 N[C@H]1CC[C@H](O)C1 Amb22386861 [2,0,0,0,0,0|2,0,0]=4 3012 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [2,0,0,0,0,0|1,0,1]=4 3013 B7R1.2 N[C@H]1CNC(=O)C1 Amb33801336 [2,0,0,0,0,0|1,0,1]=4 3014 B7R1.2 O=C1CC(O)CN1 Amb19958404 [2,0,0,0,0,0|0,0,1]=3 3015 B7R1.2 O=C1CC(O)CO1 Amb4006296 [2,0,0,0,0,0|1,0,1]=4 3016 B7R1.2 O=C1CC(S)CN1 Amb25685875 [2,0,0,0,0,0|0,1,1]=4 3017 B7R1.2 O=C1CCC(O)C1 Amb22057378 [2,0,0,0,0,0|1,0,1]=4 3018 B7R1.2 O=C1CC[C@@H](O)C1 Amb27432638 [2,0,0,0,0,0|1,0,1]=4 3019 B7R1.2 O=C1CC[C@H](O)C1 Amb27804552 [2,0,0,0,0,0|1,0,1]=4 3020 B7R1.2 O=C1C[C@@H](O)CN1 Amb15691722 [2,0,0,0,0,0|0,0,1]=3 3021 B7R1.2 O=C1C[C@@H](O)CO1 Amb2695144 [2,0,0,0,0,0|1,0,1]=4 3022 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [2,0,0,0,0,0|0,1,1]=4 3023 B7R1.2 O=C1C[C@H](O)CN1 Amb8386060 [2,0,0,0,0,0|0,0,1]=3 3024 B7R1.2 O=C1C[C@H](O)CO1 Amb8627913 [2,0,0,0,0,0|1,0,1]=4 3025 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [2,0,0,0,0,0|0,1,1]=4 3026 B7R1.2 O=S1CCC(O)C1 Amb26600157 [2,0,0,0,0,0|2,0,0]=4 3027 B7R1.2 O=S1CC[C@@H](O)C1 Amb28191911 [2,0,0,0,0,0|2,0,0]=4 3028 B7R1.2 OC1C=CC(O)C1 Amb4034755 [2,0,0,0,0,0|1,0,1]=4 3029 B7R1.2 OC1CCC(O)C1 Amb8513837 [2,0,0,0,0,0|1,0,0]=3 3030 B7R1.2 OC1CCC(O)O1 Amb4018883 [2,0,0,0,0,0|2,0,0]=4 3031 B7R1.2 OC1CCN(O)C1 Amb27430271 [2,0,0,0,0,0|2,0,0]=4 3032 B7R1.2 OC1C[C@H](O)CO1 Amb27650382 [2,0,0,0,0,0|1,0,0]=3 3033 B7R1.2 O[C@@H]1C=C[C@H](O)C1 Amb8395199 [2,0,0,0,0,0|1,0,1]=4 3034 B7R1.2 O[C@@H]1CC[C@@H](O)C1 Amb24519755 [2,0,0,0,0,0|1,0,0]=3 3035 B7R1.2 O[C@@H]1CO[C@@H](O)C1 Amb27478741 [2,0,0,0,0,0|1,0,0]=3 3036 B7R1.2 O[C@@H]1CO[C@H](O)C1 Amb27797261 [2,0,0,0,0,0|1,0,0]=3 3037 B7R1.2 O[C@H]1CC[C@@H](O)C1 Amb26035335 [2,0,0,0,0,0|1,0,0]=3 3038 B7R1.2 O[C@H]1CC[C@H](O)C1 Amb26400686 [2,0,0,0,0,0|1,0,0]=3 3039 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [2,0,0,0,0,0|1,0,1]=4 3040 B9R0.3 CC(CCCO)P(=O)(O)O Amb27852323 [0,1,1,0,0,0|2,0,0]=4 3041 B9R0.3 CCCNC(C)P(=O)(O)O Amb27239719 [0,1,1,0,0,0|2,0,0]=4 3042 B9R0.6 C#CCN(C)C(C)C(=O)O Amb18993822 [0,1,1,0,0,0|1,0,1]=4 3043 B9R0.6 CC(C(=O)O)N(C)CCF Amb27171701 [0,1,1,0,0,0|1,0,0]=3 3044 B9R0.6 CC(C(=O)O)N(C)CCN Amb19028451 [0,1,1,0,0,0|1,0,0]=3 3045 B9R0.6 CC(C(=O)O)N(C)CCO Amb5767856 [0,1,1,0,0,0|0,0,0]=2 3046 B9R0.6 CC(C(=O)O)S(=O)CCCl Amb28365842 [0,1,1,0,0,0|2,0,0]=4 3047 B9R0.6 CC(C(N)=O)N(C)CCF Amb27431241 [0,1,1,0,0,0|2,0,0]=4 3048 B9R0.6 CC(C(N)=O)N(C)CCI Amb28398768 [0,1,1,0,0,0|2,0,0]=4 3049 B9R0.6 CC(O)C(C)N(C)CCO Amb28049685 [0,1,1,0,0,0|1,0,1]=4 3050 B9R0.6 CCCC(C)C(C)C(=O)O Amb28050123 [0,1,1,0,0,0|2,0,0]=4 3051 B9R0.6 CCCC(C)[C@@H](C)C(=O)O Amb33727115 [0,1,1,0,0,0|2,0,0]=4 3052 B9R0.6 CCCC(C)[C@H](C)C(=O)O Amb33749068 [0,1,1,0,0,0|2,0,0]=4 3053 B9R0.6 CCCC(N)C(C)C(=O)O Amb24763852 [0,1,1,0,0,0|2,0,0]=4 3054 B9R0.6 CCCC(O)C(C)C(=O)O Amb18310700 [0,1,1,0,0,0|2,0,0]=4 3055 B9R0.6 CCC[C@@H](C)[C@@H](C)C(=O)O Amb27961440 [0,1,1,0,0,0|2,0,0]=4 3056 B9R0.6 CCC[C@@H](N)[C@@H](C)C(=O)O Amb27784849 [0,1,1,0,0,0|2,0,0]=4 3057 B9R0.6 CCC[C@H](N)[C@@H](C)C(=O)O Amb27618082 [0,1,1,0,0,0|2,0,0]=4 3058 B9R0.7 C=C(Br)CNC(C)C(=O)O Amb18303282 [0,1,1,0,0,0|1,0,1]=4 3059 B9R0.7 C=C(Br)CN[C@@H](C)C(=O)O Amb27174841 [0,1,1,0,0,0|1,0,1]=4 3060 B9R0.7 CC(=O)C(C)CCC(C)O Amb27823560 [0,1,1,0,0,0|2,0,0]=4 3061 B9R0.7 CC(=O)C(C)NCC(C)C Amb24480697 [0,1,1,0,0,0|2,0,0]=4 3062 B9R0.7 CC(=O)C(C)SCC(C)O Amb27651284 [0,1,1,0,0,0|2,0,0]=4 3063 B9R0.7 CC(C)CCC(C)C(=O)O Amb19033547 [0,1,1,0,0,0|2,0,0]=4 3064 B9R0.7 CC(C)CC[C@@H](C)C(=O)O Amb26983027 [0,1,1,0,0,0|2,0,0]=4 3065 B9R0.7 CC(C)CC[C@H](C)C(=O)O Amb27227250 [0,1,1,0,0,0|2,0,0]=4 3066 B9R0.7 CC(C)CNC(C)C(=O)O Amb9326958 [0,1,1,0,0,0|1,0,0]=3 3067 B9R0.7 CC(C)CNC(C)C(N)=O Amb9203289 [0,1,1,0,0,0|2,0,0]=4 3068 B9R0.7 CC(C)CN[C@@H](C)C(=O)O Amb27872965 [0,1,1,0,0,0|1,0,0]=3 3069 B9R0.7 CC(C)COC(C)C(=O)O Amb6258223 [0,1,1,0,0,0|2,0,0]=4 3070 B9R0.7 CC(C)CSC(C)C(=O)O Amb6270237 [0,1,1,0,0,0|2,0,0]=4 3071 B9R0.7 CC(CCC(=O)O)C(=O)O Amb6296609 [0,1,1,0,0,0|1,0,1]=4 3072 B9R0.7 CC(CCC(F)F)C(=O)O Amb32672190 [0,1,1,0,0,0|2,0,0]=4 3073 B9R0.7 CC(NCC(=O)O)C(=O)O Amb26506272 [0,1,1,0,0,0|0,0,1]=3 3074 B9R0.7 CC(NCC(=O)O)C(=O)O Amb3427836 [0,1,1,0,0,0|0,0,1]=3 3075 B9R0.7 CC(NCC(=O)O)C(N)=O Amb9285399 [0,1,1,0,0,0|1,0,1]=4 3076 B9R0.7 CC(NCC(F)F)C(N)=O Amb18791495 [0,1,1,0,0,0|2,0,0]=4 3077 B9R0.7 CC(NC[C@@H](C)O)C(=O)O Amb27617222 [0,1,1,0,0,0|0,0,0]=2 3078 B9R0.7 CC(NC[C@H](C)O)C(=O)O Amb27248684 [0,1,1,0,0,0|0,0,0]=2 3079 B9R0.7 CC(NC[C@H](C)O)C(N)=O Amb27596825 [0,1,1,0,0,0|1,0,0]=3 3080 B9R0.7 CC(O)C(C)NC[C@@H](C)O Amb27858438 [0,1,1,0,0,0|1,0,1]=4 3081 B9R0.7 CC(O)CCC(N)C(=O)O Amb26598749 [0,1,1,0,0,0|2,0,0]=4 3082 B9R0.7 CC(O)CC[C@@H](N)C(=O)O Amb28126862 [0,1,1,0,0,0|2,0,0]=4 3083 B9R0.7 CC(O)CC[C@H](N)C(=O)O Amb26346481 [0,1,1,0,0,0|2,0,0]=4 3084 B9R0.7 CC(O)CNC(C)C(=O)O Amb18523859 [0,1,1,0,0,0|0,0,0]=2 3085 B9R0.7 CC(O)CNC(C)C(C)O Amb27234518 [0,1,1,0,0,0|1,0,1]=4 3086 B9R0.7 CC(O)CN[C@H](C)C(=O)O Amb28246243 [0,1,1,0,0,0|0,0,0]=2 3087 B9R0.7 CC(O)CO[C@@H](C)C(=O)O Amb27273395 [0,1,1,0,0,0|1,0,0]=3 3088 B9R0.7 CC(O)\C=C\C(C)C(=O)O Amb28246267 [0,1,1,0,0,0|1,0,1]=4 3089 B9R0.7 CC(OCC(Cl)Cl)C(=O)O Amb27656855 [0,1,1,0,0,0|2,0,0]=4 3090 B9R0.7 CC(SCC(=O)O)C(=O)O Amb2431034 [0,1,1,0,0,0|1,0,1]=4 3091 B9R0.7 C[C@@H](CCC(=O)O)C(=O)O Amb22799543 [0,1,1,0,0,0|1,0,1]=4 3092 B9R0.7 C[C@@H](N)CN[C@H](C)C(=O)O Amb27646700 [0,1,1,0,0,0|1,0,0]=3 3093 B9R0.7 C[C@@H](NCC(=O)O)C(=O)O Amb22748947 [0,1,1,0,0,0|0,0,1]=3 3094 B9R0.7 C[C@@H](NCC(F)F)C(=O)O Amb27440930 [0,1,1,0,0,0|1,0,0]=3 3095 B9R0.7 C[C@H](CCC(=O)O)C(=O)O Amb22225175 [0,1,1,0,0,0|1,0,1]=4 3096 B9R0.7 C[C@H](N)CN[C@H](C)C(=O)O Amb27445282 [0,1,1,0,0,0|1,0,0]=3 3097 B9R0.7 C[C@H](NCC(=O)O)C(=O)O Amb25133540 [0,1,1,0,0,0|0,0,1]=3 3098 B9R0.7 C[C@H](NCC(=O)O)C(=O)O Amb33803333 [0,1,1,0,0,0|0,0,1]=3 3099 B9R0.7 C[C@H](NCC(=O)O)C(N)=O Amb27771293 [0,1,1,0,0,0|1,0,1]=4 3100 B9R0.7 C[C@H](O)\C=C\[C@@H](C)C(=O)O Amb27617100 [0,1,1,0,0,0|1,0,1]=4 3101 B9R0.7 C\C(=C/C[C@@H](C)O)C(=O)O Amb27254118 [0,1,1,0,0,0|1,0,1]=4 3102 B9R0.8 C#CCN[C@@H](C)C(=O)OC Amb25700538 [0,1,1,0,0,0|1,0,1]=4 3103 B9R0.8 C#CCN[C@H](C)C(=O)OC Amb26559160 [0,1,1,0,0,0|1,0,1]=4 3104 B9R0.8 C=CCNC(C)C(=O)OC Amb24411113 [0,1,1,0,0,0|1,0,1]=4 3105 B9R0.8 CC(SCCO)C(=O)NN Amb28060229 [0,1,1,0,0,0|2,0,0]=4 3106 B9R0.8 CCC(=O)C(C)CCCO Amb28314429 [0,1,1,0,0,0|2,0,0]=4 3107 B9R0.8 CCCC[C@@H](C)C(=O)OC Amb27172534 [0,1,1,0,0,0|2,0,0]=4 3108 B9R0.8 CCCNC(C)C(=O)OC Amb25350065 [0,1,1,0,0,0|1,0,0]=3 3109 B9R0.8 CCCNC(C)C(=O)OC Amb32751764 [0,1,1,0,0,0|1,0,0]=3 3110 B9R0.8 CCCNC(C)\C(N)=N\O Amb27839028 [0,1,1,0,0,0|2,0,0]=4 3111 B9R0.8 CCCN[C@H](C)C(=O)OC Amb27812247 [0,1,1,0,0,0|1,0,0]=3 3112 B9R0.8 CCCO[C@H](C)C(=O)OC Amb28145144 [0,1,1,0,0,0|2,0,0]=4 3113 B9R0.8 CNC(=O)C(C)NCCF Amb27239508 [0,1,1,0,0,0|2,0,0]=4 3114 B9R0.8 COC(=O)C(C)CCCCl Amb27626035 [0,1,1,0,0,0|2,0,0]=4 3115 B9R0.8 COC(=O)C(C)CCCN Amb25904967 [0,1,1,0,0,0|2,0,0]=4 3116 B9R0.8 COC(=O)C(C)NCCF Amb25032140 [0,1,1,0,0,0|1,0,0]=3 3117 B9R0.8 COC(=O)C(C)NCCN Amb27426861 [0,1,1,0,0,0|1,0,0]=3 3118 B9R0.8 COC(=O)C(C)NCCO Amb28137392 [0,1,1,0,0,0|0,0,0]=2 3119 B9R0.8 COC(=O)C(N)CCCO Amb18644325 [0,1,1,0,0,0|2,0,0]=4 3120 B9R0.8 COC(=O)[C@@H](N)CCCO Amb27260220 [0,1,1,0,0,0|2,0,0]=4 3121 B9R0.8 COC(=O)[C@H](O)CCCO Amb27766582 [0,1,1,0,0,0|2,0,0]=4 3122 B9R0.8 COCNC(C)C(=O)OC Amb27838101 [0,1,1,0,0,0|2,0,0]=4 3123 B9R0.8 O=C(CO)[C@H](O)CCCO Amb27427126 [0,1,1,0,0,0|2,0,0]=4 3124 B9R0.13 C=CC(NCCC)C(=O)O Amb28454234 [0,1,1,0,0,0|1,0,1]=4 3125 B9R0.13 C=CC(NCCF)C(=O)O Amb28314319 [0,1,1,0,0,0|1,0,1]=4 3126 B9R0.13 C=CC(NCCN)C(=O)O Amb27197767 [0,1,1,0,0,0|1,0,1]=4 3127 B9R0.13 C=CCNC(CS)C(=O)O Amb28382320 [0,1,1,0,0,0|1,0,1]=4 3128 B9R0.13 CCC(NCCF)C(=O)O Amb27427562 [0,1,1,0,0,0|1,0,0]=3 3129 B9R0.13 CCC(NCCN)C(=O)O Amb28061779 [0,1,1,0,0,0|1,0,0]=3 3130 B9R0.13 CCC(NCCO)C(=O)O Amb18115226 [0,1,1,0,0,0|0,0,0]=2 3131 B9R0.13 CCC(NCCO)C(C)O Amb28145033 [0,1,1,0,0,0|1,0,1]=4 3132 B9R0.13 CCC(OCCN)C(=O)O Amb18111197 [0,1,1,0,0,0|2,0,0]=4 3133 B9R0.13 CCC(SCCN)C(=O)O Amb18788222 [0,1,1,0,0,0|2,0,0]=4 3134 B9R0.13 CCC(SCCO)C(N)=O Amb18788232 [0,1,1,0,0,0|2,0,0]=4 3135 B9R0.13 CCCCC(CBr)C(=O)O Amb27799965 [0,1,1,0,0,0|2,0,0]=4 3136 B9R0.13 CCCCC(CC)C(=O)O Amb3939821 [0,1,1,0,0,0|2,0,0]=4 3137 B9R0.13 CCCCC(CN)C(=O)O Amb26978768 [0,1,1,0,0,0|2,0,0]=4 3138 B9R0.13 CCCCC(CO)C(=O)O Amb27834958 [0,1,1,0,0,0|2,0,0]=4 3139 B9R0.13 CCCCC(NC)C(=O)O Amb24116642 [0,1,1,0,0,0|2,0,0]=4 3140 B9R0.13 CCCCC(OC)C(=O)O Amb25889001 [0,1,1,0,0,0|2,0,0]=4 3141 B9R0.13 CCCC[C@@H](CC)C(=O)O Amb28398235 [0,1,1,0,0,0|2,0,0]=4 3142 B9R0.13 CCCC[C@@H](CN)C(=O)O Amb27812140 [0,1,1,0,0,0|2,0,0]=4 3143 B9R0.13 CCCC[C@@H](NC)C(=O)O Amb22799980 [0,1,1,0,0,0|2,0,0]=4 3144 B9R0.13 CCCC[C@H](CC)C(=O)O Amb24671282 [0,1,1,0,0,0|2,0,0]=4 3145 B9R0.13 CCCC[C@H](CO)C(=O)O Amb16232529 [0,1,1,0,0,0|2,0,0]=4 3146 B9R0.13 CCCC[C@H](NC)C(=O)O Amb25887554 [0,1,1,0,0,0|2,0,0]=4 3147 B9R0.13 CCCNC(CC)C(N)=O Amb27873895 [0,1,1,0,0,0|2,0,0]=4 3148 B9R0.13 CCCN[C@@H](CS)C(=O)O Amb27645159 [0,1,1,0,0,0|1,0,0]=3 3149 B9R0.13 CCCN[C@H](CO)C(=O)O Amb28125350 [0,1,1,0,0,0|1,0,0]=3 3150 B9R0.13 CCCOC(CC)C(=O)O Amb9675479 [0,1,1,0,0,0|2,0,0]=4 3151 B9R0.13 CCCSC(CC)C(=O)O Amb9675504 [0,1,1,0,0,0|2,0,0]=4 3152 B9R0.13 CCCSC(CN)C(=O)O Amb27233967 [0,1,1,0,0,0|2,0,0]=4 3153 B9R0.13 CCCSC(CO)C(=O)O Amb27629095 [0,1,1,0,0,0|2,0,0]=4 3154 B9R0.13 CNC(CCCN)C(=O)O Amb18644280 [0,1,1,0,0,0|2,0,0]=4 3155 B9R0.13 CN[C@H](CCCN)C(=O)O Amb28060751 [0,1,1,0,0,0|2,0,0]=4 3156 B9R0.13 COC(CCCF)C(=O)O Amb33196102 [0,1,1,0,0,0|2,0,0]=4 3157 B9R0.13 COC(SCCO)C(C)=O Amb27835655 [0,1,1,0,0,0|2,0,0]=4 3158 B9R0.13 NCC(NCCF)C(=O)O Amb27246937 [0,1,1,0,0,0|1,0,0]=3 3159 B9R0.13 NCC(SCCO)C(=O)O Amb27233935 [0,1,1,0,0,0|1,0,0]=3 3160 B9R0.13 NCCCC(CS)C(=O)O Amb28458435 [0,1,1,0,0,0|2,0,0]=4 3161 B9R0.13 NCCNC(CN)C(=O)O Amb28454232 [0,1,1,0,0,0|1,0,0]=3 3162 B9R0.13 NCCN[C@@H](CS)C(=O)O Amb27407766 [0,1,1,0,0,0|1,0,0]=3 3163 B9R0.13 O=C(O)C(CO)SCCO Amb28196797 [0,1,1,0,0,0|1,0,0]=3 3164 B9R0.13 O=C(O)C(CS)NCCO Amb27454918 [0,1,1,0,0,0|0,0,0]=2 3165 B9R0.13 O=C(O)[C@H](CS)NCCCl Amb27592190 [0,1,1,0,0,0|1,0,0]=3 3166 B9R0.13 O=C(O)[C@H](CS)NCCO Amb27617120 [0,1,1,0,0,0|0,0,0]=2 3167 B9R0.42 CC(=O)C(C)CC(O)CO Amb27616537 [0,1,1,0,0,0|2,0,0]=4 3168 B9R0.42 CC(CN)NC(C)C(N)=O Amb27839468 [0,1,1,0,0,0|2,0,0]=4 3169 B9R0.42 CC(CO)CC(C)C(=O)O Amb27838009 [0,1,1,0,0,0|1,0,0]=3 3170 B9R0.42 CC(CO)CC(N)C(=O)O Amb25147300 [0,1,1,0,0,0|2,0,0]=4 3171 B9R0.42 CC(CO)C[C@@H](N)C(=O)O Amb33036727 [0,1,1,0,0,0|2,0,0]=4 3172 B9R0.42 CC(CO)C[C@H](N)C(=O)O Amb32865934 [0,1,1,0,0,0|2,0,0]=4 3173 B9R0.42 CC(CO)NC(C)C(N)=O Amb9360038 [0,1,1,0,0,0|1,0,0]=3 3174 B9R0.42 CC(CO)OC(C)C(=O)O Amb27664032 [0,1,1,0,0,0|1,0,0]=3 3175 B9R0.42 CC(CO)O[C@@H](C)C(=O)O Amb28255959 [0,1,1,0,0,0|1,0,0]=3 3176 B9R0.42 CC(CO)O[C@H](C)C(=O)O Amb27450794 [0,1,1,0,0,0|1,0,0]=3 3177 B9R0.42 CC(CO)SC(C)C(N)=O Amb27664026 [0,1,1,0,0,0|2,0,0]=4 3178 B9R0.42 CC(CO)SC(F)C(=O)O Amb28205607 [0,1,1,0,0,0|2,0,0]=4 3179 B9R0.42 CC(C[C@H](N)CS)C(=O)O Amb27981242 [0,1,1,0,0,0|1,1,0]=4 3180 B9R0.42 CC(NC(=O)CCl)C(=O)O Amb3940604 [0,1,1,0,0,0|1,0,1]=4 3181 B9R0.42 CC(NC(=O)CN)C(=O)O Amb533807 [0,1,1,0,0,0|1,0,1]=4 3182 B9R0.42 CC(N[C@@H](C)CF)C(N)=O Amb28315959 [0,1,1,0,0,0|2,0,0]=4 3183 B9R0.42 CCC(=O)NC(C)C(=O)O Amb1116933 [0,1,1,0,0,0|1,0,1]=4 3184 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O Amb22901053 [0,1,1,0,0,0|1,0,1]=4 3185 B9R0.42 CCC(C)CC(C)C(=O)O Amb22228338 [0,1,1,0,0,0|2,0,0]=4 3186 B9R0.42 CCC(C)C[C@@H](C)C(=O)O Amb33727258 [0,1,1,0,0,0|2,0,0]=4 3187 B9R0.42 CCC(C)C[C@H](C)C(=O)O Amb33743264 [0,1,1,0,0,0|2,0,0]=4 3188 B9R0.42 CCC(C)NC(C)C(N)=O Amb9203258 [0,1,1,0,0,0|2,0,0]=4 3189 B9R0.42 CCC(C)N[C@@H](C)C(=O)O Amb25691180 [0,1,1,0,0,0|1,0,0]=3 3190 B9R0.42 CCC(C)O[C@@H](C)C(=O)O Amb27395318 [0,1,1,0,0,0|2,0,0]=4 3191 B9R0.42 CCC(C)O[C@H](C)C(=O)O Amb27495202 [0,1,1,0,0,0|2,0,0]=4 3192 B9R0.42 CCC(O)CC(C)C(=O)O Amb28348984 [0,1,1,0,0,0|2,0,0]=4 3193 B9R0.42 CCS(=O)NC(C)C(=O)O Amb28319239 [0,1,1,0,0,0|2,0,0]=4 3194 B9R0.42 CCS(=O)N[C@@H](C)C(=O)O Amb27243800 [0,1,1,0,0,0|2,0,0]=4 3195 B9R0.42 CC[C@@H](C)C[C@@H](C)C(=O)O Amb28248596 [0,1,1,0,0,0|2,0,0]=4 3196 B9R0.42 CC[C@H](C)CC(C)C(=O)O Amb27770364 [0,1,1,0,0,0|2,0,0]=4 3197 B9R0.42 CC[C@H](C)C[C@H](C)C(=O)O Amb27472997 [0,1,1,0,0,0|2,0,0]=4 3198 B9R0.42 C[C@@H](CO)C[C@@H](N)C(=O)O Amb27398331 [0,1,1,0,0,0|2,0,0]=4 3199 B9R0.42 C[C@@H](CO)NC(=O)C(=O)O Amb28049727 [0,1,1,0,0,0|1,0,1]=4 3200 B9R0.42 C[C@@H](C[C@@H](O)CN)C(=O)O Amb27768864 [0,1,1,0,0,0|2,0,0]=4 3201 B9R0.42 C[C@@H](NC(=O)CCl)C(=O)O Amb10842258 [0,1,1,0,0,0|1,0,1]=4 3202 B9R0.42 C[C@H](CO)C[C@H](N)C(=O)O Amb27625117 [0,1,1,0,0,0|2,0,0]=4 3203 B9R0.42 C[C@H](C[C@@H](O)CN)C(=O)O Amb27169198 [0,1,1,0,0,0|2,0,0]=4 3204 B9R0.42 C[C@H](NC(=O)CCl)C(=O)O Amb2781694 [0,1,1,0,0,0|1,0,1]=4 3205 B9R0.42 C[C@H](NC(=O)CN)C(=O)O Amb537542 [0,1,1,0,0,0|1,0,1]=4 3206 B9R0.42 C[C@H](NC(=O)CS)C(=O)O Amb27780474 [0,1,1,0,0,0|0,1,1]=4 3207 B9R0.42 NC(CC(F)CO)C(=O)O Amb27632459 [0,1,1,0,0,0|2,0,0]=4 3208 B9R0.42 NC(CC(O)CO)C(=O)O Amb18644388 [0,1,1,0,0,0|2,0,0]=4 3209 B9R0.42 NC(CC(O)CO)C(=O)O Amb24117285 [0,1,1,0,0,0|2,0,0]=4 3210 B9R0.42 N[C@@H](CC(O)CO)C(=O)O Amb25870815 [0,1,1,0,0,0|2,0,0]=4 3211 B9R0.42 N[C@H](CC(O)CO)C(=O)O Amb33036156 [0,1,1,0,0,0|2,0,0]=4 3212 B9R0.42 O=C(O)C(O)C[C@H](O)CO Amb27984868 [0,1,1,0,0,0|2,0,0]=4 3213 B9R0.47 C#CCCN[C@H](C)C(=O)O Amb27495158 [0,1,1,0,0,0|1,0,0]=3 3214 B9R0.47 C#CCNCC(C)C(=O)O Amb9400290 [0,1,1,0,0,0|1,0,1]=4 3215 B9R0.47 C#CCONC(C)C(=O)O Amb27983484 [0,1,1,0,0,0|1,0,1]=4 3216 B9R0.47 C=CCCOC(C)C(=O)O Amb9208711 [0,1,1,0,0,0|2,0,0]=4 3217 B9R0.47 C=CCCO[C@@H](C)C(=O)O Amb27254188 [0,1,1,0,0,0|2,0,0]=4 3218 B9R0.47 C=CCCO[C@H](C)C(=O)O Amb27976475 [0,1,1,0,0,0|2,0,0]=4 3219 B9R0.47 CC#CCNC(C)C(=O)O Amb27604977 [0,1,1,0,0,0|1,0,1]=4 3220 B9R0.47 CC(=O)C(C)CCCCO Amb27787398 [0,1,1,0,0,0|2,0,0]=4 3221 B9R0.47 CC(CCCCBr)C(=O)O Amb27790626 [0,1,1,0,0,0|2,0,0]=4 3222 B9R0.47 CC(CCCCF)C(=O)O Amb24370978 [0,1,1,0,0,0|2,0,0]=4 3223 B9R0.47 CC(CCCCN)C(=O)O Amb31031269 [0,1,1,0,0,0|2,0,0]=4 3224 B9R0.47 CC(CCCCO)C(=O)O Amb28040862 [0,1,1,0,0,0|1,0,0]=3 3225 B9R0.47 CC(CNCCCl)C(=O)O Amb27974547 [0,1,1,0,0,0|1,0,0]=3 3226 B9R0.47 CC(CNCCN)C(=O)O Amb27398545 [0,1,1,0,0,0|1,0,0]=3 3227 B9R0.47 CC(CNCCO)C(N)=O Amb9358396 [0,1,1,0,0,0|1,0,0]=3 3228 B9R0.47 CC(CNCCO)S(C)=O Amb27245628 [0,1,1,0,0,0|2,0,0]=4 3229 B9R0.47 CC(CSCCN)C(=O)O Amb18788221 [0,1,1,0,0,0|2,0,0]=4 3230 B9R0.47 CC(CSCCN)C(=O)O Amb28555435 [0,1,1,0,0,0|2,0,0]=4 3231 B9R0.47 CC(NCCC#N)C(=O)O Amb4019288 [0,1,1,0,0,0|1,0,0]=3 3232 B9R0.47 CC(NCCCF)C(N)=O Amb28136243 [0,1,1,0,0,0|2,0,0]=4 3233 B9R0.47 CC(NCCCO)C(N)=O Amb9246629 [0,1,1,0,0,0|1,0,0]=3 3234 B9R0.47 CC(OCCCN)C(=O)O Amb18111477 [0,1,1,0,0,0|2,0,0]=4 3235 B9R0.47 CC(SCCC#N)C(=O)O Amb17502364 [0,1,1,0,0,0|2,0,0]=4 3236 B9R0.47 CC(SCCCF)C(=O)O Amb28049559 [0,1,1,0,0,0|2,0,0]=4 3237 B9R0.47 CC(SCCCN)C(=O)O Amb17500677 [0,1,1,0,0,0|2,0,0]=4 3238 B9R0.47 CC(SCCCS)C(=O)O Amb18648366 [0,1,1,0,0,0|1,1,0]=4 3239 B9R0.47 CC(\C=C\CCO)C(N)=O Amb28314158 [0,1,1,0,0,0|2,0,0]=4 3240 B9R0.47 CCCCC[C@H](C)C(=O)O Amb10844510 [0,1,1,0,0,0|2,0,0]=4 3241 B9R0.47 CCCCNC(C)C(=O)O Amb9326961 [0,1,1,0,0,0|1,0,0]=3 3242 B9R0.47 CCCCNC(C)C(N)=O Amb9203273 [0,1,1,0,0,0|2,0,0]=4 3243 B9R0.47 CCCCN[C@@H](C)C(=O)O Amb27192156 [0,1,1,0,0,0|1,0,0]=3 3244 B9R0.47 CCCCN[C@H](C)C(=O)O Amb27461559 [0,1,1,0,0,0|1,0,0]=3 3245 B9R0.47 CCCCOC(C)C(=O)O Amb8894957 [0,1,1,0,0,0|2,0,0]=4 3246 B9R0.47 CCCCO[C@@H](C)C(=O)O Amb27216767 [0,1,1,0,0,0|2,0,0]=4 3247 B9R0.47 CCCCSC(C)C(=O)O Amb6273551 [0,1,1,0,0,0|2,0,0]=4 3248 B9R0.47 CCCCS[C@@H](C)C(=O)O Amb27408996 [0,1,1,0,0,0|2,0,0]=4 3249 B9R0.47 CCCN\N=C(/C)C(=O)O Amb27495222 [0,1,1,0,0,0|1,0,1]=4 3250 B9R0.47 CCC\C=C\C(C)C(=O)O Amb33449140 [0,1,1,0,0,0|2,0,0]=4 3251 B9R0.47 CCNCCC(C)C(=O)O Amb27473572 [0,1,1,0,0,0|2,0,0]=4 3252 B9R0.47 CCOCOC(C)C(=O)O Amb27426180 [0,1,1,0,0,0|2,0,0]=4 3253 B9R0.47 CCOCO[C@H](C)C(=O)O Amb27765041 [0,1,1,0,0,0|2,0,0]=4 3254 B9R0.47 CCONCC(C)C(=O)O Amb27265783 [0,1,1,0,0,0|2,0,0]=4 3255 B9R0.47 CCSCCC(C)C(=O)O Amb10844082 [0,1,1,0,0,0|2,0,0]=4 3256 B9R0.47 CNCCOC(C)C(=O)O Amb18630742 [0,1,1,0,0,0|2,0,0]=4 3257 B9R0.47 COCCCC(C)C(=O)O Amb26653888 [0,1,1,0,0,0|1,0,0]=3 3258 B9R0.47 COCCCC(C)C(C)=O Amb27657482 [0,1,1,0,0,0|2,0,0]=4 3259 B9R0.47 COCCCC(C)C(N)=O Amb28190149 [0,1,1,0,0,0|2,0,0]=4 3260 B9R0.47 COCCCC(N)C(=O)O Amb22058809 [0,1,1,0,0,0|2,0,0]=4 3261 B9R0.47 COCCCC(N)C(=O)O Amb33549526 [0,1,1,0,0,0|2,0,0]=4 3262 B9R0.47 COCCCC(O)C(=O)O Amb28050541 [0,1,1,0,0,0|2,0,0]=4 3263 B9R0.47 COCCC[C@@H](N)C(=O)O Amb25081508 [0,1,1,0,0,0|2,0,0]=4 3264 B9R0.47 COCCC[C@H](N)C(=O)O Amb25378737 [0,1,1,0,0,0|2,0,0]=4 3265 B9R0.47 COCCNC(=O)C(=O)O Amb9303795 [0,1,1,0,0,0|1,0,1]=4 3266 B9R0.47 COCCNC(C)C(=O)O Amb33069032 [0,1,1,0,0,0|0,0,0]=2 3267 B9R0.47 COCCNC(C)C(=O)O Amb9326996 [0,1,1,0,0,0|0,0,0]=2 3268 B9R0.47 COCCNC(C)C(C)O Amb27615108 [0,1,1,0,0,0|1,0,1]=4 3269 B9R0.47 COCCNC(C)C(N)=O Amb19222868 [0,1,1,0,0,0|1,0,0]=3 3270 B9R0.47 COCCNC(C)C(N)=O Amb9203267 [0,1,1,0,0,0|1,0,0]=3 3271 B9R0.47 COCCN[C@@H](C)C(=O)O Amb27164971 [0,1,1,0,0,0|0,0,0]=2 3272 B9R0.47 COCCN[C@H](C)C(=O)O Amb27454332 [0,1,1,0,0,0|0,0,0]=2 3273 B9R0.47 COCCOC(C)C(=O)O Amb9719532 [0,1,1,0,0,0|1,0,0]=3 3274 B9R0.47 COCCO[C@H](C)C(=O)O Amb27783895 [0,1,1,0,0,0|1,0,0]=3 3275 B9R0.47 COCOCC(C)C(=O)O Amb27667113 [0,1,1,0,0,0|2,0,0]=4 3276 B9R0.47 COCSCC(C)C(=O)O Amb27474867 [0,1,1,0,0,0|2,0,0]=4 3277 B9R0.47 CSCCCC(C)C(=O)O Amb25888073 [0,1,1,0,0,0|1,1,0]=4 3278 B9R0.47 CSCCNC(C)C(N)=O Amb27400757 [0,1,1,0,0,0|1,1,0]=4 3279 B9R0.47 CSCCOC(C)C(=O)O Amb24482366 [0,1,1,0,0,0|1,1,0]=4 3280 B9R0.47 CSCCO[C@H](C)C(=O)O Amb27865202 [0,1,1,0,0,0|1,1,0]=4 3281 B9R0.47 CSCCSC(C)C(=O)O Amb28291750 [0,1,1,0,0,0|1,1,0]=4 3282 B9R0.47 C[C@@H](CCCCBr)C(=O)O Amb27794794 [0,1,1,0,0,0|2,0,0]=4 3283 B9R0.47 C[C@@H](NCCC#N)C(=O)O Amb27445400 [0,1,1,0,0,0|1,0,0]=3 3284 B9R0.47 C[C@@H](NCCCN)C(=O)O Amb25710680 [0,1,1,0,0,0|1,0,0]=3 3285 B9R0.47 C[C@@H](OCCCN)C(=O)O Amb27465122 [0,1,1,0,0,0|2,0,0]=4 3286 B9R0.47 C[C@H](NCCCO)C(=O)O Amb27454333 [0,1,1,0,0,0|0,0,0]=2 3287 B9R0.47 C\C(=N/NCCO)C(=O)O Amb27210218 [0,1,1,0,0,0|0,0,1]=3 3288 B9R0.47 C\C=C\CN[C@@H](C)C(=O)O Amb27601181 [0,1,1,0,0,0|1,0,1]=4 3289 B9R0.47 C\C=C\CN[C@H](C)C(=O)O Amb27440981 [0,1,1,0,0,0|1,0,1]=4 3290 B9R0.47 NC(CCCCO)C(=O)O Amb2699159 [0,1,1,0,0,0|2,0,0]=4 3291 B9R0.47 NC(CSCCO)C(=O)O Amb6262852 [0,1,1,0,0,0|2,0,0]=4 3292 B9R0.47 NOCCCC(N)C(=O)O Amb24117962 [0,1,1,0,0,0|2,0,0]=4 3293 B9R0.47 NOCCCC(N)C(=O)O Amb27222313 [0,1,1,0,0,0|2,0,0]=4 3294 B9R0.47 NOCCC[C@H](N)C(=O)O Amb28397870 [0,1,1,0,0,0|2,0,0]=4 3295 B9R0.47 N[C@@H](CCCCO)C(=O)O Amb2695139 [0,1,1,0,0,0|2,0,0]=4 3296 B9R0.47 N[C@@H](CCCNO)C(=O)O Amb29083430 [0,1,1,0,0,0|2,0,0]=4 3297 B9R0.47 N[C@@H](CCCNO)C(=O)O Amb30666629 [0,1,1,0,0,0|2,0,0]=4 3298 B9R0.47 N[C@@H](CNCCO)C(=O)O Amb25146307 [0,1,1,0,0,0|1,0,0]=3 3299 B9R0.47 N[C@@H](CSCCO)C(=O)O Amb2695551 [0,1,1,0,0,0|2,0,0]=4 3300 B9R0.47 N[C@H](CCCCO)C(=O)O Amb26969244 [0,1,1,0,0,0|2,0,0]=4 3301 B9R0.47 N[C@H](CSCCO)C(=O)O Amb8629048 [0,1,1,0,0,0|2,0,0]=4 3302 B9R0.47 N[C@H](\C=C\CCO)C(=O)O Amb24603441 [0,1,1,0,0,0|2,0,0]=4 3303 B9R0.47 O=C(O)C(O)CCCCO Amb18644356 [0,1,1,0,0,0|2,0,0]=4 3304 B9R0.47 O=C(O)C(O)CNCCO Amb27456529 [0,1,1,0,0,0|1,0,0]=3 3305 B9R0.51 C=CCNC(C)(C)C(=O)O Amb17399883 [0,1,1,0,0,0|1,0,1]=4 3306 B9R0.51 CC(C)(CCCCl)C(=O)O Amb27601953 [0,1,1,0,0,0|2,0,0]=4 3307 B9R0.51 CC(C)(CCCF)C(=O)O Amb28049560 [0,1,1,0,0,0|2,0,0]=4 3308 B9R0.51 CC(C)(CCCN)C(=O)O Amb26855022 [0,1,1,0,0,0|2,0,0]=4 3309 B9R0.51 CC(C)(CCCN)C(=O)O Amb27601033 [0,1,1,0,0,0|2,0,0]=4 3310 B9R0.51 CC(C)(CCCO)C(=O)O Amb28410873 [0,1,1,0,0,0|1,0,0]=3 3311 B9R0.51 CC(C)(CCCO)C(=O)[O-] Amb32674658 [0,1,1,0,0,0|1,0,1]=4 3312 B9R0.51 CC(C)(CCNO)C(=O)O Amb28320464 [0,1,1,0,0,0|2,0,0]=4 3313 B9R0.51 CC(C)(NCCF)C(N)=O Amb27624506 [0,1,1,0,0,0|2,0,0]=4 3314 B9R0.51 CC(C)(NCCN)C(N)=O Amb27801761 [0,1,1,0,0,0|2,0,0]=4 3315 B9R0.51 CC(C)(OCCCl)C(=O)O Amb27868775 [0,1,1,0,0,0|2,0,0]=4 3316 B9R0.51 CC(C)(OCCN)C(=O)O Amb18110232 [0,1,1,0,0,0|2,0,0]=4 3317 B9R0.51 CC(C)(OCCO)C(=O)O Amb24454935 [0,1,1,0,0,0|1,0,0]=3 3318 B9R0.51 CC(C)(SCCN)C(=O)O Amb17500467 [0,1,1,0,0,0|2,0,0]=4 3319 B9R0.51 CC(C)(SCCO)C(=O)O Amb17502590 [0,1,1,0,0,0|1,0,0]=3 3320 B9R0.51 CC(N)(CCCF)C(=O)O Amb32670154 [0,1,1,0,0,0|2,0,0]=4 3321 B9R0.51 CC(N)(CCCN)C(=O)O Amb18644277 [0,1,1,0,0,0|2,0,0]=4 3322 B9R0.51 CC(N)(CCCN)C(=O)O Amb2697838 [0,1,1,0,0,0|2,0,0]=4 3323 B9R0.51 CC(O)(CCCF)C(=O)O Amb33196095 [0,1,1,0,0,0|2,0,0]=4 3324 B9R0.51 CC(O)C(C)(C)NCCO Amb27791415 [0,1,1,0,0,0|1,0,1]=4 3325 B9R0.51 CCCCC(C)(Br)C(=O)O Amb28198025 [0,1,1,0,0,0|2,0,0]=4 3326 B9R0.51 CCCCC(C)(C)C(=O)O Amb2687527 [0,1,1,0,0,0|2,0,0]=4 3327 B9R0.51 CCCCC(C)(F)C(=O)O Amb24444856 [0,1,1,0,0,0|2,0,0]=4 3328 B9R0.51 CCCCC(C)(N)C(=O)O Amb33743440 [0,1,1,0,0,0|2,0,0]=4 3329 B9R0.51 CCCCC(C)(N)C(=O)O Amb4134834 [0,1,1,0,0,0|2,0,0]=4 3330 B9R0.51 CCCCC(C)(O)C(=O)O Amb17593657 [0,1,1,0,0,0|2,0,0]=4 3331 B9R0.51 CCCC[C@@](C)(N)C(=O)O Amb26346904 [0,1,1,0,0,0|2,0,0]=4 3332 B9R0.51 CCCC[C@@](C)(O)C(=O)O Amb27221053 [0,1,1,0,0,0|2,0,0]=4 3333 B9R0.51 CCCC[C@](C)(N)C(=O)O Amb25961122 [0,1,1,0,0,0|2,0,0]=4 3334 B9R0.51 CCCC[C@](C)(O)C(=O)O Amb27615053 [0,1,1,0,0,0|2,0,0]=4 3335 B9R0.51 CCCNC(C)(C)C(=O)O Amb9620095 [0,1,1,0,0,0|1,0,0]=3 3336 B9R0.51 CCCNC(C)(C)[PH](=O)O Amb27667792 [0,1,1,0,0,0|2,0,0]=4 3337 B9R0.51 CCCSC(C)(C)C(=O)O Amb17501481 [0,1,1,0,0,0|2,0,0]=4 3338 B9R0.51 C[C@@](N)(CCCN)C(=O)O Amb27468967 [0,1,1,0,0,0|2,0,0]=4 3339 B9R0.51 C[C@](O)(CCCO)C(=O)O Amb27252130 [0,1,1,0,0,0|1,0,0]=3 3340 B9R0.51 O=C(O)C(F)(F)CCCO Amb24652882 [0,1,1,0,0,0|2,0,0]=4 3341 B9R0.21 CS(=O)(=O)CCC(O)CN Amb25803143 [0,1,1,0,0,0|1,0,1]=4 3342 B9R0.21 CS(=O)(=O)CC[C@@H](O)CN Amb33053762 [0,1,1,0,0,0|1,0,1]=4 3343 B9R0.21 CS(=O)(=O)CC[C@H](O)CN Amb33053766 [0,1,1,0,0,0|1,0,1]=4 3344 B9R0.21 NC[C@@H](O)CSP(=O)(O)O Amb28064125 [0,1,1,0,0,0|2,0,0]=4 3345 B9R0.21 O=P(O)(O)CCC(O)CO Amb27775417 [0,1,1,0,0,0|2,0,0]=4 3346 B9R0.23 CC(=O)C[C@@H](O)[C@@H](O)CO Amb25767917 [0,1,1,0,0,0|2,0,0]=4 3347 B9R0.23 CC(CC(=O)O)C(N)CO Amb27843636 [0,1,1,0,0,0|2,0,0]=4 3348 B9R0.23 CC(CN)N(C)CC(=O)O Amb27453888 [0,1,1,0,0,0|2,0,0]=4 3349 B9R0.23 CCC(C)C(C)CC(=O)O Amb18304200 [0,1,1,0,0,0|2,0,0]=4 3350 B9R0.23 CCC(C)C(N)CC(=O)O Amb2438880 [0,1,1,0,0,0|2,0,0]=4 3351 B9R0.23 CCC(C)C(O)CC(=O)O Amb18310690 [0,1,1,0,0,0|2,0,0]=4 3352 B9R0.23 CCC(C)[C@@H](N)CC(=O)O Amb28455466 [0,1,1,0,0,0|2,0,0]=4 3353 B9R0.23 CCC(C)[C@@H](O)CC(=O)O Amb33318493 [0,1,1,0,0,0|2,0,0]=4 3354 B9R0.23 CCC(C)[C@H](N)CC(=O)O Amb25117039 [0,1,1,0,0,0|2,0,0]=4 3355 B9R0.23 CCC(C)[C@H](O)CC(=O)O Amb33318492 [0,1,1,0,0,0|2,0,0]=4 3356 B9R0.23 CC[C@@H](C)C(N)CC(=O)O Amb32687892 [0,1,1,0,0,0|2,0,0]=4 3357 B9R0.23 CC[C@@H](C)[C@@H](N)CC(=O)O Amb25689818 [0,1,1,0,0,0|2,0,0]=4 3358 B9R0.23 CC[C@H](C)C(N)CC(=O)O Amb32687890 [0,1,1,0,0,0|2,0,0]=4 3359 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O Amb16184016 [0,1,1,0,0,0|2,0,0]=4 3360 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb19944304 [0,1,1,0,0,0|2,0,0]=4 3361 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb25068405 [0,1,1,0,0,0|2,0,0]=4 3362 B9R0.23 CC[C@H](O)[C@@H](N)CC(=O)O Amb27469484 [0,1,1,0,0,0|1,0,0]=3 3363 B9R0.23 NC(=O)CC(N)[C@H](O)CO Amb28050874 [0,1,1,0,0,0|2,0,0]=4 3364 B9R0.23 NC(=O)C[C@@H](O)[C@H](O)CO Amb27788545 [0,1,1,0,0,0|2,0,0]=4 3365 B9R0.23 NC(=O)C[C@H](O)[C@H](O)CO Amb27759937 [0,1,1,0,0,0|2,0,0]=4 3366 B9R0.23 NC(CC(=O)O)C(O)CF Amb28071644 [0,1,1,0,0,0|1,0,0]=3 3367 B9R0.23 NC(CO)C(N)CC(=O)O Amb27804493 [0,1,1,0,0,0|2,0,0]=4 3368 B9R0.23 N[C@@H](CO)[C@H](N)CC(=O)O Amb27594534 [0,1,1,0,0,0|2,0,0]=4 3369 B9R0.23 O=C(O)C[C@@H](O)[C@@H](O)CO Amb24726353 [0,1,1,0,0,0|1,0,0]=3 3370 B9R0.24 C#CC(O)CCC(=O)OC Amb27851096 [0,1,1,0,0,0|1,0,1]=4 3371 B9R0.24 C#C[C@@H](O)CCC(=O)OC Amb28207270 [0,1,1,0,0,0|1,0,1]=4 3372 B9R0.24 CCC(=O)CCC(C)CN Amb28060686 [0,1,1,0,0,0|2,0,0]=4 3373 B9R0.24 CCC(=O)CCC(O)CF Amb28437142 [0,1,1,0,0,0|2,0,0]=4 3374 B9R0.24 CCC(Br)CCC(=O)OC Amb28049989 [0,1,1,0,0,0|2,0,0]=4 3375 B9R0.24 CCC(C)CCC(=O)OC Amb25690993 [0,1,1,0,0,0|2,0,0]=4 3376 B9R0.24 CCC(Cl)CCC(=O)OC Amb28076681 [0,1,1,0,0,0|2,0,0]=4 3377 B9R0.24 CCC(N)CCC(=O)OC Amb26855249 [0,1,1,0,0,0|2,0,0]=4 3378 B9R0.24 CCC(N)CCC(=O)OC Amb33483211 [0,1,1,0,0,0|2,0,0]=4 3379 B9R0.24 CCC(O)CCC(=O)NN Amb6337544 [0,1,1,0,0,0|2,0,0]=4 3380 B9R0.24 CCC(O)CCC(=O)OC Amb25850223 [0,1,1,0,0,0|1,0,0]=3 3381 B9R0.24 CC[C@@H](O)CCC(=O)OC Amb24561650 [0,1,1,0,0,0|1,0,0]=3 3382 B9R0.24 COC(=O)CCC(=O)CN Amb18202127 [0,1,1,0,0,0|0,0,2]=4 3383 B9R0.24 COC(=O)CCC(=O)CN Amb6366854 [0,1,1,0,0,0|0,0,2]=4 3384 B9R0.24 COC(=O)CCC(C)CN Amb26032831 [0,1,1,0,0,0|1,0,0]=3 3385 B9R0.24 COC(=O)CCC(C)CO Amb28319952 [0,1,1,0,0,0|2,0,0]=4 3386 B9R0.24 COC(=O)CCC(N)CF Amb24517084 [0,1,1,0,0,0|2,0,0]=4 3387 B9R0.24 COC(=O)CC[C@@H](C)CN Amb27468094 [0,1,1,0,0,0|1,0,0]=3 3388 B9R0.24 COC(=O)CC[C@@H](C)CO Amb28050698 [0,1,1,0,0,0|2,0,0]=4 3389 B9R0.24 COC(=O)CC[C@@H](O)C#N Amb27763450 [0,1,1,0,0,0|0,0,2]=4 3390 B9R0.24 COC(=O)CC[C@@H](O)CO Amb27761525 [0,1,1,0,0,0|1,0,0]=3 3391 B9R0.24 COC(=O)CC[C@H](N)CF Amb27628411 [0,1,1,0,0,0|2,0,0]=4 3392 B9R0.24 COC(=O)CC[C@H](O)C#N Amb28050749 [0,1,1,0,0,0|0,0,2]=4 3393 B9R0.24 COC(=O)CC[C@H](O)CBr Amb27635803 [0,1,1,0,0,0|1,0,0]=3 3394 B9R0.24 COC(=O)NCC(O)CO Amb27876174 [0,1,1,0,0,0|2,0,0]=4 3395 B9R0.24 NCC(O)CCC(O)CN Amb27815343 [0,1,1,0,0,0|1,0,1]=4 3396 B9R0.43 CCC(C#N)CCC(=O)O Amb18643712 [0,1,1,0,0,0|2,0,0]=4 3397 B9R0.43 CCC(CC)CCC(=O)O Amb27462787 [0,1,1,0,0,0|2,0,0]=4 3398 B9R0.43 CCC(CCC(=O)O)NC Amb27230822 [0,1,1,0,0,0|2,0,0]=4 3399 B9R0.43 CCC(CCC(=O)O)OC Amb26936159 [0,1,1,0,0,0|1,0,0]=3 3400 B9R0.43 CCC(CCC(C)=O)OC Amb26981457 [0,1,1,0,0,0|2,0,0]=4 3401 B9R0.43 CCC(CO)CCC(C)=O Amb8395984 [0,1,1,0,0,0|2,0,0]=4 3402 B9R0.43 CCC(OC)OCC(=O)O Amb33341549 [0,1,1,0,0,0|2,0,0]=4 3403 B9R0.43 CC\C(CCC(=O)O)=N/O Amb27459310 [0,1,1,0,0,0|1,0,1]=4 3404 B9R0.43 COC(CCC(=O)O)OC Amb24657204 [0,1,1,0,0,0|2,0,0]=4 3405 B9R0.48 C=CCC(C)CCC(=O)O Amb27605823 [0,1,1,0,0,0|2,0,0]=4 3406 B9R0.48 C=CCC(O)CCC(C)=O Amb28194573 [0,1,1,0,0,0|2,0,0]=4 3407 B9R0.48 C=CC[C@@H](O)CCC(C)=O Amb28386579 [0,1,1,0,0,0|2,0,0]=4 3408 B9R0.48 CC(=O)CCC(C)CCN Amb27426882 [0,1,1,0,0,0|2,0,0]=4 3409 B9R0.48 CC(=O)CCC(O)CC#N Amb18643714 [0,1,1,0,0,0|1,0,1]=4 3410 B9R0.48 CC(CC=O)CCC(=O)O Amb27439382 [0,1,1,0,0,0|2,0,0]=4 3411 B9R0.48 CC(CCCl)CCC(=O)O Amb27834348 [0,1,1,0,0,0|2,0,0]=4 3412 B9R0.48 CC(CCN)CCC(=O)O Amb18124749 [0,1,1,0,0,0|1,0,0]=3 3413 B9R0.48 CC(CCN)CCC(N)=O Amb19515543 [0,1,1,0,0,0|2,0,0]=4 3414 B9R0.48 CC(CCN)SCC(=O)O Amb27244497 [0,1,1,0,0,0|2,0,0]=4 3415 B9R0.48 CC(CCS)CCC(=O)O Amb28291582 [0,1,1,0,0,0|2,0,0]=4 3416 B9R0.48 CCCC(C)CCC(=O)O Amb28193257 [0,1,1,0,0,0|2,0,0]=4 3417 B9R0.48 CCCC(N)CCC(=O)O Amb1014101 [0,1,1,0,0,0|2,0,0]=4 3418 B9R0.48 CCCC(O)CCC(=O)O Amb17689110 [0,1,1,0,0,0|1,0,0]=3 3419 B9R0.48 CCCC(O)CCC(=O)[O-] Amb17778117 [0,1,1,0,0,0|1,0,1]=4 3420 B9R0.48 CCCC(O)CCC(=O)[O-] Amb2386295 [0,1,1,0,0,0|1,0,1]=4 3421 B9R0.48 CCCN(O)CCC(=O)O Amb27196070 [0,1,1,0,0,0|2,0,0]=4 3422 B9R0.48 CCC[C@@H](O)CCC(=O)O Amb28050107 [0,1,1,0,0,0|1,0,0]=3 3423 B9R0.48 CCC[C@H](C)CCC(=O)O Amb24446759 [0,1,1,0,0,0|2,0,0]=4 3424 B9R0.48 CCC[C@H](O)CCC(=O)O Amb27618330 [0,1,1,0,0,0|1,0,0]=3 3425 B9R0.48 CCC[C@H](O)CCC(N)=O Amb27765010 [0,1,1,0,0,0|2,0,0]=4 3426 B9R0.48 CCOC(C)CCC(=O)O Amb24690847 [0,1,1,0,0,0|2,0,0]=4 3427 B9R0.48 CN(CCN)CCC(=O)O Amb28382339 [0,1,1,0,0,0|2,0,0]=4 3428 B9R0.48 CNCC(O)CNC(C)=O Amb24577191 [0,1,1,0,0,0|2,0,0]=4 3429 B9R0.48 COCC(Cl)CCC(=O)O Amb27456486 [0,1,1,0,0,0|2,0,0]=4 3430 B9R0.48 COCC(N)CCC(=O)O Amb33036364 [0,1,1,0,0,0|2,0,0]=4 3431 B9R0.48 COCC(O)CCC(=O)O Amb33036250 [0,1,1,0,0,0|1,0,0]=3 3432 B9R0.48 CSCC(N)CCC(=O)O Amb33272065 [0,1,1,0,0,0|2,0,0]=4 3433 B9R0.48 CSCC(O)CCC(=O)O Amb27490998 [0,1,1,0,0,0|1,0,0]=3 3434 B9R0.48 C[C@@H](CC#N)CCC(=O)O Amb27950078 [0,1,1,0,0,0|1,0,1]=4 3435 B9R0.48 C[C@@H](CCO)CCC(=O)O Amb28250798 [0,1,1,0,0,0|2,0,0]=4 3436 B9R0.48 NC(CCF)CCC(=O)O Amb33480872 [0,1,1,0,0,0|2,0,0]=4 3437 B9R0.48 NCCC(N)CCC(=O)O Amb27390542 [0,1,1,0,0,0|1,0,0]=3 3438 B9R0.48 NCNC(=O)CCC(=O)O Amb27753445 [0,1,1,0,0,0|0,0,2]=4 3439 B9R0.48 N[C@H](CCS)CCC(=O)O Amb27857300 [0,1,1,0,0,0|2,0,0]=4 3440 B9R0.48 O=C(O)CCC(O)CCO Amb28121295 [0,1,1,0,0,0|1,0,0]=3 3441 B9R0.64 C#CC(C)(O)CCC(=O)O Amb27168591 [0,1,1,0,0,0|1,0,1]=4 3442 B9R0.64 CC(C)(CN)CCC(=O)O Amb27790470 [0,1,1,0,0,0|1,0,0]=3 3443 B9R0.64 CC(C)(CO)CCC(=O)O Amb27173192 [0,1,1,0,0,0|2,0,0]=4 3444 B9R0.64 CC(O)(C#N)CCC(=O)O Amb28050165 [0,1,1,0,0,0|0,0,2]=4 3445 B9R0.64 CCC(C)(C)CCC(=O)O Amb18644164 [0,1,1,0,0,0|2,0,0]=4 3446 B9R0.64 CCC(C)(N)CCC(=O)O Amb33036311 [0,1,1,0,0,0|2,0,0]=4 3447 B9R0.64 CCC(C)(O)CCC(=O)O Amb25317242 [0,1,1,0,0,0|1,0,0]=3 3448 B9R0.64 CC[C@](C)(O)CCC(=O)O Amb27810635 [0,1,1,0,0,0|1,0,0]=3 3449 B9R0.64 O=C(O)CCC(F)(F)CCl Amb27477848 [0,1,1,0,0,0|2,0,0]=4 3450 B9R0.64 O=C(O)CCC(F)(F)CO Amb33620699 [0,1,1,0,0,0|2,0,0]=4 3451 B9R0.64 O=C(O)CCP(=O)(O)CCl Amb27615065 [0,1,1,0,0,0|2,0,0]=4 3452 B9R0.12 CCC(CCN)C(=O)OC Amb18831468 [0,1,1,0,0,0|2,0,0]=4 3453 B9R0.12 CCC(CCO)C(=O)OC Amb17593656 [0,1,1,0,0,0|1,0,0]=3 3454 B9R0.12 CCCC(CC)C(=O)OC Amb26855569 [0,1,1,0,0,0|2,0,0]=4 3455 B9R0.12 CCCC(NC)C(=O)OC Amb24116637 [0,1,1,0,0,0|1,0,0]=3 3456 B9R0.12 CCCC(NC)C(=O)OC Amb33735073 [0,1,1,0,0,0|1,0,0]=3 3457 B9R0.12 CCC[C@H](NC)C(=O)OC Amb25980086 [0,1,1,0,0,0|1,0,0]=3 3458 B9R0.12 CCN(CCO)C(=O)CO Amb5798176 [0,1,1,0,0,0|2,0,0]=4 3459 B9R0.12 CNC(=O)C(CCO)NC Amb10809383 [0,1,1,0,0,0|1,0,0]=3 3460 B9R0.12 CNC(COC)C(=O)OC Amb20630218 [0,1,1,0,0,0|2,0,0]=4 3461 B9R0.12 CNC(CSC)C(=O)OC Amb18788231 [0,1,1,0,0,0|2,0,0]=4 3462 B9R0.12 CNCC(NC)C(=O)OC Amb27858921 [0,1,1,0,0,0|2,0,0]=4 3463 B9R0.12 COC(=O)C(CCN)OC Amb27866819 [0,1,1,0,0,0|2,0,0]=4 3464 B9R0.12 COC(=O)[C@H](CCN)OC Amb27253593 [0,1,1,0,0,0|2,0,0]=4 3465 B9R0.15 CC#CC(CCC)C(=O)O Amb27590192 [0,1,1,0,0,0|2,0,0]=4 3466 B9R0.15 CCCC(CCC)C(=O)O Amb3940097 [0,1,1,0,0,0|2,0,0]=4 3467 B9R0.15 CCCC(CCCl)C(=O)O Amb27427463 [0,1,1,0,0,0|2,0,0]=4 3468 B9R0.15 CCCC(CCF)C(=O)O Amb27837855 [0,1,1,0,0,0|2,0,0]=4 3469 B9R0.15 CCCC(CCN)C(=O)O Amb33756786 [0,1,1,0,0,0|2,0,0]=4 3470 B9R0.15 CCCC(NC=O)C(=O)O Amb9871545 [0,1,1,0,0,0|1,0,1]=4 3471 B9R0.15 CCCC(NCC)C(=O)O Amb9496319 [0,1,1,0,0,0|1,0,0]=3 3472 B9R0.15 CCCC(OCC)C(=O)O Amb28050125 [0,1,1,0,0,0|2,0,0]=4 3473 B9R0.15 CCC[C@@H](NC=O)C(=O)O Amb27831939 [0,1,1,0,0,0|1,0,1]=4 3474 B9R0.15 CCC[C@@H](NCC)C(=O)O Amb33347491 [0,1,1,0,0,0|1,0,0]=3 3475 B9R0.15 CCC[C@H](NCC)C(=O)O Amb33347483 [0,1,1,0,0,0|1,0,0]=3 3476 B9R0.15 CCNC(CCN)C(=O)O Amb27830036 [0,1,1,0,0,0|1,0,0]=3 3477 B9R0.15 CCN[C@H](COC)C(=O)O Amb33347499 [0,1,1,0,0,0|2,0,0]=4 3478 B9R0.15 CC\C=C(/CCO)C(=O)O Amb27832032 [0,1,1,0,0,0|1,0,1]=4 3479 B9R0.15 CSCC(NCO)C(=O)O Amb28137810 [0,1,1,0,0,0|2,0,0]=4 3480 B9R0.15 C\C=C\C(CCC)C(=O)O Amb18643916 [0,1,1,0,0,0|2,0,0]=4 3481 B9R0.15 NCCC(CCF)C(=O)O Amb27870809 [0,1,1,0,0,0|2,0,0]=4 3482 B9R0.15 NCCC(CCN)C(=O)O Amb20622689 [0,1,1,0,0,0|2,0,0]=4 3483 B9R0.15 NCCC(CCN)C(=O)O Amb24120603 [0,1,1,0,0,0|2,0,0]=4 3484 B9R0.15 NCCN(CCO)C(=O)O Amb24100350 [0,1,1,0,0,0|2,0,0]=4 3485 B9R0.15 O=C(O)C(CCO)CCBr Amb24616904 [0,1,1,0,0,0|1,0,0]=3 3486 B9R0.15 O=C(O)C(CCS)CCS Amb27955283 [0,1,1,0,0,0|1,1,0]=4 3487 B9R0.15 O=CNC(CCF)C(=O)O Amb26995646 [0,1,1,0,0,0|1,0,1]=4 3488 B9R0.15 O=CNC(CCO)C(=O)O Amb18305692 [0,1,1,0,0,0|0,0,1]=3 3489 B9R0.15 O=CN[C@H](CCO)C(=O)O Amb27238455 [0,1,1,0,0,0|0,0,1]=3 3490 B9R0.29 CC(CO)C(C#N)C(=O)O Amb35741474 [0,1,1,0,0,0|2,0,0]=4 3491 B9R0.29 CCC(C(=O)O)C(C)CCl Amb27969167 [0,1,1,0,0,0|2,0,0]=4 3492 B9R0.29 CCC(C(=O)O)[C@@H](C)CC Amb28050112 [0,1,1,0,0,0|2,0,0]=4 3493 B9R0.29 CCC(C)C(NC)C(=O)O Amb33551329 [0,1,1,0,0,0|1,0,0]=3 3494 B9R0.29 CCC(C)C(NC)C(=O)O Amb4018745 [0,1,1,0,0,0|1,0,0]=3 3495 B9R0.29 CCC(C)C(NS)C(=O)O Amb27876164 [0,1,1,0,0,0|2,0,0]=4 3496 B9R0.29 CCC(C)C(OC)C(=O)O Amb24563898 [0,1,1,0,0,0|2,0,0]=4 3497 B9R0.29 CCC(C)[C@H](NC)C(=O)O Amb27390153 [0,1,1,0,0,0|1,0,0]=3 3498 B9R0.29 CCC(N)C(CC)C(=O)O Amb28041915 [0,1,1,0,0,0|2,0,0]=4 3499 B9R0.29 CCC(O)C(CC)C(=O)O Amb18310733 [0,1,1,0,0,0|2,0,0]=4 3500 B9R0.29 CCC(O)C(OC)C(=O)O Amb18644355 [0,1,1,0,0,0|2,0,0]=4 3501 B9R0.29 CC[C@H](C(=O)O)[C@H](N)CC Amb27461449 [0,1,1,0,0,0|2,0,0]=4 3502 B9R0.29 CC[C@H](C)[C@@H](OC)C(=O)O Amb28239702 [0,1,1,0,0,0|2,0,0]=4 3503 B9R0.29 CC[C@H](C)[C@H](CC)C(=O)O Amb28340911 [0,1,1,0,0,0|2,0,0]=4 3504 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O Amb16183967 [0,1,1,0,0,0|1,0,0]=3 3505 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O Amb22747123 [0,1,1,0,0,0|1,0,0]=3 3506 B9R0.29 CNC(C(=O)O)C(C)OC Amb24117895 [0,1,1,0,0,0|2,0,0]=4 3507 B9R0.29 CN[C@@H](C(=O)O)[C@@H](C)OC Amb33347469 [0,1,1,0,0,0|2,0,0]=4 3508 B9R0.29 COC(C(N)=O)C(O)CO Amb27794891 [0,1,1,0,0,0|2,0,0]=4 3509 B9R0.33 C=CCC(C(=O)O)N(C)C Amb28241066 [0,1,1,0,0,0|1,0,1]=4 3510 B9R0.33 CC(C)C(CCF)C(=O)O Amb27837856 [0,1,1,0,0,0|2,0,0]=4 3511 B9R0.33 CC(C)C(CCN)C(=O)O Amb22371125 [0,1,1,0,0,0|2,0,0]=4 3512 B9R0.33 CC(C)C(CCN)C(=O)O Amb24426418 [0,1,1,0,0,0|2,0,0]=4 3513 B9R0.33 CC(O)C(CCO)C(N)=O Amb27467700 [0,1,1,0,0,0|2,0,0]=4 3514 B9R0.33 CCCC(C(=O)O)C(C)C Amb17616275 [0,1,1,0,0,0|2,0,0]=4 3515 B9R0.33 CCCC(C(=O)O)C(C)N Amb33036414 [0,1,1,0,0,0|2,0,0]=4 3516 B9R0.33 CCCC(C(=O)O)C(C)O Amb26422276 [0,1,1,0,0,0|2,0,0]=4 3517 B9R0.33 CCCC(C(=O)O)N(C)C Amb33534626 [0,1,1,0,0,0|1,0,0]=3 3518 B9R0.33 CCCC(C(=O)O)S(C)=O Amb27255158 [0,1,1,0,0,0|2,0,0]=4 3519 B9R0.33 CCCC(C(C)=O)N(C)C Amb27823561 [0,1,1,0,0,0|2,0,0]=4 3520 B9R0.33 CCCC(C(N)=O)N(C)C Amb24116638 [0,1,1,0,0,0|2,0,0]=4 3521 B9R0.33 CCC[C@H](C(=O)O)N(C)C Amb32660270 [0,1,1,0,0,0|1,0,0]=3 3522 B9R0.33 CCC[C@H](C(=O)O)[C@H](C)O Amb27221692 [0,1,1,0,0,0|2,0,0]=4 3523 B9R0.33 CN(C)C(CCO)C(=O)O Amb24116966 [0,1,1,0,0,0|0,0,0]=2 3524 B9R0.33 COCC(C(=O)O)N(C)O Amb27976733 [0,1,1,0,0,0|2,0,0]=4 3525 B9R0.33 CS(=O)C(CCN)C(=O)O Amb27425024 [0,1,1,0,0,0|2,0,0]=4 3526 B9R0.33 CSC[C@@H](C(=O)O)N(C)C Amb27974193 [0,1,1,0,0,0|2,0,0]=4 3527 B9R0.33 C\C(O)=C(/CCO)C(=O)O Amb27254116 [0,1,1,0,0,0|1,0,1]=4 3528 B9R0.39 CC(C)CC(NCl)C(=O)O Amb27401848 [0,1,1,0,0,0|2,0,0]=4 3529 B9R0.39 CC(C)C[C@@H](NN)C(=O)O Amb27424998 [0,1,1,0,0,0|2,0,0]=4 3530 B9R0.39 CC(C)C[C@H](NN)C(=O)O Amb27488207 [0,1,1,0,0,0|2,0,0]=4 3531 B9R0.39 CC(O)CC(C#N)C(=O)O Amb35741473 [0,1,1,0,0,0|2,0,0]=4 3532 B9R0.39 CCC(CC(=O)O)C(=O)O Amb10071696 [0,1,1,0,0,0|1,0,1]=4 3533 B9R0.39 CCC(CC(C)C)C(=O)O Amb19014184 [0,1,1,0,0,0|2,0,0]=4 3534 B9R0.39 CCC(CC(C)O)C(=O)O Amb27254121 [0,1,1,0,0,0|1,0,0]=3 3535 B9R0.39 CCC(CC(F)F)C(=O)O Amb25709926 [0,1,1,0,0,0|2,0,0]=4 3536 B9R0.39 CC[C@@H](CC(=O)O)C(=O)O Amb27830576 [0,1,1,0,0,0|1,0,1]=4 3537 B9R0.39 CC[C@@H](CC(C)C)C(=O)O Amb28397993 [0,1,1,0,0,0|2,0,0]=4 3538 B9R0.39 CC[C@H](CC(=O)O)C(=O)O Amb24643194 [0,1,1,0,0,0|1,0,1]=4 3539 B9R0.39 CNC(CC(=O)O)C(=O)O Amb1905634 [0,1,1,0,0,0|0,0,1]=3 3540 B9R0.39 CNC(CC(=O)O)C(=O)O Amb30867747 [0,1,1,0,0,0|0,0,1]=3 3541 B9R0.39 CNC(CC(=O)O)C(C)=O Amb18611382 [0,1,1,0,0,0|1,0,1]=4 3542 B9R0.39 CNC(CC(C)C)C(=O)O Amb22274694 [0,1,1,0,0,0|1,0,0]=3 3543 B9R0.39 CNC(CC(C)C)C(=O)O Amb9283589 [0,1,1,0,0,0|1,0,0]=3 3544 B9R0.39 CNC(CC(C)C)C(N)=O Amb19006600 [0,1,1,0,0,0|2,0,0]=4 3545 B9R0.39 CNC(CC(C)C)C(N)=O Amb32753443 [0,1,1,0,0,0|2,0,0]=4 3546 B9R0.39 CNC(CC(N)=O)C(=O)O Amb18644255 [0,1,1,0,0,0|0,0,2]=4 3547 B9R0.39 CNC(CN(C)C)C(=O)O Amb28388875 [0,1,1,0,0,0|2,0,0]=4 3548 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O Amb3499450 [0,1,1,0,0,0|0,0,1]=3 3549 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Amb16183858 [0,1,1,0,0,0|1,0,0]=3 3550 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Amb2779901 [0,1,1,0,0,0|1,0,0]=3 3551 B9R0.39 CN[C@@H](CC(C)C)C(N)=O Amb24550819 [0,1,1,0,0,0|2,0,0]=4 3552 B9R0.39 CN[C@@H](CC(C)C)C(N)=O Amb32679561 [0,1,1,0,0,0|2,0,0]=4 3553 B9R0.39 CN[C@H](CC(=O)O)C(=O)O Amb8515692 [0,1,1,0,0,0|0,0,1]=3 3554 B9R0.39 CN[C@H](CC(C)C)C(=O)O Amb10842218 [0,1,1,0,0,0|1,0,0]=3 3555 B9R0.39 CN[C@H](CC(C)C)C(=O)O Amb22745995 [0,1,1,0,0,0|1,0,0]=3 3556 B9R0.39 CN[C@H](CC(N)=O)C(=O)O Amb28049962 [0,1,1,0,0,0|0,0,2]=4 3557 B9R0.39 COC(CC(C)C)C(=O)O Amb26656466 [0,1,1,0,0,0|2,0,0]=4 3558 B9R0.39 COC(CC(F)F)C(=O)O Amb32811478 [0,1,1,0,0,0|2,0,0]=4 3559 B9R0.39 CO[C@@H](CC(C)C)C(=O)O Amb28126876 [0,1,1,0,0,0|2,0,0]=4 3560 B9R0.39 CO[C@H](CC(=O)O)C(=O)O Amb27849552 [0,1,1,0,0,0|1,0,1]=4 3561 B9R0.39 CSC(CC(=O)O)C(=O)O Amb18646024 [0,1,1,0,0,0|1,0,1]=4 3562 B9R0.39 CSC(CC(C)C)C(=O)O Amb27658945 [0,1,1,0,0,0|2,0,0]=4 3563 B9R0.39 NNC(CC(=O)O)C(=O)O Amb28070991 [0,1,1,0,0,0|1,0,1]=4 3564 B9R0.39 NN[C@@H](CC(=O)O)C(=O)O Amb24117193 [0,1,1,0,0,0|1,0,1]=4 3565 B9R0.39 O=C(O)CC(NCl)C(=O)O Amb27953217 [0,1,1,0,0,0|1,0,1]=4 3566 B9R0.39 O=C(O)CC(NO)C(=O)O Amb24685872 [0,1,1,0,0,0|1,0,1]=4 3567 B9R0.39 O=C(O)CC(NS)C(=O)O Amb25808901 [0,1,1,0,0,0|1,0,1]=4 3568 B9R0.39 O=C(O)C[C@H](NCl)C(=O)O Amb27401859 [0,1,1,0,0,0|1,0,1]=4 3569 B9R0.39 O=C(O)C[C@H](NO)C(=O)O Amb24117497 [0,1,1,0,0,0|1,0,1]=4 3570 B9R0.39 O=C(O)C[C@H](NO)C(=O)O Amb24630025 [0,1,1,0,0,0|1,0,1]=4 3571 B9R0.74 CC(CN)(CCO)C(=O)O Amb28136078 [0,1,1,0,0,0|2,0,0]=4 3572 B9R0.74 CCC(C)(CCN)C(=O)O Amb24562793 [0,1,1,0,0,0|2,0,0]=4 3573 B9R0.74 CCC(C)(CCO)C(=O)O Amb25698302 [0,1,1,0,0,0|1,0,0]=3 3574 B9R0.74 CCCC(Br)(CC)C(=O)O Amb27614914 [0,1,1,0,0,0|2,0,0]=4 3575 B9R0.74 CCCC(C)(CC)C(=O)O Amb18311361 [0,1,1,0,0,0|2,0,0]=4 3576 B9R0.74 CCC[C@@](C)(CC)C(=O)O Amb28119970 [0,1,1,0,0,0|2,0,0]=4 3577 B9R0.74 CCC[C@@](C)(OC)C(=O)O Amb27770608 [0,1,1,0,0,0|2,0,0]=4 3578 B9R0.74 CCC[C@](C)(CC)C(=O)O Amb28398097 [0,1,1,0,0,0|2,0,0]=4 3579 B9R0.74 CCC[C@](O)(CC)C(=O)O Amb27977076 [0,1,1,0,0,0|2,0,0]=4 3580 B9R0.74 CNC(C)(COC)C(=O)O Amb19025782 [0,1,1,0,0,0|2,0,0]=4 3581 B9R0.74 CNC(C)(COC)C(=O)O Amb28555445 [0,1,1,0,0,0|2,0,0]=4 3582 B9R0.74 NCC(O)(CCO)C(=O)O Amb27975659 [0,1,1,0,0,0|2,0,0]=4 3583 B9R0.10 CC(C)CC(N)P(=O)(O)O Amb564159 [0,1,1,0,0,0|2,0,0]=4 3584 B9R0.10 CC(C)CC(N)S(=O)(=O)O Amb24390196 [0,1,1,0,0,0|2,0,0]=4 3585 B9R0.10 CC(C)C[C@@H](N)P(=O)(O)O Amb25992755 [0,1,1,0,0,0|2,0,0]=4 3586 B9R0.10 CC(C)C[C@H](N)P(=O)(O)O Amb25889931 [0,1,1,0,0,0|2,0,0]=4 3587 B9R0.11 C=C(C)CC(C)(N)C(=O)O Amb27838051 [0,1,1,0,0,0|1,0,1]=4 3588 B9R0.11 CC(C)CC(C)(C)C(=O)O Amb10843993 [0,1,1,0,0,0|2,0,0]=4 3589 B9R0.11 CC(C)CC(C)(F)C(=O)O Amb25997944 [0,1,1,0,0,0|2,0,0]=4 3590 B9R0.11 CC(C)CC(C)(N)C(=O)O Amb4134832 [0,1,1,0,0,0|1,0,0]=3 3591 B9R0.11 CC(C)CC(C)(N)C(N)=O Amb18288986 [0,1,1,0,0,0|2,0,0]=4 3592 B9R0.11 CC(C)CC(C)(O)C(=O)O Amb18523766 [0,1,1,0,0,0|2,0,0]=4 3593 B9R0.11 CC(C)CC(F)(F)C(=O)O Amb25773701 [0,1,1,0,0,0|2,0,0]=4 3594 B9R0.11 CC(C)C[C@@](C)(N)C(=O)O Amb8630501 [0,1,1,0,0,0|1,0,0]=3 3595 B9R0.11 CC(C)C[C@](C)(N)C(=O)O Amb10066904 [0,1,1,0,0,0|1,0,0]=3 3596 B9R0.11 CC(N)(CC(=O)O)C(=O)O Amb10807406 [0,1,1,0,0,0|1,0,1]=4 3597 B9R0.11 CC(N)CC(C)(C)C(=O)O Amb27881524 [0,1,1,0,0,0|2,0,0]=4 3598 B9R0.11 CC(O)CC(C)(N)C(=O)O Amb28289237 [0,1,1,0,0,0|0,0,0]=2 3599 B9R0.11 CC(O)CC(C)(N)C(N)=O Amb35725166 [0,1,1,0,0,0|1,0,0]=3 3600 B9R0.11 CC(S)CC(C)(C)C(=O)O Amb35675430 [0,1,1,0,0,0|1,1,0]=4 3601 B9R0.11 CN(C)CC(C)(N)C(=O)O Amb18294465 [0,1,1,0,0,0|2,0,0]=4 3602 B9R0.11 CN(O)CC(C)(O)C(=O)O Amb28349124 [0,1,1,0,0,0|2,0,0]=4 3603 B9R0.11 CN(O)CC(F)(F)C(=O)O Amb33169729 [0,1,1,0,0,0|2,0,0]=4 3604 B9R0.11 C[C@](N)(CC(=O)O)C(=O)O Amb10601663 [0,1,1,0,0,0|1,0,1]=4 3605 B9R0.57 CC(=O)C(N)CC(C)(C)C Amb27959417 [0,1,1,0,0,0|2,0,0]=4 3606 B9R0.57 CC(C)(C)CC(N)C(=O)O Amb7172575 [0,1,1,0,0,0|1,0,0]=3 3607 B9R0.57 CC(C)(C)CC(N)C(=O)O Amb8385710 [0,1,1,0,0,0|1,0,0]=3 3608 B9R0.57 CC(C)(C)CC(N)C(N)=O Amb19000296 [0,1,1,0,0,0|2,0,0]=4 3609 B9R0.57 CC(C)(C)CC(O)C(=O)O Amb18302187 [0,1,1,0,0,0|2,0,0]=4 3610 B9R0.57 CC(C)(C)C[C@@H](Br)C(=O)O Amb28049945 [0,1,1,0,0,0|2,0,0]=4 3611 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O Amb16184025 [0,1,1,0,0,0|1,0,0]=3 3612 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O Amb6295897 [0,1,1,0,0,0|1,0,0]=3 3613 B9R0.57 CC(C)(Cl)CC(N)C(=O)O Amb28555620 [0,1,1,0,0,0|1,0,0]=3 3614 B9R0.57 CC(C)(F)CC(N)C(=O)O Amb26496047 [0,1,1,0,0,0|1,0,0]=3 3615 B9R0.57 CC(C)(F)CC(N)C(N)=O Amb33036949 [0,1,1,0,0,0|2,0,0]=4 3616 B9R0.57 CC(C)(F)CC(O)C(=O)O Amb33272231 [0,1,1,0,0,0|2,0,0]=4 3617 B9R0.57 CC(C)(F)C[C@@H](N)C(=O)O Amb24055873 [0,1,1,0,0,0|1,0,0]=3 3618 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O Amb26959500 [0,1,1,0,0,0|1,0,0]=3 3619 B9R0.57 CC(C)(O)CC(N)C(=O)O Amb18644326 [0,1,1,0,0,0|0,0,0]=2 3620 B9R0.57 CC(C)(O)CC(N)C(=O)[O-] Amb33109899 [0,1,1,0,0,0|0,0,1]=3 3621 B9R0.57 CC(C)(O)CC(N)C(N)=O Amb33065412 [0,1,1,0,0,0|1,0,0]=3 3622 B9R0.57 CC(C)(O)CC(O)C(=O)O Amb27953570 [0,1,1,0,0,0|1,0,0]=3 3623 B9R0.57 CC(C)(O)C[C@@H](N)C(=O)O Amb24479570 [0,1,1,0,0,0|0,0,0]=2 3624 B9R0.57 CC(C)(O)C[C@@H](O)C(=O)O Amb27254266 [0,1,1,0,0,0|1,0,0]=3 3625 B9R0.57 CC(C)(O)C[C@H](N)C(=O)O Amb25992355 [0,1,1,0,0,0|0,0,0]=2 3626 B9R0.57 CC(C)(S)CC(N)C(=O)O Amb27984144 [0,1,1,0,0,0|0,1,0]=3 3627 B9R0.57 CC(CC(C)(C)C)C(=O)O Amb18124693 [0,1,1,0,0,0|2,0,0]=4 3628 B9R0.57 CC(CC(C)(C)F)C(=O)O Amb25971880 [0,1,1,0,0,0|2,0,0]=4 3629 B9R0.57 CC(CC(C)(C)N)C(=O)O Amb22364426 [0,1,1,0,0,0|2,0,0]=4 3630 B9R0.57 CC(CC(C)(C)N)C(=O)O Amb28555536 [0,1,1,0,0,0|2,0,0]=4 3631 B9R0.57 CC(CC(C)(F)F)C(=O)O Amb33482229 [0,1,1,0,0,0|2,0,0]=4 3632 B9R0.57 CC(F)(F)CC(N)C(=O)O Amb26866987 [0,1,1,0,0,0|1,0,0]=3 3633 B9R0.57 CC(F)(F)CC(N)C(=O)O Amb33483896 [0,1,1,0,0,0|1,0,0]=3 3634 B9R0.57 CC(F)(F)CC(N)C(N)=O Amb33036598 [0,1,1,0,0,0|2,0,0]=4 3635 B9R0.57 CC(F)(F)CC(O)C(=O)O Amb26361859 [0,1,1,0,0,0|2,0,0]=4 3636 B9R0.57 CC(F)(F)C[C@@H](N)C(=O)O Amb33309023 [0,1,1,0,0,0|1,0,0]=3 3637 B9R0.57 CC(F)(F)C[C@H](N)C(=O)O Amb26573683 [0,1,1,0,0,0|1,0,0]=3 3638 B9R0.57 CP(=O)(O)CC(N)C(=O)O Amb27770381 [0,1,1,0,0,0|1,0,0]=3 3639 B9R0.57 CS(=O)(=O)CC(N)C(=O)O Amb27983621 [0,1,1,0,0,0|1,0,1]=4 3640 B9R0.57 CS(=O)(=O)CC(N)C(=O)O Amb32753509 [0,1,1,0,0,0|1,0,1]=4 3641 B9R0.57 CS(=O)(=O)C[C@@H](N)C(=O)O Amb27831327 [0,1,1,0,0,0|1,0,1]=4 3642 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O Amb27231797 [0,1,1,0,0,0|1,0,1]=4 3643 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O Amb32683294 [0,1,1,0,0,0|1,0,1]=4 3644 B9R0.57 C[C@@H](CC(C)(C)C)C(=O)O Amb10844016 [0,1,1,0,0,0|2,0,0]=4 3645 B9R0.57 C[C@@H](CC(C)(F)F)C(=O)O Amb33744369 [0,1,1,0,0,0|2,0,0]=4 3646 B9R0.57 C[C@H](CC(C)(C)C)C(=O)O Amb10844015 [0,1,1,0,0,0|2,0,0]=4 3647 B9R0.57 C[C@H](CC(C)(F)F)C(=O)O Amb33743241 [0,1,1,0,0,0|2,0,0]=4 3648 B9R0.57 C[Si](C)(C)CC(N)C(=O)O Amb26361043 [0,1,1,0,0,0|1,1,0]=4 3649 B9R0.57 C[Si](C)(C)C[C@@H](N)C(=O)O Amb27658975 [0,1,1,0,0,0|1,1,0]=4 3650 B9R0.57 C[Si](C)(C)C[C@H](N)C(=O)O Amb24482244 [0,1,1,0,0,0|1,1,0]=4 3651 B9R0.57 C[Si](C)(O)C[C@H](N)C(=O)O Amb27408998 [0,1,1,0,0,0|0,1,0]=3 3652 B9R0.57 NC(CC(F)(F)Cl)C(=O)O Amb27477823 [0,1,1,0,0,0|2,0,0]=4 3653 B9R0.57 NC(CC(F)(F)F)C(=O)O Amb10603542 [0,1,1,0,0,0|2,0,0]=4 3654 B9R0.57 NC(CC(F)(F)F)C(=O)O Amb2684546 [0,1,1,0,0,0|2,0,0]=4 3655 B9R0.57 NC(CP(=O)(O)O)C(=O)O Amb542762 [0,1,1,0,0,0|2,0,0]=4 3656 B9R0.57 NC(CP(O)(O)=S)C(=O)O Amb27232821 [0,1,1,0,0,0|2,0,0]=4 3657 B9R0.57 NC(CS(=O)(=O)O)C(=O)O Amb2698240 [0,1,1,0,0,0|2,0,0]=4 3658 B9R0.57 N[C@@H](CC(Cl)(Cl)Cl)C(=O)O Amb25967143 [0,1,1,0,0,0|2,0,0]=4 3659 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O Amb19889287 [0,1,1,0,0,0|2,0,0]=4 3660 B9R0.57 N[C@@H](CP(=O)(O)O)C(=O)O Amb2719731 [0,1,1,0,0,0|2,0,0]=4 3661 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O Amb17942867 [0,1,1,0,0,0|2,0,0]=4 3662 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O Amb3940873 [0,1,1,0,0,0|2,0,0]=4 3663 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O Amb19889286 [0,1,1,0,0,0|2,0,0]=4 3664 B9R0.57 N[C@H](CP(=O)(O)O)C(=O)O Amb8515685 [0,1,1,0,0,0|2,0,0]=4 3665 B9R0.79 C=C(C)C(O)C(N)C(=O)O Amb33199606 [0,1,1,0,0,0|1,0,1]=4 3666 B9R0.79 CC(=O)C(C)C(N)C(=O)O Amb18202116 [0,1,1,0,0,0|0,0,2]=4 3667 B9R0.79 CC(=O)[C@H](C)[C@H](N)C(=O)O Amb27424983 [0,1,1,0,0,0|0,0,2]=4 3668 B9R0.79 CC(=S)[C@H](C)[C@H](N)C(=O)O Amb26642807 [0,1,1,0,0,0|0,1,1]=4 3669 B9R0.79 CC(C(=O)O)C(N)C(=O)O Amb2099482 [0,1,1,0,0,0|1,0,1]=4 3670 B9R0.79 CC(C(F)F)C(N)C(=O)O Amb4442353 [0,1,1,0,0,0|2,0,0]=4 3671 B9R0.79 CC(C(F)F)[C@H](N)C(=O)O Amb27424746 [0,1,1,0,0,0|2,0,0]=4 3672 B9R0.79 CC(C(N)C(=O)O)N(C)C Amb30020664 [0,1,1,0,0,0|2,0,0]=4 3673 B9R0.79 CC(C)C(=S)[C@H](N)C(=O)O Amb26586364 [0,1,1,0,0,0|1,0,1]=4 3674 B9R0.79 CC(C)C(C)C(N)C(=O)O Amb26965499 [0,1,1,0,0,0|1,0,0]=3 3675 B9R0.79 CC(C)C(C)C(N)C(N)=O Amb28315989 [0,1,1,0,0,0|2,0,0]=4 3676 B9R0.79 CC(C)C(C)[C@@H](N)C(=O)O Amb28119442 [0,1,1,0,0,0|1,0,0]=3 3677 B9R0.79 CC(C)C(C)[C@H](N)C(=O)O Amb27951299 [0,1,1,0,0,0|1,0,0]=3 3678 B9R0.79 CC(C)C(F)C(N)C(=O)O Amb28071157 [0,1,1,0,0,0|1,0,0]=3 3679 B9R0.79 CC(C)C(F)[C@@H](N)C(=O)O Amb27248487 [0,1,1,0,0,0|1,0,0]=3 3680 B9R0.79 CC(C)C(F)[C@H](N)C(=O)O Amb25863595 [0,1,1,0,0,0|1,0,0]=3 3681 B9R0.79 CC(C)C(F)[C@H](N)C(=O)O Amb33328671 [0,1,1,0,0,0|1,0,0]=3 3682 B9R0.79 CC(C)C(N)C(C)C(=O)O Amb28121227 [0,1,1,0,0,0|2,0,0]=4 3683 B9R0.79 CC(C)C(N)C(F)C(=O)O Amb28385013 [0,1,1,0,0,0|2,0,0]=4 3684 B9R0.79 CC(C)C(N)C(O)C(=O)O Amb27615047 [0,1,1,0,0,0|2,0,0]=4 3685 B9R0.79 CC(C)C(O)C(C)C(=O)O Amb18990636 [0,1,1,0,0,0|2,0,0]=4 3686 B9R0.79 CC(C)C(O)C(F)C(=O)O Amb33136392 [0,1,1,0,0,0|2,0,0]=4 3687 B9R0.79 CC(C)C(O)C(N)C(=O)O Amb23399656 [0,1,1,0,0,0|1,0,0]=3 3688 B9R0.79 CC(C)C(O)C(O)C(=O)O Amb27655491 [0,1,1,0,0,0|2,0,0]=4 3689 B9R0.79 CC(C)C(O)[C@@H](C)C(=O)O Amb27494047 [0,1,1,0,0,0|2,0,0]=4 3690 B9R0.79 CC(C)C(O)[C@H](N)C(=O)O Amb24509492 [0,1,1,0,0,0|1,0,0]=3 3691 B9R0.79 CC(C)C(S)C(N)C(=O)O Amb28076641 [0,1,1,0,0,0|1,0,0]=3 3692 B9R0.79 CC(C)[C@@H](Cl)[C@@H](N)C(=O)O Amb27409092 [0,1,1,0,0,0|1,0,0]=3 3693 B9R0.79 CC(C)[C@@H](O)[C@@H](Br)C(=O)O Amb27394249 [0,1,1,0,0,0|2,0,0]=4 3694 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(=O)O Amb27874042 [0,1,1,0,0,0|2,0,0]=4 3695 B9R0.79 CC(C)[C@@H](O)[C@H](C)C(=O)O Amb28347218 [0,1,1,0,0,0|2,0,0]=4 3696 B9R0.79 CC(C)[C@H](Cl)[C@@H](N)C(=O)O Amb27796326 [0,1,1,0,0,0|1,0,0]=3 3697 B9R0.79 CC(C)[C@H](N)[C@H](C)C(=O)O Amb27216704 [0,1,1,0,0,0|2,0,0]=4 3698 B9R0.79 CC(C)[C@H](N)[C@H](O)C(=O)O Amb25147282 [0,1,1,0,0,0|2,0,0]=4 3699 B9R0.79 CC(C)[C@H](O)[C@@H](C)C(=O)O Amb10844253 [0,1,1,0,0,0|2,0,0]=4 3700 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O Amb10807407 [0,1,1,0,0,0|1,0,0]=3 3701 B9R0.79 CC(C)[C@H](O)[C@H](C)C(=O)O Amb28346279 [0,1,1,0,0,0|2,0,0]=4 3702 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O Amb26333625 [0,1,1,0,0,0|1,0,0]=3 3703 B9R0.79 CC(C)[C@H](O)[C@H](O)C(=O)O Amb28050049 [0,1,1,0,0,0|2,0,0]=4 3704 B9R0.79 CC(Cl)C(C)C(N)C(=O)O Amb27838066 [0,1,1,0,0,0|1,0,0]=3 3705 B9R0.79 CC(F)C(C)C(Br)C(=O)O Amb28050032 [0,1,1,0,0,0|2,0,0]=4 3706 B9R0.79 CC(F)C(C)C(N)C(=O)O Amb28041913 [0,1,1,0,0,0|1,0,0]=3 3707 B9R0.79 CC(N)C(O)C(C)C(=O)O Amb25870814 [0,1,1,0,0,0|2,0,0]=4 3708 B9R0.79 CC(O)C(C)C(C)C(=O)O Amb28059349 [0,1,1,0,0,0|1,0,0]=3 3709 B9R0.79 CC(O)C(C)C(N)C(=O)O Amb21953714 [0,1,1,0,0,0|0,0,0]=2 3710 B9R0.79 CC(O)C(C)C(N)C(N)=O Amb33036679 [0,1,1,0,0,0|1,0,0]=3 3711 B9R0.79 CC(O)C(C)[C@@H](N)C(=O)O Amb22800202 [0,1,1,0,0,0|0,0,0]=2 3712 B9R0.79 CC(O)C(C)[C@H](N)C(=O)O Amb27390194 [0,1,1,0,0,0|0,0,0]=2 3713 B9R0.79 CC(O)C(O)C(N)C(=O)O Amb27210841 [0,1,1,0,0,0|0,0,0]=2 3714 B9R0.79 CC(O)[C@@H](C)[C@@H](N)C(=O)O Amb33524291 [0,1,1,0,0,0|0,0,0]=2 3715 B9R0.79 CC(S)C(C)C(N)C(=O)O Amb27241739 [0,1,1,0,0,0|0,1,0]=3 3716 B9R0.79 C[C@@H](C(=O)O)C(N)C(=O)O Amb27877897 [0,1,1,0,0,0|1,0,1]=4 3717 B9R0.79 C[C@@H](C(=O)O)[C@@H](N)C(=O)O Amb27170727 [0,1,1,0,0,0|1,0,1]=4 3718 B9R0.79 C[C@@H](C(=O)O)[C@H](N)C(=O)O Amb25324829 [0,1,1,0,0,0|1,0,1]=4 3719 B9R0.79 C[C@@H](O)[C@@H](O)[C@H](O)C(N)=O Amb27760015 [0,1,1,0,0,0|2,0,0]=4 3720 B9R0.79 C[C@@H](O)[C@H](C)[C@@H](N)C(=O)O Amb27252085 [0,1,1,0,0,0|0,0,0]=2 3721 B9R0.79 C[C@@H](O)[C@H](C)[C@H](N)C(=O)O Amb17615448 [0,1,1,0,0,0|0,0,0]=2 3722 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O Amb27783086 [0,1,1,0,0,0|1,0,1]=4 3723 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O Amb31031234 [0,1,1,0,0,0|1,0,1]=4 3724 B9R0.79 C[C@H](N)[C@@H](O)[C@@H](C)C(=O)O Amb27845316 [0,1,1,0,0,0|2,0,0]=4 3725 B9R0.79 C[C@H](O)[C@@H](C)[C@@H](N)C(=O)O Amb27655509 [0,1,1,0,0,0|0,0,0]=2 3726 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O Amb27595659 [0,1,1,0,0,0|0,0,0]=2 3727 B9R0.79 C[C@H](O)[C@H](O)[C@@H](O)C(=O)O Amb27592166 [0,1,1,0,0,0|1,0,0]=3 3728 B9R0.79 C[C@H](O)[C@H](O)[C@@H](O)C(N)=O Amb27424984 [0,1,1,0,0,0|2,0,0]=4 3729 B9R0.79 C[C@H]([C@@H](C)O)[C@@H](N)C(=O)O Amb25693814 [0,1,1,0,0,0|0,0,0]=2 3730 B9R0.79 NC(C(=O)O)C(F)C(=O)O Amb24061061 [0,1,1,0,0,0|1,0,1]=4 3731 B9R0.79 NC(C(=O)O)C(N)C(=O)O Amb24117894 [0,1,1,0,0,0|1,0,1]=4 3732 B9R0.79 NC(C(=O)O)C(O)C(=O)O Amb9871461 [0,1,1,0,0,0|1,0,1]=4 3733 B9R0.79 NC(C(=O)O)C(O)C(Cl)Cl Amb27837948 [0,1,1,0,0,0|2,0,0]=4 3734 B9R0.79 NC(C(=O)O)C(O)C(F)F Amb19148422 [0,1,1,0,0,0|2,0,0]=4 3735 B9R0.79 N[C@@H](C(=O)O)C(F)C(=O)O Amb27494927 [0,1,1,0,0,0|1,0,1]=4 3736 B9R0.79 N[C@@H](C(=O)O)[C@@H](O)C(=O)O Amb17942870 [0,1,1,0,0,0|1,0,1]=4 3737 B9R0.79 N[C@@H](C(=O)O)[C@@H](O)C(Cl)Cl Amb27792191 [0,1,1,0,0,0|2,0,0]=4 3738 B9R0.79 N[C@@H](C(=O)O)[C@H](O)C(=O)O Amb27470435 [0,1,1,0,0,0|1,0,1]=4 3739 B9R0.79 N[C@@H](C(=O)O)[C@H](O)C(F)F Amb25940794 [0,1,1,0,0,0|2,0,0]=4 3740 B9R0.79 N[C@H](C(=O)O)C(F)C(=O)O Amb27796116 [0,1,1,0,0,0|1,0,1]=4 3741 B9R0.79 N[C@H](C(=O)O)[C@@H](F)C(=O)O Amb27865514 [0,1,1,0,0,0|1,0,1]=4 3742 B9R0.79 N[C@H](C(=O)O)[C@@H](N)C(=O)O Amb10072362 [0,1,1,0,0,0|1,0,1]=4 3743 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(=O)O Amb24087715 [0,1,1,0,0,0|1,0,1]=4 3744 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(=O)O Amb24117974 [0,1,1,0,0,0|1,0,1]=4 3745 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(F)F Amb26336091 [0,1,1,0,0,0|2,0,0]=4 3746 B9R0.79 N[C@H](C(=O)O)[C@H](Cl)C(=O)O Amb27796563 [0,1,1,0,0,0|1,0,1]=4 3747 B9R0.79 N[C@H](C(=O)O)[C@H](F)C(=O)O Amb26945975 [0,1,1,0,0,0|1,0,1]=4 3748 B9R0.79 N[C@H](C(=O)O)[C@H](N)C(=O)O Amb27173533 [0,1,1,0,0,0|1,0,1]=4 3749 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O Amb17615140 [0,1,1,0,0,0|1,0,1]=4 3750 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O Amb33714683 [0,1,1,0,0,0|1,0,1]=4 3751 B9R0.1 C#CC(C)CCCC(=O)O Amb27273525 [0,1,1,0,0,0|2,0,0]=4 3752 B9R0.1 C=C(Br)CNCC(C)OC Amb28240774 [0,1,1,0,0,0|2,0,0]=4 3753 B9R0.1 C=C(Br)CNCC(O)CO Amb28146419 [0,1,1,0,0,0|2,0,0]=4 3754 B9R0.1 C=C(Br)CNC[C@@H](O)CC Amb27770561 [0,1,1,0,0,0|2,0,0]=4 3755 B9R0.1 C=C(Br)CNC[C@H](O)CO Amb27249252 [0,1,1,0,0,0|2,0,0]=4 3756 B9R0.1 C=C(C)CNCC(O)CC Amb27857305 [0,1,1,0,0,0|2,0,0]=4 3757 B9R0.1 C=C(CC)CNCC(=O)O Amb27661467 [0,1,1,0,0,0|1,0,1]=4 3758 B9R0.1 C=C(Cl)CNCC(C)OC Amb28254492 [0,1,1,0,0,0|2,0,0]=4 3759 B9R0.1 C=C(Cl)CNC[C@@H](O)CC Amb28323805 [0,1,1,0,0,0|2,0,0]=4 3760 B9R0.1 C=C(Cl)CNC[C@H](O)CO Amb27816923 [0,1,1,0,0,0|2,0,0]=4 3761 B9R0.1 C=CC(C)COCC(=O)O Amb27831618 [0,1,1,0,0,0|2,0,0]=4 3762 B9R0.1 C=CC(O)CNCC(C)O Amb28363878 [0,1,1,0,0,0|1,0,1]=4 3763 B9R0.1 CC(=O)CCC[C@@H](C)CO Amb26391997 [0,1,1,0,0,0|2,0,0]=4 3764 B9R0.1 CC(=O)CSCC(O)CO Amb28049681 [0,1,1,0,0,0|2,0,0]=4 3765 B9R0.1 CC(C#N)CCCC(=O)O Amb18643710 [0,1,1,0,0,0|2,0,0]=4 3766 B9R0.1 CC(C)CCCC(=O)CO Amb26467261 [0,1,1,0,0,0|2,0,0]=4 3767 B9R0.1 CC(C)CNCC(=O)CN Amb27781669 [0,1,1,0,0,0|2,0,0]=4 3768 B9R0.1 CC(C=O)CCCC(=O)O Amb27173621 [0,1,1,0,0,0|1,0,1]=4 3769 B9R0.1 CC(CN)CCCC(=O)O Amb27592530 [0,1,1,0,0,0|2,0,0]=4 3770 B9R0.1 CC(CN)CSCC(=O)O Amb27639745 [0,1,1,0,0,0|2,0,0]=4 3771 B9R0.1 CC(CO)CNCC(=O)O Amb28246419 [0,1,1,0,0,0|0,0,0]=2 3772 B9R0.1 CC(CO)CNCC(N)=O Amb27463837 [0,1,1,0,0,0|1,0,0]=3 3773 B9R0.1 CC(CO)COCC(=O)O Amb28280816 [0,1,1,0,0,0|1,0,0]=3 3774 B9R0.1 CC(CO)CSCC(=O)O Amb28365901 [0,1,1,0,0,0|1,0,0]=3 3775 B9R0.1 CC(CO)CSCC(N)=O Amb27649504 [0,1,1,0,0,0|2,0,0]=4 3776 B9R0.1 CC(N)CCCC(=O)NO Amb28122781 [0,1,1,0,0,0|2,0,0]=4 3777 B9R0.1 CC(O)CCCC(=O)NN Amb24352284 [0,1,1,0,0,0|2,0,0]=4 3778 B9R0.1 CC(O)CNC[C@H](O)CO Amb27412288 [0,1,1,0,0,0|0,0,2]=4 3779 B9R0.1 CC(O)CNC\C(N)=N\O Amb28368064 [0,1,1,0,0,0|1,0,0]=3 3780 B9R0.1 CCC(C)CCCC(=O)O Amb18124682 [0,1,1,0,0,0|2,0,0]=4 3781 B9R0.1 CCC(C)CNCC(N)=O Amb6718890 [0,1,1,0,0,0|2,0,0]=4 3782 B9R0.1 CCC(C)COCC(=O)O Amb28368866 [0,1,1,0,0,0|2,0,0]=4 3783 B9R0.1 CCC(O)CC#CC(=O)O Amb27461426 [0,1,1,0,0,0|1,0,1]=4 3784 B9R0.1 CCC(O)CCCC(=O)O Amb18644263 [0,1,1,0,0,0|1,0,0]=3 3785 B9R0.1 CCC(O)CNCC(C)O Amb28344778 [0,1,1,0,0,0|1,0,1]=4 3786 B9R0.1 CCC(O)CNC[C@H](C)O Amb27772022 [0,1,1,0,0,0|1,0,1]=4 3787 B9R0.1 CCC(O)CSCC(=O)O Amb18792573 [0,1,1,0,0,0|1,0,0]=3 3788 B9R0.1 CCN(O)CCCC(=O)O Amb27630754 [0,1,1,0,0,0|2,0,0]=4 3789 B9R0.1 CC[C@@H](O)CCCC(C)=O Amb27227255 [0,1,1,0,0,0|2,0,0]=4 3790 B9R0.1 CC[C@@H](O)CNCC(C)O Amb27770562 [0,1,1,0,0,0|1,0,1]=4 3791 B9R0.1 CC[C@@H](O)CNCC(N)=O Amb27226499 [0,1,1,0,0,0|1,0,0]=3 3792 B9R0.1 CC[C@@H](O)CSCC(N)=O Amb28202586 [0,1,1,0,0,0|2,0,0]=4 3793 B9R0.1 CC[C@H](C)CCCC(=O)O Amb28313011 [0,1,1,0,0,0|2,0,0]=4 3794 B9R0.1 CNC(=O)CNCC(=O)O Amb8943036 [0,1,1,0,0,0|0,0,2]=4 3795 B9R0.1 CNC(=O)CNC[C@@H](C)O Amb28188407 [0,1,1,0,0,0|1,0,0]=3 3796 B9R0.1 CNC(=O)CSC[C@@H](C)O Amb27790534 [0,1,1,0,0,0|2,0,0]=4 3797 B9R0.1 COC(=O)CCCC(C)Br Amb24346809 [0,1,1,0,0,0|2,0,0]=4 3798 B9R0.1 COC(=O)CCCC(C)Cl Amb24626627 [0,1,1,0,0,0|2,0,0]=4 3799 B9R0.1 COC(=O)CCCC(C)N Amb27759913 [0,1,1,0,0,0|2,0,0]=4 3800 B9R0.1 COC(=O)CCCC(C)O Amb24414468 [0,1,1,0,0,0|1,0,0]=3 3801 B9R0.1 COC(=O)CCC[C@H](C)O Amb27839593 [0,1,1,0,0,0|1,0,0]=3 3802 B9R0.1 COC(=O)CNCC(=O)O Amb7766422 [0,1,1,0,0,0|0,0,2]=4 3803 B9R0.1 COC(=O)CNCC(C)C Amb6686983 [0,1,1,0,0,0|1,0,0]=3 3804 B9R0.1 COC(=O)CNCC(C)O Amb9247006 [0,1,1,0,0,0|0,0,0]=2 3805 B9R0.1 COC(=O)CNCC(F)F Amb18179465 [0,1,1,0,0,0|2,0,0]=4 3806 B9R0.1 COC(=O)CNCC(F)F Amb33204438 [0,1,1,0,0,0|2,0,0]=4 3807 B9R0.1 COC(=O)CNCN(C)C Amb28041215 [0,1,1,0,0,0|2,0,0]=4 3808 B9R0.1 COC(=O)COCC(C)C Amb9206382 [0,1,1,0,0,0|2,0,0]=4 3809 B9R0.1 COC(=O)CSCC(C)C Amb839626 [0,1,1,0,0,0|2,0,0]=4 3810 B9R0.1 COC(=O)CSCC(C)N Amb27770371 [0,1,1,0,0,0|2,0,0]=4 3811 B9R0.1 COC(=O)CSCC(C)O Amb18792574 [0,1,1,0,0,0|1,0,0]=3 3812 B9R0.1 COC(=O)C\C=C\C(C)O Amb27756374 [0,1,1,0,0,0|1,0,1]=4 3813 B9R0.1 COC(=O)C\C=C\[C@@H](C)O Amb28321357 [0,1,1,0,0,0|1,0,1]=4 3814 B9R0.1 COC(=O)NCC[C@H](C)O Amb27663109 [0,1,1,0,0,0|2,0,0]=4 3815 B9R0.1 CON(C)CCCC(=O)O Amb28126925 [0,1,1,0,0,0|2,0,0]=4 3816 B9R0.1 C[C@H](O)CNCC(O)CO Amb27469837 [0,1,1,0,0,0|0,0,2]=4 3817 B9R0.1 C\C(=C/Cl)CNCC(C)O Amb27205444 [0,1,1,0,0,0|2,0,0]=4 3818 B9R0.1 C\C(CCCC(=O)O)=N/O Amb27779283 [0,1,1,0,0,0|1,0,1]=4 3819 B9R0.1 NC(=O)CNCC(O)CF Amb27859350 [0,1,1,0,0,0|1,0,0]=3 3820 B9R0.1 NC(=O)CSCC(O)CF Amb27249405 [0,1,1,0,0,0|2,0,0]=4 3821 B9R0.1 NC(=O)CSCC(O)CO Amb27593990 [0,1,1,0,0,0|2,0,0]=4 3822 B9R0.1 NC(CO)CCCC(=O)O Amb25889148 [0,1,1,0,0,0|2,0,0]=4 3823 B9R0.1 NCC(=O)CNCC(=O)O Amb27979091 [0,1,1,0,0,0|0,0,2]=4 3824 B9R0.1 NC[C@@H](N)CCCC(=O)O Amb33756779 [0,1,1,0,0,0|2,0,0]=4 3825 B9R0.1 N[C@H](CO)CCCC(=O)O Amb27751891 [0,1,1,0,0,0|2,0,0]=4 3826 B9R0.1 N\C(CNCC(=O)O)=N/O Amb27881601 [0,1,1,0,0,0|1,0,1]=4 3827 B9R0.1 O=C(O)CCCC(Cl)CCl Amb18649051 [0,1,1,0,0,0|2,0,0]=4 3828 B9R0.1 O=C(O)CSCC(O)CCl Amb27858669 [0,1,1,0,0,0|1,0,0]=3 3829 B9R0.53 C=C(Br)CN(C)C[C@@H](C)O Amb27802333 [0,1,1,0,0,0|2,0,0]=4 3830 B9R0.53 C=C(CC(=O)O)CC(C)C Amb18643897 [0,1,1,0,0,0|2,0,0]=4 3831 B9R0.53 C=C(Cl)CN(C)CC(C)O Amb18798255 [0,1,1,0,0,0|2,0,0]=4 3832 B9R0.53 CC(=O)CC(O)CC(C)O Amb28202187 [0,1,1,0,0,0|2,0,0]=4 3833 B9R0.53 CC(=O)C[C@H](O)C[C@@H](C)O Amb27973069 [0,1,1,0,0,0|2,0,0]=4 3834 B9R0.53 CC(C)CC(C)CC(=O)O Amb6749218 [0,1,1,0,0,0|2,0,0]=4 3835 B9R0.53 CC(C)CC(N)CC(=O)O Amb2438867 [0,1,1,0,0,0|2,0,0]=4 3836 B9R0.53 CC(C)CC(O)CC(=O)O Amb17232005 [0,1,1,0,0,0|2,0,0]=4 3837 B9R0.53 CC(C)CN(C)CC(=O)O Amb8900040 [0,1,1,0,0,0|1,0,0]=3 3838 B9R0.53 CC(C)CN(C)CC(N)=O Amb28204122 [0,1,1,0,0,0|2,0,0]=4 3839 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631385 [0,1,1,0,0,0|2,0,0]=4 3840 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631386 [0,1,1,0,0,0|2,0,0]=4 3841 B9R0.53 CC(C)C[C@@H](O)CC(=O)O Amb28050162 [0,1,1,0,0,0|2,0,0]=4 3842 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb16184017 [0,1,1,0,0,0|2,0,0]=4 3843 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb19944305 [0,1,1,0,0,0|2,0,0]=4 3844 B9R0.53 CC(C)C[C@H](O)CC(=O)O Amb24505145 [0,1,1,0,0,0|2,0,0]=4 3845 B9R0.53 CC(Cl)CC(Cl)CC(=O)O Amb28436914 [0,1,1,0,0,0|2,0,0]=4 3846 B9R0.53 CC(O)CN(C)CC(C)O Amb17334272 [0,1,1,0,0,0|1,0,1]=4 3847 B9R0.53 CC(O)CN(C)C[C@@H](C)O Amb27876867 [0,1,1,0,0,0|1,0,1]=4 3848 B9R0.53 CC(O)CN(O)CC(C)O Amb28240775 [0,1,1,0,0,0|1,0,1]=4 3849 B9R0.53 CN(CC(=O)O)CC(=O)O Amb1156001 [0,1,1,0,0,0|1,0,1]=4 3850 B9R0.53 C[C@@H](O)CN(C)CC(N)=O Amb27979416 [0,1,1,0,0,0|1,0,0]=3 3851 B9R0.53 C[C@H](O)CN(C)C[C@H](C)O Amb27396185 [0,1,1,0,0,0|1,0,1]=4 3852 B9R0.53 NN(CC(=O)O)CC(=O)O Amb534841 [0,1,1,0,0,0|1,0,1]=4 3853 B9R0.53 [NH3+]N(CC(=O)O)CC(=O)O Amb23453377 [0,1,1,0,0,0|1,0,1]=4 3854 B9R0.56 CC(=O)CCCC(C)(C)O Amb17593627 [0,1,1,0,0,0|2,0,0]=4 3855 B9R0.56 CC(C)(C)CCCC(=O)O Amb18307485 [0,1,1,0,0,0|2,0,0]=4 3856 B9R0.56 CC(C)(C)CNCC(=O)O Amb19012829 [0,1,1,0,0,0|1,0,0]=3 3857 B9R0.56 CC(C)(C)CNCC(=O)O Amb28555432 [0,1,1,0,0,0|1,0,0]=3 3858 B9R0.56 CC(C)(C)COCC(=O)O Amb25079059 [0,1,1,0,0,0|2,0,0]=4 3859 B9R0.56 CC(C)(C)CSCC(=O)O Amb28050005 [0,1,1,0,0,0|2,0,0]=4 3860 B9R0.56 CC(C)(F)CCCC(=O)O Amb25270576 [0,1,1,0,0,0|2,0,0]=4 3861 B9R0.56 CC(C)(N)CNCC(N)=O Amb28321690 [0,1,1,0,0,0|2,0,0]=4 3862 B9R0.56 CC(C)(N)COCC(=O)O Amb18630788 [0,1,1,0,0,0|2,0,0]=4 3863 B9R0.56 CC(C)(O)CCCC(=O)O Amb24340189 [0,1,1,0,0,0|1,0,0]=3 3864 B9R0.56 CC(C)(O)CCCC(=O)[O-] Amb32653027 [0,1,1,0,0,0|1,0,1]=4 3865 B9R0.56 CC(C)(O)CSCC(=O)O Amb18307056 [0,1,1,0,0,0|1,0,0]=3 3866 B9R0.56 CC(C)(O)CSCC(N)=O Amb27763121 [0,1,1,0,0,0|2,0,0]=4 3867 B9R0.56 CC(C)(O)C\C=C\C(=O)O Amb18644104 [0,1,1,0,0,0|1,0,1]=4 3868 B9R0.56 CC(C)CNCS(=O)(=O)O Amb27426840 [0,1,1,0,0,0|2,0,0]=4 3869 B9R0.56 CC(F)(F)CCCC(=O)O Amb17593778 [0,1,1,0,0,0|2,0,0]=4 3870 B9R0.56 CP(=O)(O)CCCC(=O)O Amb24524573 [0,1,1,0,0,0|2,0,0]=4 3871 B9R0.56 CP(C)(=O)CNCC(=O)O Amb25339632 [0,1,1,0,0,0|1,0,1]=4 3872 B9R0.56 NP(=O)(O)CNCC(=O)O Amb27233408 [0,1,1,0,0,0|2,0,0]=4 3873 B9R0.56 O=C(O)CNCC(F)(F)F Amb19372984 [0,1,1,0,0,0|2,0,0]=4 3874 B9R0.56 O=C(O)CNCC(F)(F)F Amb7766553 [0,1,1,0,0,0|2,0,0]=4 3875 B9R0.56 O=C(O)CNCP(=O)(O)O Amb3941678 [0,1,1,0,0,0|2,0,0]=4 3876 B9R0.56 O=C(O)CNCP(=O)([O-])O Amb28995134 [0,1,1,0,0,0|2,0,0]=4 3877 B9R0.56 O=P(O)(O)CNCC(O)O Amb27792531 [0,1,1,0,0,0|2,0,0]=4 3878 B9R1.7 C=CCC1CC(O)CN1 Amb18642526 [1,1,0,0,0,0|1,0,0]=3 3879 B9R1.7 C=CCC1CC(O)CO1 Amb27650261 [1,1,0,0,0,0|2,0,0]=4 3880 B9R1.7 C=CC[C@@H]1CC[C@H](O)C1 Amb27455824 [1,1,0,0,0,0|2,0,0]=4 3881 B9R1.7 C=CC[C@@H]1C[C@H](O)CO1 Amb27198045 [1,1,0,0,0,0|2,0,0]=4 3882 B9R1.7 CC1CCC(NC=O)C1 Amb28349441 [1,1,0,0,0,0|2,0,0]=4 3883 B9R1.7 CNCC1CC(O)CN1 Amb25885673 [1,1,0,0,0,0|1,0,1]=4 3884 B9R1.7 CNCC1CC(O)CN1 Amb32666419 [1,1,0,0,0,0|1,0,1]=4 3885 B9R1.7 CNC[C@@H]1C[C@@H](O)CN1 Amb25950829 [1,1,0,0,0,0|1,0,1]=4 3886 B9R1.7 CNC[C@@H]1C[C@@H](O)CN1 Amb28921071 [1,1,0,0,0,0|1,0,1]=4 3887 B9R1.7 COCC1CC(O)CN1 Amb25102542 [1,1,0,0,0,0|0,0,1]=3 3888 B9R1.7 COCC1CC(O)CN1 Amb32663501 [1,1,0,0,0,0|0,0,1]=3 3889 B9R1.7 COC[C@@H]1C[C@@H](O)CN1 Amb27221570 [1,1,0,0,0,0|0,0,1]=3 3890 B9R1.7 COC[C@@H]1C[C@@H](O)CN1 Amb32664596 [1,1,0,0,0,0|0,0,1]=3 3891 B9R1.7 COC[C@@H]1C[C@H](F)CN1 Amb27249887 [1,1,0,0,0,0|1,0,1]=4 3892 B9R1.7 COC[C@@H]1C[C@H](O)CN1 Amb25841067 [1,1,0,0,0,0|0,0,1]=3 3893 B9R1.7 COC[C@@H]1C[C@H](O)CN1 Amb28644471 [1,1,0,0,0,0|0,0,1]=3 3894 B9R1.7 COC[C@H]1C[C@@H](O)CN1 Amb32664687 [1,1,0,0,0,0|0,0,1]=3 3895 B9R1.7 COC[C@H]1C[C@@H](O)CN1 Amb32664688 [1,1,0,0,0,0|0,0,1]=3 3896 B9R1.7 OCC[C@@H]1CC[C@H](O)C1 Amb28070933 [1,1,0,0,0,0|1,0,1]=4 3897 B9R1.21 C=C[C@H]1CC[C@@H](CO)C1 Amb27665525 [1,1,0,0,0,0|2,0,0]=4 3898 B9R1.21 C=C[C@H]1C[C@@H](CO)CO1 Amb27978340 [1,1,0,0,0,0|2,0,0]=4 3899 B9R1.21 CCC1CC(CO)CN1 Amb27621656 [1,1,0,0,0,0|1,0,1]=4 3900 B9R1.21 CCC1CC(OC)CN1 Amb23453856 [1,1,0,0,0,0|1,0,1]=4 3901 B9R1.21 CCC1CCC(C=O)C1 Amb25312233 [1,1,0,0,0,0|2,0,0]=4 3902 B9R1.21 CCC1CNC(CO)C1 Amb27876349 [1,1,0,0,0,0|1,0,1]=4 3903 B9R1.21 CN[C@@H]1CN[C@@H](CO)C1 Amb28051812 [1,1,0,0,0,0|1,0,1]=4 3904 B9R1.21 COC1CCN(C=O)C1 Amb28188409 [1,1,0,0,0,0|2,0,0]=4 3905 B9R1.21 COC1CNC(CBr)C1 Amb27956526 [1,1,0,0,0,0|1,0,1]=4 3906 B9R1.21 COC1CNC(CF)C1 Amb32753270 [1,1,0,0,0,0|1,0,1]=4 3907 B9R1.21 COC1CNC(CF)C1 Amb32753400 [1,1,0,0,0,0|1,0,1]=4 3908 B9R1.21 COC1CNC(CO)C1 Amb26864113 [1,1,0,0,0,0|0,0,1]=3 3909 B9R1.21 COC1CNC(CO)C1 Amb32663020 [1,1,0,0,0,0|0,0,1]=3 3910 B9R1.21 CO[C@@H]1CN[C@H](CF)C1 Amb32675507 [1,1,0,0,0,0|1,0,1]=4 3911 B9R1.21 CO[C@@H]1CN[C@H](CF)C1 Amb32679369 [1,1,0,0,0,0|1,0,1]=4 3912 B9R1.21 CO[C@@H]1CN[C@H](CO)C1 Amb26528627 [1,1,0,0,0,0|0,0,1]=3 3913 B9R1.21 CO[C@@H]1CN[C@H](CO)C1 Amb32662679 [1,1,0,0,0,0|0,0,1]=3 3914 B9R1.21 CO[C@H]1CN[C@@H](CO)C1 Amb28057437 [1,1,0,0,0,0|0,0,1]=3 3915 B9R1.21 CO[C@H]1CN[C@H](CCl)C1 Amb35750082 [1,1,0,0,0,0|1,0,1]=4 3916 B9R1.21 CO[C@H]1CN[C@H](CCl)C1 Amb35750221 [1,1,0,0,0,0|1,0,1]=4 3917 B9R1.21 CO[C@H]1CN[C@H](CO)C1 Amb27436445 [1,1,0,0,0,0|0,0,1]=3 3918 B9R1.21 CO[C@H]1C[C@H](C=O)CO1 Amb28057458 [1,1,0,0,0,0|2,0,0]=4 3919 B9R1.21 N#CC1CCC(C=O)C1 Amb25147099 [1,1,0,0,0,0|2,0,0]=4 3920 B9R1.21 O=CC1CCC(C=O)C1 Amb18642420 [1,1,0,0,0,0|1,0,1]=4 3921 B9R1.21 O=CC1CCC(CO)C1 Amb26516032 [1,1,0,0,0,0|1,0,0]=3 3922 B9R1.21 O=CC1CCC(CO)O1 Amb18642773 [1,1,0,0,0,0|2,0,0]=4 3923 B9R1.21 OCC1CCC(CO)C1 Amb27975602 [1,1,0,0,0,0|1,0,1]=4 3924 B9R1.21 OCC1CNC(CO)C1 Amb33042677 [1,1,0,0,0,0|0,0,1]=3 3925 B9R1.21 OCC1CNC(CO)C1 Amb33042748 [1,1,0,0,0,0|0,0,1]=3 3926 B9R1.21 OC[C@@H]1CC[C@@H](CO)C1 Amb28138723 [1,1,0,0,0,0|1,0,1]=4 3927 B9R1.22 CC1CC(=O)C(C=O)C1 Amb27234402 [1,1,0,0,0,0|2,0,0]=4 3928 B9R1.22 CC1CC(O)CN1C=O Amb27266299 [1,1,0,0,0,0|2,0,0]=4 3929 B9R1.22 CN1CC(F)CC1C=O Amb28288494 [1,1,0,0,0,0|1,0,0]=3 3930 B9R1.22 CN1CC(N)CC1CO Amb27469649 [1,1,0,0,0,0|1,0,1]=4 3931 B9R1.22 CN1CC(O)CC1CN Amb26916984 [1,1,0,0,0,0|1,0,1]=4 3932 B9R1.22 CN1CC(O)CC1CN Amb32666313 [1,1,0,0,0,0|1,0,1]=4 3933 B9R1.22 CN1CC(O)C[C@@H]1CO Amb27780484 [1,1,0,0,0,0|0,0,1]=3 3934 B9R1.22 CN1C[C@@H](F)C[C@H]1CO Amb28436055 [1,1,0,0,0,0|1,0,1]=4 3935 B9R1.22 CN1C[C@@H](N)C[C@H]1CO Amb23385232 [1,1,0,0,0,0|1,0,1]=4 3936 B9R1.22 CN1C[C@@H](O)C[C@@H]1CN Amb26008329 [1,1,0,0,0,0|1,0,1]=4 3937 B9R1.22 CN1C[C@@H](O)C[C@@H]1CN Amb32661301 [1,1,0,0,0,0|1,0,1]=4 3938 B9R1.22 CN1C[C@@H](O)C[C@H]1CO Amb27211716 [1,1,0,0,0,0|0,0,1]=3 3939 B9R1.22 CN1C[C@@H](S)C[C@H]1CO Amb27230463 [1,1,0,0,0,0|0,1,1]=4 3940 B9R1.22 CN1C[C@H](N)C[C@@H]1CO Amb34916490 [1,1,0,0,0,0|1,0,1]=4 3941 B9R1.22 CN1C[C@H](N)C[C@H]1CO Amb15701329 [1,1,0,0,0,0|1,0,1]=4 3942 B9R1.22 CN1C[C@H](O)C[C@H]1CN Amb24539864 [1,1,0,0,0,0|1,0,1]=4 3943 B9R1.22 CN1C[C@H](O)C[C@H]1CO Amb13883425 [1,1,0,0,0,0|0,0,1]=3 3944 B9R1.22 NN1CC(O)CC1CO Amb35662758 [1,1,0,0,0,0|0,0,1]=3 3945 B9R1.22 OCC1CC(O)CC1O Amb27857703 [1,1,0,0,0,0|1,0,1]=4 3946 B9R1.22 OC[C@@H]1C[C@@H](O)C[C@@H]1O Amb26418412 [1,1,0,0,0,0|1,0,1]=4 3947 B9R1.23 C=CC1CC(O)C(O)C1 Amb28069533 [1,1,0,0,0,0|2,0,0]=4 3948 B9R1.23 C=C[C@@H]1C[C@@H](O)[C@@H](O)O1 Amb27207689 [1,1,0,0,0,0|2,0,0]=4 3949 B9R1.23 CC1OC(CO)CC1O Amb27237511 [1,1,0,0,0,0|1,0,1]=4 3950 B9R1.23 CCC1CC(O)C(C)N1 Amb23453816 [1,1,0,0,0,0|1,0,1]=4 3951 B9R1.23 C[C@@H]1O[C@H](CO)C[C@@H]1O Amb26450794 [1,1,0,0,0,0|1,0,1]=4 3952 B9R1.23 C[C@H]1O[C@H](CO)C[C@@H]1O Amb27849652 [1,1,0,0,0,0|1,0,1]=4 3953 B9R1.23 NC1CC(CO)CC1O Amb27766107 [1,1,0,0,0,0|1,0,1]=4 3954 B9R1.23 N[C@@H]1C[C@@H](CO)C[C@H]1O Amb27261497 [1,1,0,0,0,0|1,0,1]=4 3955 B9R1.23 O=CC1CC(O)C(=O)O1 Amb27838700 [1,1,0,0,0,0|1,0,1]=4 3956 B9R1.23 O=CC1CC(O)C(O)O1 Amb28324397 [1,1,0,0,0,0|1,0,0]=3 3957 B9R1.23 OC[C@@H]1C[C@@H](O)C(O)O1 Amb27204425 [1,1,0,0,0,0|1,0,1]=4 3958 B9R1.23 OC[C@@H]1C[C@H](O)[C@@H](Br)C1 Amb26387681 [1,1,0,0,0,0|1,0,1]=4 3959 B9R1.23 OC[C@H]1C[C@@H](O)C(O)O1 Amb25235052 [1,1,0,0,0,0|1,0,1]=4 3960 B9R1.125 C=C[C@]1(C)CC[C@H](O)C1 Amb28401084 [1,1,0,0,0,0|2,0,0]=4 3961 B9R1.125 CC1(CO)CC(O)CN1 Amb32667664 [1,1,0,0,0,0|0,0,1]=3 3962 B9R1.125 CC1(CO)CC(O)CN1 Amb32667666 [1,1,0,0,0,0|0,0,1]=3 3963 B9R1.125 CC1CCC(C)(C=O)C1 Amb23454036 [1,1,0,0,0,0|2,0,0]=4 3964 B9R1.125 NC1(CO)CCC(O)C1 Amb29850596 [1,1,0,0,0,0|1,0,1]=4 3965 B9R1.132 CC[C@@H]1NC[C@@H](O)[C@H]1O Amb27621501 [1,1,0,0,0,0|1,0,1]=4 3966 B9R1.132 NC[C@@H]1NC[C@H](O)[C@@H]1O Amb27494043 [1,1,0,0,0,0|1,0,1]=4 3967 B9R1.132 O=CC1OCC(O)C1O Amb27256563 [1,1,0,0,0,0|1,0,0]=3 3968 B9R1.132 O=C[C@@H]1OC[C@@H](O)[C@H]1O Amb27629808 [1,1,0,0,0,0|1,0,0]=3 3969 B9R1.132 O=C[C@@H]1OC[C@H](O)[C@@H]1O Amb28457584 [1,1,0,0,0,0|1,0,0]=3 3970 B9R1.132 OCC1NCC(O)C1O Amb25348005 [1,1,0,0,0,0|0,0,1]=3 3971 B9R1.132 OCC1NC[C@@H](O)[C@H]1O Amb27815201 [1,1,0,0,0,0|0,0,1]=3 3972 B9R1.132 OCC1OCC(O)C1O Amb26636536 [1,1,0,0,0,0|1,0,1]=4 3973 B9R1.132 OCC1SCC(O)C1O Amb26976977 [1,1,0,0,0,0|1,0,1]=4 3974 B9R1.132 OC[C@@H]1NC[C@@H](O)[C@@H]1O Amb27655914 [1,1,0,0,0,0|0,0,1]=3 3975 B9R1.132 OC[C@@H]1OC[C@@H](O)[C@@H]1O Amb22747091 [1,1,0,0,0,0|1,0,1]=4 3976 B9R1.132 OC[C@@H]1OC[C@@H](O)[C@H]1O Amb27788292 [1,1,0,0,0,0|1,0,1]=4 3977 B9R1.132 OC[C@@H]1SC[C@@H](O)[C@@H]1O Amb27186502 [1,1,0,0,0,0|1,0,1]=4 3978 B9R1.132 OC[C@H]1NC[C@@H](Cl)[C@@H]1O Amb27489135 [1,1,0,0,0,0|1,0,1]=4 3979 B9R1.132 OC[C@H]1NC[C@@H](O)C1O Amb28206172 [1,1,0,0,0,0|0,0,1]=3 3980 B9R1.132 OC[C@H]1NC[C@@H](O)[C@@H]1O Amb25231751 [1,1,0,0,0,0|0,0,1]=3 3981 B9R1.132 OC[C@H]1NC[C@H](O)[C@@H]1O Amb27851435 [1,1,0,0,0,0|0,0,1]=3 3982 B9R1.132 OC[C@H]1OCC(O)C1O Amb27624028 [1,1,0,0,0,0|1,0,1]=4 3983 B9R1.132 OC[C@H]1OC[C@H](O)[C@@H]1O Amb22233163 [1,1,0,0,0,0|1,0,1]=4 3984 B9R1.132 OC[C@H]1OC[C@H](O)[C@H]1O Amb24572863 [1,1,0,0,0,0|1,0,1]=4 3985 B9R1.132 OC[C@H]1SC[C@H](O)[C@@H]1O Amb28133423 [1,1,0,0,0,0|1,0,1]=4 3986 B9R1.133 CC1(C)CNC(CO)C1 Amb26628891 [1,1,0,0,0,0|1,0,1]=4 3987 B9R1.133 CC1(C)CNC(CO)C1 Amb33172794 [1,1,0,0,0,0|1,0,1]=4 3988 B9R1.133 CC1(C)CN[C@@H](CO)C1 Amb31289590 [1,1,0,0,0,0|1,0,1]=4 3989 B9R1.133 CC1(C)CN[C@H](CO)C1 Amb26980862 [1,1,0,0,0,0|1,0,1]=4 3990 B9R1.133 CC1(C)CN[C@H](CO)C1 Amb30874087 [1,1,0,0,0,0|1,0,1]=4 3991 B9R1.133 CC1(O)CCN(C=O)C1 Amb27807755 [1,1,0,0,0,0|2,0,0]=4 3992 B9R1.133 O=CC1CCC(F)(F)C1 Amb24620428 [1,1,0,0,0,0|2,0,0]=4 3993 B9R1.133 O=C[C@@H]1CC(F)(F)CN1 Amb27185638 [1,1,0,0,0,0|1,0,0]=3 3994 B9R1.133 OCC1CC(F)(F)CN1 Amb33495133 [1,1,0,0,0,0|1,0,1]=4 3995 B9R1.133 OC[C@@H]1CC(F)(F)CN1 Amb22886267 [1,1,0,0,0,0|1,0,1]=4 3996 B9R1.133 OC[C@@H]1CC(F)(F)CN1 Amb28047313 [1,1,0,0,0,0|1,0,1]=4 3997 B9R1.133 OC[C@H]1CC(F)(F)CN1 Amb31204639 [1,1,0,0,0,0|1,0,1]=4 3998 B9R1.11 C#CC(=O)C1CCCC1 Amb22498876 [1,1,0,0,0,0|2,0,0]=4 3999 B9R1.11 C#CC(=O)C1CCCN1 Amb26983722 [1,1,0,0,0,0|1,0,0]=3 4000 B9R1.11 C#CC(=O)C1CCCS1 Amb28345587 [1,1,0,0,0,0|2,0,0]=4 4001 B9R1.11 C#CC(=O)N1CCCN1 Amb27787317 [1,1,0,0,0,0|2,0,0]=4 4002 B9R1.11 C#CC(=O)[C@@H]1CCCN1 Amb33132129 [1,1,0,0,0,0|1,0,0]=3 4003 B9R1.11 C#CC(=O)[C@H]1CCCN1 Amb30038901 [1,1,0,0,0,0|1,0,0]=3 4004 B9R1.11 C#CC(O)[C@@H]1CCCN1 Amb30038966 [1,1,0,0,0,0|1,0,1]=4 4005 B9R1.11 C#CC(O)[C@H]1CCCN1 Amb30039105 [1,1,0,0,0,0|1,0,1]=4 4006 B9R1.11 C=C(CC)C1CCCN1 Amb23536671 [1,1,0,0,0,0|2,0,0]=4 4007 B9R1.11 C=C(CO)C1CCCC1 Amb27751861 [1,1,0,0,0,0|2,0,0]=4 4008 B9R1.11 C=C(CO)[C@@H]1CCCN1 Amb27473829 [1,1,0,0,0,0|1,0,0]=3 4009 B9R1.11 C=CC(=O)C1CCCC1 Amb25180831 [1,1,0,0,0,0|2,0,0]=4 4010 B9R1.11 C=CC(=O)C1CCCN1 Amb24376988 [1,1,0,0,0,0|1,0,0]=3 4011 B9R1.11 C=CC(=O)C1CCCO1 Amb25139821 [1,1,0,0,0,0|2,0,0]=4 4012 B9R1.11 C=CC(=O)C1CCCS1 Amb24462018 [1,1,0,0,0,0|2,0,0]=4 4013 B9R1.11 C=CC(=O)[C@@H]1CCCN1 Amb33132130 [1,1,0,0,0,0|1,0,0]=3 4014 B9R1.11 C=CC(=O)[C@H]1CCCN1 Amb33132116 [1,1,0,0,0,0|1,0,0]=3 4015 B9R1.11 C=CC(O)[C@H]1CCCN1 Amb30039307 [1,1,0,0,0,0|1,0,1]=4 4016 B9R1.11 CC(NO)C1CCCN1 Amb27626918 [1,1,0,0,0,0|1,0,1]=4 4017 B9R1.11 CCC(=O)C1CCCC1 Amb33534974 [1,1,0,0,0,0|2,0,0]=4 4018 B9R1.11 CCC(=O)C1CCCN1 Amb17231849 [1,1,0,0,0,0|1,0,0]=3 4019 B9R1.11 CCC(=O)C1CCCN1 Amb32666386 [1,1,0,0,0,0|1,0,0]=3 4020 B9R1.11 CCC(=O)[C@@H]1CCCN1 Amb26856430 [1,1,0,0,0,0|1,0,0]=3 4021 B9R1.11 CCC(=O)[C@@H]1CCCN1 Amb32663156 [1,1,0,0,0,0|1,0,0]=3 4022 B9R1.11 CCC(=O)[C@H]1CCCN1 Amb33132117 [1,1,0,0,0,0|1,0,0]=3 4023 B9R1.11 CCC(O)C1CCCN1 Amb17231861 [1,1,0,0,0,0|1,0,1]=4 4024 B9R1.11 CCC(O)[C@@H]1CCCN1 Amb28340949 [1,1,0,0,0,0|1,0,1]=4 4025 B9R1.11 CCC(O)[C@@H]1CCCN1 Amb33734033 [1,1,0,0,0,0|1,0,1]=4 4026 B9R1.11 CCC(O)[C@H]1CCCN1 Amb29891705 [1,1,0,0,0,0|1,0,1]=4 4027 B9R1.11 CCC(O)[C@H]1CCCN1 Amb33734032 [1,1,0,0,0,0|1,0,1]=4 4028 B9R1.11 CNC(=O)C1CCCC1 Amb8340768 [1,1,0,0,0,0|2,0,0]=4 4029 B9R1.11 CNC(=O)C1CCCN1 Amb10609065 [1,1,0,0,0,0|1,0,0]=3 4030 B9R1.11 CNC(=O)C1CCCN1 Amb9717334 [1,1,0,0,0,0|1,0,0]=3 4031 B9R1.11 CNC(=O)C1CCCO1 Amb3445623 [1,1,0,0,0,0|2,0,0]=4 4032 B9R1.11 CNC(=O)C1NCCS1 Amb27975503 [1,1,0,0,0,0|2,0,0]=4 4033 B9R1.11 CNC(=O)N1CCCN1 Amb27250602 [1,1,0,0,0,0|2,0,0]=4 4034 B9R1.11 CNC(=O)[C@@H]1CCCN1 Amb10874670 [1,1,0,0,0,0|1,0,0]=3 4035 B9R1.11 CNC(=O)[C@@H]1CCCN1 Amb15740702 [1,1,0,0,0,0|1,0,0]=3 4036 B9R1.11 CNC(=O)[C@@H]1CCCN1 Amb22587500 [1,1,0,0,0,0|1,0,0]=3 4037 B9R1.11 CNC(=O)[C@@H]1CCCO1 Amb25864777 [1,1,0,0,0,0|2,0,0]=4 4038 B9R1.11 CNC(=O)[C@H]1CCCN1 Amb22232105 [1,1,0,0,0,0|1,0,0]=3 4039 B9R1.11 CNC(=O)[C@H]1CCCN1 Amb22587598 [1,1,0,0,0,0|1,0,0]=3 4040 B9R1.11 COC(=N)C1CCCC1 Amb25713898 [1,1,0,0,0,0|2,0,0]=4 4041 B9R1.11 COC(=N)C1CCCC1 Amb33249615 [1,1,0,0,0,0|2,0,0]=4 4042 B9R1.11 COC(=O)C1=CCCC1 Amb8385478 [1,1,0,0,0,0|1,0,1]=4 4043 B9R1.11 COC(=O)C1=CCCN1 Amb28249997 [1,1,0,0,0,0|0,0,2]=4 4044 B9R1.11 COC(=O)C1=NCCC1 Amb21964254 [1,1,0,0,0,0|0,0,2]=4 4045 B9R1.11 COC(=O)C1C=CCC1 Amb23456135 [1,1,0,0,0,0|1,0,1]=4 4046 B9R1.11 COC(=O)C1C=CCN1 Amb17621965 [1,1,0,0,0,0|0,0,2]=4 4047 B9R1.11 COC(=O)C1C=CCN1 Amb2720249 [1,1,0,0,0,0|0,0,2]=4 4048 B9R1.11 COC(=O)C1CCC=N1 Amb25106874 [1,1,0,0,0,0|0,0,2]=4 4049 B9R1.11 COC(=O)C1CCCC1 Amb4021254 [1,1,0,0,0,0|1,0,0]=3 4050 B9R1.11 COC(=O)C1CCCN1 Amb33539333 [1,1,0,0,0,0|0,0,0]=2 4051 B9R1.11 COC(=O)C1CCCN1 Amb5492762 [1,1,0,0,0,0|0,0,0]=2 4052 B9R1.11 COC(=O)C1CCCO1 Amb8392933 [1,1,0,0,0,0|1,0,0]=3 4053 B9R1.11 COC(=O)C1CCCS1 Amb23590656 [1,1,0,0,0,0|1,0,0]=3 4054 B9R1.11 COC(=O)C1CCC[NH2+]1 Amb22045239 [1,1,0,0,0,0|0,0,1]=3 4055 B9R1.11 COC(=O)C1CCC[NH2+]1 Amb33513046 [1,1,0,0,0,0|0,0,1]=3 4056 B9R1.11 COC(=O)C1CCNC1 Amb2695367 [1,1,0,0,0,0|2,0,0]=4 4057 B9R1.11 COC(=O)C1CCNC1 Amb9721388 [1,1,0,0,0,0|2,0,0]=4 4058 B9R1.11 COC(=O)C1CCNN1 Amb27218833 [1,1,0,0,0,0|1,0,0]=3 4059 B9R1.11 COC(=O)C1CCNO1 Amb24607719 [1,1,0,0,0,0|2,0,0]=4 4060 B9R1.11 COC(=O)C1CCNO1 Amb32896053 [1,1,0,0,0,0|2,0,0]=4 4061 B9R1.11 COC(=O)C1CCOC1 Amb10610344 [1,1,0,0,0,0|2,0,0]=4 4062 B9R1.11 COC(=O)C1CCSC1 Amb24598032 [1,1,0,0,0,0|2,0,0]=4 4063 B9R1.11 COC(=O)C1CCSS1 Amb33483432 [1,1,0,0,0,0|2,0,0]=4 4064 B9R1.11 COC(=O)C1COCN1 Amb27754634 [1,1,0,0,0,0|1,0,0]=3 4065 B9R1.11 COC(=O)C1CSCN1 Amb1154599 [1,1,0,0,0,0|1,0,0]=3 4066 B9R1.11 COC(=O)C1CSCN1 Amb2967255 [1,1,0,0,0,0|1,0,0]=3 4067 B9R1.11 COC(=O)C1NCCS1 Amb3941401 [1,1,0,0,0,0|1,0,0]=3 4068 B9R1.11 COC(=O)C1[NH2+]CCS1 Amb24113751 [1,1,0,0,0,0|1,0,1]=4 4069 B9R1.11 COC(=O)C1[NH2+]CCS1 Amb6365986 [1,1,0,0,0,0|1,0,1]=4 4070 B9R1.11 COC(=O)N1CCCC1 Amb15693435 [1,1,0,0,0,0|2,0,0]=4 4071 B9R1.11 COC(=O)N1CCCO1 Amb27981531 [1,1,0,0,0,0|2,0,0]=4 4072 B9R1.11 COC(=O)[C@@H]1C=CCN1 Amb16183938 [1,1,0,0,0,0|0,0,2]=4 4073 B9R1.11 COC(=O)[C@@H]1C=CCN1 Amb22800018 [1,1,0,0,0,0|0,0,2]=4 4074 B9R1.11 COC(=O)[C@@H]1CC=NN1 Amb24340266 [1,1,0,0,0,0|1,0,1]=4 4075 B9R1.11 COC(=O)[C@@H]1CCC=N1 Amb27249637 [1,1,0,0,0,0|0,0,2]=4 4076 B9R1.11 COC(=O)[C@@H]1CCCN1 Amb2700050 [1,1,0,0,0,0|0,0,0]=2 4077 B9R1.11 COC(=O)[C@@H]1CCCN1 Amb2720243 [1,1,0,0,0,0|0,0,0]=2 4078 B9R1.11 COC(=O)[C@@H]1CCCO1 Amb25113406 [1,1,0,0,0,0|1,0,0]=3 4079 B9R1.11 COC(=O)[C@@H]1CCNC1 Amb20241764 [1,1,0,0,0,0|2,0,0]=4 4080 B9R1.11 COC(=O)[C@@H]1CCNC1 Amb22225397 [1,1,0,0,0,0|2,0,0]=4 4081 B9R1.11 COC(=O)[C@@H]1CCNC1 Amb22405891 [1,1,0,0,0,0|2,0,0]=4 4082 B9R1.11 COC(=O)[C@@H]1CCOC1 Amb27167435 [1,1,0,0,0,0|2,0,0]=4 4083 B9R1.11 COC(=O)[C@@H]1CSCN1 Amb5759061 [1,1,0,0,0,0|1,0,0]=3 4084 B9R1.11 COC(=O)[C@@H]1CSCN1 Amb9860665 [1,1,0,0,0,0|1,0,0]=3 4085 B9R1.11 COC(=O)[C@H]1C=CCN1 Amb27430886 [1,1,0,0,0,0|0,0,2]=4 4086 B9R1.11 COC(=O)[C@H]1CC=NN1 Amb25976015 [1,1,0,0,0,0|1,0,1]=4 4087 B9R1.11 COC(=O)[C@H]1CCCN1 Amb10844896 [1,1,0,0,0,0|0,0,0]=2 4088 B9R1.11 COC(=O)[C@H]1CCCN1 Amb2700059 [1,1,0,0,0,0|0,0,0]=2 4089 B9R1.11 COC(=O)[C@H]1CCC[NH2+]1 Amb6366044 [1,1,0,0,0,0|0,0,1]=3 4090 B9R1.11 COC(=O)[C@H]1CCNC1 Amb22405890 [1,1,0,0,0,0|2,0,0]=4 4091 B9R1.11 COC(=O)[C@H]1CCNC1 Amb22744897 [1,1,0,0,0,0|2,0,0]=4 4092 B9R1.11 COC(=O)[C@H]1CCNC1 Amb28398077 [1,1,0,0,0,0|2,0,0]=4 4093 B9R1.11 COC(=O)[C@H]1CCOC1 Amb23439173 [1,1,0,0,0,0|2,0,0]=4 4094 B9R1.11 COC(=O)[C@H]1CSCN1 Amb25865131 [1,1,0,0,0,0|1,0,0]=3 4095 B9R1.11 C\C(=N/O)C1CCCC1 Amb28064503 [1,1,0,0,0,0|2,0,0]=4 4096 B9R1.11 C\C=C(\C)C1CCCN1 Amb27851858 [1,1,0,0,0,0|2,0,0]=4 4097 B9R1.11 N=C(NO)C1CCCC1 Amb22733339 [1,1,0,0,0,0|2,0,0]=4 4098 B9R1.11 NC(CO)C1CCCN1 Amb27631593 [1,1,0,0,0,0|1,0,1]=4 4099 B9R1.11 NCC(=O)C1CCCC1 Amb18832687 [1,1,0,0,0,0|2,0,0]=4 4100 B9R1.11 NCC(=O)C1CCCC1 Amb29083225 [1,1,0,0,0,0|2,0,0]=4 4101 B9R1.11 NCC(=O)C1CCCO1 Amb24398393 [1,1,0,0,0,0|2,0,0]=4 4102 B9R1.11 NCC(=O)C1CCCS1 Amb33416249 [1,1,0,0,0,0|2,0,0]=4 4103 B9R1.11 NNC(=O)C1CCCC1 Amb6555160 [1,1,0,0,0,0|2,0,0]=4 4104 B9R1.11 NNC(=O)C1CCCN1 Amb18061830 [1,1,0,0,0,0|1,0,0]=3 4105 B9R1.11 NNC(=O)C1CCCO1 Amb34916470 [1,1,0,0,0,0|2,0,0]=4 4106 B9R1.11 NNC(=O)C1CCCO1 Amb9707217 [1,1,0,0,0,0|2,0,0]=4 4107 B9R1.11 NNC(=O)C1CCCS1 Amb25887207 [1,1,0,0,0,0|2,0,0]=4 4108 B9R1.11 NNC(=O)C1CCCS1 Amb32664150 [1,1,0,0,0,0|2,0,0]=4 4109 B9R1.11 NNC(=O)C1CSCN1 Amb24730884 [1,1,0,0,0,0|2,0,0]=4 4110 B9R1.11 NNC(=O)[C@@H]1CCCO1 Amb25796517 [1,1,0,0,0,0|2,0,0]=4 4111 B9R1.11 NNC(=O)[C@@H]1CSCN1 Amb25865010 [1,1,0,0,0,0|2,0,0]=4 4112 B9R1.11 NNC(=O)[C@H]1CCCO1 Amb25221584 [1,1,0,0,0,0|2,0,0]=4 4113 B9R1.11 NNC(=O)[C@H]1CSCN1 Amb28049813 [1,1,0,0,0,0|2,0,0]=4 4114 B9R1.11 NOC(=O)C1CCOC1 Amb22170066 [1,1,0,0,0,0|2,0,0]=4 4115 B9R1.11 N\C(=N/O)C1CCCC1 Amb2695057 [1,1,0,0,0,0|2,0,0]=4 4116 B9R1.11 N\C(=N/O)C1CCCN1 Amb24749080 [1,1,0,0,0,0|1,0,0]=3 4117 B9R1.11 N\C(=N/O)C1CCCO1 Amb24340285 [1,1,0,0,0,0|2,0,0]=4 4118 B9R1.11 N\C(=N/O)C1CCCS1 Amb26500911 [1,1,0,0,0,0|2,0,0]=4 4119 B9R1.11 N\C(=N/O)[C@@H]1CCCO1 Amb27844059 [1,1,0,0,0,0|2,0,0]=4 4120 B9R1.11 N\C(=N/O)[C@H]1CCCO1 Amb28187020 [1,1,0,0,0,0|2,0,0]=4 4121 B9R1.11 O=C(CBr)C1CCCC1 Amb19375225 [1,1,0,0,0,0|2,0,0]=4 4122 B9R1.11 O=C(CBr)C1CCCO1 Amb24104046 [1,1,0,0,0,0|2,0,0]=4 4123 B9R1.11 O=C(CBr)C1CCCS1 Amb27798466 [1,1,0,0,0,0|2,0,0]=4 4124 B9R1.11 O=C(CBr)[C@@H]1CCCO1 Amb26860082 [1,1,0,0,0,0|2,0,0]=4 4125 B9R1.11 O=C(CCl)C1CCCC1 Amb8396061 [1,1,0,0,0,0|2,0,0]=4 4126 B9R1.11 O=C(CCl)C1CCCO1 Amb24751558 [1,1,0,0,0,0|2,0,0]=4 4127 B9R1.11 O=C(CCl)C1CCCS1 Amb25328071 [1,1,0,0,0,0|2,0,0]=4 4128 B9R1.11 O=C(CF)C1CCCC1 Amb23571962 [1,1,0,0,0,0|2,0,0]=4 4129 B9R1.11 O=C(CO)C1CCCC1 Amb28194788 [1,1,0,0,0,0|1,0,0]=3 4130 B9R1.11 O=C(CO)C1CCOC1 Amb27390723 [1,1,0,0,0,0|2,0,0]=4 4131 B9R1.11 O=C(CO)N1CCCC1 Amb5798098 [1,1,0,0,0,0|2,0,0]=4 4132 B9R1.11 O=C(NO)C1=CCCC1 Amb25178133 [1,1,0,0,0,0|1,0,1]=4 4133 B9R1.11 O=C(NO)C1CCCC1 Amb6262531 [1,1,0,0,0,0|1,0,0]=3 4134 B9R1.11 O=C(NO)C1CCCN1 Amb25127054 [1,1,0,0,0,0|0,0,0]=2 4135 B9R1.11 O=C(NO)C1CCCN1 Amb33204459 [1,1,0,0,0,0|0,0,0]=2 4136 B9R1.11 O=C(NO)C1CCCO1 Amb6264210 [1,1,0,0,0,0|1,0,0]=3 4137 B9R1.11 O=C(NO)C1CCCS1 Amb27170986 [1,1,0,0,0,0|1,0,0]=3 4138 B9R1.11 O=C(NO)C1CCNC1 Amb27856778 [1,1,0,0,0,0|2,0,0]=4 4139 B9R1.11 O=C(NO)C1CSCN1 Amb27762965 [1,1,0,0,0,0|1,0,0]=3 4140 B9R1.11 O=C(NO)C1SCCS1 Amb28256032 [1,1,0,0,0,0|2,0,0]=4 4141 B9R1.11 O=C(NO)[C@@H]1CCCN1 Amb27410904 [1,1,0,0,0,0|0,0,0]=2 4142 B9R1.11 O=C(NO)[C@@H]1CCNC1 Amb35675145 [1,1,0,0,0,0|2,0,0]=4 4143 B9R1.11 O=C(NO)[C@H]1CCCO1 Amb27837680 [1,1,0,0,0,0|1,0,0]=3 4144 B9R1.11 O=C(NO)[C@H]1CCNC1 Amb35593664 [1,1,0,0,0,0|2,0,0]=4 4145 B9R1.11 O=CC(=O)C1CCCO1 Amb27817025 [1,1,0,0,0,0|1,0,1]=4 4146 B9R1.11 O\N=C(/Cl)C1CCCO1 Amb35637771 [1,1,0,0,0,0|2,0,0]=4 4147 B9R1.19 CC(C)(O)C1CCCN1 Amb18061666 [1,1,0,0,0,0|1,0,1]=4 4148 B9R1.19 CC(C)(O)[C@@H]1CCCN1 Amb23439134 [1,1,0,0,0,0|1,0,1]=4 4149 B9R1.19 CC(C)(O)[C@H]1CCCN1 Amb22641927 [1,1,0,0,0,0|1,0,1]=4 4150 B9R1.19 CC(C)(O)[C@H]1CCCN1 Amb24077127 [1,1,0,0,0,0|1,0,1]=4 4151 B9R1.19 CP(=O)(O)C1CCCN1 Amb27799028 [1,1,0,0,0,0|1,0,0]=3 4152 B9R1.19 CP(C)(=O)C1CCCN1 Amb35746231 [1,1,0,0,0,0|2,0,0]=4 4153 B9R1.19 CP(C)(=O)C1CCCN1 Amb35752075 [1,1,0,0,0,0|2,0,0]=4 4154 B9R1.19 O=P(O)(O)C1CCCN1 Amb24479952 [1,1,0,0,0,0|1,0,0]=3 4155 B9R1.19 O=P(O)(O)C1CCCN1 Amb33716526 [1,1,0,0,0,0|1,0,0]=3 4156 B9R1.19 O=P(O)(O)[C@H]1CCCN1 Amb27876707 [1,1,0,0,0,0|1,0,0]=3 4157 B9R1.19 O=S(=O)(O)C1CCCC1 Amb24615046 [1,1,0,0,0,0|2,0,0]=4 4158 B9R1.41 C=C1CCCC1C(C)=O Amb27164651 [1,1,0,0,0,0|2,0,0]=4 4159 B9R1.41 CC(=O)C1CCCC1=O Amb6600481 [1,1,0,0,0,0|2,0,0]=4 4160 B9R1.41 CC(=O)C1CCCC1N Amb26959185 [1,1,0,0,0,0|2,0,0]=4 4161 B9R1.41 CC(=O)C1CCCC1O Amb25086736 [1,1,0,0,0,0|2,0,0]=4 4162 B9R1.41 CC(=O)C1CCCN1C Amb25295317 [1,1,0,0,0,0|1,0,0]=3 4163 B9R1.41 CC(=O)C1OCCC1N Amb33307372 [1,1,0,0,0,0|2,0,0]=4 4164 B9R1.41 CC(=O)[C@@H]1CCCN1N Amb26968682 [1,1,0,0,0,0|1,0,0]=3 4165 B9R1.41 CC(=O)[C@@H]1CCC[C@@H]1N Amb33132196 [1,1,0,0,0,0|2,0,0]=4 4166 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1C Amb24692616 [1,1,0,0,0,0|2,0,0]=4 4167 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1O Amb27440450 [1,1,0,0,0,0|2,0,0]=4 4168 B9R1.41 CC(=O)[C@@H]1OCC[C@@H]1N Amb33307350 [1,1,0,0,0,0|2,0,0]=4 4169 B9R1.41 CC(=O)[C@H]1CCC[C@H]1C Amb27428390 [1,1,0,0,0,0|2,0,0]=4 4170 B9R1.41 CC(O)C1CCCN1C Amb27491503 [1,1,0,0,0,0|1,0,1]=4 4171 B9R1.41 CC(O)[C@@H]1CCCN1C Amb24534366 [1,1,0,0,0,0|1,0,1]=4 4172 B9R1.41 CC1=C(C(=O)O)CCC1 Amb4021851 [1,1,0,0,0,0|1,0,1]=4 4173 B9R1.41 CC1CCCC1C(=O)Cl Amb26447682 [1,1,0,0,0,0|2,0,0]=4 4174 B9R1.41 CC1CCCC1C(=O)O Amb8496598 [1,1,0,0,0,0|1,0,0]=3 4175 B9R1.41 CC1CCNC1C(=O)O Amb22496299 [1,1,0,0,0,0|0,0,0]=2 4176 B9R1.41 CC1CCNC1C(=O)O Amb28895929 [1,1,0,0,0,0|0,0,0]=2 4177 B9R1.41 CC1CCNC1C(N)=O Amb26893292 [1,1,0,0,0,0|1,0,0]=3 4178 B9R1.41 CC1CCNC1C(N)=O Amb33307145 [1,1,0,0,0,0|1,0,0]=3 4179 B9R1.41 CC1CCN[C@@H]1C(=O)O Amb25786199 [1,1,0,0,0,0|0,0,0]=2 4180 B9R1.41 CC1CCOC1C(=O)O Amb20668280 [1,1,0,0,0,0|1,0,0]=3 4181 B9R1.41 CC1CCSC1C(=O)O Amb33038449 [1,1,0,0,0,0|1,0,0]=3 4182 B9R1.41 CC1CNCC1C(=O)O Amb2695368 [1,1,0,0,0,0|2,0,0]=4 4183 B9R1.41 CC1CNCC1C(=O)O Amb32665482 [1,1,0,0,0,0|2,0,0]=4 4184 B9R1.41 CC1NCCC1C(=O)O Amb18118138 [1,1,0,0,0,0|2,0,0]=4 4185 B9R1.41 CC1NCCC1C(=O)O Amb28555367 [1,1,0,0,0,0|2,0,0]=4 4186 B9R1.41 CC1OCCC1C(=O)O Amb33548509 [1,1,0,0,0,0|2,0,0]=4 4187 B9R1.41 CC1OCOC1C(=O)O Amb27828880 [1,1,0,0,0,0|2,0,0]=4 4188 B9R1.41 CC1SCNC1C(=O)O Amb27591597 [1,1,0,0,0,0|1,0,0]=3 4189 B9R1.41 CN1CC=CC1C(=O)O Amb15701264 [1,1,0,0,0,0|0,0,2]=4 4190 B9R1.41 CN1CC=CC1C(=O)O Amb22587153 [1,1,0,0,0,0|0,0,2]=4 4191 B9R1.41 CN1CCCC1C(=N)N Amb26563327 [1,1,0,0,0,0|2,0,0]=4 4192 B9R1.41 CN1CCCC1C(=N)N Amb33457486 [1,1,0,0,0,0|2,0,0]=4 4193 B9R1.41 CN1CCCC1C(=O)Cl Amb25250467 [1,1,0,0,0,0|1,0,0]=3 4194 B9R1.41 CN1CCCC1C(=O)O Amb33545070 [1,1,0,0,0,0|0,0,0]=2 4195 B9R1.41 CN1CCCC1C(=O)O Amb8559038 [1,1,0,0,0,0|0,0,0]=2 4196 B9R1.41 CN1CCCC1C(N)=O Amb22371060 [1,1,0,0,0,0|1,0,0]=3 4197 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb17935722 [1,1,0,0,0,0|0,0,0]=2 4198 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb18559228 [1,1,0,0,0,0|0,0,0]=2 4199 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb22748316 [1,1,0,0,0,0|0,0,0]=2 4200 B9R1.41 CN1CCC[C@H]1C(=O)O Amb10604041 [1,1,0,0,0,0|0,0,0]=2 4201 B9R1.41 CN1CCC[C@H]1C(=O)O Amb22587172 [1,1,0,0,0,0|0,0,0]=2 4202 B9R1.41 CN1CCC[C@H]1C(=O)O Amb9825903 [1,1,0,0,0,0|0,0,0]=2 4203 B9R1.41 CN1CCC[C@H]1C(N)=O Amb28059484 [1,1,0,0,0,0|1,0,0]=3 4204 B9R1.41 CN1CSCC1C(=O)O Amb19650934 [1,1,0,0,0,0|1,0,0]=3 4205 B9R1.41 CN1CSCC1C(=O)O Amb21959971 [1,1,0,0,0,0|1,0,0]=3 4206 B9R1.41 CN1CSC[C@@H]1C(=O)O Amb27157377 [1,1,0,0,0,0|1,0,0]=3 4207 B9R1.41 CN1CSC[C@H]1C(=O)O Amb10608462 [1,1,0,0,0,0|1,0,0]=3 4208 B9R1.41 CN1CSC[C@H]1C(=O)O Amb22587250 [1,1,0,0,0,0|1,0,0]=3 4209 B9R1.41 C[C@@H]1CCCC1C(=O)O Amb27167847 [1,1,0,0,0,0|1,0,0]=3 4210 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [1,1,0,0,0,0|1,0,0]=3 4211 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [1,1,0,0,0,0|1,0,0]=3 4212 B9R1.41 C[C@@H]1CCN[C@@H]1C(N)=O Amb27446302 [1,1,0,0,0,0|1,0,0]=3 4213 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O Amb22747259 [1,1,0,0,0,0|0,0,0]=2 4214 B9R1.41 C[C@@H]1CCO[C@@H]1C(=O)O Amb25251332 [1,1,0,0,0,0|1,0,0]=3 4215 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O Amb34916171 [1,1,0,0,0,0|1,0,0]=3 4216 B9R1.41 C[C@@H]1CNC[C@@H]1C(=O)O Amb27440055 [1,1,0,0,0,0|2,0,0]=4 4217 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb26442159 [1,1,0,0,0,0|2,0,0]=4 4218 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb32664837 [1,1,0,0,0,0|2,0,0]=4 4219 B9R1.41 C[C@@H]1COC[C@H]1C(=O)O Amb28286229 [1,1,0,0,0,0|2,0,0]=4 4220 B9R1.41 C[C@@H]1NCC[C@@H]1C(=O)O Amb27969130 [1,1,0,0,0,0|2,0,0]=4 4221 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O Amb18832568 [1,1,0,0,0,0|2,0,0]=4 4222 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O Amb22886528 [1,1,0,0,0,0|2,0,0]=4 4223 B9R1.41 C[C@@H]1OCC[C@H]1C(=O)O Amb25992190 [1,1,0,0,0,0|2,0,0]=4 4224 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [1,1,0,0,0,0|1,0,0]=3 4225 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [1,1,0,0,0,0|1,0,0]=3 4226 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O Amb8387164 [1,1,0,0,0,0|0,0,0]=2 4227 B9R1.41 C[C@H]1CNC[C@@H]1C(=O)O Amb27217270 [1,1,0,0,0,0|2,0,0]=4 4228 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O Amb27655604 [1,1,0,0,0,0|2,0,0]=4 4229 B9R1.41 C[C@H]1OCC[C@H]1C(=O)O Amb25253338 [1,1,0,0,0,0|2,0,0]=4 4230 B9R1.41 C[C@H]1OCNC1C(=O)O Amb28057581 [1,1,0,0,0,0|1,0,0]=3 4231 B9R1.41 C[C@H]1OCN[C@@H]1C(=O)O Amb27782646 [1,1,0,0,0,0|1,0,0]=3 4232 B9R1.41 C[C@H]1OCO[C@@H]1C(=O)O Amb27782406 [1,1,0,0,0,0|2,0,0]=4 4233 B9R1.41 NC(=O)C1CCCC1=O Amb16233729 [1,1,0,0,0,0|2,0,0]=4 4234 B9R1.41 NC(=O)C1CCCC1N Amb19148786 [1,1,0,0,0,0|2,0,0]=4 4235 B9R1.41 NC(=O)C1CCCC1N Amb32644747 [1,1,0,0,0,0|2,0,0]=4 4236 B9R1.41 NC(=O)C1CCCC1N Amb32662680 [1,1,0,0,0,0|2,0,0]=4 4237 B9R1.41 NC(=O)C1CCCC1O Amb25310986 [1,1,0,0,0,0|2,0,0]=4 4238 B9R1.41 NC(=O)C1CCCN1O Amb27607865 [1,1,0,0,0,0|1,0,0]=3 4239 B9R1.41 NC(=O)C1NCCC1O Amb24709283 [1,1,0,0,0,0|1,0,0]=3 4240 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N Amb8515831 [1,1,0,0,0,0|2,0,0]=4 4241 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1O Amb8515027 [1,1,0,0,0,0|2,0,0]=4 4242 B9R1.41 NC(=O)[C@@H]1NCC[C@@H]1O Amb27779452 [1,1,0,0,0,0|1,0,0]=3 4243 B9R1.41 NC(=O)[C@@H]1NCC[C@H]1O Amb22744802 [1,1,0,0,0,0|1,0,0]=3 4244 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb26432403 [1,1,0,0,0,0|2,0,0]=4 4245 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb32662604 [1,1,0,0,0,0|2,0,0]=4 4246 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb32662606 [1,1,0,0,0,0|2,0,0]=4 4247 B9R1.41 NC(=O)[C@H]1CCC[C@H]1O Amb26630221 [1,1,0,0,0,0|2,0,0]=4 4248 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O Amb25194866 [1,1,0,0,0,0|1,0,0]=3 4249 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O Amb27630066 [1,1,0,0,0,0|1,0,0]=3 4250 B9R1.41 NC1=C(C(=O)O)CCC1 Amb20240586 [1,1,0,0,0,0|1,0,1]=4 4251 B9R1.41 NC1CCCC1C(=O)O Amb2697364 [1,1,0,0,0,0|1,0,0]=3 4252 B9R1.41 NC1CCCC1C(=O)O Amb8630257 [1,1,0,0,0,0|1,0,0]=3 4253 B9R1.41 NC1CCCC1C(O)=[ClH] Amb27883058 [1,1,0,0,0,0|2,0,0]=4 4254 B9R1.41 NC1CCNC1C(=O)O Amb27153692 [1,1,0,0,0,0|0,0,0]=2 4255 B9R1.41 NC1CCOC1C(=O)O Amb26642919 [1,1,0,0,0,0|1,0,0]=3 4256 B9R1.41 NC1CNCC1C(=O)O Amb8630131 [1,1,0,0,0,0|2,0,0]=4 4257 B9R1.41 NC1COCC1C(=O)O Amb24709230 [1,1,0,0,0,0|2,0,0]=4 4258 B9R1.41 NC1CSCC1C(=O)O Amb24457278 [1,1,0,0,0,0|2,0,0]=4 4259 B9R1.41 NN1CCCC1C(=O)O Amb18642792 [1,1,0,0,0,0|0,0,0]=2 4260 B9R1.41 NN1CCC[C@H]1C(=O)O Amb25887284 [1,1,0,0,0,0|0,0,0]=2 4261 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8387462 [1,1,0,0,0,0|1,0,0]=3 4262 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8516030 [1,1,0,0,0,0|1,0,0]=3 4263 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb20241297 [1,1,0,0,0,0|1,0,0]=3 4264 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb33524005 [1,1,0,0,0,0|1,0,0]=3 4265 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb19929517 [1,1,0,0,0,0|0,0,0]=2 4266 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb31028940 [1,1,0,0,0,0|0,0,0]=2 4267 B9R1.41 N[C@@H]1CCO[C@@H]1C(=O)O Amb31264036 [1,1,0,0,0,0|1,0,0]=3 4268 B9R1.41 N[C@@H]1CCO[C@@H]1C(=O)O Amb32666901 [1,1,0,0,0,0|1,0,0]=3 4269 B9R1.41 N[C@@H]1CNC[C@H]1C(=O)O Amb27207888 [1,1,0,0,0,0|2,0,0]=4 4270 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O Amb24078777 [1,1,0,0,0,0|2,0,0]=4 4271 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O Amb33330248 [1,1,0,0,0,0|2,0,0]=4 4272 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb20241298 [1,1,0,0,0,0|1,0,0]=3 4273 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb22224860 [1,1,0,0,0,0|1,0,0]=3 4274 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993719 [1,1,0,0,0,0|1,0,0]=3 4275 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993764 [1,1,0,0,0,0|1,0,0]=3 4276 B9R1.41 N[C@H]1CCN[C@@H]1C(=O)O Amb27460833 [1,1,0,0,0,0|0,0,0]=2 4277 B9R1.41 N[C@H]1CCN[C@H]1C(=O)O Amb26904835 [1,1,0,0,0,0|0,0,0]=2 4278 B9R1.41 N[C@H]1CNC[C@@H]1C(=O)O Amb27880509 [1,1,0,0,0,0|2,0,0]=4 4279 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O Amb24605467 [1,1,0,0,0,0|2,0,0]=4 4280 B9R1.41 N[C@H]1CSC[C@H]1C(=O)O Amb25980819 [1,1,0,0,0,0|2,0,0]=4 4281 B9R1.41 O=C(Cl)C1CCCC1=O Amb21961757 [1,1,0,0,0,0|2,0,0]=4 4282 B9R1.41 O=C(Cl)C1CCCC1O Amb24524192 [1,1,0,0,0,0|2,0,0]=4 4283 B9R1.41 O=C(Cl)[C@@H]1CCC[C@@H]1O Amb27475951 [1,1,0,0,0,0|2,0,0]=4 4284 B9R1.41 O=C(O)C1=C(Cl)CCC1 Amb2612728 [1,1,0,0,0,0|1,0,1]=4 4285 B9R1.41 O=C(O)C1=C(S)CCC1 Amb27815303 [1,1,0,0,0,0|1,0,1]=4 4286 B9R1.41 O=C(O)C1=CCCC1O Amb27251744 [1,1,0,0,0,0|1,0,1]=4 4287 B9R1.41 O=C(O)C1=NCCC1O Amb28137087 [1,1,0,0,0,0|0,0,2]=4 4288 B9R1.41 O=C(O)C1CCCC1=O Amb18642571 [1,1,0,0,0,0|1,0,0]=3 4289 B9R1.41 O=C(O)C1CCCC1O Amb19148040 [1,1,0,0,0,0|1,0,0]=3 4290 B9R1.41 O=C(O)C1CCCC1S Amb18280971 [1,1,0,0,0,0|1,0,0]=3 4291 B9R1.41 O=C(O)C1CCNC1=O Amb18642691 [1,1,0,0,0,0|2,0,0]=4 4292 B9R1.41 O=C(O)C1CCOC1=O Amb17593365 [1,1,0,0,0,0|2,0,0]=4 4293 B9R1.41 O=C(O)C1CNCC1F Amb26864070 [1,1,0,0,0,0|2,0,0]=4 4294 B9R1.41 O=C(O)C1CNCC1F Amb33496211 [1,1,0,0,0,0|2,0,0]=4 4295 B9R1.41 O=C(O)C1CNCC1O Amb22886381 [1,1,0,0,0,0|2,0,0]=4 4296 B9R1.41 O=C(O)C1CNCC1O Amb26026738 [1,1,0,0,0,0|2,0,0]=4 4297 B9R1.41 O=C(O)C1COCC1O Amb27270738 [1,1,0,0,0,0|2,0,0]=4 4298 B9R1.41 O=C(O)C1CSCC1=O Amb16230660 [1,1,0,0,0,0|2,0,0]=4 4299 B9R1.41 O=C(O)C1CSCC1O Amb18831363 [1,1,0,0,0,0|2,0,0]=4 4300 B9R1.41 O=C(O)C1NCCC1F Amb25772909 [1,1,0,0,0,0|0,0,0]=2 4301 B9R1.41 O=C(O)C1NCCC1O Amb22387784 [1,1,0,0,0,0|0,0,0]=2 4302 B9R1.41 O=C(O)C1NCC[C@@H]1O Amb34913313 [1,1,0,0,0,0|0,0,0]=2 4303 B9R1.41 O=C(O)C1SCCC1F Amb27201981 [1,1,0,0,0,0|1,0,0]=3 4304 B9R1.41 O=C(O)[C@@H]1CNC[C@@H]1O Amb27186915 [1,1,0,0,0,0|2,0,0]=4 4305 B9R1.41 O=C(O)[C@@H]1CNC[C@H]1O Amb24120417 [1,1,0,0,0,0|2,0,0]=4 4306 B9R1.41 O=C(O)[C@@H]1NCCC1F Amb30988050 [1,1,0,0,0,0|0,0,0]=2 4307 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F Amb26904377 [1,1,0,0,0,0|0,0,0]=2 4308 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb22230426 [1,1,0,0,0,0|0,0,0]=2 4309 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801217 [1,1,0,0,0,0|0,0,0]=2 4310 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801367 [1,1,0,0,0,0|0,0,0]=2 4311 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Amb26891987 [1,1,0,0,0,0|0,0,0]=2 4312 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Amb30988051 [1,1,0,0,0,0|0,0,0]=2 4313 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb22746713 [1,1,0,0,0,0|0,0,0]=2 4314 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb24183557 [1,1,0,0,0,0|0,0,0]=2 4315 B9R1.41 O=C(O)[C@H]1CCC[C@@H]1O Amb27437088 [1,1,0,0,0,0|1,0,0]=3 4316 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O Amb22747315 [1,1,0,0,0,0|1,0,0]=3 4317 B9R1.41 O=C(O)[C@H]1CNC[C@@H]1O Amb27421639 [1,1,0,0,0,0|2,0,0]=4 4318 B9R1.41 O=C(O)[C@H]1CNC[C@H]1O Amb27818119 [1,1,0,0,0,0|2,0,0]=4 4319 B9R1.41 O=C(O)[C@H]1NCCC1O Amb10604192 [1,1,0,0,0,0|0,0,0]=2 4320 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1Cl Amb27618755 [1,1,0,0,0,0|0,0,0]=2 4321 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb24055327 [1,1,0,0,0,0|0,0,0]=2 4322 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb34154004 [1,1,0,0,0,0|0,0,0]=2 4323 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb8515204 [1,1,0,0,0,0|0,0,0]=2 4324 B9R1.41 O=C(O)[C@H]1NCC[C@H]1Br Amb27232994 [1,1,0,0,0,0|0,0,0]=2 4325 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb22746928 [1,1,0,0,0,0|0,0,0]=2 4326 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb23439285 [1,1,0,0,0,0|0,0,0]=2 4327 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb24183503 [1,1,0,0,0,0|0,0,0]=2 4328 B9R1.41 O=C(O)[C@H]1NCC[C@H]1S Amb27421961 [1,1,0,0,0,0|0,0,0]=2 4329 B9R1.163 CC(=O)C1(C)CCCC1 Amb17593318 [1,1,0,0,0,0|2,0,0]=4 4330 B9R1.163 CC(=O)C1(C)CCCN1 Amb25789427 [1,1,0,0,0,0|1,0,0]=3 4331 B9R1.163 CC(=O)C1(C)CCCO1 Amb24332633 [1,1,0,0,0,0|2,0,0]=4 4332 B9R1.163 CC(=O)C1(C)NCCO1 Amb27795907 [1,1,0,0,0,0|2,0,0]=4 4333 B9R1.163 CC(=O)C1(Cl)CCCC1 Amb27950094 [1,1,0,0,0,0|2,0,0]=4 4334 B9R1.163 CC(=O)C1(N)CCCC1 Amb1091405 [1,1,0,0,0,0|2,0,0]=4 4335 B9R1.163 CC(=O)C1(N)CCCC1 Amb22283948 [1,1,0,0,0,0|2,0,0]=4 4336 B9R1.163 CC(=O)C1(N)NCCS1 Amb27162223 [1,1,0,0,0,0|2,0,0]=4 4337 B9R1.163 CC(=O)C1(O)CCCC1 Amb17593345 [1,1,0,0,0,0|2,0,0]=4 4338 B9R1.163 CC(=O)[C@@]1(C)CCCN1 Amb33307927 [1,1,0,0,0,0|1,0,0]=3 4339 B9R1.163 CC(=O)[C@]1(C)CCCN1 Amb33307921 [1,1,0,0,0,0|1,0,0]=3 4340 B9R1.163 CC(O)C1(C)CCCN1 Amb35740734 [1,1,0,0,0,0|1,0,1]=4 4341 B9R1.163 CC(O)[C@]1(C)CCCN1 Amb33744143 [1,1,0,0,0,0|1,0,1]=4 4342 B9R1.163 CC1(C(=O)Cl)CCCC1 Amb24476587 [1,1,0,0,0,0|2,0,0]=4 4343 B9R1.163 CC1(C(=O)Cl)CCCO1 Amb26359915 [1,1,0,0,0,0|2,0,0]=4 4344 B9R1.163 CC1(C(=O)Cl)CCCS1 Amb27838547 [1,1,0,0,0,0|2,0,0]=4 4345 B9R1.163 CC1(C(=O)O)C=CCC1 Amb18642405 [1,1,0,0,0,0|1,0,1]=4 4346 B9R1.163 CC1(C(=O)O)CCCC1 Amb482493 [1,1,0,0,0,0|1,0,0]=3 4347 B9R1.163 CC1(C(=O)O)CCCN1 Amb15701407 [1,1,0,0,0,0|0,0,0]=2 4348 B9R1.163 CC1(C(=O)O)CCCN1 Amb22587331 [1,1,0,0,0,0|0,0,0]=2 4349 B9R1.163 CC1(C(=O)O)CCCO1 Amb1088877 [1,1,0,0,0,0|1,0,0]=3 4350 B9R1.163 CC1(C(=O)O)CCCS1 Amb20623191 [1,1,0,0,0,0|1,0,0]=3 4351 B9R1.163 CC1(C(=O)O)CCNC1 Amb20634439 [1,1,0,0,0,0|2,0,0]=4 4352 B9R1.163 CC1(C(=O)O)CCNC1 Amb2683246 [1,1,0,0,0,0|2,0,0]=4 4353 B9R1.163 CC1(C(=O)O)CCNO1 Amb27972280 [1,1,0,0,0,0|2,0,0]=4 4354 B9R1.163 CC1(C(=O)O)CCOC1 Amb18280535 [1,1,0,0,0,0|2,0,0]=4 4355 B9R1.163 CC1(C(=O)O)CCSC1 Amb27782020 [1,1,0,0,0,0|2,0,0]=4 4356 B9R1.163 CC1(C(=O)O)CNCO1 Amb32672096 [1,1,0,0,0,0|2,0,0]=4 4357 B9R1.163 CC1(C(=O)O)NCCS1 Amb27860566 [1,1,0,0,0,0|1,0,0]=3 4358 B9R1.163 CC1(C(=O)O)OCCO1 Amb19516908 [1,1,0,0,0,0|2,0,0]=4 4359 B9R1.163 CC1(C(N)=O)CCCC1 Amb4018896 [1,1,0,0,0,0|2,0,0]=4 4360 B9R1.163 CC1(C(N)=O)CCCN1 Amb20061427 [1,1,0,0,0,0|1,0,0]=3 4361 B9R1.163 CC1(C(N)=O)NCCS1 Amb27817829 [1,1,0,0,0,0|2,0,0]=4 4362 B9R1.163 C[C@@]1(C(=O)O)C=CCN1 Amb27883467 [1,1,0,0,0,0|0,0,2]=4 4363 B9R1.163 C[C@@]1(C(=O)O)CCCN1 Amb10603262 [1,1,0,0,0,0|0,0,0]=2 4364 B9R1.163 C[C@@]1(C(=O)O)CCCN1 Amb22405952 [1,1,0,0,0,0|0,0,0]=2 4365 B9R1.163 C[C@@]1(C(=O)O)CCCO1 Amb27600317 [1,1,0,0,0,0|1,0,0]=3 4366 B9R1.163 C[C@@]1(C(=O)O)CCNC1 Amb26869183 [1,1,0,0,0,0|2,0,0]=4 4367 B9R1.163 C[C@@]1(C(N)=O)CCCN1 Amb24410858 [1,1,0,0,0,0|1,0,0]=3 4368 B9R1.163 C[C@@]1(C(N)=O)CCCN1 Amb33457642 [1,1,0,0,0,0|1,0,0]=3 4369 B9R1.163 C[C@]1(C(=O)O)CCCN1 Amb22406107 [1,1,0,0,0,0|0,0,0]=2 4370 B9R1.163 C[C@]1(C(=O)O)CCCN1 Amb8630480 [1,1,0,0,0,0|0,0,0]=2 4371 B9R1.163 C[C@]1(C(=O)O)CCCO1 Amb24117235 [1,1,0,0,0,0|1,0,0]=3 4372 B9R1.163 C[C@]1(C(=O)O)CCNC1 Amb24346794 [1,1,0,0,0,0|2,0,0]=4 4373 B9R1.163 C[C@]1(C(N)=O)CCCN1 Amb25146194 [1,1,0,0,0,0|1,0,0]=3 4374 B9R1.163 NC(=O)C1(Cl)CCCC1 Amb27879093 [1,1,0,0,0,0|2,0,0]=4 4375 B9R1.163 NC(=O)C1(F)CCCC1 Amb28193242 [1,1,0,0,0,0|2,0,0]=4 4376 B9R1.163 NC(=O)C1(N)CCCC1 Amb19265774 [1,1,0,0,0,0|2,0,0]=4 4377 B9R1.163 NC(=O)C1(N)CCCC1 Amb8628017 [1,1,0,0,0,0|2,0,0]=4 4378 B9R1.163 NC(=O)C1(O)CCCC1 Amb33529797 [1,1,0,0,0,0|2,0,0]=4 4379 B9R1.163 NC1(C(=O)Cl)CCCC1 Amb27236109 [1,1,0,0,0,0|2,0,0]=4 4380 B9R1.163 NC1(C(=O)O)CCCC1 Amb1838882 [1,1,0,0,0,0|1,0,0]=3 4381 B9R1.163 NC1(C(=O)O)CCNC1 Amb8630265 [1,1,0,0,0,0|2,0,0]=4 4382 B9R1.163 NC1(C(=O)O)CCOC1 Amb16232669 [1,1,0,0,0,0|2,0,0]=4 4383 B9R1.163 NC1(C(=O)O)CCOC1 Amb22274600 [1,1,0,0,0,0|2,0,0]=4 4384 B9R1.163 NC1(C(=O)O)CCSC1 Amb9724111 [1,1,0,0,0,0|2,0,0]=4 4385 B9R1.163 NC1(C(=O)O)OCCO1 Amb25887263 [1,1,0,0,0,0|2,0,0]=4 4386 B9R1.163 N[C@@]1(C(=O)O)CCNC1 Amb6893795 [1,1,0,0,0,0|2,0,0]=4 4387 B9R1.163 N[C@@]1(C(=O)O)CCOC1 Amb20241211 [1,1,0,0,0,0|2,0,0]=4 4388 B9R1.163 N[C@@]1(C(=O)O)CCSC1 Amb27972704 [1,1,0,0,0,0|2,0,0]=4 4389 B9R1.163 N[C@]1(C(=O)O)CCNC1 Amb6893796 [1,1,0,0,0,0|2,0,0]=4 4390 B9R1.163 N[C@]1(C(=O)O)CCOC1 Amb20241209 [1,1,0,0,0,0|2,0,0]=4 4391 B9R1.163 O=C(Cl)C1(Br)CCCC1 Amb25888908 [1,1,0,0,0,0|2,0,0]=4 4392 B9R1.163 O=C(Cl)C1(Cl)CCCC1 Amb25106802 [1,1,0,0,0,0|2,0,0]=4 4393 B9R1.163 O=C(O)C1(Br)CCCC1 Amb17595053 [1,1,0,0,0,0|1,0,0]=3 4394 B9R1.163 O=C(O)C1(Cl)CCCC1 Amb32716554 [1,1,0,0,0,0|1,0,0]=3 4395 B9R1.163 O=C(O)C1(Cl)CCOC1 Amb33127967 [1,1,0,0,0,0|2,0,0]=4 4396 B9R1.163 O=C(O)C1(F)CCCC1 Amb26957187 [1,1,0,0,0,0|1,0,0]=3 4397 B9R1.163 O=C(O)C1(F)CCNC1 Amb24120613 [1,1,0,0,0,0|2,0,0]=4 4398 B9R1.163 O=C(O)C1(F)CCNC1 Amb32992647 [1,1,0,0,0,0|2,0,0]=4 4399 B9R1.163 O=C(O)C1(F)CCOC1 Amb24420228 [1,1,0,0,0,0|2,0,0]=4 4400 B9R1.163 O=C(O)C1(O)CCCC1 Amb1159211 [1,1,0,0,0,0|1,0,0]=3 4401 B9R1.163 O=C(O)C1(O)CCNC1 Amb22500918 [1,1,0,0,0,0|2,0,0]=4 4402 B9R1.163 O=C(O)C1(O)CCNC1 Amb22899772 [1,1,0,0,0,0|2,0,0]=4 4403 B9R1.163 O=C(O)C1(O)CCOC1 Amb26332318 [1,1,0,0,0,0|2,0,0]=4 4404 B9R1.163 O=C(O)C1(O)CCSC1 Amb18944714 [1,1,0,0,0,0|2,0,0]=4 4405 B9R1.163 O=C(O)C1(S)CCCC1 Amb27185727 [1,1,0,0,0,0|1,0,0]=3 4406 B9R1.163 O=C(O)C1(S)CCCN1 Amb28383197 [1,1,0,0,0,0|0,0,0]=2 4407 B9R1.163 O=C(O)[C@@]1(F)CCCN1 Amb22748241 [1,1,0,0,0,0|0,0,0]=2 4408 B9R1.163 O=C(O)[C@@]1(O)CCSC1 Amb28119971 [1,1,0,0,0,0|2,0,0]=4 4409 B9R1.163 O=C(O)[C@]1(F)CCCN1 Amb27216006 [1,1,0,0,0,0|0,0,0]=2 4410 B9R1.163 [NH3+]C1(C(=O)O)CC[NH2+]C1 Amb22583868 [1,1,0,0,0,0|2,0,0]=4 4411 B9R1.51 CP(=O)(O)C1CC(N)C1 Amb27882645 [0,1,0,0,1,0|2,0,0]=4 4412 B9R1.51 CS(=O)(=O)C1CC(O)C1 Amb24570498 [0,1,0,0,1,0|1,0,1]=4 4413 B9R1.51 CS(=O)(=O)[C@H]1C[C@@H](O)C1 Amb32675126 [0,1,0,0,1,0|1,0,1]=4 4414 B9R1.55 C=C1C[C@@H](C(=O)O)[C@H]1N Amb28055563 [0,1,0,0,1,0|1,0,1]=4 4415 B9R1.55 CC(=O)C1CC(Cl)C1Cl Amb25689885 [0,1,0,0,1,0|2,0,0]=4 4416 B9R1.55 CC(=O)[C@@H]1C[C@H](Cl)[C@H]1Cl Amb27244175 [0,1,0,0,1,0|2,0,0]=4 4417 B9R1.55 CC1CC(C(=O)Cl)N1C Amb27594214 [0,1,0,0,1,0|2,0,0]=4 4418 B9R1.55 CC1CC(C(=O)O)N1C Amb28285280 [0,1,0,0,1,0|1,0,0]=3 4419 B9R1.55 C[C@@H]1C[C@@H](C(=O)Cl)N1C Amb25336470 [0,1,0,0,1,0|2,0,0]=4 4420 B9R1.55 C[C@@H]1C[C@H](C(=O)Cl)N1C Amb27654275 [0,1,0,0,1,0|2,0,0]=4 4421 B9R1.55 C[C@H]1CC(C(=O)O)[C@@H]1C Amb28132441 [0,1,0,0,1,0|1,0,0]=3 4422 B9R1.55 C[C@H]1C[C@@H](C(=O)Cl)N1C Amb27858264 [0,1,0,0,1,0|2,0,0]=4 4423 B9R1.55 NC1C(=O)NC1C(=O)O Amb25871338 [0,1,0,0,1,0|0,0,2]=4 4424 B9R1.55 N[C@H]1[C@@H](C(=O)O)C[C@H]1O Amb27848566 [0,1,0,0,1,0|0,0,0]=2 4425 B9R1.82 C#CC(=O)C1CC(C)C1 Amb30032163 [0,1,0,0,1,0|2,0,0]=4 4426 B9R1.82 C#CC(=O)C1CC(N)C1 Amb33131646 [0,1,0,0,1,0|2,0,0]=4 4427 B9R1.82 C#CC(=O)N1CC(O)C1 Amb25127461 [0,1,0,0,1,0|2,0,0]=4 4428 B9R1.82 C=C1CC(C(=O)OC)C1 Amb21962131 [0,1,0,0,1,0|1,0,1]=4 4429 B9R1.82 C=CC(=O)C1CC(C)C1 Amb30031980 [0,1,0,0,1,0|2,0,0]=4 4430 B9R1.82 C=CC(=O)C1CC(N)C1 Amb33131642 [0,1,0,0,1,0|2,0,0]=4 4431 B9R1.82 CC1CC(C(=N)NO)C1 Amb33033622 [0,1,0,0,1,0|2,0,0]=4 4432 B9R1.82 CC1CC(C(=O)CBr)C1 Amb29885059 [0,1,0,0,1,0|2,0,0]=4 4433 B9R1.82 CC1CC(C(=O)CCl)C1 Amb29886995 [0,1,0,0,1,0|2,0,0]=4 4434 B9R1.82 CC1CC(C(=O)CN)C1 Amb30032039 [0,1,0,0,1,0|2,0,0]=4 4435 B9R1.82 CC1CC(C(=O)NO)C1 Amb27203488 [0,1,0,0,1,0|1,0,0]=3 4436 B9R1.82 CCC(=O)C1CC(C)C1 Amb23589656 [0,1,0,0,1,0|2,0,0]=4 4437 B9R1.82 CCC(=O)C1CC(N)C1 Amb33131647 [0,1,0,0,1,0|2,0,0]=4 4438 B9R1.82 CNC(=N)C1CC(O)C1 Amb35745146 [0,1,0,0,1,0|2,0,0]=4 4439 B9R1.82 CNC(=O)C1CC(O)C1 Amb19888985 [0,1,0,0,1,0|1,0,0]=3 4440 B9R1.82 CNC(=O)[C@H]1C[C@@H](N)C1 Amb27966745 [0,1,0,0,1,0|2,0,0]=4 4441 B9R1.82 COC(=O)C1CC(=O)C1 Amb17597687 [0,1,0,0,1,0|0,0,2]=4 4442 B9R1.82 COC(=O)C1CC(=O)N1 Amb24711580 [0,1,0,0,1,0|0,0,2]=4 4443 B9R1.82 COC(=O)C1CC(Br)C1 Amb23439345 [0,1,0,0,1,0|1,0,0]=3 4444 B9R1.82 COC(=O)C1CC(C)C1 Amb25771219 [0,1,0,0,1,0|1,0,0]=3 4445 B9R1.82 COC(=O)C1CC(C)N1 Amb33743739 [0,1,0,0,1,0|1,0,0]=3 4446 B9R1.82 COC(=O)C1CC(C)N1 Amb33743758 [0,1,0,0,1,0|1,0,0]=3 4447 B9R1.82 COC(=O)C1CC(C)O1 Amb22737249 [0,1,0,0,1,0|2,0,0]=4 4448 B9R1.82 COC(=O)C1CC(Cl)C1 Amb21962427 [0,1,0,0,1,0|1,0,0]=3 4449 B9R1.82 COC(=O)C1CC(F)C1 Amb24480349 [0,1,0,0,1,0|1,0,0]=3 4450 B9R1.82 COC(=O)C1CC(N)C1 Amb20622659 [0,1,0,0,1,0|1,0,0]=3 4451 B9R1.82 COC(=O)C1CC(N)C1 Amb21963494 [0,1,0,0,1,0|1,0,0]=3 4452 B9R1.82 COC(=O)C1CC(O)C1 Amb19516177 [0,1,0,0,1,0|0,0,0]=2 4453 B9R1.82 COC(=O)N1CC(F)C1 Amb24476710 [0,1,0,0,1,0|2,0,0]=4 4454 B9R1.82 COC(=O)N1CC(N)C1 Amb20668343 [0,1,0,0,1,0|2,0,0]=4 4455 B9R1.82 COC(=O)N1CC(N)C1 Amb33506233 [0,1,0,0,1,0|2,0,0]=4 4456 B9R1.82 COC(=O)N1CC(O)C1 Amb24056451 [0,1,0,0,1,0|1,0,0]=3 4457 B9R1.82 COC(=O)[C@@H]1CC(=O)N1 Amb22747568 [0,1,0,0,1,0|0,0,2]=4 4458 B9R1.82 COC(=O)[C@@H]1CC(=S)N1 Amb24478569 [0,1,0,0,1,0|0,1,1]=4 4459 B9R1.82 COC(=O)[C@@H]1C[C@@H](C)O1 Amb24056487 [0,1,0,0,1,0|2,0,0]=4 4460 B9R1.82 COC(=O)[C@@H]1C[C@H](C)O1 Amb26885653 [0,1,0,0,1,0|2,0,0]=4 4461 B9R1.82 COC(=O)[C@H]1C[C@@H](Br)C1 Amb24361749 [0,1,0,0,1,0|1,0,0]=3 4462 B9R1.82 COC(=O)[C@H]1C[C@@H](Cl)C1 Amb25032105 [0,1,0,0,1,0|1,0,0]=3 4463 B9R1.82 COC(=O)[C@H]1C[C@@H](F)C1 Amb34152215 [0,1,0,0,1,0|1,0,0]=3 4464 B9R1.82 COC(=O)[C@H]1C[C@@H](N)C1 Amb22757971 [0,1,0,0,1,0|1,0,0]=3 4465 B9R1.82 COC(=O)[C@H]1C[C@@H](N)C1 Amb7970127 [0,1,0,0,1,0|1,0,0]=3 4466 B9R1.82 COC(=O)[C@H]1C[C@@H](O)C1 Amb22754751 [0,1,0,0,1,0|0,0,0]=2 4467 B9R1.82 COC(=O)[C@H]1C[C@H](Br)C1 Amb23439405 [0,1,0,0,1,0|1,0,0]=3 4468 B9R1.82 COC(=O)[C@H]1C[C@H](F)C1 Amb25870416 [0,1,0,0,1,0|1,0,0]=3 4469 B9R1.82 COC(=O)[C@H]1C[C@H](N)C1 Amb19148540 [0,1,0,0,1,0|1,0,0]=3 4470 B9R1.82 COC(=O)[C@H]1C[C@H](N)C1 Amb22747954 [0,1,0,0,1,0|1,0,0]=3 4471 B9R1.82 COC(=O)[C@H]1C[C@H](O)C1 Amb22746996 [0,1,0,0,1,0|0,0,0]=2 4472 B9R1.82 NC1CC(C(=O)NO)C1 Amb29885636 [0,1,0,0,1,0|1,0,0]=3 4473 B9R1.82 NCC(=O)N1CC(O)C1 Amb28049187 [0,1,0,0,1,0|2,0,0]=4 4474 B9R1.82 NNC(=O)C1CC(N)C1 Amb29885782 [0,1,0,0,1,0|2,0,0]=4 4475 B9R1.82 NNC(=O)[C@H]1C[C@@H](N)C1 Amb29888129 [0,1,0,0,1,0|2,0,0]=4 4476 B9R1.82 NNC(=O)[C@H]1C[C@H](N)C1 Amb35585940 [0,1,0,0,1,0|2,0,0]=4 4477 B9R1.82 N[C@H]1C[C@@H](C(=O)NO)C1 Amb35594492 [0,1,0,0,1,0|1,0,0]=3 4478 B9R1.82 N[C@H]1C[C@H](C(=O)NO)C1 Amb35585941 [0,1,0,0,1,0|1,0,0]=3 4479 B9R1.82 N\C(=N/O)N1CC(O)C1 Amb25262518 [0,1,0,0,1,0|2,0,0]=4 4480 B9R1.82 N\C(=N/O)[C@H]1C[C@H](Cl)C1 Amb35750948 [0,1,0,0,1,0|2,0,0]=4 4481 B9R1.82 O=C(CBr)N1CC(O)C1 Amb27495597 [0,1,0,0,1,0|2,0,0]=4 4482 B9R1.82 O=C(CCl)N1CC(O)C1 Amb25884848 [0,1,0,0,1,0|2,0,0]=4 4483 B9R1.82 O=C(CO)N1CC(F)C1 Amb28256581 [0,1,0,0,1,0|2,0,0]=4 4484 B9R1.82 O=C1CC(C(=O)NO)C1 Amb27163827 [0,1,0,0,1,0|0,0,2]=4 4485 B9R1.95 C#CC1CC(C(=O)O)C1 Amb27168169 [0,1,0,0,1,0|1,0,0]=3 4486 B9R1.95 C#CC1CC(C(C)=O)C1 Amb27669434 [0,1,0,0,1,0|2,0,0]=4 4487 B9R1.95 C#C[C@H]1C[C@@H](C(C)=O)C1 Amb27211903 [0,1,0,0,1,0|2,0,0]=4 4488 B9R1.95 CC(=O)C1CC(C=O)C1 Amb32669290 [0,1,0,0,1,0|1,0,1]=4 4489 B9R1.95 CC(=O)N1CC(CO)C1 Amb26549681 [0,1,0,0,1,0|2,0,0]=4 4490 B9R1.95 CCC1CC(C(=O)Cl)C1 Amb25791521 [0,1,0,0,1,0|2,0,0]=4 4491 B9R1.95 CCC1CC(C(=O)O)C1 Amb23456004 [0,1,0,0,1,0|1,0,0]=3 4492 B9R1.95 CCN1CC(C(=O)O)C1 Amb24117130 [0,1,0,0,1,0|2,0,0]=4 4493 B9R1.95 CC[C@H]1C[C@@H](C(N)=O)C1 Amb27168704 [0,1,0,0,1,0|2,0,0]=4 4494 B9R1.95 CNC1CC(C(=O)O)C1 Amb20622656 [0,1,0,0,1,0|1,0,0]=3 4495 B9R1.95 CNC1CC(C(=O)O)C1 Amb32668940 [0,1,0,0,1,0|1,0,0]=3 4496 B9R1.95 CNC1CC(C(C)=O)C1 Amb30032621 [0,1,0,0,1,0|2,0,0]=4 4497 B9R1.95 CNC1CC(C(N)=O)C1 Amb32670672 [0,1,0,0,1,0|2,0,0]=4 4498 B9R1.95 CNC1CC(C(N)=O)C1 Amb32670673 [0,1,0,0,1,0|2,0,0]=4 4499 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb28903920 [0,1,0,0,1,0|1,0,0]=3 4500 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb32667482 [0,1,0,0,1,0|1,0,0]=3 4501 B9R1.95 CN[C@H]1C[C@@H](C(N)=O)C1 Amb32670695 [0,1,0,0,1,0|2,0,0]=4 4502 B9R1.95 CN[C@H]1C[C@@H](C(N)=O)C1 Amb32670696 [0,1,0,0,1,0|2,0,0]=4 4503 B9R1.95 COC1CC(C(=O)O)C1 Amb8011538 [0,1,0,0,1,0|0,0,0]=2 4504 B9R1.95 COC1CC(C(C)=O)C1 Amb24595933 [0,1,0,0,1,0|1,0,0]=3 4505 B9R1.95 COC1CN(C(=O)Cl)C1 Amb32863915 [0,1,0,0,1,0|2,0,0]=4 4506 B9R1.95 COC1CN(C(N)=O)C1 Amb27656454 [0,1,0,0,1,0|2,0,0]=4 4507 B9R1.95 CO[C@H]1C[C@@H](C(=O)O)C1 Amb23440276 [0,1,0,0,1,0|0,0,0]=2 4508 B9R1.95 CO[C@H]1C[C@H](C(=O)O)C1 Amb23440277 [0,1,0,0,1,0|0,0,0]=2 4509 B9R1.95 N#CC1CC(C(=O)O)C1 Amb26049887 [0,1,0,0,1,0|1,0,0]=3 4510 B9R1.95 N#CN1CC(C(=O)O)C1 Amb35634495 [0,1,0,0,1,0|2,0,0]=4 4511 B9R1.95 NC(O)C1CC(CO)C1 Amb28285108 [0,1,0,0,1,0|1,0,1]=4 4512 B9R1.95 NCC1CC(C(=O)O)C1 Amb26631130 [0,1,0,0,1,0|1,0,0]=3 4513 B9R1.95 NCC1CC(C(=O)O)C1 Amb31307793 [0,1,0,0,1,0|1,0,0]=3 4514 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34136858 [0,1,0,0,1,0|1,0,0]=3 4515 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34148892 [0,1,0,0,1,0|1,0,0]=3 4516 B9R1.95 NC[C@H]1C[C@H](C(=O)O)C1 Amb33715808 [0,1,0,0,1,0|1,0,0]=3 4517 B9R1.95 NN=C1CC(C(=O)O)C1 Amb23570285 [0,1,0,0,1,0|1,0,1]=4 4518 B9R1.95 O=C(O)C1CC(CBr)C1 Amb19958667 [0,1,0,0,1,0|1,0,0]=3 4519 B9R1.95 O=C(O)C1CC(CF)C1 Amb27186059 [0,1,0,0,1,0|1,0,0]=3 4520 B9R1.95 O=C(O)C1CC(CO)C1 Amb22002175 [0,1,0,0,1,0|0,0,0]=2 4521 B9R1.95 O=C(O)[C@H]1C[C@H](CO)C1 Amb34162163 [0,1,0,0,1,0|0,0,0]=2 4522 B9R1.95 O=C[C@H]1C[C@@H](C(=O)O)C1 Amb33309677 [0,1,0,0,1,0|0,0,1]=3 4523 B9R1.95 OCC1CC(B(O)O)C1 Amb27791655 [0,1,0,0,1,0|1,0,1]=4 4524 B9R1.152 C=C(C)C1(N)CC(O)C1 Amb33199183 [0,1,0,0,1,0|2,0,0]=4 4525 B9R1.152 C=C1CC(C)(C(=O)O)C1 Amb25887446 [0,1,0,0,1,0|1,0,1]=4 4526 B9R1.152 C=C1CC(N)(C(=O)O)C1 Amb34145346 [0,1,0,0,1,0|1,0,1]=4 4527 B9R1.152 C=C1CC(O)(C(=O)O)C1 Amb28201676 [0,1,0,0,1,0|1,0,1]=4 4528 B9R1.152 CC1(C(=O)O)CC(=O)C1 Amb22406208 [0,1,0,0,1,0|0,0,2]=4 4529 B9R1.152 CC1(C(=O)O)CC(Cl)C1 Amb27460159 [0,1,0,0,1,0|1,0,0]=3 4530 B9R1.152 CC1(C(=O)O)CC(F)C1 Amb32906768 [0,1,0,0,1,0|1,0,0]=3 4531 B9R1.152 CC1(C(=O)O)CC(N)C1 Amb25889781 [0,1,0,0,1,0|1,0,0]=3 4532 B9R1.152 CC1(C(=O)O)CC(N)C1 Amb33456976 [0,1,0,0,1,0|1,0,0]=3 4533 B9R1.152 CC1(C(=O)O)CC(O)C1 Amb33361249 [0,1,0,0,1,0|0,0,0]=2 4534 B9R1.152 CC1CC(C)(C(=O)O)C1 Amb23448860 [0,1,0,0,1,0|1,0,0]=3 4535 B9R1.152 CC1CC(N)(C(=O)O)C1 Amb25821754 [0,1,0,0,1,0|1,0,0]=3 4536 B9R1.152 CC1CC(N)(C(=O)O)C1 Amb30585229 [0,1,0,0,1,0|1,0,0]=3 4537 B9R1.152 CC1CC(N)(C(N)=O)C1 Amb27465840 [0,1,0,0,1,0|2,0,0]=4 4538 B9R1.152 CN1CC(C)(C(=O)O)C1 Amb27264651 [0,1,0,0,1,0|2,0,0]=4 4539 B9R1.152 CN1CC(N)(C(=O)O)C1 Amb28312895 [0,1,0,0,1,0|2,0,0]=4 4540 B9R1.152 CN1CC(O)(C(=O)O)C1 Amb28347279 [0,1,0,0,1,0|2,0,0]=4 4541 B9R1.152 C[C@]1(C(=O)O)C[C@@H](N)C1 Amb23440223 [0,1,0,0,1,0|1,0,0]=3 4542 B9R1.152 C[C@]1(C(=O)O)C[C@@H](N)C1 Amb24730954 [0,1,0,0,1,0|1,0,0]=3 4543 B9R1.152 C[C@]1(C(=O)O)C[C@H](N)C1 Amb23439475 [0,1,0,0,1,0|1,0,0]=3 4544 B9R1.152 C[C@]1(C(=O)O)C[C@H](N)C1 Amb25275111 [0,1,0,0,1,0|1,0,0]=3 4545 B9R1.152 NC(=O)[C@]1(N)C[C@@H](O)C1 Amb33328633 [0,1,0,0,1,0|1,0,0]=3 4546 B9R1.152 NC(=O)[C@]1(N)C[C@@H](O)C1 Amb33328634 [0,1,0,0,1,0|1,0,0]=3 4547 B9R1.152 NC1(C(=O)O)CC(F)C1 Amb26579071 [0,1,0,0,1,0|1,0,0]=3 4548 B9R1.152 NC1(C(=O)O)CC(F)C1 Amb30585191 [0,1,0,0,1,0|1,0,0]=3 4549 B9R1.152 NC1(C(=O)O)CC(O)C1 Amb26585144 [0,1,0,0,1,0|0,0,0]=2 4550 B9R1.152 NC1(C(=O)O)CC(O)C1 Amb28992378 [0,1,0,0,1,0|0,0,0]=2 4551 B9R1.152 NC1CC(F)(C(=O)O)C1 Amb25784332 [0,1,0,0,1,0|1,0,0]=3 4552 B9R1.152 NC1CC(F)(C(=O)O)C1 Amb33484269 [0,1,0,0,1,0|1,0,0]=3 4553 B9R1.152 NC1CC(O)(C(=O)O)C1 Amb27194402 [0,1,0,0,1,0|1,0,0]=3 4554 B9R1.152 N[C@]1(C(=O)O)C[C@@H](F)C1 Amb26959446 [0,1,0,0,1,0|1,0,0]=3 4555 B9R1.152 N[C@]1(C(=O)O)C[C@@H](F)C1 Amb32655998 [0,1,0,0,1,0|1,0,0]=3 4556 B9R1.152 N[C@]1(C(=O)O)C[C@H](F)C1 Amb22746505 [0,1,0,0,1,0|1,0,0]=3 4557 B9R1.152 N[C@]1(C(=O)O)C[C@H](O)C1 Amb25297893 [0,1,0,0,1,0|0,0,0]=2 4558 B9R1.152 N[C@]1(C(=O)O)C[C@H](O)C1 Amb32679390 [0,1,0,0,1,0|0,0,0]=2 4559 B9R1.152 O=C(O)C1(F)CC(F)C1 Amb34162941 [0,1,0,0,1,0|1,0,0]=3 4560 B9R1.152 O=C(O)C1(F)CC(O)C1 Amb34142466 [0,1,0,0,1,0|0,0,0]=2 4561 B9R1.152 O=C(O)[C@]1(F)C[C@@H](O)C1 Amb34912853 [0,1,0,0,1,0|0,0,0]=2 4562 B9R1.152 O=C(O)[C@]1(F)C[C@H](O)C1 Amb34161934 [0,1,0,0,1,0|0,0,0]=2 4563 B9R1.152 O=C(O)[C@]1(O)C[C@@H](O)C1 Amb34147022 [0,1,0,0,1,0|0,0,0]=2 4564 B9R1.152 O=C(O)[C@]1(O)C[C@H](O)C1 Amb34136524 [0,1,0,0,1,0|0,0,0]=2 4565 B9R1.152 O=C1CC(F)(C(=O)O)C1 Amb34136578 [0,1,0,0,1,0|0,0,2]=4 4566 B9R1.164 CC(=O)C1CC(C)(C)C1 Amb24614703 [0,1,0,0,1,0|2,0,0]=4 4567 B9R1.164 CC(=O)C1CC(C)(Cl)C1 Amb26038046 [0,1,0,0,1,0|2,0,0]=4 4568 B9R1.164 CC(=O)C1CC(C)(O)C1 Amb25773446 [0,1,0,0,1,0|1,0,0]=3 4569 B9R1.164 CC(=O)C1CC(F)(F)C1 Amb24517327 [0,1,0,0,1,0|2,0,0]=4 4570 B9R1.164 CC(=O)[C@H]1C[C@](C)(Cl)C1 Amb27845269 [0,1,0,0,1,0|2,0,0]=4 4571 B9R1.164 CC1(C)CC(C(=O)O)C1 Amb33542624 [0,1,0,0,1,0|1,0,0]=3 4572 B9R1.164 CC1(C)CC(C(=O)O)N1 Amb24117447 [0,1,0,0,1,0|1,0,0]=3 4573 B9R1.164 CC1(Cl)CC(C(=O)Cl)C1 Amb25337558 [0,1,0,0,1,0|2,0,0]=4 4574 B9R1.164 CC1(Cl)CC(C(=O)O)C1 Amb28364447 [0,1,0,0,1,0|1,0,0]=3 4575 B9R1.164 CC1(F)CC(C(=O)O)C1 Amb23439467 [0,1,0,0,1,0|1,0,0]=3 4576 B9R1.164 CC1(O)CC(C(=O)O)C1 Amb33545096 [0,1,0,0,1,0|0,0,0]=2 4577 B9R1.164 CC1(O)CN(C(N)=O)C1 Amb27816996 [0,1,0,0,1,0|2,0,0]=4 4578 B9R1.164 C[C@]1(Cl)C[C@@H](C(=O)O)C1 Amb27170444 [0,1,0,0,1,0|1,0,0]=3 4579 B9R1.164 C[C@]1(F)C[C@@H](C(=O)O)C1 Amb26394027 [0,1,0,0,1,0|1,0,0]=3 4580 B9R1.164 C[C@]1(F)C[C@H](C(=O)O)C1 Amb28350729 [0,1,0,0,1,0|1,0,0]=3 4581 B9R1.164 C[C@]1(O)C[C@@H](C(=O)O)C1 Amb23440037 [0,1,0,0,1,0|0,0,0]=2 4582 B9R1.164 C[C@]1(O)C[C@H](C(=O)O)C1 Amb23440038 [0,1,0,0,1,0|0,0,0]=2 4583 B9R1.164 C[C@]1(O)C[C@H](C(=O)[O-])C1 Amb34913076 [0,1,0,0,1,0|0,0,1]=3 4584 B9R1.164 NC(=O)C1CC(F)(F)C1 Amb22896712 [0,1,0,0,1,0|2,0,0]=4 4585 B9R1.164 O=C(Cl)C1CC(F)(F)C1 Amb26976510 [0,1,0,0,1,0|2,0,0]=4 4586 B9R1.164 O=C(O)C1CC(Br)(Br)C1 Amb32687813 [0,1,0,0,1,0|1,0,0]=3 4587 B9R1.164 O=C(O)C1CC(Cl)(Cl)C1 Amb27759559 [0,1,0,0,1,0|1,0,0]=3 4588 B9R1.164 O=C(O)C1CC(F)(F)C1 Amb6252612 [0,1,0,0,1,0|1,0,0]=3 4589 B9R1.164 O=C(O)C1CC(O)(O)C1 Amb27490909 [0,1,0,0,1,0|0,0,0]=2 4590 B9R1.164 O=C(O)C1CP(=O)(O)C1 Amb4297467 [0,1,0,0,1,0|1,0,0]=3 4591 B9R1.164 O=C(O)C1CS(=O)(=O)C1 Amb8439029 [0,1,0,0,1,0|1,0,1]=4 4592 B9R1.52 C=C1CC(N)C1C(=O)O Amb27590177 [0,1,0,0,1,0|2,0,0]=4 4593 B9R1.52 CC1CC(O)C1C(=O)O Amb28076807 [0,1,0,0,1,0|1,0,0]=3 4594 B9R1.52 CC1CN(C)[C@@H]1C(=O)O Amb30869400 [0,1,0,0,1,0|1,0,0]=3 4595 B9R1.52 CC1CN(C)[C@H]1C(=O)O Amb34915559 [0,1,0,0,1,0|1,0,0]=3 4596 B9R1.52 C[C@H]1C[C@@H](O)[C@H]1C(=O)O Amb28057126 [0,1,0,0,1,0|1,0,0]=3 4597 B9R1.81 COC(=O)C1CCC1C Amb25110041 [0,1,0,0,1,0|2,0,0]=4 4598 B9R1.81 COC(=O)C1CCC1N Amb25363640 [0,1,0,0,1,0|2,0,0]=4 4599 B9R1.81 COC(=O)C1CCC1N Amb32664922 [0,1,0,0,1,0|2,0,0]=4 4600 B9R1.81 COC(=O)C1NCC1=O Amb28208249 [0,1,0,0,1,0|0,0,2]=4 4601 B9R1.81 COC(=O)C1NCC1C Amb28070582 [0,1,0,0,1,0|1,0,0]=3 4602 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb22232595 [0,1,0,0,1,0|2,0,0]=4 4603 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb23439308 [0,1,0,0,1,0|2,0,0]=4 4604 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb30633597 [0,1,0,0,1,0|2,0,0]=4 4605 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb33714361 [0,1,0,0,1,0|2,0,0]=4 4606 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb33719044 [0,1,0,0,1,0|2,0,0]=4 4607 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N Amb27617550 [0,1,0,0,1,0|2,0,0]=4 4608 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N Amb33719045 [0,1,0,0,1,0|2,0,0]=4 4609 B9R1.81 COC(=O)[C@H]1CC[C@H]1C Amb25919237 [0,1,0,0,1,0|2,0,0]=4 4610 B9R1.81 COC(=O)[C@H]1CC[C@H]1N Amb22232608 [0,1,0,0,1,0|2,0,0]=4 4611 B9R1.81 COC(=O)[C@H]1CC[C@H]1N Amb34144031 [0,1,0,0,1,0|2,0,0]=4 4612 B9R1.81 O=C[C@@H](O)[C@@H]1SC[C@@H]1O Amb28129425 [0,1,0,0,1,0|1,0,1]=4 4613 B9R1.81 OC[C@H](O)[C@H]1NC[C@H]1O Amb27216406 [0,1,0,0,1,0|0,0,2]=4 4614 B9R1.96 CCC1CCC1C(=O)O Amb25727014 [0,1,0,0,1,0|2,0,0]=4 4615 B9R1.96 CCC1CN[C@@H]1C(=O)O Amb30633665 [0,1,0,0,1,0|1,0,0]=3 4616 B9R1.96 COC1CCC1C(=O)O Amb26516125 [0,1,0,0,1,0|1,0,0]=3 4617 B9R1.96 COC1CCC1C(N)=O Amb27645560 [0,1,0,0,1,0|2,0,0]=4 4618 B9R1.96 CO[C@@H]1CC[C@@H]1C(=O)O Amb34912847 [0,1,0,0,1,0|1,0,0]=3 4619 B9R1.96 CO[C@@H]1CC[C@H]1C(=O)O Amb26636288 [0,1,0,0,1,0|1,0,0]=3 4620 B9R1.96 C\C=C1/CN[C@@H]1C(=O)O Amb25075476 [0,1,0,0,1,0|1,0,1]=4 4621 B9R1.96 N#CC1CCC1C(=O)O Amb26949285 [0,1,0,0,1,0|2,0,0]=4 4622 B9R1.96 NC[C@@H]1CC[C@H]1C(=O)O Amb27259838 [0,1,0,0,1,0|2,0,0]=4 4623 B9R1.96 O=C(O)C1C=CC1CO Amb27875148 [0,1,0,0,1,0|1,0,1]=4 4624 B9R1.96 O=C(O)C1CCC1CF Amb20667674 [0,1,0,0,1,0|2,0,0]=4 4625 B9R1.96 O=C(O)C1CCC1CO Amb24340315 [0,1,0,0,1,0|1,0,0]=3 4626 B9R1.96 O=C(O)N1CCC1CO Amb22756926 [0,1,0,0,1,0|2,0,0]=4 4627 B9R1.96 O=C(O)[C@H]1C=C[C@H]1CO Amb27783406 [0,1,0,0,1,0|1,0,1]=4 4628 B9R1.159 CC1(C(=O)O)CCC1N Amb28397422 [0,1,0,0,1,0|2,0,0]=4 4629 B9R1.159 CC1CCC1(C)C(=O)O Amb28397417 [0,1,0,0,1,0|2,0,0]=4 4630 B9R1.159 CC1CCC1(N)C(=O)O Amb23456072 [0,1,0,0,1,0|2,0,0]=4 4631 B9R1.159 C[C@@H]1CC[C@@]1(C)C(=O)O Amb27655982 [0,1,0,0,1,0|2,0,0]=4 4632 B9R1.159 C[C@@H]1CC[C@@]1(N)C(=O)O Amb26027352 [0,1,0,0,1,0|2,0,0]=4 4633 B9R1.159 C[C@@H]1CC[C@]1(N)C(=O)O Amb24586126 [0,1,0,0,1,0|2,0,0]=4 4634 B9R1.159 C[C@H]1CC[C@@]1(N)C(=O)O Amb28056437 [0,1,0,0,1,0|2,0,0]=4 4635 B9R1.159 C[C@]1(C(=O)O)CC[C@H]1N Amb27961498 [0,1,0,0,1,0|2,0,0]=4 4636 B9R1.159 NC1(C(=O)O)CCC1O Amb27482724 [0,1,0,0,1,0|1,0,0]=3 4637 B9R1.159 NC1CCC1(F)C(=O)O Amb27768660 [0,1,0,0,1,0|2,0,0]=4 4638 B9R1.159 N[C@@H]1CC[C@]1(F)C(=O)O Amb27188263 [0,1,0,0,1,0|2,0,0]=4 4639 B9R1.159 N[C@H]1CC[C@@]1(N)C(=O)O Amb27216513 [0,1,0,0,1,0|2,0,0]=4 4640 B9R1.159 N[C@]1(C(=O)O)CC[C@@H]1O Amb28058284 [0,1,0,0,1,0|1,0,0]=3 4641 B9R1.159 O=C(O)C1(O)CCC1Br Amb28137512 [0,1,0,0,1,0|2,0,0]=4 4642 B9R1.166 CC1(C)CCC1C(=O)O Amb25032090 [0,1,0,0,1,0|2,0,0]=4 4643 B9R1.166 CC1(C)CNC1C(=O)O Amb24117326 [0,1,0,0,1,0|1,0,0]=3 4644 B9R1.166 CC1(C)CNC1C(=O)O Amb27253737 [0,1,0,0,1,0|1,0,0]=3 4645 B9R1.166 CC1(C)CN[C@@H]1C(=O)O Amb30869393 [0,1,0,0,1,0|1,0,0]=3 4646 B9R1.166 CC1(C)CN[C@H]1C(=O)O Amb34161295 [0,1,0,0,1,0|1,0,0]=3 4647 B9R1.166 CC1(C)COC1C(=O)O Amb8010835 [0,1,0,0,1,0|2,0,0]=4 4648 B9R1.166 O=C(O)C1CCC1(F)F Amb24452747 [0,1,0,0,1,0|2,0,0]=4 4649 B9R1.166 O=C(O)C1NCC1(F)F Amb27813163 [0,1,0,0,1,0|1,0,0]=3 4650 B11R1.3 C#CC1CCC(C(=O)O)CC1 Amb26456299 [0,1,0,0,0,1|2,0,0]=4 4651 B11R1.3 C=CC1CCC(C(=O)O)CC1 Amb25027907 [0,1,0,0,0,1|2,0,0]=4 4652 B11R1.3 CCC1CCC(C(=O)O)CC1 Amb2413128 [0,1,0,0,0,1|2,0,0]=4 4653 B11R1.3 CCC1CCC(C(=O)O)CN1 Amb25848341 [0,1,0,0,0,1|2,0,0]=4 4654 B11R1.3 CCC1CCC(C(=O)O)NC1 Amb18126073 [0,1,0,0,0,1|1,0,0]=3 4655 B11R1.3 CCC1CNC(C(=O)O)CO1 Amb28188774 [0,1,0,0,0,1|1,0,0]=3 4656 B11R1.3 CC[C@H]1CC[C@H](C(=O)O)CC1 Amb9786888 [0,1,0,0,0,1|2,0,0]=4 4657 B11R1.3 CNC1CCC(C(=O)O)CC1 Amb18949863 [0,1,0,0,0,1|2,0,0]=4 4658 B11R1.3 CNC1CCC(C(=O)O)CC1 Amb34913416 [0,1,0,0,0,1|2,0,0]=4 4659 B11R1.3 CN[C@H]1CC[C@@H](C(=O)O)CC1 Amb27984750 [0,1,0,0,0,1|2,0,0]=4 4660 B11R1.3 COC1CC=C(C(=O)O)CC1 Amb27215250 [0,1,0,0,0,1|1,0,1]=4 4661 B11R1.3 COC1CCC(C(=O)Cl)CC1 Amb33545508 [0,1,0,0,0,1|2,0,0]=4 4662 B11R1.3 COC1CCC(C(=O)O)CC1 Amb3939863 [0,1,0,0,0,1|1,0,0]=3 4663 B11R1.3 COC1CCC(C(C)=O)CC1 Amb24570436 [0,1,0,0,0,1|2,0,0]=4 4664 B11R1.3 CON1CCC(C(=O)O)CC1 Amb26881350 [0,1,0,0,0,1|2,0,0]=4 4665 B11R1.3 CON1CCC(C(=O)O)CC1 Amb28921116 [0,1,0,0,0,1|2,0,0]=4 4666 B11R1.3 CO[C@H]1CC[C@@H](C(=O)O)CC1 Amb27760413 [0,1,0,0,0,1|1,0,0]=3 4667 B11R1.3 CO[C@H]1CC[C@H](C(=O)O)CC1 Amb24183374 [0,1,0,0,0,1|1,0,0]=3 4668 B11R1.3 CSC1CCC(C(=O)O)CC1 Amb28292503 [0,1,0,0,0,1|1,1,0]=4 4669 B11R1.3 N#CC1CCC(C(=O)O)CC1 Amb18125541 [0,1,0,0,0,1|2,0,0]=4 4670 B11R1.3 N#CC1CNC(C(=O)O)CO1 Amb27448518 [0,1,0,0,0,1|1,0,0]=3 4671 B11R1.3 N#C[C@H]1CC[C@@H](C(=O)O)CC1 Amb24740677 [0,1,0,0,0,1|2,0,0]=4 4672 B11R1.3 N#C[C@H]1CC[C@H](C(=O)O)CC1 Amb28381399 [0,1,0,0,0,1|2,0,0]=4 4673 B11R1.3 NCC1CCC(C(=O)O)CC1 Amb3940763 [0,1,0,0,0,1|2,0,0]=4 4674 B11R1.3 NC[C@@H]1CC[C@@H](C(=O)O)OC1 Amb27658954 [0,1,0,0,0,1|2,0,0]=4 4675 B11R1.3 NC[C@H]1CC[C@@H](C(=O)O)CC1 Amb17620787 [0,1,0,0,0,1|2,0,0]=4 4676 B11R1.3 NC[C@H]1CC[C@H](C(=O)O)CC1 Amb540893 [0,1,0,0,0,1|2,0,0]=4 4677 B11R1.3 NC[C@H]1CO[C@H](C(=O)O)CO1 Amb28385581 [0,1,0,0,0,1|2,0,0]=4 4678 B11R1.3 NN[C@H]1CC[C@H](C(=O)O)CC1 Amb27944771 [0,1,0,0,0,1|2,0,0]=4 4679 B11R1.3 O=C(Cl)[C@H]1CC[C@H](CO)CC1 Amb27829888 [0,1,0,0,0,1|2,0,0]=4 4680 B11R1.3 O=C(O)C1CCC(CO)CC1 Amb7089021 [0,1,0,0,0,1|1,0,0]=3 4681 B11R1.3 O=C(O)C1CCC(CO)NC1 Amb27880322 [0,1,0,0,0,1|1,0,0]=3 4682 B11R1.3 O=C(O)[C@H]1CC[C@@H](CO)CC1 Amb28254647 [0,1,0,0,0,1|1,0,0]=3 4683 B11R1.3 O=C(O)[C@H]1CC[C@H](CF)CC1 Amb25351015 [0,1,0,0,0,1|2,0,0]=4 4684 B11R1.3 O=C(O)[C@H]1CC[C@H](CO)CC1 Amb22750650 [0,1,0,0,0,1|1,0,0]=3 4685 B11R1.3 O=C[C@H]1CC[C@H](C(=O)O)CC1 Amb25909662 [0,1,0,0,0,1|1,0,1]=4 4686 B11R1.19 O=S(=O)(O)[C@H]1CC[C@H](O)CC1 Amb27588898 [0,1,0,0,0,1|2,0,0]=4 4687 B11R1.21 CC(=O)C1CCC(O)C(O)C1 Amb26937963 [0,1,0,0,0,1|2,0,0]=4 4688 B11R1.21 CC1CCC(C(=O)O)CC1C Amb26037213 [0,1,0,0,0,1|2,0,0]=4 4689 B11R1.21 CC1CCC(C(=O)O)CC1N Amb25065260 [0,1,0,0,0,1|2,0,0]=4 4690 B11R1.21 CC1CCC(C(=O)O)NC1C Amb27862874 [0,1,0,0,0,1|1,0,0]=3 4691 B11R1.21 CC1CCC(C(=O)O)NC1C Amb28594270 [0,1,0,0,0,1|1,0,0]=3 4692 B11R1.21 CC1CCC(C(N)=O)NC1C Amb27875309 [0,1,0,0,0,1|2,0,0]=4 4693 B11R1.21 CC1NC(C(=O)O)CCC1O Amb28344643 [0,1,0,0,0,1|0,0,0]=2 4694 B11R1.21 CC1NC(C(=O)O)COC1C Amb28248835 [0,1,0,0,0,1|1,0,0]=3 4695 B11R1.21 CC1NC(C(=O)O)COC1C Amb32663609 [0,1,0,0,0,1|1,0,0]=3 4696 B11R1.21 CC1SCC(C(=O)O)NC1=O Amb23590306 [0,1,0,0,0,1|1,0,1]=4 4697 B11R1.21 CN1CC(C(=O)O)NCC1=O Amb27839721 [0,1,0,0,0,1|0,0,2]=4 4698 B11R1.21 CN1CC(C(=O)O)NCC1=O Amb30584778 [0,1,0,0,0,1|0,0,2]=4 4699 B11R1.21 C[C@H]1C[C@@H](C(=O)O)NC[C@H]1O Amb28056092 [0,1,0,0,0,1|0,0,0]=2 4700 B11R1.21 C[C@H]1C[C@H](C(=O)O)CC[C@H]1Cl Amb28245232 [0,1,0,0,0,1|2,0,0]=4 4701 B11R1.21 NC1CC(C(=O)O)CCC1O Amb28251132 [0,1,0,0,0,1|1,0,0]=3 4702 B11R1.21 N[C@@H]1C[C@H](C(=O)O)CC[C@@H]1O Amb26636622 [0,1,0,0,0,1|1,0,0]=3 4703 B11R1.21 O=C(O)C1CCC(Cl)C(Cl)C1 Amb28076627 [0,1,0,0,0,1|2,0,0]=4 4704 B11R1.21 O=C(O)C1C[C@H](O)[C@@H](O)CN1 Amb27875087 [0,1,0,0,0,1|0,0,0]=2 4705 B11R1.21 O=C(O)[C@@H]1CC[C@@H](F)[C@@H](F)C1 Amb27226178 [0,1,0,0,0,1|2,0,0]=4 4706 B11R1.21 O=C(O)[C@@H]1CC[C@@H](O)[C@H](O)C1 Amb28320743 [0,1,0,0,0,1|1,0,0]=3 4707 B11R1.21 O=C(O)[C@@H]1CC[C@H](O)[C@@H](O)C1 Amb28245268 [0,1,0,0,0,1|1,0,0]=3 4708 B11R1.21 O=C(O)[C@@H]1C[C@H](O)[C@@H](O)CN1 Amb27460469 [0,1,0,0,0,1|0,0,0]=2 4709 B11R1.21 O=C(O)[C@@H]1C[C@H](O)[C@H](O)CN1 Amb27635007 [0,1,0,0,0,1|0,0,0]=2 4710 B11R1.21 O=C(O)[C@@H]1C[C@H](O)[C@H](O)CO1 Amb35750828 [0,1,0,0,0,1|1,0,0]=3 4711 B11R1.21 O=C(O)[C@H]1C[C@@H](O)[C@@H](O)CN1 Amb27818197 [0,1,0,0,0,1|0,0,0]=2 4712 B11R1.21 O=C(O)[C@H]1C[C@@H](O)[C@H](O)CN1 Amb28320503 [0,1,0,0,0,1|0,0,0]=2 4713 B11R1.21 O=C(O)[C@H]1C[C@H](O)[C@H](O)CO1 Amb35750235 [0,1,0,0,0,1|1,0,0]=3 4714 B11R1.21 O=C1CC(C(=O)O)CCC1O Amb27176349 [0,1,0,0,0,1|1,0,0]=3 4715 B11R1.21 O=C1CC(C(=O)O)OCC1O Amb24390226 [0,1,0,0,0,1|1,0,0]=3 4716 B11R1.22 CCC(=O)C1CCC(O)CC1 Amb28199939 [0,1,0,0,0,1|2,0,0]=4 4717 B11R1.22 CCC(=O)[C@H]1CC[C@@H](O)CC1 Amb28201182 [0,1,0,0,0,1|2,0,0]=4 4718 B11R1.22 CCC(=O)[C@H]1CC[C@H](O)CC1 Amb27599418 [0,1,0,0,0,1|2,0,0]=4 4719 B11R1.22 CNC(=O)C1CCC(C)CN1 Amb33495760 [0,1,0,0,0,1|2,0,0]=4 4720 B11R1.22 CNC(=O)C1CCC(O)CC1 Amb25142086 [0,1,0,0,0,1|2,0,0]=4 4721 B11R1.22 CNC(=O)[C@H]1CC[C@@H](O)CC1 Amb27759268 [0,1,0,0,0,1|2,0,0]=4 4722 B11R1.22 COC(=O)C1CC=C(F)CN1 Amb27945428 [0,1,0,0,0,1|1,0,1]=4 4723 B11R1.22 COC(=O)C1CCC(Br)CC1 Amb25377448 [0,1,0,0,0,1|2,0,0]=4 4724 B11R1.22 COC(=O)C1CCC(C)CC1 Amb24738407 [0,1,0,0,0,1|2,0,0]=4 4725 B11R1.22 COC(=O)C1CCC(C)CN1 Amb33189228 [0,1,0,0,0,1|1,0,0]=3 4726 B11R1.22 COC(=O)C1CCC(C)NC1 Amb21961304 [0,1,0,0,0,1|2,0,0]=4 4727 B11R1.22 COC(=O)C1CCC(C)NC1 Amb30586515 [0,1,0,0,0,1|2,0,0]=4 4728 B11R1.22 COC(=O)C1CCC(Cl)CC1 Amb28076575 [0,1,0,0,0,1|2,0,0]=4 4729 B11R1.22 COC(=O)C1CCC(N)CC1 Amb18548678 [0,1,0,0,0,1|2,0,0]=4 4730 B11R1.22 COC(=O)C1CCC(N)CC1 Amb3432259 [0,1,0,0,0,1|2,0,0]=4 4731 B11R1.22 COC(=O)C1CCC(N)CO1 Amb28421880 [0,1,0,0,0,1|2,0,0]=4 4732 B11R1.22 COC(=O)C1CCC(O)CC1 Amb2695239 [0,1,0,0,0,1|1,0,0]=3 4733 B11R1.22 COC(=O)C1CCC(O)CO1 Amb26566250 [0,1,0,0,0,1|1,0,0]=3 4734 B11R1.22 COC(=O)C1CCC(S)CC1 Amb32788101 [0,1,0,0,0,1|1,1,0]=4 4735 B11R1.22 COC(=O)C1CNC(=O)CN1 Amb24419888 [0,1,0,0,0,1|0,0,2]=4 4736 B11R1.22 COC(=O)C1CNC(C)CN1 Amb24533023 [0,1,0,0,0,1|1,0,0]=3 4737 B11R1.22 COC(=O)C1CNC(Cl)CN1 Amb19516141 [0,1,0,0,0,1|1,0,0]=3 4738 B11R1.22 COC(=O)N1CCC(O)CC1 Amb9285618 [0,1,0,0,0,1|2,0,0]=4 4739 B11R1.22 COC(=O)[C@@H]1CC[C@@H](C)NC1 Amb22886452 [0,1,0,0,0,1|2,0,0]=4 4740 B11R1.22 COC(=O)[C@@H]1CC[C@@H](C)NC1 Amb24655066 [0,1,0,0,0,1|2,0,0]=4 4741 B11R1.22 COC(=O)[C@@H]1CC[C@H](C)CN1 Amb33804469 [0,1,0,0,0,1|1,0,0]=3 4742 B11R1.22 COC(=O)[C@@H]1CC[C@H](C)NC1 Amb27956215 [0,1,0,0,0,1|2,0,0]=4 4743 B11R1.22 COC(=O)[C@@H]1CC[C@H](O)CN1 Amb24571184 [0,1,0,0,0,1|0,0,0]=2 4744 B11R1.22 COC(=O)[C@@H]1CNC(=O)CN1 Amb10608895 [0,1,0,0,0,1|0,0,2]=4 4745 B11R1.22 COC(=O)[C@@H]1CO[C@@H](C)CN1 Amb33749504 [0,1,0,0,0,1|1,0,0]=3 4746 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 Amb23439745 [0,1,0,0,0,1|2,0,0]=4 4747 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 Amb28992565 [0,1,0,0,0,1|2,0,0]=4 4748 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 Amb32405028 [0,1,0,0,0,1|2,0,0]=4 4749 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 Amb32406036 [0,1,0,0,0,1|2,0,0]=4 4750 B11R1.22 COC(=O)[C@H]1CC[C@@H](F)CC1 Amb34913698 [0,1,0,0,0,1|2,0,0]=4 4751 B11R1.22 COC(=O)[C@H]1CC[C@@H](N)CC1 Amb16183877 [0,1,0,0,0,1|2,0,0]=4 4752 B11R1.22 COC(=O)[C@H]1CC[C@@H](N)CC1 Amb22755441 [0,1,0,0,0,1|2,0,0]=4 4753 B11R1.22 COC(=O)[C@H]1CC[C@@H](O)CC1 Amb23439292 [0,1,0,0,0,1|1,0,0]=3 4754 B11R1.22 COC(=O)[C@H]1CC[C@H](C)NC1 Amb26528013 [0,1,0,0,0,1|2,0,0]=4 4755 B11R1.22 COC(=O)[C@H]1CC[C@H](F)CC1 Amb34163014 [0,1,0,0,0,1|2,0,0]=4 4756 B11R1.22 COC(=O)[C@H]1CC[C@H](N)CC1 Amb16183878 [0,1,0,0,0,1|2,0,0]=4 4757 B11R1.22 COC(=O)[C@H]1CC[C@H](N)CC1 Amb32411780 [0,1,0,0,0,1|2,0,0]=4 4758 B11R1.22 COC(=O)[C@H]1CC[C@H](O)CC1 Amb22756640 [0,1,0,0,0,1|1,0,0]=3 4759 B11R1.22 NC1CCC(C(=O)NO)CC1 Amb28288248 [0,1,0,0,0,1|2,0,0]=4 4760 B11R1.22 NNC(=O)[C@H]1CC[C@@H](O)CC1 Amb27495621 [0,1,0,0,0,1|2,0,0]=4 4761 B11R1.22 O=C(CCl)C1CCC(O)CC1 Amb26034623 [0,1,0,0,0,1|2,0,0]=4 4762 B11R1.22 O=C(CCl)[C@H]1CC[C@H](O)CC1 Amb28239785 [0,1,0,0,0,1|2,0,0]=4 4763 B11R1.22 O\N=C(/O)C1CCC(O)CN1 Amb27983784 [0,1,0,0,0,1|0,0,1]=3 4764 B11R1.166 CC(=O)[C@@H]1CC[C@H](O)C[C@H]1C Amb27220610 [0,1,0,0,0,1|2,0,0]=4 4765 B11R1.166 CC1=CCC(C(=O)O)N(C)C1 Amb8011553 [0,1,0,0,0,1|1,0,1]=4 4766 B11R1.166 CC1CC(C)C(C(=O)O)CN1 Amb33330510 [0,1,0,0,0,1|2,0,0]=4 4767 B11R1.166 CC1CC(C)C(C(=O)O)CN1 Amb33330511 [0,1,0,0,0,1|2,0,0]=4 4768 B11R1.166 CC1CC(O)C(C(=O)O)CN1 Amb18830395 [0,1,0,0,0,1|2,0,0]=4 4769 B11R1.166 CC1CCC(C(=O)O)C(C)N1 Amb25138873 [0,1,0,0,0,1|2,0,0]=4 4770 B11R1.166 CC1CCC(C(=O)O)C(C)N1 Amb28594206 [0,1,0,0,0,1|2,0,0]=4 4771 B11R1.166 CC1CCC(C(N)=O)N(C)C1 Amb27176421 [0,1,0,0,0,1|2,0,0]=4 4772 B11R1.166 CC1CNC(C(=O)O)C(C)C1 Amb26560226 [0,1,0,0,0,1|1,0,0]=3 4773 B11R1.166 CC1CNC(C(=O)O)C(C)C1 Amb33338906 [0,1,0,0,0,1|1,0,0]=3 4774 B11R1.166 CC1CNC(C(=O)O)C(C)O1 Amb25238030 [0,1,0,0,0,1|1,0,0]=3 4775 B11R1.166 CC1CNC(C(=O)O)C(C)O1 Amb28652973 [0,1,0,0,0,1|1,0,0]=3 4776 B11R1.166 C[C@@H]1CC[C@H](C(=O)O)[C@H](O)C1 Amb27472461 [0,1,0,0,0,1|2,0,0]=4 4777 B11R1.166 C[C@@H]1N[C@H](C)CC[C@@H]1C(=O)O Amb28345999 [0,1,0,0,0,1|2,0,0]=4 4778 B11R1.166 C[C@H]1CCC(C(=O)O)[C@H](C)O1 Amb27801338 [0,1,0,0,0,1|2,0,0]=4 4779 B11R1.166 C[C@H]1CC[C@@H](C(=O)O)[C@@H](C)N1 Amb27655911 [0,1,0,0,0,1|2,0,0]=4 4780 B11R1.166 C[C@H]1CC[C@@H](C(N)=O)N(C)C1 Amb27640640 [0,1,0,0,0,1|2,0,0]=4 4781 B11R1.166 C[C@H]1CC[C@H](C(=O)O)[C@H](O)C1 Amb26602933 [0,1,0,0,0,1|2,0,0]=4 4782 B11R1.166 NC(=O)[C@@H]1NC[C@@H](O)C[C@@H]1O Amb27878661 [0,1,0,0,0,1|1,0,0]=3 4783 B11R1.166 N[C@@H]1C[C@@H](O)CC[C@@H]1C(=O)O Amb24546400 [0,1,0,0,0,1|1,0,0]=3 4784 B11R1.166 N[C@@H]1C[C@@H](O)CC[C@H]1C(=O)O Amb27630523 [0,1,0,0,0,1|1,0,0]=3 4785 B11R1.166 N[C@H]1C[C@@H](O)CC[C@@H]1C(=O)O Amb27195777 [0,1,0,0,0,1|1,0,0]=3 4786 B11R1.166 N[C@H]1C[C@@H](O)CC[C@H]1C(=O)O Amb28457447 [0,1,0,0,0,1|1,0,0]=3 4787 B11R1.166 O=C(O)C1CCC(Cl)NC1Cl Amb24514282 [0,1,0,0,0,1|2,0,0]=4 4788 B11R1.220 CC1(C(=O)O)CCC(N)CC1 Amb23536219 [0,1,0,0,0,1|2,0,0]=4 4789 B11R1.220 CC1(C(=O)O)CCC(O)CC1 Amb18126139 [0,1,0,0,0,1|1,0,0]=3 4790 B11R1.220 CC1(C(N)=O)OCC(O)CO1 Amb28195102 [0,1,0,0,0,1|2,0,0]=4 4791 B11R1.220 CC1CCC(C)(C(=O)O)CC1 Amb25083864 [0,1,0,0,0,1|2,0,0]=4 4792 B11R1.220 CC1CCC(Cl)(C(=O)O)CC1 Amb32716553 [0,1,0,0,0,1|2,0,0]=4 4793 B11R1.220 CC1CCC(F)(C(=O)O)CC1 Amb26530517 [0,1,0,0,0,1|2,0,0]=4 4794 B11R1.220 CC1CCC(N)(C(=O)O)CC1 Amb4134830 [0,1,0,0,0,1|2,0,0]=4 4795 B11R1.220 CC1CCC(N)(C(=O)O)CO1 Amb35694652 [0,1,0,0,0,1|2,0,0]=4 4796 B11R1.220 CC1CCC(N)(C(=O)O)CS1 Amb35725377 [0,1,0,0,0,1|2,0,0]=4 4797 B11R1.220 CC1CCC(O)(C(=O)O)CC1 Amb18944702 [0,1,0,0,0,1|2,0,0]=4 4798 B11R1.220 CC1CCC(O)(C(=O)O)CO1 Amb29850026 [0,1,0,0,0,1|2,0,0]=4 4799 B11R1.220 CC1CCC(O)(C(=O)O)CS1 Amb35717586 [0,1,0,0,0,1|2,0,0]=4 4800 B11R1.220 C[C@H]1CC[C@@](C)(C(=O)O)CC1 Amb27406355 [0,1,0,0,0,1|2,0,0]=4 4801 B11R1.220 C[C@H]1CC[C@@](N)(C(=O)O)CC1 Amb27863411 [0,1,0,0,0,1|2,0,0]=4 4802 B11R1.220 C[C@]1(C(=O)O)CC[C@@H](O)CC1 Amb25085529 [0,1,0,0,0,1|1,0,0]=3 4803 B11R1.220 C[C@]1(C(=O)O)CC[C@H](O)CC1 Amb27484088 [0,1,0,0,0,1|1,0,0]=3 4804 B11R1.220 NC1(C(=O)O)CCC(O)CC1 Amb2699209 [0,1,0,0,0,1|1,0,0]=3 4805 B11R1.220 NC1CCC(F)(C(=O)O)CC1 Amb24105434 [0,1,0,0,0,1|2,0,0]=4 4806 B11R1.220 NC1CCC(N)(C(=O)O)CC1 Amb27645400 [0,1,0,0,0,1|2,0,0]=4 4807 B11R1.220 NC1CCC(N)(C(=O)O)CC1 Amb28652943 [0,1,0,0,0,1|2,0,0]=4 4808 B11R1.220 NC1CCC(O)(C(=O)O)CC1 Amb24116860 [0,1,0,0,0,1|2,0,0]=4 4809 B11R1.727 CC(=O)C1CCC(N)(O)CC1 Amb16233808 [0,1,0,0,0,1|2,0,0]=4 4810 B11R1.727 CC(=O)[C@H]1CC[C@](C)(O)CC1 Amb27750068 [0,1,0,0,0,1|2,0,0]=4 4811 B11R1.727 CC1(C)CCC(C(=O)O)CC1 Amb33546102 [0,1,0,0,0,1|2,0,0]=4 4812 B11R1.727 CC1(C)CCC(C(=O)O)CO1 Amb24312659 [0,1,0,0,0,1|2,0,0]=4 4813 B11R1.727 CC1(C)CCC(C(=O)O)NC1 Amb24649754 [0,1,0,0,0,1|1,0,0]=3 4814 B11R1.727 CC1(C)CCC(C(=O)O)NC1 Amb33295240 [0,1,0,0,0,1|1,0,0]=3 4815 B11R1.727 CC1(C)CNC(C(=O)O)CO1 Amb10608911 [0,1,0,0,0,1|1,0,0]=3 4816 B11R1.727 CC1(C)CNC(C(=O)O)CO1 Amb19889803 [0,1,0,0,0,1|1,0,0]=3 4817 B11R1.727 CC1(C)CNC(C(=O)O)OC1 Amb33193231 [0,1,0,0,0,1|1,0,0]=3 4818 B11R1.727 CC1(C)CNC(C(N)=O)CN1 Amb28066843 [0,1,0,0,0,1|2,0,0]=4 4819 B11R1.727 CC1(C)CNC(C(N)=O)CO1 Amb27238571 [0,1,0,0,0,1|2,0,0]=4 4820 B11R1.727 CC1(C)CN[C@@H](C(=O)O)CO1 Amb25207391 [0,1,0,0,0,1|1,0,0]=3 4821 B11R1.727 CC1(C)CN[C@@H](C(=O)O)CO1 Amb31291605 [0,1,0,0,0,1|1,0,0]=3 4822 B11R1.727 CC1(C)CN[C@H](C(=O)O)CO1 Amb19889802 [0,1,0,0,0,1|1,0,0]=3 4823 B11R1.727 CC1(C)CN[C@H](C(=O)O)CO1 Amb25111013 [0,1,0,0,0,1|1,0,0]=3 4824 B11R1.727 CC1(C)CN[C@H](C(N)=O)CO1 Amb27267831 [0,1,0,0,0,1|2,0,0]=4 4825 B11R1.727 CC1(C)COC(C(=O)O)CN1 Amb25148099 [0,1,0,0,0,1|2,0,0]=4 4826 B11R1.727 CC1(C)COC(C(=O)O)CN1 Amb33804031 [0,1,0,0,0,1|2,0,0]=4 4827 B11R1.727 CC1(C)COC(C(=O)O)CO1 Amb24558775 [0,1,0,0,0,1|2,0,0]=4 4828 B11R1.727 CC1(F)CCC(C(=O)O)CC1 Amb27659312 [0,1,0,0,0,1|2,0,0]=4 4829 B11R1.727 CC1(N)CCC(C(=O)O)CC1 Amb9782657 [0,1,0,0,0,1|2,0,0]=4 4830 B11R1.727 CC1(O)CCC(C(=O)O)CC1 Amb27803990 [0,1,0,0,0,1|1,0,0]=3 4831 B11R1.727 C[C@]1(O)CC[C@H](C(=O)O)CC1 Amb27478059 [0,1,0,0,0,1|1,0,0]=3 4832 B11R1.727 O=C(O)C1CCC(F)(F)CC1 Amb2691957 [0,1,0,0,0,1|2,0,0]=4 4833 B11R1.727 O=C(O)C1CCC(F)(F)CN1 Amb23439100 [0,1,0,0,0,1|1,0,0]=3 4834 B11R1.727 O=C(O)C1CCC(F)(F)CO1 Amb26059279 [0,1,0,0,0,1|2,0,0]=4 4835 B11R1.727 O=C(O)C1CCS(=O)(=O)CN1 Amb33299374 [0,1,0,0,0,1|1,0,1]=4 4836 B11R1.727 O=C(O)C1CCS(=O)(=O)CN1 Amb33482835 [0,1,0,0,0,1|1,0,1]=4 4837 B11R1.727 O=C(O)C1NCC(F)(F)CO1 Amb33194098 [0,1,0,0,0,1|1,0,0]=3 4838 B11R1.727 O=C(O)[C@@H]1CCC(F)(F)CN1 Amb28399246 [0,1,0,0,0,1|1,0,0]=3 4839 B11R1.39 C#CC(=O)CC1CC(O)CN1 Amb27233391 [0,1,0,0,0,1|1,0,0]=3 4840 B11R1.39 CC1CCC(CC(=O)NO)C1 Amb27833535 [0,1,0,0,0,1|2,0,0]=4 4841 B11R1.39 CC1CCC(OC(=O)CO)C1 Amb27397179 [0,1,0,0,0,1|2,0,0]=4 4842 B11R1.39 CNC(=O)CC1CC(O)CN1 Amb27873485 [0,1,0,0,0,1|1,0,0]=3 4843 B11R1.39 COC(=O)CC1CC(O)CS1 Amb27448818 [0,1,0,0,0,1|1,0,0]=3 4844 B11R1.39 COC(=O)CC1CCC(Br)C1 Amb33742926 [0,1,0,0,0,1|2,0,0]=4 4845 B11R1.39 COC(=O)CC1CCC(C)C1 Amb25120585 [0,1,0,0,0,1|2,0,0]=4 4846 B11R1.39 COC(=O)CC1CCC(N)C1 Amb25891564 [0,1,0,0,0,1|2,0,0]=4 4847 B11R1.39 COC(=O)CC1CCC(N)C1 Amb33096653 [0,1,0,0,0,1|2,0,0]=4 4848 B11R1.39 COC(=O)CC1CCC(O)C1 Amb26009531 [0,1,0,0,0,1|1,0,0]=3 4849 B11R1.39 COC(=O)CC1CCC(O)O1 Amb27652891 [0,1,0,0,0,1|2,0,0]=4 4850 B11R1.39 COC(=O)CN1CCC(O)C1 Amb18177629 [0,1,0,0,0,1|2,0,0]=4 4851 B11R1.39 COC(=O)CN1CC[C@@H](O)C1 Amb27782944 [0,1,0,0,0,1|2,0,0]=4 4852 B11R1.39 COC(=O)CN1CC[C@H](O)C1 Amb27875017 [0,1,0,0,0,1|2,0,0]=4 4853 B11R1.39 COC(=O)CN1C[C@@H](O)CO1 Amb28365804 [0,1,0,0,0,1|2,0,0]=4 4854 B11R1.39 COC(=O)C[C@@H]1C=C[C@@H](O)C1 Amb28253596 [0,1,0,0,0,1|1,0,1]=4 4855 B11R1.39 COC(=O)C[C@@H]1C=C[C@H](O)C1 Amb26554002 [0,1,0,0,0,1|1,0,1]=4 4856 B11R1.39 COC(=O)C[C@@H]1CC[C@@H](O)C1 Amb26957023 [0,1,0,0,0,1|1,0,0]=3 4857 B11R1.39 COC(=O)C[C@@H]1CC[C@H](N)C1 Amb24734862 [0,1,0,0,0,1|2,0,0]=4 4858 B11R1.39 COC(=O)C[C@@H]1CC[C@H](N)C1 Amb32992400 [0,1,0,0,0,1|2,0,0]=4 4859 B11R1.39 COC(=O)C[C@@H]1CC[C@H](O)C1 Amb25054455 [0,1,0,0,0,1|1,0,0]=3 4860 B11R1.39 COC(=O)C[C@@H]1C[C@@H](F)CN1 Amb33329928 [0,1,0,0,0,1|1,0,0]=3 4861 B11R1.39 COC(=O)C[C@@H]1C[C@@H](F)CN1 Amb33457873 [0,1,0,0,0,1|1,0,0]=3 4862 B11R1.39 COC(=O)C[C@@H]1C[C@@H](O)CN1 Amb27626754 [0,1,0,0,0,1|0,0,0]=2 4863 B11R1.39 COC(=O)C[C@@H]1C[C@H](F)CN1 Amb33329503 [0,1,0,0,0,1|1,0,0]=3 4864 B11R1.39 COC(=O)C[C@@H]1C[C@H](F)CN1 Amb33331078 [0,1,0,0,0,1|1,0,0]=3 4865 B11R1.39 COC(=O)C[C@H]1C=C[C@@H](O)C1 Amb22747624 [0,1,0,0,0,1|1,0,1]=4 4866 B11R1.39 COC(=O)C[C@H]1CC[C@@H](Cl)C1 Amb28384485 [0,1,0,0,0,1|2,0,0]=4 4867 B11R1.39 COC(=O)C[C@H]1C[C@H](O)CS1 Amb27451551 [0,1,0,0,0,1|1,0,0]=3 4868 B11R1.39 COC(=O)NC1CCC(F)C1 Amb27768285 [0,1,0,0,0,1|2,0,0]=4 4869 B11R1.39 COC(=O)NC1CCC(O)C1 Amb27832474 [0,1,0,0,0,1|1,0,0]=3 4870 B11R1.39 COC(=O)OC1C=CC(O)C1 Amb28078903 [0,1,0,0,0,1|1,0,1]=4 4871 B11R1.39 COC(=O)OC1CCC(N)C1 Amb27637757 [0,1,0,0,0,1|2,0,0]=4 4872 B11R1.39 NC1CCC(CC(=O)NO)C1 Amb28128429 [0,1,0,0,0,1|2,0,0]=4 4873 B11R1.39 O=C(CO)NC1CCC(F)C1 Amb27853008 [0,1,0,0,0,1|2,0,0]=4 4874 B11R1.43 CC(=O)NC1CCC(CO)C1 Amb24380802 [0,1,0,0,0,1|2,0,0]=4 4875 B11R1.43 CC(=O)N[C@@H]1CC[C@H](CO)C1 Amb32685059 [0,1,0,0,0,1|2,0,0]=4 4876 B11R1.43 COC1CCC(NC(=O)Cl)C1 Amb35633573 [0,1,0,0,0,1|2,0,0]=4 4877 B11R1.43 COC1CCC(NC(N)=O)C1 Amb27475793 [0,1,0,0,0,1|2,0,0]=4 4878 B11R1.43 COC1CNC(CC(=O)O)C1 Amb25149435 [0,1,0,0,0,1|0,0,0]=2 4879 B11R1.43 CO[C@@H]1CCN(CC(=O)O)C1 Amb27660698 [0,1,0,0,0,1|2,0,0]=4 4880 B11R1.43 CO[C@@H]1CCN(CC(=O)O)C1 Amb27982842 [0,1,0,0,0,1|2,0,0]=4 4881 B11R1.43 CO[C@@H]1CN[C@H](CC(=O)O)C1 Amb27818160 [0,1,0,0,0,1|0,0,0]=2 4882 B11R1.43 CO[C@H]1CNC(CC(=O)O)C1 Amb32990264 [0,1,0,0,0,1|0,0,0]=2 4883 B11R1.43 N#CC1CCC(CC(=O)O)C1 Amb18201140 [0,1,0,0,0,1|2,0,0]=4 4884 B11R1.43 NCC1CCC(CC(=O)O)C1 Amb32681887 [0,1,0,0,0,1|2,0,0]=4 4885 B11R1.43 O=C(O)CC1CC\C(=N/O)C1 Amb32415691 [0,1,0,0,0,1|1,0,1]=4 4886 B11R1.43 O=C(O)CN1CCC(CO)C1 Amb18296497 [0,1,0,0,0,1|2,0,0]=4 4887 B11R1.76 O=S(=O)(O)CC1CCC(O)C1 Amb24653599 [0,1,0,0,0,1|2,0,0]=4 4888 B11R1.76 O=S(=O)(O)C[C@@H]1CC[C@@H](O)C1 Amb25175032 [0,1,0,0,0,1|2,0,0]=4 4889 B11R1.76 O=S(=O)(O)C[C@H]1CC[C@@H](O)C1 Amb27956119 [0,1,0,0,0,1|2,0,0]=4 4890 B11R1.80 CC1CN(CC(=O)O)CC1O Amb28138165 [0,1,0,0,0,1|2,0,0]=4 4891 B11R1.80 O=C(O)CN1C[C@H](O)[C@@H](O)C1 Amb27668925 [0,1,0,0,0,1|2,0,0]=4 4892 B11R1.313 CC(=O)NC1CCC(O)C1O Amb27783365 [0,1,0,0,0,1|2,0,0]=4 4893 B11R1.313 CC1CCC(CC(=O)O)C1C Amb27240379 [0,1,0,0,0,1|2,0,0]=4 4894 B11R1.313 O=C(O)C[C@@H]1NC[C@H](O)[C@@H]1O Amb27212952 [0,1,0,0,0,1|0,0,0]=2 4895 B11R1.314 CC(C(=O)O)N1CC[C@H](O)C1 Amb27400907 [0,1,0,0,0,1|2,0,0]=4 4896 B11R1.314 CC(C(=O)O)[C@H]1C=C[C@H](O)C1 Amb27848059 [0,1,0,0,0,1|1,0,1]=4 4897 B11R1.314 CC1CCC(C(C)C(=O)O)C1 Amb28119009 [0,1,0,0,0,1|2,0,0]=4 4898 B11R1.314 CC1CCC(C(F)C(=O)O)C1 Amb26371222 [0,1,0,0,0,1|2,0,0]=4 4899 B11R1.314 CC1CCC(C(N)C(=O)O)C1 Amb35663080 [0,1,0,0,0,1|2,0,0]=4 4900 B11R1.314 CC1CCC([C@@H](C)C(=O)O)C1 Amb33728206 [0,1,0,0,0,1|2,0,0]=4 4901 B11R1.314 CC1CCC([C@H](C)C(=O)O)C1 Amb33749539 [0,1,0,0,0,1|2,0,0]=4 4902 B11R1.314 O=C(O)C(=O)N1CC[C@@H](O)C1 Amb27664885 [0,1,0,0,0,1|2,0,0]=4 4903 B11R1.645 CC1CC(O)CN1CC(=O)O Amb27483321 [0,1,0,0,0,1|2,0,0]=4 4904 B11R1.645 O=C(O)CN1C[C@@H](O)CC1=O Amb2697165 [0,1,0,0,0,1|2,0,0]=4 4905 B11R1.710 CC1(C)CCC(CC(=O)O)C1 Amb27669517 [0,1,0,0,0,1|2,0,0]=4 4906 B11R1.710 CC1(C)CNC(CC(=O)O)C1 Amb32834429 [0,1,0,0,0,1|1,0,0]=3 4907 B11R1.710 CC1(C)CNC(CC(=O)O)C1 Amb33456407 [0,1,0,0,0,1|1,0,0]=3 4908 B11R1.710 CC1(C)COC(CC(=O)O)C1 Amb32675272 [0,1,0,0,0,1|2,0,0]=4 4909 B11R1.710 CC1(F)CCC(CC(=O)O)C1 Amb27872732 [0,1,0,0,0,1|2,0,0]=4 4910 B11R1.710 CC1(O)CCN(CC(=O)O)C1 Amb26051946 [0,1,0,0,0,1|2,0,0]=4 4911 B11R1.710 O=C(O)CC1CCC(F)(F)C1 Amb26858554 [0,1,0,0,0,1|2,0,0]=4 4912 B11R1.710 O=C(O)CC1CCS(O)(O)C1 Amb27798771 [0,1,0,0,0,1|2,0,0]=4 4913 B11R1.710 O=C(O)C[C@@H]1CC(F)(F)CN1 Amb27451363 [0,1,0,0,0,1|1,0,0]=3 4914 B11R1.1039 CC1CCC(N)(CC(=O)O)C1 Amb27469252 [0,1,0,0,0,1|2,0,0]=4 4915 B11R1.1039 CC1CCC(O)(CC(=O)O)C1 Amb32680030 [0,1,0,0,0,1|2,0,0]=4 4916 B11R1.23 C#CC(=O)C1CNCC(C)C1 Amb24599646 [0,1,0,0,0,1|2,0,0]=4 4917 B11R1.23 C=C1CCNC(C(=O)OC)C1 Amb27750430 [0,1,0,0,0,1|1,0,1]=4 4918 B11R1.23 C=CC(=O)C1CNCC(C)C1 Amb24542993 [0,1,0,0,0,1|2,0,0]=4 4919 B11R1.23 CC1CC(C(=O)NO)CCO1 Amb27757128 [0,1,0,0,0,1|2,0,0]=4 4920 B11R1.23 CC1CC(C(=O)ON)CCO1 Amb25313398 [0,1,0,0,0,1|2,0,0]=4 4921 B11R1.23 CC1CNCC(C(=O)NN)C1 Amb27776008 [0,1,0,0,0,1|2,0,0]=4 4922 B11R1.23 CCC(=O)C1CNCC(C)C1 Amb27630973 [0,1,0,0,0,1|2,0,0]=4 4923 B11R1.23 CCC(=O)[C@@H]1CCC[C@H](O)C1 Amb28349328 [0,1,0,0,0,1|2,0,0]=4 4924 B11R1.23 CNC(=O)C1CC(C)CCN1 Amb28059101 [0,1,0,0,0,1|2,0,0]=4 4925 B11R1.23 CNC(=O)C1CCCC(O)C1 Amb25792016 [0,1,0,0,0,1|2,0,0]=4 4926 B11R1.23 CNC(=O)C1CNCC(C)C1 Amb26938436 [0,1,0,0,0,1|2,0,0]=4 4927 B11R1.23 COC(=O)C1=CCCC(O)C1 Amb25043658 [0,1,0,0,0,1|1,0,1]=4 4928 B11R1.23 COC(=O)C1CC(=O)CCN1 Amb13889092 [0,1,0,0,0,1|0,0,2]=4 4929 B11R1.23 COC(=O)C1CC(C)CCN1 Amb13886431 [0,1,0,0,0,1|1,0,0]=3 4930 B11R1.23 COC(=O)C1CC(C)CCN1 Amb30584728 [0,1,0,0,0,1|1,0,0]=3 4931 B11R1.23 COC(=O)C1CC(F)CCN1 Amb25270013 [0,1,0,0,0,1|1,0,0]=3 4932 B11R1.23 COC(=O)C1CC(O)C=CO1 Amb28248661 [0,1,0,0,0,1|1,0,1]=4 4933 B11R1.23 COC(=O)C1CC(O)CCN1 Amb21856404 [0,1,0,0,0,1|0,0,0]=2 4934 B11R1.23 COC(=O)C1CC(O)CCN1 Amb21963536 [0,1,0,0,0,1|0,0,0]=2 4935 B11R1.23 COC(=O)C1CC(O)CNN1 Amb27660893 [0,1,0,0,0,1|0,0,0]=2 4936 B11R1.23 COC(=O)C1CC=CC(O)C1 Amb26962072 [0,1,0,0,0,1|1,0,1]=4 4937 B11R1.23 COC(=O)C1CCCC(C)C1 Amb27607963 [0,1,0,0,0,1|2,0,0]=4 4938 B11R1.23 COC(=O)C1CCCC(Cl)C1 Amb24390370 [0,1,0,0,0,1|2,0,0]=4 4939 B11R1.23 COC(=O)C1CCCC(N)C1 Amb18288448 [0,1,0,0,0,1|2,0,0]=4 4940 B11R1.23 COC(=O)C1CCCC(N)C1 Amb20668217 [0,1,0,0,0,1|2,0,0]=4 4941 B11R1.23 COC(=O)C1CCCC(O)C1 Amb19516181 [0,1,0,0,0,1|1,0,0]=3 4942 B11R1.23 COC(=O)C1CCCC(S)C1 Amb32788133 [0,1,0,0,0,1|1,1,0]=4 4943 B11R1.23 COC(=O)C1CCNC(C)C1 Amb25104902 [0,1,0,0,0,1|2,0,0]=4 4944 B11R1.23 COC(=O)C1CCNC(C)C1 Amb33071704 [0,1,0,0,0,1|2,0,0]=4 4945 B11R1.23 COC(=O)C1CCOC(C)C1 Amb25730422 [0,1,0,0,0,1|2,0,0]=4 4946 B11R1.23 COC(=O)C1CN(C)CCN1 Amb15692177 [0,1,0,0,0,1|2,0,0]=4 4947 B11R1.23 COC(=O)C1CNCC(C)C1 Amb22728513 [0,1,0,0,0,1|1,0,0]=3 4948 B11R1.23 COC(=O)C1CNCC(C)C1 Amb28144998 [0,1,0,0,0,1|1,0,0]=3 4949 B11R1.23 COC(=O)C1CNCC(C)O1 Amb24761259 [0,1,0,0,0,1|2,0,0]=4 4950 B11R1.23 COC(=O)C1CNCC(C)O1 Amb32652650 [0,1,0,0,0,1|2,0,0]=4 4951 B11R1.23 COC(=O)C1CNCC(O)C1 Amb13885763 [0,1,0,0,0,1|0,0,0]=2 4952 B11R1.23 COC(=O)C1CNCC(O)C1 Amb17739877 [0,1,0,0,0,1|0,0,0]=2 4953 B11R1.23 COC(=O)C1CNC[C@@H](C)C1 Amb27250592 [0,1,0,0,0,1|1,0,0]=3 4954 B11R1.23 COC(=O)C1CNC[C@@H](C)O1 Amb25684325 [0,1,0,0,0,1|2,0,0]=4 4955 B11R1.23 COC(=O)C1CNC[C@@H](C)O1 Amb32652686 [0,1,0,0,0,1|2,0,0]=4 4956 B11R1.23 COC(=O)C1COCC(N)C1 Amb27783317 [0,1,0,0,0,1|2,0,0]=4 4957 B11R1.23 COC(=O)C1COCC(O)C1 Amb27408385 [0,1,0,0,0,1|1,0,0]=3 4958 B11R1.23 COC(=O)C1CS(=O)CCN1 Amb26035292 [0,1,0,0,0,1|1,0,1]=4 4959 B11R1.23 COC(=O)N1C=CCC(O)C1 Amb25172124 [0,1,0,0,0,1|2,0,0]=4 4960 B11R1.23 COC(=O)N1CCCC(O)C1 Amb9173673 [0,1,0,0,0,1|2,0,0]=4 4961 B11R1.23 COC(=O)[C@@H]1C=CC[C@H](N)C1 Amb27803897 [0,1,0,0,0,1|2,0,0]=4 4962 B11R1.23 COC(=O)[C@@H]1CC(=O)CCN1 Amb13889085 [0,1,0,0,0,1|0,0,2]=4 4963 B11R1.23 COC(=O)[C@@H]1CC(C)=CCN1 Amb25087820 [0,1,0,0,0,1|1,0,1]=4 4964 B11R1.23 COC(=O)[C@@H]1CC=C[C@@H](O)C1 Amb28195209 [0,1,0,0,0,1|1,0,1]=4 4965 B11R1.23 COC(=O)[C@@H]1CC=C[C@H](O)C1 Amb25176273 [0,1,0,0,0,1|1,0,1]=4 4966 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](Cl)C1 Amb28244806 [0,1,0,0,0,1|2,0,0]=4 4967 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](N)C1 Amb10873181 [0,1,0,0,0,1|2,0,0]=4 4968 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](N)C1 Amb24563866 [0,1,0,0,0,1|2,0,0]=4 4969 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](O)C1 Amb22899456 [0,1,0,0,0,1|1,0,0]=3 4970 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 Amb22747531 [0,1,0,0,0,1|2,0,0]=4 4971 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 Amb23438867 [0,1,0,0,0,1|2,0,0]=4 4972 B11R1.23 COC(=O)[C@@H]1CCC[C@H](O)C1 Amb27844007 [0,1,0,0,0,1|1,0,0]=3 4973 B11R1.23 COC(=O)[C@@H]1CCN[C@H](C)C1 Amb22406179 [0,1,0,0,0,1|2,0,0]=4 4974 B11R1.23 COC(=O)[C@@H]1CCN[C@H](C)C1 Amb23440187 [0,1,0,0,0,1|2,0,0]=4 4975 B11R1.23 COC(=O)[C@@H]1CN(C)CCN1 Amb28042519 [0,1,0,0,0,1|2,0,0]=4 4976 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](C)C1 Amb24062238 [0,1,0,0,0,1|1,0,0]=3 4977 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](C)C1 Amb32414717 [0,1,0,0,0,1|1,0,0]=3 4978 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](C)O1 Amb32668808 [0,1,0,0,0,1|2,0,0]=4 4979 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](C)O1 Amb32668809 [0,1,0,0,0,1|2,0,0]=4 4980 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](O)C1 Amb33620324 [0,1,0,0,0,1|0,0,0]=2 4981 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](O)C1 Amb33738361 [0,1,0,0,0,1|0,0,0]=2 4982 B11R1.23 COC(=O)[C@@H]1CNC[C@H](C)C1 Amb24062237 [0,1,0,0,0,1|1,0,0]=3 4983 B11R1.23 COC(=O)[C@@H]1CNC[C@H](C)O1 Amb34914989 [0,1,0,0,0,1|2,0,0]=4 4984 B11R1.23 COC(=O)[C@@H]1CNC[C@H](C)O1 Amb35745789 [0,1,0,0,0,1|2,0,0]=4 4985 B11R1.23 COC(=O)[C@@H]1COC[C@H](O)C1 Amb27974537 [0,1,0,0,0,1|1,0,0]=3 4986 B11R1.23 COC(=O)[C@@H]1CSC[C@H](N)C1 Amb27870756 [0,1,0,0,0,1|2,0,0]=4 4987 B11R1.23 COC(=O)[C@@H]1C[C@@H](N)CCO1 Amb33039930 [0,1,0,0,0,1|2,0,0]=4 4988 B11R1.23 COC(=O)[C@@H]1C[C@@H](O)CCN1 Amb22748265 [0,1,0,0,0,1|0,0,0]=2 4989 B11R1.23 COC(=O)[C@@H]1C[C@@H](O)CCN1 Amb30628604 [0,1,0,0,0,1|0,0,0]=2 4990 B11R1.23 COC(=O)[C@@H]1C[C@@H](O)CNN1 Amb28069785 [0,1,0,0,0,1|0,0,0]=2 4991 B11R1.23 COC(=O)[C@@H]1C[C@H](C)CCN1 Amb26433028 [0,1,0,0,0,1|1,0,0]=3 4992 B11R1.23 COC(=O)[C@@H]1C[C@H](O)CCN1 Amb10606654 [0,1,0,0,0,1|0,0,0]=2 4993 B11R1.23 COC(=O)[C@H]1CC(C)=CCN1 Amb28255531 [0,1,0,0,0,1|1,0,1]=4 4994 B11R1.23 COC(=O)[C@H]1CCC[C@@H](N)C1 Amb26618546 [0,1,0,0,0,1|2,0,0]=4 4995 B11R1.23 COC(=O)[C@H]1CCC[C@@H](O)C1 Amb25198846 [0,1,0,0,0,1|1,0,0]=3 4996 B11R1.23 COC(=O)[C@H]1CCC[C@H](N)C1 Amb33871486 [0,1,0,0,0,1|2,0,0]=4 4997 B11R1.23 COC(=O)[C@H]1CCC[C@H](O)C1 Amb25225913 [0,1,0,0,0,1|1,0,0]=3 4998 B11R1.23 COC(=O)[C@H]1CCN[C@@H](C)C1 Amb28132483 [0,1,0,0,0,1|2,0,0]=4 4999 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C)C1 Amb24062236 [0,1,0,0,0,1|1,0,0]=3 5000 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C)C1 Amb30869454 [0,1,0,0,0,1|1,0,0]=3 5001 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C)O1 Amb24555590 [0,1,0,0,0,1|2,0,0]=4 5002 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C)O1 Amb32652224 [0,1,0,0,0,1|2,0,0]=4 5003 B11R1.23 COC(=O)[C@H]1C[C@@H](F)CCO1 Amb27421936 [0,1,0,0,0,1|2,0,0]=4 5004 B11R1.23 COC(=O)[C@H]1C[C@@H](O)CCN1 Amb26573656 [0,1,0,0,0,1|0,0,0]=2 5005 B11R1.23 COC(=O)[C@H]1C[C@H](F)CCO1 Amb24620300 [0,1,0,0,0,1|2,0,0]=4 5006 B11R1.23 NCC(=O)C1CCCC(O)C1 Amb25315833 [0,1,0,0,0,1|2,0,0]=4 5007 B11R1.23 NCC(=O)[C@H]1CCC[C@H](O)C1 Amb27205210 [0,1,0,0,0,1|2,0,0]=4 5008 B11R1.23 NNC(=O)C1CCCC(O)C1 Amb25381484 [0,1,0,0,0,1|2,0,0]=4 5009 B11R1.23 N\C(=N/O)C1CCCC(O)C1 Amb33328436 [0,1,0,0,0,1|2,0,0]=4 5010 B11R1.23 O=C(CBr)C1CCCC(O)C1 Amb25880065 [0,1,0,0,0,1|2,0,0]=4 5011 B11R1.23 O=C(CBr)[C@@H]1CCC[C@@H](O)C1 Amb25694930 [0,1,0,0,0,1|2,0,0]=4 5012 B11R1.23 O=C(CBr)[C@@H]1CCC[C@H](O)C1 Amb28200648 [0,1,0,0,0,1|2,0,0]=4 5013 B11R1.74 CC1=CC(C(=O)O)CC(C)C1 Amb26585310 [0,1,0,0,0,1|2,0,0]=4 5014 B11R1.74 CC1CC(=O)CC(C(=O)O)N1 Amb18200027 [0,1,0,0,0,1|0,0,2]=4 5015 B11R1.74 CC1CC(=O)NC(C(=O)O)C1 Amb26352891 [0,1,0,0,0,1|1,0,0]=3 5016 B11R1.74 CC1CC(C(=O)O)CC(C)N1 Amb23535943 [0,1,0,0,0,1|2,0,0]=4 5017 B11R1.74 CC1CC(C(=O)O)CC(C)N1 Amb32670799 [0,1,0,0,0,1|2,0,0]=4 5018 B11R1.74 CC1CC(C(=O)O)CC(C)O1 Amb18830483 [0,1,0,0,0,1|2,0,0]=4 5019 B11R1.74 CC1CC(C)CC(C(=O)O)C1 Amb28314873 [0,1,0,0,0,1|2,0,0]=4 5020 B11R1.74 CC1CC(C)NC(C(=O)O)C1 Amb24588101 [0,1,0,0,0,1|1,0,0]=3 5021 B11R1.74 CC1CC(C)NC(C(N)=O)C1 Amb27750832 [0,1,0,0,0,1|2,0,0]=4 5022 B11R1.74 CC1CC(C)OC(C(=O)O)C1 Amb18830486 [0,1,0,0,0,1|2,0,0]=4 5023 B11R1.74 CC1CC(N)CC(C(=O)O)C1 Amb27212274 [0,1,0,0,0,1|2,0,0]=4 5024 B11R1.74 CC1CN(C)CC(C(=O)O)O1 Amb27428986 [0,1,0,0,0,1|2,0,0]=4 5025 B11R1.74 CC1CN(C)CC(C(=O)O)O1 Amb28920052 [0,1,0,0,0,1|2,0,0]=4 5026 B11R1.74 CC1CS(=O)C[C@@H](C(=O)O)N1 Amb28244788 [0,1,0,0,0,1|1,0,1]=4 5027 B11R1.74 CC1C[C@@H](O)C[C@H](C(=O)O)C1 Amb28195097 [0,1,0,0,0,1|1,0,0]=3 5028 B11R1.74 CC1NC(=O)CC(C(=O)O)N1 Amb28399335 [0,1,0,0,0,1|0,0,2]=4 5029 B11R1.74 CN1CC(O)CC(C(=O)O)C1 Amb35687162 [0,1,0,0,0,1|0,0,0]=2 5030 B11R1.74 C[C@@H]1CC(=O)N[C@H](C(=O)O)C1 Amb28134065 [0,1,0,0,0,1|1,0,0]=3 5031 B11R1.74 C[C@@H]1CC(=O)N[C@H](C(N)=O)C1 Amb27854487 [0,1,0,0,0,1|2,0,0]=4 5032 B11R1.74 C[C@@H]1CN(C)C[C@H](C(=O)O)O1 Amb28904325 [0,1,0,0,0,1|2,0,0]=4 5033 B11R1.74 C[C@@H]1C[C@@H](C(=O)O)NC(=S)N1 Amb10608553 [0,1,0,0,0,1|1,0,1]=4 5034 B11R1.74 C[C@@H]1C[C@H](C(=O)O)C[C@H](C)C1 Amb24487888 [0,1,0,0,0,1|2,0,0]=4 5035 B11R1.74 C[C@@H]1C[C@H](O)C[C@H](C(=O)O)C1 Amb28384451 [0,1,0,0,0,1|1,0,0]=3 5036 B11R1.74 C[C@H]1CC(=O)N[C@@H](C(=O)O)C1 Amb28284476 [0,1,0,0,0,1|1,0,0]=3 5037 B11R1.74 C[C@H]1CC(C(=O)O)C[C@@H](C)N1 Amb34915526 [0,1,0,0,0,1|2,0,0]=4 5038 B11R1.74 C[C@H]1CC(C(=O)O)C[C@@H](C)O1 Amb32680762 [0,1,0,0,0,1|2,0,0]=4 5039 B11R1.74 C[C@H]1C[C@@H](C(=O)O)C[C@@H](C)N1 Amb28723478 [0,1,0,0,0,1|2,0,0]=4 5040 B11R1.74 C[C@H]1C[C@@H](C(=O)O)C[C@@H](C)N1 Amb32670819 [0,1,0,0,0,1|2,0,0]=4 5041 B11R1.74 C[C@H]1C[C@@H](C(=O)O)C[C@@H](C)O1 Amb32695424 [0,1,0,0,0,1|2,0,0]=4 5042 B11R1.74 C[C@H]1C[C@@H](C)N[C@@H](C(=O)O)C1 Amb28132155 [0,1,0,0,0,1|1,0,0]=3 5043 B11R1.74 C[C@H]1C[C@H](O)C[C@H](C(=O)O)C1 Amb28051869 [0,1,0,0,0,1|1,0,0]=3 5044 B11R1.74 NC1CC(=O)NC(C(=O)O)C1 Amb18199921 [0,1,0,0,0,1|1,0,0]=3 5045 B11R1.74 NC1CC(N)CC(C(=O)O)C1 Amb26941963 [0,1,0,0,0,1|2,0,0]=4 5046 B11R1.74 NC1CC(O)CC(C(=O)O)C1 Amb28285635 [0,1,0,0,0,1|1,0,0]=3 5047 B11R1.74 N[C@@H]1C[C@H](O)C[C@H](C(=O)O)C1 Amb27650583 [0,1,0,0,0,1|1,0,0]=3 5048 B11R1.74 N[C@H]1CC(C(=O)O)C[C@H](N)C1 Amb27776579 [0,1,0,0,0,1|2,0,0]=4 5049 B11R1.74 O=C(O)C1=CC(O)CC(O)C1 Amb27759387 [0,1,0,0,0,1|1,0,1]=4 5050 B11R1.74 O=C(O)C1CC(O)CC(O)C1 Amb26351388 [0,1,0,0,0,1|1,0,0]=3 5051 B11R1.74 O=C1CC(=O)NC(C(=O)O)C1 Amb18200050 [0,1,0,0,0,1|0,0,2]=4 5052 B11R1.74 O=C1CC(=O)N[C@H](C(=O)O)C1 Amb27985272 [0,1,0,0,0,1|0,0,2]=4 5053 B11R1.74 O=C1CC(C(=O)O)CC(O)N1 Amb27234573 [0,1,0,0,0,1|1,0,1]=4 5054 B11R1.74 O=C1CC(O)CC(C(=O)O)N1 Amb28077591 [0,1,0,0,0,1|0,0,0]=2 5055 B11R1.74 O=C1CS(=O)CC(C(=O)O)N1 Amb27444598 [0,1,0,0,0,1|1,0,1]=4 5056 B11R1.155 O=S(=O)(O)[C@@H]1CCC[C@H](O)C1 Amb28319780 [0,1,0,0,0,1|2,0,0]=4 5057 B11R1.159 CC(=O)C1CCCC(O)C1O Amb27599413 [0,1,0,0,0,1|2,0,0]=4 5058 B11R1.159 CC(O)C1CNCC(O)C1O Amb27657873 [0,1,0,0,0,1|1,0,1]=4 5059 B11R1.159 CC1CCCC(C(=O)O)C1N Amb28132204 [0,1,0,0,0,1|2,0,0]=4 5060 B11R1.159 CC1NCCC(C(=O)O)C1C Amb28136882 [0,1,0,0,0,1|2,0,0]=4 5061 B11R1.159 C[C@@H]1CNC[C@H](C(=O)O)[C@@H]1O Amb27233628 [0,1,0,0,0,1|1,0,0]=3 5062 B11R1.159 C[C@H](O)[C@H]1CNC[C@@H](O)[C@@H]1O Amb28130416 [0,1,0,0,0,1|1,0,1]=4 5063 B11R1.159 C[C@H]1[C@@H](O)CCC[C@H]1C(=O)O Amb28051870 [0,1,0,0,0,1|1,0,0]=3 5064 B11R1.159 NC1CCCC(C(=O)O)C1O Amb27237633 [0,1,0,0,0,1|2,0,0]=4 5065 B11R1.159 N[C@H]1CCC[C@H](C(=O)O)[C@@H]1O Amb24557744 [0,1,0,0,0,1|2,0,0]=4 5066 B11R1.159 N[C@H]1[C@@H](C(=O)O)CCC[C@H]1O Amb27640678 [0,1,0,0,0,1|1,0,0]=3 5067 B11R1.159 O=C(O)[C@H]1NCC[C@@H](O)[C@@H]1O Amb28457421 [0,1,0,0,0,1|0,0,0]=2 5068 B11R1.159 O=C(O)[C@H]1NCC[C@@H](O)[C@H]1O Amb27860415 [0,1,0,0,0,1|0,0,0]=2 5069 B11R1.167 CC1=C(C(=O)O)C[C@@H](O)CC1 Amb27409054 [0,1,0,0,0,1|1,0,1]=4 5070 B11R1.167 CC1CC(C(=O)O)C(C)CN1 Amb32757575 [0,1,0,0,0,1|2,0,0]=4 5071 B11R1.167 CC1CC(C(=O)O)C(C)CN1 Amb32830931 [0,1,0,0,0,1|2,0,0]=4 5072 B11R1.167 CC1CCC(=O)C(C(=O)O)C1 Amb33194615 [0,1,0,0,0,1|2,0,0]=4 5073 B11R1.167 CC1CCC(C)C(C(=O)O)C1 Amb27870887 [0,1,0,0,0,1|2,0,0]=4 5074 B11R1.167 CC1CCC(Cl)CC1C(=O)O Amb25260877 [0,1,0,0,0,1|2,0,0]=4 5075 B11R1.167 CC1CCC(F)CC1C(=O)O Amb28050842 [0,1,0,0,0,1|2,0,0]=4 5076 B11R1.167 CC1CCC(N)C(C(=O)O)C1 Amb18200001 [0,1,0,0,0,1|2,0,0]=4 5077 B11R1.167 CC1CCC(N)CC1C(=O)O Amb26073941 [0,1,0,0,0,1|2,0,0]=4 5078 B11R1.167 CC1CCC(O)CC1C(=O)O Amb24392245 [0,1,0,0,0,1|1,0,0]=3 5079 B11R1.167 CC1CC[C@H](O)C[C@H]1C(=O)O Amb28195098 [0,1,0,0,0,1|1,0,0]=3 5080 B11R1.167 CC1CNC(=O)C(C(=O)O)C1 Amb26570606 [0,1,0,0,0,1|1,0,0]=3 5081 B11R1.167 CC1CNC(=O)C(C(=O)O)N1 Amb27670120 [0,1,0,0,0,1|2,0,0]=4 5082 B11R1.167 CN1CCC(=O)CC1C(=O)O Amb18200028 [0,1,0,0,0,1|0,0,2]=4 5083 B11R1.167 CN1CCC(F)CC1C(=O)O Amb25864461 [0,1,0,0,0,1|1,0,0]=3 5084 B11R1.167 CN1CCN(C)C(C(=O)O)C1 Amb10982458 [0,1,0,0,0,1|2,0,0]=4 5085 B11R1.167 CN1CCN(C)C(C(=O)O)C1 Amb25760074 [0,1,0,0,0,1|2,0,0]=4 5086 B11R1.167 C[C@H]1CC[C@@H](C)[C@@H](C(=O)O)C1 Amb26927968 [0,1,0,0,0,1|2,0,0]=4 5087 B11R1.167 NC(=O)C1CC(O)CNC1=O Amb27858649 [0,1,0,0,0,1|1,0,0]=3 5088 B11R1.167 NC1CCC(O)CC1C(=O)O Amb25139597 [0,1,0,0,0,1|1,0,0]=3 5089 B11R1.167 N[C@@H]1CC[C@@H](O)C[C@H]1C(=O)O Amb27231807 [0,1,0,0,0,1|1,0,0]=3 5090 B11R1.167 N[C@@H]1CC[C@H](O)C[C@@H]1C(=O)O Amb27444612 [0,1,0,0,0,1|1,0,0]=3 5091 B11R1.167 N[C@@H]1CC[C@H](O)C[C@H]1C(=O)O Amb27878771 [0,1,0,0,0,1|1,0,0]=3 5092 B11R1.167 N[C@H]1CC[C@@H](O)C[C@H]1C(=O)O Amb28193740 [0,1,0,0,0,1|1,0,0]=3 5093 B11R1.167 O=C(O)C1CC(O)CCC1O Amb25809422 [0,1,0,0,0,1|1,0,0]=3 5094 B11R1.266 CCC1CC(C(=O)O)CCN1 Amb18199986 [0,1,0,0,0,1|2,0,0]=4 5095 B11R1.266 CCC1CC(C(=O)O)CCO1 Amb25679263 [0,1,0,0,0,1|2,0,0]=4 5096 B11R1.266 CCC1CCNC(C(=O)O)C1 Amb18830613 [0,1,0,0,0,1|1,0,0]=3 5097 B11R1.266 CCC1CCNC(C(=O)O)C1 Amb33338905 [0,1,0,0,0,1|1,0,0]=3 5098 B11R1.266 CCC1CCNC(C(=O)O)O1 Amb33193374 [0,1,0,0,0,1|2,0,0]=4 5099 B11R1.266 CCC1CNCC(C(=O)O)C1 Amb33275578 [0,1,0,0,0,1|1,0,0]=3 5100 B11R1.266 CCN1CCNC(C(=O)O)C1 Amb26946426 [0,1,0,0,0,1|2,0,0]=4 5101 B11R1.266 CC[C@@H]1CCN[C@H](C(=O)O)C1 Amb27421998 [0,1,0,0,0,1|1,0,0]=3 5102 B11R1.266 CC[C@H]1CCN[C@@H](C(=O)O)C1 Amb25937982 [0,1,0,0,0,1|1,0,0]=3 5103 B11R1.266 CC[C@H]1CCN[C@@H](C(=O)O)C1 Amb33338984 [0,1,0,0,0,1|1,0,0]=3 5104 B11R1.266 CNC1CCOC(C(=O)O)C1 Amb27419779 [0,1,0,0,0,1|2,0,0]=4 5105 B11R1.266 COC1=CCCC(C(=O)O)C1 Amb28244804 [0,1,0,0,0,1|1,0,1]=4 5106 B11R1.266 COC1=NCCC(C(=O)O)C1 Amb32668294 [0,1,0,0,0,1|1,0,1]=4 5107 B11R1.266 COC1CCCC(C(=O)Cl)C1 Amb2689121 [0,1,0,0,0,1|2,0,0]=4 5108 B11R1.266 COC1CCCC(C(=O)O)C1 Amb3939936 [0,1,0,0,0,1|1,0,0]=3 5109 B11R1.266 COC1CCCC(C(=O)O)O1 Amb27483979 [0,1,0,0,0,1|2,0,0]=4 5110 B11R1.266 COC1CCCC(C(C)=O)C1 Amb28139124 [0,1,0,0,0,1|2,0,0]=4 5111 B11R1.266 COC1CCNC(C(N)=O)C1 Amb28284793 [0,1,0,0,0,1|1,0,0]=3 5112 B11R1.266 COC1CNCC(C(=O)O)C1 Amb28050836 [0,1,0,0,0,1|0,0,0]=2 5113 B11R1.266 CO[C@@H]1CCC[C@@H](C(N)=O)C1 Amb27489103 [0,1,0,0,0,1|2,0,0]=4 5114 B11R1.266 CO[C@H]1CCC[C@@H](C(=O)O)C1 Amb28411305 [0,1,0,0,0,1|1,0,0]=3 5115 B11R1.266 CO[C@H]1CCC[C@@H](C(N)=O)C1 Amb28051977 [0,1,0,0,0,1|2,0,0]=4 5116 B11R1.266 CO[C@H]1CCN[C@@H](C(=O)O)C1 Amb27984982 [0,1,0,0,0,1|0,0,0]=2 5117 B11R1.266 CSC1CCCC(C(=O)O)C1 Amb28322463 [0,1,0,0,0,1|1,1,0]=4 5118 B11R1.266 NCC1CCCC(C(=O)O)C1 Amb25684748 [0,1,0,0,0,1|2,0,0]=4 5119 B11R1.266 NCC1CCCC(C(=O)O)C1 Amb27777100 [0,1,0,0,0,1|2,0,0]=4 5120 B11R1.266 NCC1CNCC(C(=O)O)C1 Amb27984747 [0,1,0,0,0,1|1,0,0]=3 5121 B11R1.266 O=C(O)C1CCCC(CF)C1 Amb27958907 [0,1,0,0,0,1|2,0,0]=4 5122 B11R1.266 O=C(O)C1CCCC(CO)C1 Amb24488127 [0,1,0,0,0,1|1,0,0]=3 5123 B11R1.266 O=C(O)C1CCC\C(=N/O)C1 Amb23453123 [0,1,0,0,0,1|1,0,1]=4 5124 B11R1.266 O=C(O)C1CN(CF)CCN1 Amb27463603 [0,1,0,0,0,1|2,0,0]=4 5125 B11R1.266 O=C(O)C1CNCC(CO)C1 Amb28240330 [0,1,0,0,0,1|0,0,0]=2 5126 B11R1.266 O=C(O)[C@@H]1CCC[C@H](CF)C1 Amb35789416 [0,1,0,0,0,1|2,0,0]=4 5127 B11R1.266 O=C(O)[C@H]1CCC[C@@H](CO)N1 Amb25348501 [0,1,0,0,0,1|2,0,0]=4 5128 B11R1.266 O=C(O)[C@H]1CNC[C@@H](CO)C1 Amb27240274 [0,1,0,0,0,1|0,0,0]=2 5129 B11R1.667 CC1(C(=O)O)C=CCC(O)C1 Amb27964537 [0,1,0,0,0,1|1,0,0]=3 5130 B11R1.667 CC1(C(=O)O)CC(N)CCO1 Amb32675435 [0,1,0,0,0,1|2,0,0]=4 5131 B11R1.667 CC1(C(=O)O)CC(N)CCO1 Amb32682437 [0,1,0,0,0,1|2,0,0]=4 5132 B11R1.667 CC1(C(=O)O)CCCC(Cl)C1 Amb18127807 [0,1,0,0,0,1|2,0,0]=4 5133 B11R1.667 CC1(C(=O)O)CCCC(F)C1 Amb27429155 [0,1,0,0,0,1|2,0,0]=4 5134 B11R1.667 CC1CC(C)(C(=O)O)CCO1 Amb32654883 [0,1,0,0,0,1|2,0,0]=4 5135 B11R1.667 CC1CC(Cl)(C(=O)O)CCO1 Amb33127970 [0,1,0,0,0,1|2,0,0]=4 5136 B11R1.667 CC1CC(N)(C(=O)O)CCO1 Amb26893175 [0,1,0,0,0,1|2,0,0]=4 5137 B11R1.667 CC1CC(N)(C(=O)O)CCO1 Amb30584653 [0,1,0,0,0,1|2,0,0]=4 5138 B11R1.667 CC1CC(O)(C(=O)O)CCO1 Amb25744122 [0,1,0,0,0,1|2,0,0]=4 5139 B11R1.667 CC1CCCC(C)(C(=O)O)C1 Amb25892566 [0,1,0,0,0,1|2,0,0]=4 5140 B11R1.667 CC1CCCC(Cl)(C(=O)O)C1 Amb33127952 [0,1,0,0,0,1|2,0,0]=4 5141 B11R1.667 CC1CCCC(N)(C(=O)O)C1 Amb2695467 [0,1,0,0,0,1|2,0,0]=4 5142 B11R1.667 CC1CNCC(N)(C(N)=O)C1 Amb35709611 [0,1,0,0,0,1|2,0,0]=4 5143 B11R1.667 C[C@@H]1CCC[C@@](C)(C(=O)O)C1 Amb28384471 [0,1,0,0,0,1|2,0,0]=4 5144 B11R1.667 C[C@@H]1CCC[C@@](N)(C(=O)O)C1 Amb27858765 [0,1,0,0,0,1|2,0,0]=4 5145 B11R1.667 C[C@@H]1CCC[C@](N)(C(=O)O)C1 Amb27444576 [0,1,0,0,0,1|2,0,0]=4 5146 B11R1.667 C[C@H]1CCC[C@](C)(C(=O)O)C1 Amb28132417 [0,1,0,0,0,1|2,0,0]=4 5147 B11R1.667 NC(=O)C1(N)CCCC(O)C1 Amb29866305 [0,1,0,0,0,1|2,0,0]=4 5148 B11R1.667 NC1(C(=O)O)CCCC(O)C1 Amb27607815 [0,1,0,0,0,1|1,0,0]=3 5149 B11R1.667 NC1CCCC(F)(C(=O)O)C1 Amb27165541 [0,1,0,0,0,1|2,0,0]=4 5150 B11R1.667 N[C@@]1(C(=O)O)CCC[C@@H](O)C1 Amb25377812 [0,1,0,0,0,1|1,0,0]=3 5151 B11R1.667 O=C(O)C1(Cl)CCCC(Cl)C1 Amb28118839 [0,1,0,0,0,1|2,0,0]=4 5152 B11R1.667 O=C(O)C1(O)CCCC(O)C1 Amb28071186 [0,1,0,0,0,1|1,0,0]=3 5153 B11R1.667 O=C(O)[C@@]1(O)CCC[C@H](O)C1 Amb28131475 [0,1,0,0,0,1|1,0,0]=3 5154 B11R1.730 CC1(C)CC(C(=O)O)CCN1 Amb23590785 [0,1,0,0,0,1|2,0,0]=4 5155 B11R1.730 CC1(C)CC(C(=O)O)CCO1 Amb33545187 [0,1,0,0,0,1|2,0,0]=4 5156 B11R1.730 CC1(C)CC(C(=O)O)CCS1 Amb17594418 [0,1,0,0,0,1|2,0,0]=4 5157 B11R1.730 CC1(C)CCCC(C(=O)O)C1 Amb22059548 [0,1,0,0,0,1|2,0,0]=4 5158 B11R1.730 CC1(C)CCNC(C(=O)O)C1 Amb23589292 [0,1,0,0,0,1|1,0,0]=3 5159 B11R1.730 CC1(C)CCNC(C(=O)O)C1 Amb28872326 [0,1,0,0,0,1|1,0,0]=3 5160 B11R1.730 CC1(C)CCNC(C(=O)O)O1 Amb33194422 [0,1,0,0,0,1|2,0,0]=4 5161 B11R1.730 CC1(C)CCNC(C(N)=O)C1 Amb27625202 [0,1,0,0,0,1|2,0,0]=4 5162 B11R1.730 CC1(C)CNCC(C(=O)O)C1 Amb35789444 [0,1,0,0,0,1|1,0,0]=3 5163 B11R1.730 CC1(C)CNCC(C(=O)O)C1 Amb35789724 [0,1,0,0,0,1|1,0,0]=3 5164 B11R1.730 CC1(C)CNCC(C(=O)O)O1 Amb24509651 [0,1,0,0,0,1|2,0,0]=4 5165 B11R1.730 CC1(C)CNCC(C(=O)O)O1 Amb33743425 [0,1,0,0,0,1|2,0,0]=4 5166 B11R1.730 CC1(Cl)CCCC(C(=O)O)C1 Amb18648012 [0,1,0,0,0,1|2,0,0]=4 5167 B11R1.730 CC1(F)CCCC(C(=O)O)C1 Amb27872745 [0,1,0,0,0,1|2,0,0]=4 5168 B11R1.730 O=C(O)C1CC(F)(F)CCN1 Amb26964474 [0,1,0,0,0,1|1,0,0]=3 5169 B11R1.730 O=C(O)C1CC(F)(F)CCN1 Amb33484267 [0,1,0,0,0,1|1,0,0]=3 5170 B11R1.730 O=C(O)C1CCCC(F)(F)C1 Amb22738663 [0,1,0,0,0,1|2,0,0]=4 5171 B11R1.730 O=C(O)C1CNCC(F)(F)C1 Amb22411162 [0,1,0,0,0,1|1,0,0]=3 5172 B11R1.730 O=C(O)C1CNCC(F)(F)C1 Amb25259159 [0,1,0,0,0,1|1,0,0]=3 5173 B11R1.730 O=C(O)C1CS(=O)(=O)CCN1 Amb23603855 [0,1,0,0,0,1|1,0,1]=4 5174 B11R1.730 O=C(O)C1CS(=O)(=O)CCN1 Amb28652934 [0,1,0,0,0,1|1,0,1]=4 5175 B11R1.730 O=C(O)[C@@H]1CC(F)(F)CCN1 Amb27598022 [0,1,0,0,0,1|1,0,0]=3 5176 B11R1.730 O=C(O)[C@@H]1CC(O)(O)CCN1 Amb27632354 [0,1,0,0,0,1|0,0,0]=2 5177 B11R1.730 O=C(O)[C@@H]1CS(=O)(=O)CCN1 Amb27146192 [0,1,0,0,0,1|1,0,1]=4 5178 B11R1.6 COC(C)(C)C1CC(O)CN1 Amb27233804 [0,2,0,0,0,0|1,0,1]=4 5179 B11R1.15 CCNC(=O)C1CC(O)CN1 Amb7775476 [0,2,0,0,0,0|1,0,0]=3 5180 B11R1.15 CCNC(=O)[C@@H]1CC(F)CN1 Amb28281219 [0,2,0,0,0,0|2,0,0]=4 5181 B11R1.15 CCNC(=O)[C@@H]1CC[C@@H](O)C1 Amb27766292 [0,2,0,0,0,0|2,0,0]=4 5182 B11R1.15 CCNC(=O)[C@@H]1C[C@@H](F)CN1 Amb27669384 [0,2,0,0,0,0|2,0,0]=4 5183 B11R1.15 CCOC(=O)C1CC(C)CN1 Amb2695748 [0,2,0,0,0,0|1,0,0]=3 5184 B11R1.15 CCOC(=O)C1CC(C)CN1 Amb8630141 [0,2,0,0,0,0|1,0,0]=3 5185 B11R1.15 CCOC(=O)C1CC(F)CN1 Amb23597508 [0,2,0,0,0,0|1,0,0]=3 5186 B11R1.15 CCOC(=O)C1CC(O)CN1 Amb1091858 [0,2,0,0,0,0|0,0,0]=2 5187 B11R1.15 CCOC(=O)C1CC(O)CN1 Amb21955583 [0,2,0,0,0,0|0,0,0]=2 5188 B11R1.15 CCOC(=O)C1CC(O)CO1 Amb22230657 [0,2,0,0,0,0|1,0,0]=3 5189 B11R1.15 CCOC(=O)C1CCC(F)C1 Amb27826263 [0,2,0,0,0,0|2,0,0]=4 5190 B11R1.15 CCOC(=O)C1CCC(N)C1 Amb22059628 [0,2,0,0,0,0|2,0,0]=4 5191 B11R1.15 CCOC(=O)C1CCC(N)C1 Amb33549640 [0,2,0,0,0,0|2,0,0]=4 5192 B11R1.15 CCOC(=O)C1CCC(O)C1 Amb22754536 [0,2,0,0,0,0|1,0,0]=3 5193 B11R1.15 CCOC(=O)N1CC[C@H](O)C1 Amb28061675 [0,2,0,0,0,0|2,0,0]=4 5194 B11R1.15 CCOC(=O)N1C[C@@H](O)CO1 Amb27603459 [0,2,0,0,0,0|2,0,0]=4 5195 B11R1.15 CCOC(=O)[C@@H]1CC(C)CN1 Amb22736075 [0,2,0,0,0,0|1,0,0]=3 5196 B11R1.15 CCOC(=O)[C@@H]1CCC(O)N1 Amb27945675 [0,2,0,0,0,0|2,0,0]=4 5197 B11R1.15 CCOC(=O)[C@@H]1CCC(O)O1 Amb27425160 [0,2,0,0,0,0|2,0,0]=4 5198 B11R1.15 CCOC(=O)[C@@H]1CC[C@@H](O)O1 Amb24613347 [0,2,0,0,0,0|2,0,0]=4 5199 B11R1.15 CCOC(=O)[C@@H]1CC[C@H](N)C1 Amb24079839 [0,2,0,0,0,0|2,0,0]=4 5200 B11R1.15 CCOC(=O)[C@@H]1CC[C@H](N)C1 Amb26988391 [0,2,0,0,0,0|2,0,0]=4 5201 B11R1.15 CCOC(=O)[C@@H]1C[C@@H](C)CN1 Amb28285795 [0,2,0,0,0,0|1,0,0]=3 5202 B11R1.15 CCOC(=O)[C@@H]1C[C@@H](C)CN1 Amb30588704 [0,2,0,0,0,0|1,0,0]=3 5203 B11R1.15 CCOC(=O)[C@@H]1C[C@@H](F)CN1 Amb23439395 [0,2,0,0,0,0|1,0,0]=3 5204 B11R1.15 CCOC(=O)[C@@H]1C[C@@H](O)CN1 Amb10601386 [0,2,0,0,0,0|0,0,0]=2 5205 B11R1.15 CCOC(=O)[C@@H]1C[C@@H](O)CN1 Amb22748330 [0,2,0,0,0,0|0,0,0]=2 5206 B11R1.15 CCOC(=O)[C@@H]1C[C@H](C)CN1 Amb27669000 [0,2,0,0,0,0|1,0,0]=3 5207 B11R1.15 CCOC(=O)[C@@H]1C[C@H](F)CN1 Amb27633511 [0,2,0,0,0,0|1,0,0]=3 5208 B11R1.15 CCOC(=O)[C@@H]1C[C@H](F)CN1 Amb33483273 [0,2,0,0,0,0|1,0,0]=3 5209 B11R1.15 CCOC(=O)[C@@H]1C[C@H](O)CN1 Amb22747710 [0,2,0,0,0,0|0,0,0]=2 5210 B11R1.15 CCOC(=O)[C@H]1CC(O)CN1 Amb27644823 [0,2,0,0,0,0|0,0,0]=2 5211 B11R1.15 CCOC(=O)[C@H]1C[C@@H](F)CN1 Amb33803458 [0,2,0,0,0,0|1,0,0]=3 5212 B11R1.15 CCOC(=O)[C@H]1C[C@H](C)CN1 Amb26958223 [0,2,0,0,0,0|1,0,0]=3 5213 B11R1.15 CCOC(=O)[C@H]1C[C@H](F)CN1 Amb25222540 [0,2,0,0,0,0|1,0,0]=3 5214 B11R1.15 CCOC(=O)[C@H]1C[C@H](O)CN1 Amb27223936 [0,2,0,0,0,0|0,0,0]=2 5215 B11R1.15 COCC(=O)C1CCC(C)C1 Amb27464888 [0,2,0,0,0,0|2,0,0]=4 5216 B11R1.15 COCC(=O)C1CCC(N)C1 Amb25188782 [0,2,0,0,0,0|2,0,0]=4 5217 B11R1.15 COCC(=O)N1CCC(O)C1 Amb18177627 [0,2,0,0,0,0|2,0,0]=4 5218 B11R1.15 COCC(=O)N1C[C@H](O)CO1 Amb27953437 [0,2,0,0,0,0|2,0,0]=4 5219 B11R1.15 CONC(=O)C1CCC(O)C1 Amb27598308 [0,2,0,0,0,0|1,0,0]=3 5220 B11R1.15 CONC(=O)[C@H]1C[C@@H](O)CN1 Amb27836666 [0,2,0,0,0,0|0,0,0]=2 5221 B11R1.15 C[C@@H]1CC[C@@H](C(=O)CCO)C1 Amb27256496 [0,2,0,0,0,0|2,0,0]=4 5222 B11R1.15 O=C(OCCl)N1CCC(O)C1 Amb29880256 [0,2,0,0,0,0|2,0,0]=4 5223 B11R1.15 O=C(OCCl)N1CC[C@@H](O)C1 Amb29880253 [0,2,0,0,0,0|2,0,0]=4 5224 B11R1.15 O=C(OCCl)N1CC[C@H](O)C1 Amb29880254 [0,2,0,0,0,0|2,0,0]=4 5225 B11R1.44 C#CC(=O)C1CC(OC)CN1 Amb24393037 [0,2,0,0,0,0|1,0,0]=3 5226 B11R1.44 C#CC(O)C1CC(OC)CN1 Amb35620601 [0,2,0,0,0,0|1,0,1]=4 5227 B11R1.44 C=CC(=O)C1CC(OC)CN1 Amb26047014 [0,2,0,0,0,0|1,0,0]=3 5228 B11R1.44 C=CC(O)C1CC(OC)CN1 Amb29875422 [0,2,0,0,0,0|1,0,1]=4 5229 B11R1.44 CCC(=O)C1CC(OC)CN1 Amb27655256 [0,2,0,0,0,0|1,0,0]=3 5230 B11R1.44 CCC(O)C1CC(OC)CN1 Amb35740748 [0,2,0,0,0,0|1,0,1]=4 5231 B11R1.44 CCC1CNC(C(=O)OC)C1 Amb33804560 [0,2,0,0,0,0|1,0,0]=3 5232 B11R1.44 CNC(=O)[C@@H]1C[C@@H](OC)CN1 Amb28145083 [0,2,0,0,0,0|1,0,0]=3 5233 B11R1.44 CNC(=O)[C@@H]1C[C@@H](OC)CN1 Amb28322647 [0,2,0,0,0,0|1,0,0]=3 5234 B11R1.44 CN[C@H]1CN[C@@H](C(=O)OC)C1 Amb27442417 [0,2,0,0,0,0|1,0,0]=3 5235 B11R1.44 CN[C@H]1CN[C@H](C(=O)OC)C1 Amb28137727 [0,2,0,0,0,0|1,0,0]=3 5236 B11R1.44 COC(=O)C1CC(OC)CN1 Amb19408202 [0,2,0,0,0,0|0,0,0]=2 5237 B11R1.44 COC(=O)C1CC(OC)CN1 Amb7772450 [0,2,0,0,0,0|0,0,0]=2 5238 B11R1.44 COC(=O)C1CCC(C=O)C1 Amb18644789 [0,2,0,0,0,0|1,0,1]=4 5239 B11R1.44 COC(=O)C1CCC(CN)C1 Amb26987439 [0,2,0,0,0,0|2,0,0]=4 5240 B11R1.44 COC(=O)C1CCC(CN)C1 Amb34157870 [0,2,0,0,0,0|2,0,0]=4 5241 B11R1.44 COC(=O)C1CCC(CO)C1 Amb26448823 [0,2,0,0,0,0|1,0,0]=3 5242 B11R1.44 COC(=O)C1CCC(CO)O1 Amb13951705 [0,2,0,0,0,0|2,0,0]=4 5243 B11R1.44 COC(=O)C1CNC(CO)C1 Amb27237553 [0,2,0,0,0,0|2,0,0]=4 5244 B11R1.44 COC(=O)N1CCC(CO)C1 Amb18182409 [0,2,0,0,0,0|2,0,0]=4 5245 B11R1.44 COC(=O)N1CC[C@H](CO)C1 Amb27658731 [0,2,0,0,0,0|2,0,0]=4 5246 B11R1.44 COC(=O)[C@@H]1C=C[C@H](CO)C1 Amb24515131 [0,2,0,0,0,0|1,0,1]=4 5247 B11R1.44 COC(=O)[C@@H]1CC(SC)CN1 Amb28293048 [0,2,0,0,0,0|0,1,0]=3 5248 B11R1.44 COC(=O)[C@@H]1CC[C@@H](C=O)C1 Amb25335264 [0,2,0,0,0,0|1,0,1]=4 5249 B11R1.44 COC(=O)[C@@H]1CC[C@H](C=O)C1 Amb27799242 [0,2,0,0,0,0|1,0,1]=4 5250 B11R1.44 COC(=O)[C@@H]1CC[C@H](CO)C1 Amb6299837 [0,2,0,0,0,0|1,0,0]=3 5251 B11R1.44 COC(=O)[C@@H]1CC[C@H](CO)O1 Amb25168854 [0,2,0,0,0,0|2,0,0]=4 5252 B11R1.44 COC(=O)[C@@H]1C[C@@H](C#N)CN1 Amb27645149 [0,2,0,0,0,0|1,0,0]=3 5253 B11R1.44 COC(=O)[C@@H]1C[C@@H](OC)CN1 Amb24596399 [0,2,0,0,0,0|0,0,0]=2 5254 B11R1.44 COC(=O)[C@@H]1C[C@@H](OC)CN1 Amb30526642 [0,2,0,0,0,0|0,0,0]=2 5255 B11R1.44 COC(=O)[C@@H]1C[C@@H](SC)CN1 Amb26531269 [0,2,0,0,0,0|0,1,0]=3 5256 B11R1.44 COC(=O)[C@@H]1C[C@@H](SC)CN1 Amb33484276 [0,2,0,0,0,0|0,1,0]=3 5257 B11R1.44 COC(=O)[C@@H]1C[C@H](C#N)CN1 Amb27259207 [0,2,0,0,0,0|1,0,0]=3 5258 B11R1.44 COC(=O)[C@@H]1C[C@H](C#N)CN1 Amb32412006 [0,2,0,0,0,0|1,0,0]=3 5259 B11R1.44 COC(=O)[C@@H]1C[C@H](OC)CN1 Amb25179328 [0,2,0,0,0,0|0,0,0]=2 5260 B11R1.44 COC(=O)[C@H]1C=C[C@H](CO)C1 Amb26061992 [0,2,0,0,0,0|1,0,1]=4 5261 B11R1.44 COC(=O)[C@H]1CC[C@@H](C=O)C1 Amb32757572 [0,2,0,0,0,0|1,0,1]=4 5262 B11R1.44 COC(=O)[C@H]1CC[C@@H](CO)C1 Amb26970565 [0,2,0,0,0,0|1,0,0]=3 5263 B11R1.44 COC(=O)[C@H]1CC[C@@H](CO)O1 Amb27775833 [0,2,0,0,0,0|2,0,0]=4 5264 B11R1.44 COC(=O)[C@H]1C[C@@H](OC)CN1 Amb24656111 [0,2,0,0,0,0|0,0,0]=2 5265 B11R1.44 [C-]#[N+][C@H]1CC[C@@H](C(=O)OC)C1 Amb33747516 [0,2,0,0,0,0|2,0,0]=4 5266 B11R1.225 CC1CC(O)CN1C(=O)CO Amb28207063 [0,2,0,0,0,0|2,0,0]=4 5267 B11R1.225 CN1CC(F)CC1C(=O)NN Amb27811292 [0,2,0,0,0,0|2,0,0]=4 5268 B11R1.225 CN1C[C@@H](F)C[C@@H]1C(=O)NN Amb27628211 [0,2,0,0,0,0|2,0,0]=4 5269 B11R1.225 CN1C[C@@H](F)C[C@H]1C(=O)NN Amb28056280 [0,2,0,0,0,0|2,0,0]=4 5270 B11R1.225 CN1C[C@H](F)C[C@H]1C(=O)NN Amb28056401 [0,2,0,0,0,0|2,0,0]=4 5271 B11R1.225 CNC(=O)C1CC(S)CN1C Amb27201406 [0,2,0,0,0,0|1,1,0]=4 5272 B11R1.225 CNC(=O)[C@@H]1C[C@@H](F)CN1C Amb27945054 [0,2,0,0,0,0|2,0,0]=4 5273 B11R1.225 CNC(=O)[C@@H]1C[C@H](S)CN1C Amb28457519 [0,2,0,0,0,0|1,1,0]=4 5274 B11R1.225 COC(=O)C1CC(=O)CN1C Amb27199079 [0,2,0,0,0,0|0,0,2]=4 5275 B11R1.225 COC(=O)C1CC(C)CC1=O Amb2697200 [0,2,0,0,0,0|2,0,0]=4 5276 B11R1.225 COC(=O)C1CC(N)CN1C Amb24484570 [0,2,0,0,0,0|1,0,0]=3 5277 B11R1.225 COC(=O)C1CC(O)CC1N Amb26459825 [0,2,0,0,0,0|1,0,0]=3 5278 B11R1.225 COC(=O)C1CC(O)CC1N Amb32683452 [0,2,0,0,0,0|1,0,0]=3 5279 B11R1.225 COC(=O)C1CC(O)CN1C Amb24406309 [0,2,0,0,0,0|0,0,0]=2 5280 B11R1.225 COC(=O)C1CC(O)CN1C Amb30584654 [0,2,0,0,0,0|0,0,0]=2 5281 B11R1.225 COC(=O)[C@@H]1CC(=O)CN1C Amb25893450 [0,2,0,0,0,0|0,0,2]=4 5282 B11R1.225 COC(=O)[C@@H]1CC(F)CN1C Amb25917903 [0,2,0,0,0,0|1,0,0]=3 5283 B11R1.225 COC(=O)[C@@H]1CC(O)CN1C Amb24484989 [0,2,0,0,0,0|0,0,0]=2 5284 B11R1.225 COC(=O)[C@@H]1C[C@@H](N)CN1C Amb15701328 [0,2,0,0,0,0|1,0,0]=3 5285 B11R1.225 COC(=O)[C@@H]1C[C@@H](N)CN1C Amb22587280 [0,2,0,0,0,0|1,0,0]=3 5286 B11R1.225 COC(=O)[C@@H]1C[C@@H](O)CN1C Amb24057512 [0,2,0,0,0,0|0,0,0]=2 5287 B11R1.225 COC(=O)[C@@H]1C[C@H](F)CN1C Amb27213411 [0,2,0,0,0,0|1,0,0]=3 5288 B11R1.225 COC(=O)[C@@H]1C[C@H](N)CN1C Amb15701327 [0,2,0,0,0,0|1,0,0]=3 5289 B11R1.225 COC(=O)[C@@H]1C[C@H](N)CN1C Amb22587279 [0,2,0,0,0,0|1,0,0]=3 5290 B11R1.225 COC(=O)[C@@H]1C[C@H](O)C[C@@H]1N Amb32683524 [0,2,0,0,0,0|1,0,0]=3 5291 B11R1.225 COC(=O)[C@@H]1C[C@H](O)C[C@@H]1N Amb32683525 [0,2,0,0,0,0|1,0,0]=3 5292 B11R1.225 COC(=O)[C@@H]1C[C@H](O)C[C@H]1N Amb28320505 [0,2,0,0,0,0|1,0,0]=3 5293 B11R1.225 COC(=O)[C@H]1CC(O)CN1C Amb25230168 [0,2,0,0,0,0|0,0,0]=2 5294 B11R1.225 COC(=O)[C@H]1C[C@@H](O)CN1C Amb34916055 [0,2,0,0,0,0|0,0,0]=2 5295 B11R1.226 COC(=O)C1CC(C)C(O)C1 Amb27206047 [0,2,0,0,0,0|1,0,0]=3 5296 B11R1.226 COC(=O)C1CC(N)C(O)C1 Amb25228978 [0,2,0,0,0,0|1,0,0]=3 5297 B11R1.226 COC(=O)C1CC(O)C(=O)O1 Amb27605255 [0,2,0,0,0,0|1,0,1]=4 5298 B11R1.226 COC(=O)C1CC(O)C(F)C1 Amb22898817 [0,2,0,0,0,0|1,0,0]=3 5299 B11R1.226 COC(=O)C1CC(O)C(O)C1 Amb25686051 [0,2,0,0,0,0|1,0,0]=3 5300 B11R1.226 COC(=O)C1C[C@@H](O)[C@H](Br)C1 Amb24112913 [0,2,0,0,0,0|1,0,0]=3 5301 B11R1.226 COC(=O)C1C[C@H](N)[C@@H](O)C1 Amb27457656 [0,2,0,0,0,0|1,0,0]=3 5302 B11R1.226 COC(=O)C1C[C@H](O)[C@H](O)C1 Amb25357463 [0,2,0,0,0,0|1,0,0]=3 5303 B11R1.226 COC(=O)N1CC(O)C(O)C1 Amb28062031 [0,2,0,0,0,0|2,0,0]=4 5304 B11R1.226 COC(=O)[C@@H]1CC(O)C(=O)N1 Amb24392740 [0,2,0,0,0,0|0,0,1]=3 5305 B11R1.226 COC(=O)[C@@H]1C[C@@H](O)C(=O)N1 Amb27841236 [0,2,0,0,0,0|0,0,1]=3 5306 B11R1.226 COC(=O)[C@@H]1C[C@@H](O)[C@H](C)O1 Amb28194278 [0,2,0,0,0,0|1,0,0]=3 5307 B11R1.226 COC(=O)[C@@H]1C[C@H](N)[C@@H](O)C1 Amb27419877 [0,2,0,0,0,0|1,0,0]=3 5308 B11R1.226 COC(=O)[C@@H]1C[C@H](O)C(=O)N1 Amb24555635 [0,2,0,0,0,0|0,0,1]=3 5309 B11R1.226 COC(=O)[C@@H]1C[C@H](O)C(=O)O1 Amb26922301 [0,2,0,0,0,0|1,0,1]=4 5310 B11R1.226 COC(=O)[C@@H]1C[C@H](O)[C@@H](F)C1 Amb28186085 [0,2,0,0,0,0|1,0,0]=3 5311 B11R1.226 COC(=O)[C@@H]1C[C@H](O)[C@H](O)C1 Amb28065366 [0,2,0,0,0,0|1,0,0]=3 5312 B11R1.226 COC(=O)[C@H]1C=C(C)[C@H](O)C1 Amb27457637 [0,2,0,0,0,0|1,0,1]=4 5313 B11R1.226 COC(=O)[C@H]1C[C@@H](N)C(=O)N1 Amb28051811 [0,2,0,0,0,0|1,0,1]=4 5314 B11R1.226 COC(=O)[C@H]1C[C@@H](N)[C@H](O)C1 Amb25263789 [0,2,0,0,0,0|1,0,0]=3 5315 B11R1.226 COC(=O)[C@H]1C[C@@H](O)C(=O)O1 Amb28249106 [0,2,0,0,0,0|1,0,1]=4 5316 B11R1.226 COC(=O)[C@H]1C[C@@H](O)[C@H](C)O1 Amb28194255 [0,2,0,0,0,0|1,0,0]=3 5317 B11R1.226 COC(=O)[C@H]1C[C@H](N)C(=O)N1 Amb27202006 [0,2,0,0,0,0|1,0,1]=4 5318 B11R1.226 COC(=O)[C@H]1C[C@H](O)[C@@H](F)C1 Amb24630860 [0,2,0,0,0,0|1,0,0]=3 5319 B11R1.226 COC(=O)[C@H]1C[C@H](O)[C@H](O)C1 Amb28065833 [0,2,0,0,0,0|1,0,0]=3 5320 B11R1.865 CC1CN[C@H](C(=O)NN)C1C Amb28071475 [0,2,0,0,0,0|2,0,0]=4 5321 B11R1.865 CC[C@H](O)[C@@H]1NC[C@H](O)[C@H]1O Amb27965020 [0,2,0,0,0,0|1,0,1]=4 5322 B11R1.865 CNC(=O)C1NCC(O)C1O Amb27602286 [0,2,0,0,0,0|1,0,0]=3 5323 B11R1.865 COC(=O)C1=NCC(O)C1C Amb27665305 [0,2,0,0,0,0|0,0,2]=4 5324 B11R1.865 COC(=O)C1CCC(N)C1C Amb28060963 [0,2,0,0,0,0|2,0,0]=4 5325 B11R1.865 COC(=O)C1CCC(O)C1C Amb26014485 [0,2,0,0,0,0|1,0,0]=3 5326 B11R1.865 COC(=O)C1CCC(O)C1O Amb23456142 [0,2,0,0,0,0|1,0,0]=3 5327 B11R1.865 COC(=O)C1NCC(Cl)C1Cl Amb28066102 [0,2,0,0,0,0|1,0,0]=3 5328 B11R1.865 COC(=O)N1CC[C@@H](O)[C@@H]1C Amb27402112 [0,2,0,0,0,0|2,0,0]=4 5329 B11R1.865 COC(=O)N1CC[C@H](O)[C@H]1C Amb26587227 [0,2,0,0,0,0|2,0,0]=4 5330 B11R1.865 COC(=O)[C@@H]1CC[C@@H](C)[C@@H]1N Amb28132892 [0,2,0,0,0,0|2,0,0]=4 5331 B11R1.865 COC(=O)[C@@H]1NC[C@H](O)[C@H]1C Amb27657855 [0,2,0,0,0,0|0,0,0]=2 5332 B11R1.865 COC(=O)[C@H]1CCC(O)[C@@H]1C Amb27970896 [0,2,0,0,0,0|1,0,0]=3 5333 B11R1.865 COC(=O)[C@H]1CC[C@@H](Cl)[C@@H]1O Amb27192139 [0,2,0,0,0,0|2,0,0]=4 5334 B11R1.865 COC(=O)[C@H]1NC[C@@H](Cl)[C@H]1Cl Amb27206092 [0,2,0,0,0,0|1,0,0]=3 5335 B11R1.865 COC(=O)[C@H]1NC[C@@H](O)[C@@H]1O Amb27966069 [0,2,0,0,0,0|0,0,0]=2 5336 B11R1.865 NCC(O)C1NCC(O)C1O Amb27768407 [0,2,0,0,0,0|1,0,1]=4 5337 B11R1.865 O=C[C@@H](O)[C@H]1SC[C@@H](O)[C@H]1O Amb27841292 [0,2,0,0,0,0|1,0,1]=4 5338 B11R1.865 O=C[C@H](O)[C@@H]1OC[C@@H](O)[C@H]1O Amb28247157 [0,2,0,0,0,0|1,0,1]=4 5339 B11R1.865 O=C[C@H](O)[C@H]1SC[C@@H](O)[C@H]1O Amb27861178 [0,2,0,0,0,0|1,0,1]=4 5340 B11R1.865 OC1CNC(C(O)CF)C1O Amb27176363 [0,2,0,0,0,0|1,0,1]=4 5341 B11R1.865 OC[C@@H](O)[C@@H]1NC[C@@H](O)[C@H]1O Amb28145146 [0,2,0,0,0,0|0,0,2]=4 5342 B11R1.865 OC[C@@H](O)[C@H]1NC[C@@H](O)[C@@H]1O Amb27420406 [0,2,0,0,0,0|0,0,2]=4 5343 B11R1.865 OC[C@@H](O)[C@H]1NC[C@@H](O)[C@H]1O Amb6297501 [0,2,0,0,0,0|0,0,2]=4 5344 B11R1.865 OC[C@H](O)C1NC[C@@H](O)[C@@H]1O Amb27221091 [0,2,0,0,0,0|0,0,2]=4 5345 B11R1.865 OC[C@H](O)[C@H]1NC[C@@H](O)[C@@H]1O Amb27647500 [0,2,0,0,0,0|0,0,2]=4 5346 B11R1.866 C#CC(=O)C1CC(F)(F)CN1 Amb33307738 [0,2,0,0,0,0|2,0,0]=4 5347 B11R1.866 C#CC(=O)[C@@H]1CC(F)(F)CN1 Amb33307721 [0,2,0,0,0,0|2,0,0]=4 5348 B11R1.866 C#CC(=O)[C@H]1CC(F)(F)CN1 Amb33307726 [0,2,0,0,0,0|2,0,0]=4 5349 B11R1.866 C=CC(=O)C1CC(F)(F)CN1 Amb33307739 [0,2,0,0,0,0|2,0,0]=4 5350 B11R1.866 C=CC(=O)[C@@H]1CC(F)(F)CN1 Amb33307722 [0,2,0,0,0,0|2,0,0]=4 5351 B11R1.866 C=CC(=O)[C@H]1CC(F)(F)CN1 Amb33307727 [0,2,0,0,0,0|2,0,0]=4 5352 B11R1.866 CC1(C)CCC(C(=O)NO)C1 Amb27833522 [0,2,0,0,0,0|2,0,0]=4 5353 B11R1.866 CC1(O)CCN(C(=O)CO)C1 Amb28187916 [0,2,0,0,0,0|2,0,0]=4 5354 B11R1.866 CCC(=O)C1CC(F)(F)CN1 Amb33307740 [0,2,0,0,0,0|2,0,0]=4 5355 B11R1.866 CCC(=O)[C@@H]1CC(F)(F)CN1 Amb33307723 [0,2,0,0,0,0|2,0,0]=4 5356 B11R1.866 CCC(=O)[C@H]1CC(F)(F)CN1 Amb33307728 [0,2,0,0,0,0|2,0,0]=4 5357 B11R1.866 COC(=O)C1CC(C)(C)CN1 Amb24540936 [0,2,0,0,0,0|1,0,0]=3 5358 B11R1.866 COC(=O)C1CC(C)(C)CN1 Amb33483551 [0,2,0,0,0,0|1,0,0]=3 5359 B11R1.866 COC(=O)C1CC(F)(F)CN1 Amb23585430 [0,2,0,0,0,0|1,0,0]=3 5360 B11R1.866 COC(=O)C1CC(F)(F)CN1 Amb30647402 [0,2,0,0,0,0|1,0,0]=3 5361 B11R1.866 COC(=O)C1CCC(C)(C)C1 Amb27768099 [0,2,0,0,0,0|2,0,0]=4 5362 B11R1.866 COC(=O)C1CCC(F)(F)C1 Amb22899319 [0,2,0,0,0,0|2,0,0]=4 5363 B11R1.866 COC(=O)C1CS(=N)(=O)CN1 Amb32753500 [0,2,0,0,0,0|1,0,1]=4 5364 B11R1.866 COC(=O)C1C[Si](C)(C)CN1 Amb29837964 [0,2,0,0,0,0|1,1,0]=4 5365 B11R1.866 COC(=O)[C@@H]1CC(C)(C)CN1 Amb26587371 [0,2,0,0,0,0|1,0,0]=3 5366 B11R1.866 COC(=O)[C@@H]1CC(C)(C)CN1 Amb33623684 [0,2,0,0,0,0|1,0,0]=3 5367 B11R1.866 COC(=O)[C@@H]1CC(F)(F)CN1 Amb22406226 [0,2,0,0,0,0|1,0,0]=3 5368 B11R1.866 COC(=O)[C@@H]1CC(F)(F)CN1 Amb23438988 [0,2,0,0,0,0|1,0,0]=3 5369 B11R1.866 COC(=O)[C@@H]1CC(F)(F)CN1 Amb27606377 [0,2,0,0,0,0|1,0,0]=3 5370 B11R1.866 COC(=O)[C@@H]1CCC(F)(F)C1 Amb25188886 [0,2,0,0,0,0|2,0,0]=4 5371 B11R1.866 COC(=O)[C@@H]1CS(=N)(=O)CN1 Amb32681938 [0,2,0,0,0,0|1,0,1]=4 5372 B11R1.866 COC(=O)[C@H]1CC(C)(C)CN1 Amb33803235 [0,2,0,0,0,0|1,0,0]=3 5373 B11R1.866 COC(=O)[C@H]1CC(F)(F)CN1 Amb25049283 [0,2,0,0,0,0|1,0,0]=3 5374 B11R1.866 COC(=O)[C@H]1CC(F)(F)CN1 Amb32409394 [0,2,0,0,0,0|1,0,0]=3 5375 B11R1.866 COC(=O)[C@H]1CCC(F)(F)C1 Amb24413944 [0,2,0,0,0,0|2,0,0]=4 5376 B11R1.866 COC(=O)[C@H]1C[Si](C)(C)CN1 Amb28246425 [0,2,0,0,0,0|1,1,0]=4 5377 B11R1.885 COC(=O)C1(C)C=CC(O)C1 Amb27607118 [0,2,0,0,0,0|1,0,1]=4 5378 B11R1.885 COC(=O)C1(C)CC(Br)CN1 Amb32659668 [0,2,0,0,0,0|1,0,0]=3 5379 B11R1.885 COC(=O)C1(C)CC(Cl)CN1 Amb32659674 [0,2,0,0,0,0|1,0,0]=3 5380 B11R1.885 COC(=O)C1(C)CC(F)CN1 Amb32667160 [0,2,0,0,0,0|1,0,0]=3 5381 B11R1.885 COC(=O)C1(C)CCC(N)C1 Amb28323142 [0,2,0,0,0,0|2,0,0]=4 5382 B11R1.885 COC(=O)C1(C)COC(O)C1 Amb27751928 [0,2,0,0,0,0|2,0,0]=4 5383 B11R1.885 COC(=O)C1(F)CCC(N)C1 Amb33732677 [0,2,0,0,0,0|2,0,0]=4 5384 B11R1.885 COC(=O)C1(N)CCC(C)C1 Amb25061739 [0,2,0,0,0,0|2,0,0]=4 5385 B11R1.885 COC(=O)C1(N)CCC(C)C1 Amb31156080 [0,2,0,0,0,0|2,0,0]=4 5386 B11R1.885 COC(=O)C1(N)CCC(O)C1 Amb29867577 [0,2,0,0,0,0|1,0,0]=3 5387 B11R1.885 COC(=O)C1(O)C=CC(O)C1 Amb27945783 [0,2,0,0,0,0|1,0,1]=4 5388 B11R1.885 COC(=O)[C@@]1(C)CC[C@@H](Cl)C1 Amb27489065 [0,2,0,0,0,0|2,0,0]=4 5389 B11R1.885 COC(=O)[C@@]1(C)CC[C@H](Cl)C1 Amb27640595 [0,2,0,0,0,0|2,0,0]=4 5390 B11R1.885 COC(=O)[C@]1(O)CC[C@H](N)C1 Amb27234758 [0,2,0,0,0,0|2,0,0]=4 5391 B11R1.48 CC(=O)C1C[C@@H](C)[C@H](CO)C1 Amb27432691 [0,2,0,0,0,0|2,0,0]=4 5392 B11R1.48 CC(=O)C1C[C@H](C)[C@@H](CO)C1 Amb27471957 [0,2,0,0,0,0|2,0,0]=4 5393 B11R1.48 CC1CC(C(=O)O)C\C1=N/O Amb27407107 [0,2,0,0,0,0|1,0,1]=4 5394 B11R1.48 CCC1NC(C(=O)O)CC1C Amb18200003 [0,2,0,0,0,0|1,0,0]=3 5395 B11R1.48 C[C@@H]1C[C@@H](C(=O)O)N[C@@H]1CO Amb25918100 [0,2,0,0,0,0|1,0,0]=3 5396 B11R1.48 NC(=O)C1CC(O)C(CO)C1 Amb28325884 [0,2,0,0,0,0|2,0,0]=4 5397 B11R1.48 NC(=O)[C@@H]1C[C@H](O)[C@H](CO)C1 Amb27660977 [0,2,0,0,0,0|2,0,0]=4 5398 B11R1.48 NCC1OC(C(=O)O)CC1O Amb27596958 [0,2,0,0,0,0|1,0,0]=3 5399 B11R1.48 NC[C@H]1CC(C(=O)O)C[C@H]1O Amb27879994 [0,2,0,0,0,0|1,0,0]=3 5400 B11R1.48 NC[C@H]1O[C@@H](C(=O)O)C[C@@H]1O Amb10066959 [0,2,0,0,0,0|1,0,0]=3 5401 B11R1.48 O=C(O)C1CC(O)C(CO)O1 Amb27596869 [0,2,0,0,0,0|1,0,0]=3 5402 B11R1.48 O=C(O)[C@@H]1C[C@H](O)[C@@H](CO)N1 Amb27658923 [0,2,0,0,0,0|0,0,0]=2 5403 B11R1.48 O=C(O)[C@@H]1C[C@H](O)[C@H](CO)N1 Amb25273969 [0,2,0,0,0,0|0,0,0]=2 5404 B11R1.48 O=C(O)[C@@H]1C[C@H](O)[C@H](CO)O1 Amb28325693 [0,2,0,0,0,0|1,0,0]=3 5405 B11R1.48 O=C(O)[C@H]1C[C@@H](O)[C@H](CO)N1 Amb26456314 [0,2,0,0,0,0|0,0,0]=2 5406 B11R1.48 O=C(O)[C@H]1C[C@H](O)[C@@H](CO)N1 Amb28193760 [0,2,0,0,0,0|0,0,0]=2 5407 B11R1.48 O=C(O)[C@H]1C[C@H](O)[C@@H](CO)O1 Amb27216302 [0,2,0,0,0,0|1,0,0]=3 5408 B11R1.48 O=C1N[C@H](C(=O)O)C[C@@H]1CF Amb28320761 [0,2,0,0,0,0|1,0,1]=4 5409 B11R1.50 C=CC1C[C@H](N)[C@H](C(=O)O)C1 Amb28056172 [0,2,0,0,0,0|2,0,0]=4 5410 B11R1.50 CC[C@@H]1C[C@@H](C(=O)O)N(C)C1 Amb28429523 [0,2,0,0,0,0|1,0,0]=3 5411 B11R1.50 CC[C@@H]1C[C@H](C(=O)O)[C@H](N)C1 Amb28246143 [0,2,0,0,0,0|2,0,0]=4 5412 B11R1.50 CC[C@H]1C[C@@H](C(=O)O)N(C)C1 Amb27238027 [0,2,0,0,0,0|1,0,0]=3 5413 B11R1.50 CC[C@H]1C[C@H](C(=O)O)N(C)C1 Amb28052102 [0,2,0,0,0,0|1,0,0]=3 5414 B11R1.50 COC1CC(C(=O)O)N(C)C1 Amb26051729 [0,2,0,0,0,0|0,0,0]=2 5415 B11R1.50 COC1CC(C(=O)[O-])N(C)C1 Amb32666396 [0,2,0,0,0,0|0,0,1]=3 5416 B11R1.50 COC1CC(N)C(C(=O)O)O1 Amb27442999 [0,2,0,0,0,0|2,0,0]=4 5417 B11R1.50 COC1CC(O)C(C(=O)O)O1 Amb28195185 [0,2,0,0,0,0|2,0,0]=4 5418 B11R1.50 CO[C@@H]1C[C@@H](C(=O)O)N(C)C1 Amb24653984 [0,2,0,0,0,0|0,0,0]=2 5419 B11R1.50 CO[C@@H]1C[C@@H](C(=O)O)N(C)C1 Amb30633702 [0,2,0,0,0,0|0,0,0]=2 5420 B11R1.50 CO[C@@H]1C[C@@H](C(=O)O)N(C)C1 Amb33715735 [0,2,0,0,0,0|0,0,0]=2 5421 B11R1.50 CO[C@@H]1C[C@H](C(=O)O)N(C)C1 Amb30633736 [0,2,0,0,0,0|0,0,0]=2 5422 B11R1.50 CO[C@H]1C[C@@H](C(=O)O)N(C)C1 Amb25993055 [0,2,0,0,0,0|0,0,0]=2 5423 B11R1.50 CO[C@H]1C[C@@H](C(=O)O)N(C)C1 Amb33801207 [0,2,0,0,0,0|0,0,0]=2 5424 B11R1.50 CO[C@H]1C[C@@H](C(=O)[O-])N(C)C1 Amb32663059 [0,2,0,0,0,0|0,0,1]=3 5425 B11R1.50 CO[C@H]1C[C@H](C(=O)O)N(C)C1 Amb27440368 [0,2,0,0,0,0|0,0,0]=2 5426 B11R1.50 CO[C@H]1C[C@H](C(=O)O)N(C)C1 Amb33801206 [0,2,0,0,0,0|0,0,0]=2 5427 B11R1.50 NC(=O)C1CC(CO)CC1O Amb27876227 [0,2,0,0,0,0|2,0,0]=4 5428 B11R1.50 NC(=O)[C@@H]1C[C@H](CO)C[C@@H]1O Amb28318168 [0,2,0,0,0,0|2,0,0]=4 5429 B11R1.124 C#CCC1CNC(C(=O)O)C1 Amb26543319 [0,2,0,0,0,0|1,0,0]=3 5430 B11R1.124 C#CC[C@H]1CN[C@H](C(=O)O)C1 Amb26553780 [0,2,0,0,0,0|1,0,0]=3 5431 B11R1.124 C=CC[C@H]1CN[C@H](C(=O)O)C1 Amb26551150 [0,2,0,0,0,0|1,0,0]=3 5432 B11R1.124 CCCC1CN[C@H](C(=O)O)C1 Amb24487717 [0,2,0,0,0,0|1,0,0]=3 5433 B11R1.124 CCC[C@H]1CN[C@H](C(=O)O)C1 Amb26636529 [0,2,0,0,0,0|1,0,0]=3 5434 B11R1.124 CCOC1CC(C(=O)O)NO1 Amb27176586 [0,2,0,0,0,0|1,0,0]=3 5435 B11R1.124 CCOC1CNC(C(=O)O)C1 Amb25955377 [0,2,0,0,0,0|0,0,0]=2 5436 B11R1.124 CCOC1CNC(C(N)=O)C1 Amb28240201 [0,2,0,0,0,0|1,0,0]=3 5437 B11R1.124 CCO[C@@H]1C[C@H](C(=O)O)NO1 Amb27634891 [0,2,0,0,0,0|1,0,0]=3 5438 B11R1.124 CCO[C@H]1CN[C@@H](C(N)=O)C1 Amb28051964 [0,2,0,0,0,0|1,0,0]=3 5439 B11R1.124 CCO[C@H]1CN[C@H](C(=O)O)C1 Amb26060615 [0,2,0,0,0,0|0,0,0]=2 5440 B11R1.124 CCO[C@H]1CN[C@H](C(=O)O)C1 Amb35748112 [0,2,0,0,0,0|0,0,0]=2 5441 B11R1.124 COCC1CCC(C(=O)O)C1 Amb25780193 [0,2,0,0,0,0|1,0,0]=3 5442 B11R1.124 COCC1CCC(C(=O)O)N1 Amb24441382 [0,2,0,0,0,0|2,0,0]=4 5443 B11R1.124 COCC1CCC(C(=O)O)O1 Amb18988012 [0,2,0,0,0,0|2,0,0]=4 5444 B11R1.124 COC[C@@H]1CC[C@@H](C(=O)O)N1 Amb24547011 [0,2,0,0,0,0|2,0,0]=4 5445 B11R1.124 COC[C@@H]1CC[C@H](C(=O)O)C1 Amb27768044 [0,2,0,0,0,0|1,0,0]=3 5446 B11R1.124 COC[C@@H]1CC[C@H](C(=O)O)N1 Amb25919696 [0,2,0,0,0,0|2,0,0]=4 5447 B11R1.124 COC[C@H]1CC[C@@H](C(=O)O)C1 Amb27781461 [0,2,0,0,0,0|1,0,0]=3 5448 B11R1.124 COC[C@H]1CC[C@@H](C(=O)O)N1 Amb25369771 [0,2,0,0,0,0|2,0,0]=4 5449 B11R1.124 COC[C@H]1CC[C@@H](C(=O)O)O1 Amb27217029 [0,2,0,0,0,0|2,0,0]=4 5450 B11R1.124 CO\N=C1/CCC(C(=O)O)C1 Amb28207180 [0,2,0,0,0,0|1,0,1]=4 5451 B11R1.124 C\C=C/[C@@H]1CN[C@H](C(=O)O)C1 Amb27435419 [0,2,0,0,0,0|1,0,0]=3 5452 B11R1.124 C\C=C\C1CCC(C(=O)O)C1 Amb27878751 [0,2,0,0,0,0|2,0,0]=4 5453 B11R1.124 N#CC[C@@H]1CN[C@H](C(=O)O)C1 Amb28066566 [0,2,0,0,0,0|1,0,0]=3 5454 B11R1.124 N#CC[C@H]1CN[C@H](C(=O)O)C1 Amb25179025 [0,2,0,0,0,0|1,0,0]=3 5455 B11R1.124 N#CNC1CCC(C(=O)O)C1 Amb30031696 [0,2,0,0,0,0|2,0,0]=4 5456 B11R1.124 N#CN[C@H]1CC[C@@H](C(=O)O)C1 Amb35593386 [0,2,0,0,0,0|2,0,0]=4 5457 B11R1.124 NCCC1CNC(C(=O)O)C1 Amb27952384 [0,2,0,0,0,0|1,0,0]=3 5458 B11R1.124 NCC[C@H]1CN[C@H](C(=O)O)C1 Amb28385485 [0,2,0,0,0,0|1,0,0]=3 5459 B11R1.124 O=C(O)C1CCC(CNO)O1 Amb27478942 [0,2,0,0,0,0|2,0,0]=4 5460 B11R1.124 O=C=N[C@H]1CC[C@@H](C(=O)O)C1 Amb27419967 [0,2,0,0,0,0|1,0,1]=4 5461 B11R1.124 [N-]=[N+]=NC1CCC(C(=O)O)C1 Amb33744158 [0,2,0,0,0,0|2,0,0]=4 5462 B11R1.124 [N-]=[N+]=NC1CNC(C(=O)O)C1 Amb25054733 [0,2,0,0,0,0|1,0,0]=3 5463 B11R1.124 [N-]=[N+]=NC1CNC(C(=O)O)C1 Amb33330386 [0,2,0,0,0,0|1,0,0]=3 5464 B11R1.124 [N-]=[N+]=N[C@@H]1CN[C@@H](C(=O)O)C1 Amb32406521 [0,2,0,0,0,0|1,0,0]=3 5465 B11R1.124 [N-]=[N+]=N[C@@H]1CN[C@H](C(=O)O)C1 Amb28285548 [0,2,0,0,0,0|1,0,0]=3 5466 B11R1.124 [N-]=[N+]=N[C@@H]1CN[C@H](C(=O)O)C1 Amb28989741 [0,2,0,0,0,0|1,0,0]=3 5467 B11R1.124 [N-]=[N+]=N[C@@H]1CN[C@H](C(=O)O)C1 Amb33330981 [0,2,0,0,0,0|1,0,0]=3 5468 B11R1.124 [N-]=[N+]=N[C@@H]1CN[C@H](C(N)=O)C1 Amb27635495 [0,2,0,0,0,0|2,0,0]=4 5469 B11R1.124 [N-]=[N+]=N[C@H]1CN[C@H](C(=O)O)C1 Amb26601741 [0,2,0,0,0,0|1,0,0]=3 5470 B11R1.175 C=C(C)C1CN[C@H](C(=O)O)C1 Amb26474274 [0,2,0,0,0,0|1,0,0]=3 5471 B11R1.175 C=C(C)[C@@H]1CN[C@H](C(=O)O)C1 Amb26552795 [0,2,0,0,0,0|1,0,0]=3 5472 B11R1.175 C=C(C)[C@H]1CN[C@@H](C(=O)O)C1 Amb27446209 [0,2,0,0,0,0|1,0,0]=3 5473 B11R1.175 C=C(C)[C@H]1CN[C@H](C(=O)O)C1 Amb26527939 [0,2,0,0,0,0|1,0,0]=3 5474 B11R1.175 CC(=O)C1CCC(C(=O)O)C1 Amb24373216 [0,2,0,0,0,0|1,0,1]=4 5475 B11R1.175 CC(=O)[C@@H]1CC[C@H](C(=O)O)C1 Amb28052085 [0,2,0,0,0,0|1,0,1]=4 5476 B11R1.175 CC(=O)[C@@H]1C[C@@H](C(=O)O)CO1 Amb27424004 [0,2,0,0,0,0|2,0,0]=4 5477 B11R1.175 CC(=O)[C@H]1CC[C@H](C(=O)O)C1 Amb28052084 [0,2,0,0,0,0|1,0,1]=4 5478 B11R1.175 CC(=O)[C@H]1C[C@@H](C(=O)O)CO1 Amb27221215 [0,2,0,0,0,0|2,0,0]=4 5479 B11R1.175 CC(C)C1CCC(C(=O)O)C1 Amb27791822 [0,2,0,0,0,0|2,0,0]=4 5480 B11R1.175 CN(C)C1CNC(C(N)=O)C1 Amb28140142 [0,2,0,0,0,0|2,0,0]=4 5481 B11R1.175 CN(C)[C@@H]1CC[C@H](C(=O)O)C1 Amb27822798 [0,2,0,0,0,0|2,0,0]=4 5482 B11R1.175 CN(C)[C@@H]1CN[C@@H](C(=O)O)C1 Amb28286387 [0,2,0,0,0,0|1,0,0]=3 5483 B11R1.175 CN(C)[C@@H]1CN[C@H](C(=O)O)C1 Amb22587285 [0,2,0,0,0,0|1,0,0]=3 5484 B11R1.175 CN(C)[C@@H]1CN[C@H](C(=O)O)C1 Amb34915545 [0,2,0,0,0,0|1,0,0]=3 5485 B11R1.175 CN(C)[C@H]1CN[C@H](C(=O)O)C1 Amb15701330 [0,2,0,0,0,0|1,0,0]=3 5486 B11R1.175 CN(C)[C@H]1CN[C@H](C(=O)O)C1 Amb22587286 [0,2,0,0,0,0|1,0,0]=3 5487 B11R1.175 CN(C)[C@H]1CN[C@H](C(N)=O)C1 Amb27202528 [0,2,0,0,0,0|2,0,0]=4 5488 B11R1.175 NC(=O)C1CCC(C(=O)O)C1 Amb18126050 [0,2,0,0,0,0|1,0,1]=4 5489 B11R1.175 NC(=O)[C@@H]1CC[C@H](C(=O)O)C1 Amb25983681 [0,2,0,0,0,0|1,0,1]=4 5490 B11R1.175 O=C(O)C1=NNC(C(=O)O)C1 Amb28385649 [0,2,0,0,0,0|1,0,1]=4 5491 B11R1.175 O=C(O)C1C=CC(C(=O)O)C1 Amb27192014 [0,2,0,0,0,0|1,0,1]=4 5492 B11R1.175 O=C(O)C1CCC(C(=O)Cl)C1 Amb28074649 [0,2,0,0,0,0|1,0,1]=4 5493 B11R1.175 O=C(O)C1CCC(C(=O)O)C1 Amb2221143 [0,2,0,0,0,0|1,0,0]=3 5494 B11R1.175 O=C(O)C1CCC(C(=O)O)O1 Amb18126226 [0,2,0,0,0,0|2,0,0]=4 5495 B11R1.175 O=C(O)C1CCC(C(=O)O)[Se]1 Amb2793472 [0,2,0,0,0,0|2,0,0]=4 5496 B11R1.175 O=C(O)C1CCC(C(F)F)C1 Amb27617334 [0,2,0,0,0,0|2,0,0]=4 5497 B11R1.175 O=C(O)C1CNC(C(=O)O)C1 Amb2695727 [0,2,0,0,0,0|0,0,0]=2 5498 B11R1.175 O=C(O)C1COC(C(=O)O)C1 Amb23454154 [0,2,0,0,0,0|1,0,0]=3 5499 B11R1.175 O=C(O)C1CSC(C(=O)O)C1 Amb18647960 [0,2,0,0,0,0|1,0,0]=3 5500 B11R1.175 O=C(O)C1CSC(C(=O)O)N1 Amb16203736 [0,2,0,0,0,0|2,0,0]=4 5501 B11R1.175 O=C(O)[C@@H]1C=C[C@H](C(=O)O)C1 Amb27491019 [0,2,0,0,0,0|1,0,1]=4 5502 B11R1.175 O=C(O)[C@@H]1CC[C@@H](C(=O)O)C1 Amb27455546 [0,2,0,0,0,0|1,0,0]=3 5503 B11R1.175 O=C(O)[C@@H]1CC[C@@H](C(=O)O)N1 Amb25174831 [0,2,0,0,0,0|2,0,0]=4 5504 B11R1.175 O=C(O)[C@@H]1CC[C@@H](C(=O)O)O1 Amb27966839 [0,2,0,0,0,0|2,0,0]=4 5505 B11R1.175 O=C(O)[C@@H]1CC[C@@H](C(=O)O)S1 Amb23560341 [0,2,0,0,0,0|2,0,0]=4 5506 B11R1.175 O=C(O)[C@@H]1CC[C@H](C(=O)O)O1 Amb17620468 [0,2,0,0,0,0|2,0,0]=4 5507 B11R1.175 O=C(O)[C@@H]1CC[C@H](C(=O)O)S1 Amb23560340 [0,2,0,0,0,0|2,0,0]=4 5508 B11R1.175 O=C(O)[C@@H]1CN[C@@H](C(=O)O)C1 Amb24559908 [0,2,0,0,0,0|0,0,0]=2 5509 B11R1.175 O=C(O)[C@@H]1CN[C@H](C(=O)O)C1 Amb22262950 [0,2,0,0,0,0|0,0,0]=2 5510 B11R1.175 O=C(O)[C@@H]1C[C@@H](C(=O)O)CN1 Amb19930523 [0,2,0,0,0,0|0,0,0]=2 5511 B11R1.175 O=C(O)[C@@H]1C[C@@H](C(=O)O)SS1 Amb27817898 [0,2,0,0,0,0|2,0,0]=4 5512 B11R1.175 O=C(O)[C@H]1CC[C@@H](C(=O)O)C1 Amb6299713 [0,2,0,0,0,0|1,0,0]=3 5513 B11R1.175 O=C(O)[C@H]1CC[C@H](C(=O)O)C1 Amb22744933 [0,2,0,0,0,0|1,0,0]=3 5514 B11R1.175 O=C(O)[C@H]1CC[C@H](C(=O)O)N1 Amb27195626 [0,2,0,0,0,0|2,0,0]=4 5515 B11R1.175 O=C(O)[C@H]1CN[C@@H](C(=O)O)C1 Amb26528102 [0,2,0,0,0,0|0,0,0]=2 5516 B11R1.175 O=C(O)[C@H]1C[C@H](C(=O)O)SS1 Amb27657788 [0,2,0,0,0,0|2,0,0]=4 5517 B11R1.417 C#CC1(O)CCC(C(=O)O)C1 Amb23454112 [0,2,0,0,0,0|1,0,0]=3 5518 B11R1.417 NC[C@@]1(F)CC[C@@H](C(=O)O)C1 Amb35788228 [0,2,0,0,0,0|2,0,0]=4 5519 B11R1.417 NC[C@@]1(F)CC[C@@H](C(=O)O)C1 Amb35788859 [0,2,0,0,0,0|2,0,0]=4 5520 B11R1.417 NC[C@@]1(F)CC[C@H](C(=O)O)C1 Amb35788594 [0,2,0,0,0,0|2,0,0]=4 5521 B11R1.417 NC[C@@]1(F)CC[C@H](C(=O)O)C1 Amb35788896 [0,2,0,0,0,0|2,0,0]=4 5522 B11R1.473 C=CC1CCC(C(=O)O)C1C Amb24355854 [0,2,0,0,0,0|2,0,0]=4 5523 B11R1.473 CCC1CCC(C(=O)O)C1N Amb27596871 [0,2,0,0,0,0|2,0,0]=4 5524 B11R1.473 CC[C@@H]1CC[C@@H](C(=O)O)[C@H]1N Amb28052145 [0,2,0,0,0,0|2,0,0]=4 5525 B11R1.473 COC1CCC(C(=O)O)C1N Amb27437876 [0,2,0,0,0,0|1,0,0]=3 5526 B11R1.473 CO[C@H]1CC[C@@H](C(=O)O)[C@@H]1N Amb27666963 [0,2,0,0,0,0|1,0,0]=3 5527 B11R1.1229 CC1(C(=O)O)CC\C(=N/O)C1 Amb27419969 [0,2,0,0,0,0|1,0,1]=4 5528 B11R1.1229 CCC1CCC(O)(C(=O)O)C1 Amb33528775 [0,2,0,0,0,0|2,0,0]=4 5529 B11R1.1229 COC1CNC(C)(C(=O)O)C1 Amb32667249 [0,2,0,0,0,0|0,0,0]=2 5530 B11R1.1229 COC1CNC(C)(C(=O)O)C1 Amb32668386 [0,2,0,0,0,0|0,0,0]=2 5531 B11R1.1229 COC1CNC(C)(C(C)=O)C1 Amb33307369 [0,2,0,0,0,0|1,0,0]=3 5532 B11R1.1229 CSC1CCC(N)(C(=O)O)C1 Amb26856563 [0,2,0,0,0,0|1,1,0]=4 5533 B11R1.1229 CS[C@@H]1CC[C@](N)(C(=O)O)C1 Amb28342618 [0,2,0,0,0,0|1,1,0]=4 5534 B11R1.1229 O=C(O)[C@]1(O)CO[C@H](CO)C1 Amb27983669 [0,2,0,0,0,0|2,0,0]=4 5535 B11R1.316 O=S(=O)(O)[C@@H]1NC[C@@H](O)[C@H]1O Amb27194326 [0,2,0,0,0,0|1,0,0]=3 5536 B11R1.316 O=S(=O)(O)[C@H]1NC[C@@H](O)[C@@H]1O Amb27658940 [0,2,0,0,0,0|1,0,0]=3 5537 B11R1.487 NC1(C(=O)O)CC(O)C(O)C1 Amb28435165 [0,2,0,0,0,0|1,0,0]=3 5538 B11R1.487 NC1(C(=O)O)C[C@H](O)[C@H](O)C1 Amb27831420 [0,2,0,0,0,0|1,0,0]=3 5539 B11R1.644 CC1(C)CC(C(=O)O)NC1=O Amb25893103 [0,2,0,0,0,0|1,0,1]=4 5540 B11R1.644 CC1(C)C[C@@H](C(=O)O)NC1=O Amb17613371 [0,2,0,0,0,0|1,0,1]=4 5541 B11R1.644 N[C@H]1C[C@@H](C(=O)O)CC1(F)F Amb26388985 [0,2,0,0,0,0|2,0,0]=4 5542 B11R1.644 O=C(O)C1CC(F)(F)C(=O)N1 Amb25828417 [0,2,0,0,0,0|1,0,1]=4 5543 B11R1.672 CC(=O)C1OC(O)C(O)C1O Amb27198578 [0,2,0,0,0,0|2,0,0]=4 5544 B11R1.672 CC(=O)[C@@H]1C[C@H](O)[C@@H](C)[C@@H]1C Amb28253721 [0,2,0,0,0,0|2,0,0]=4 5545 B11R1.672 CC(=O)[C@H]1OC(O)[C@@H](O)[C@@H]1O Amb24598967 [0,2,0,0,0,0|2,0,0]=4 5546 B11R1.672 CC1CC(C(=O)O)C(C)C1C Amb27607747 [0,2,0,0,0,0|2,0,0]=4 5547 B11R1.672 CC1C[C@@H](C(=O)O)C(C)C1C Amb27590210 [0,2,0,0,0,0|2,0,0]=4 5548 B11R1.672 CC1C[C@@H](C(=O)O)N(C)C1C Amb25881057 [0,2,0,0,0,0|1,0,0]=3 5549 B11R1.672 CC1NC(C(=O)O)C(O)C1=O Amb28123093 [0,2,0,0,0,0|0,0,2]=4 5550 B11R1.672 CC1N[C@H](C(=O)O)C(O)C1=O Amb25319073 [0,2,0,0,0,0|0,0,2]=4 5551 B11R1.672 CC1OC(C(=O)O)C(O)C1O Amb27793297 [0,2,0,0,0,0|1,0,0]=3 5552 B11R1.672 CN1C(=O)C(N)CC1C(=O)O Amb28323541 [0,2,0,0,0,0|1,0,1]=4 5553 B11R1.672 C[C@@H]1N[C@H](C(=O)O)[C@H](O)[C@@H]1O Amb27634870 [0,2,0,0,0,0|0,0,0]=2 5554 B11R1.672 C[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H]1O Amb28325640 [0,2,0,0,0,0|1,0,0]=3 5555 B11R1.672 NC1C(Br)CC(C(=O)O)C1O Amb28365510 [0,2,0,0,0,0|2,0,0]=4 5556 B11R1.672 N[C@@H]1C[C@H](C(=O)O)[C@@H](O)[C@H]1O Amb27984686 [0,2,0,0,0,0|1,0,0]=3 5557 B11R1.672 N[C@@H]1[C@@H](Br)C[C@H](C(=O)O)[C@H]1O Amb27451655 [0,2,0,0,0,0|2,0,0]=4 5558 B11R1.672 O=C(O)C1OC(O)C(O)C1O Amb24445981 [0,2,0,0,0,0|1,0,0]=3 5559 B11R1.672 O=C(O)[C@H]1O[C@@H](O)[C@@H](O)[C@H]1O Amb28193751 [0,2,0,0,0,0|1,0,0]=3 5560 B11R1.672 O=C(O)[C@H]1O[C@H](O)[C@@H](O)[C@@H]1O Amb27433954 [0,2,0,0,0,0|1,0,0]=3 5561 B11R1.672 O=C1OC(C(=O)O)C(O)C1O Amb27875078 [0,2,0,0,0,0|1,0,1]=4 5562 B11R1.49 C=CN1CC(=O)CC1C(=O)O Amb27876350 [0,2,0,0,0,0|0,0,2]=4 5563 B11R1.49 CCN1CC(=O)CC1C(=O)O Amb25722959 [0,2,0,0,0,0|0,0,2]=4 5564 B11R1.49 N#CN1CC(O)CC1C(=O)O Amb29870224 [0,2,0,0,0,0|0,0,0]=2 5565 B11R1.49 N#CN1CC(O)C[C@H]1C(=O)O Amb29870337 [0,2,0,0,0,0|0,0,0]=2 5566 B11R1.49 N#CN1C[C@@H](O)C[C@H]1C(=O)O Amb29870314 [0,2,0,0,0,0|0,0,0]=2 5567 B11R1.49 N#CN1C[C@H](O)C[C@@H]1C(=O)O Amb29870327 [0,2,0,0,0,0|0,0,0]=2 5568 B11R1.49 N#CN1C[C@H](O)C[C@H]1C(=O)O Amb29870339 [0,2,0,0,0,0|0,0,0]=2 5569 B11R1.49 NC(=O)C1CC(O)CN1N=O Amb27792041 [0,2,0,0,0,0|1,0,0]=3 5570 B11R1.49 NC(=O)[C@@H]1CC(N)CN1C=O Amb27632301 [0,2,0,0,0,0|2,0,0]=4 5571 B11R1.49 O=CN1C[C@@H](O)C[C@H]1C(=O)O Amb28314329 [0,2,0,0,0,0|0,0,0]=2 5572 B11R1.49 O=CN1C[C@H](O)C[C@@H]1C(=O)O Amb27413726 [0,2,0,0,0,0|0,0,0]=2 5573 B11R1.49 O=CN1C[C@H](O)C[C@H]1C(=O)O Amb27786166 [0,2,0,0,0,0|0,0,0]=2 5574 B11R1.49 O=NN1CC(O)C[C@H]1C(=O)O Amb24487956 [0,2,0,0,0,0|0,0,0]=2 5575 B11R1.49 O=NN1C[C@@H](F)C[C@H]1C(=O)O Amb27444667 [0,2,0,0,0,0|1,0,0]=3 5576 B11R1.49 O=NN1C[C@@H](O)C[C@@H]1C(=O)O Amb27794996 [0,2,0,0,0,0|0,0,0]=2 5577 B11R1.49 O=NN1C[C@@H](O)C[C@H]1C(=O)O Amb27423867 [0,2,0,0,0,0|0,0,0]=2 5578 B11R1.49 O=NN1C[C@H](F)C[C@H]1C(=O)O Amb27650659 [0,2,0,0,0,0|1,0,0]=3 5579 B11R1.49 O=NN1C[C@H](O)C[C@H]1C(=O)O Amb17618587 [0,2,0,0,0,0|0,0,0]=2 5580 B11R1.488 CC1(C)CC(F)C(C(=O)O)C1 Amb28208602 [0,2,0,0,0,0|2,0,0]=4 5581 B11R1.488 CC1(C)CC(O)C(C(=O)O)C1 Amb18126148 [0,2,0,0,0,0|2,0,0]=4 5582 B11R1.488 CC1(C)C[C@@H](N)[C@H](C(=O)O)C1 Amb27231806 [0,2,0,0,0,0|2,0,0]=4 5583 B11R1.488 CN1CC(C)(C)CC1C(=O)O Amb25150795 [0,2,0,0,0,0|1,0,0]=3 5584 B11R1.488 CN1CC(C)(C)CC1C(=O)O Amb33483861 [0,2,0,0,0,0|1,0,0]=3 5585 B11R1.488 CN1CC(C)(C)C[C@@H]1C(=O)O Amb31307959 [0,2,0,0,0,0|1,0,0]=3 5586 B11R1.488 CN1CC(C)(C)C[C@H]1C(=O)O Amb25148306 [0,2,0,0,0,0|1,0,0]=3 5587 B11R1.488 CN1CC(F)(F)CC1C(N)=O Amb27660733 [0,2,0,0,0,0|2,0,0]=4 5588 B11R1.488 NC1CC(F)(F)CC1C(=O)O Amb27804038 [0,2,0,0,0,0|2,0,0]=4 5589 B11R1.489 CC1(C)CC(O)CC1C(=O)O Amb27233377 [0,2,0,0,0,0|1,0,0]=3 5590 B11R1.489 C[N+]1(C)CC(O)C[C@H]1C(=O)[O-] Amb28128343 [0,2,0,0,0,0|0,0,2]=4 5591 B11R1.489 C[N+]1(C)C[C@@H](O)C[C@H]1C(=O)[O-] Amb18511511 [0,2,0,0,0,0|0,0,2]=4 5592 B11R1.489 C[N+]1(C)C[C@H](O)C[C@@H]1C(=O)[O-] Amb559382 [0,2,0,0,0,0|0,0,2]=4 5593 B11R1.490 CC1CC(=O)C(C)(C(=O)O)C1 Amb33232148 [0,2,0,0,0,0|2,0,0]=4 5594 B11R1.490 CC1CC(N)C(C)(C(=O)O)C1 Amb33232154 [0,2,0,0,0,0|2,0,0]=4 5595 B11R1.490 CN1CC(O)CC1(C)C(=O)O Amb32667257 [0,2,0,0,0,0|0,0,0]=2 5596 B11R1.490 CN1CC(O)CC1(C)C(=O)O Amb32668463 [0,2,0,0,0,0|0,0,0]=2 5597 B11R1.673 CN1CC(O)C(O)[C@H]1C(=O)O Amb27607650 [0,2,0,0,0,0|0,0,0]=2 5598 B11R1.64 CC(=O)N1NC[C@H](O)[C@H]1CO Amb27421986 [0,2,0,0,0,0|2,0,0]=4 5599 B11R1.64 CC1CCC(C(=O)O)C1CN Amb20623956 [0,2,0,0,0,0|2,0,0]=4 5600 B11R1.64 CC[C@H]1C(=O)CN[C@@H]1C(=O)O Amb18830650 [0,2,0,0,0,0|0,0,2]=4 5601 B11R1.64 CO[C@@H]1[C@@H](F)CN[C@@H]1C(=O)O Amb27660933 [0,2,0,0,0,0|1,0,0]=3 5602 B11R1.315 CC1(C)C(O)CCC1C(=O)O Amb23536041 [0,2,0,0,0,0|1,0,0]=3 5603 B11R1.315 CC1(C)[C@@H](N)CC[C@H]1C(=O)O Amb32640344 [0,2,0,0,0,0|2,0,0]=4 5604 B11R1.315 CC1CCC(C(=O)O)C1(C)O Amb28368998 [0,2,0,0,0,0|2,0,0]=4 5605 B11R1.315 C[C@H]1CC[C@H](C(=O)O)C1(C)C Amb26455590 [0,2,0,0,0,0|2,0,0]=4 5606 B11R1.515 CC1C(C(=O)O)CCC1(C)N Amb27871509 [0,2,0,0,0,0|2,0,0]=4 5607 B11R1.515 C[C@H]1[C@H](C(=O)O)CC[C@]1(C)N Amb28052115 [0,2,0,0,0,0|2,0,0]=4 5608 B11R1.515 NC1C(C(=O)O)CCC1(F)F Amb27238570 [0,2,0,0,0,0|2,0,0]=4 5609 B11R1.738 CC1(C(=O)O)CC(F)(F)CN1 Amb27237631 [0,2,0,0,0,0|1,0,0]=3 5610 B11R1.738 CC1(C(=O)O)CC(F)(F)CN1 Amb33742480 [0,2,0,0,0,0|1,0,0]=3 5611 B11R1.738 CC1(C(=O)O)CCC(F)(F)C1 Amb25212373 [0,2,0,0,0,0|2,0,0]=4 5612 B11R1.738 CC1(C)CCC(N)(C(=O)O)C1 Amb25961568 [0,2,0,0,0,0|2,0,0]=4 5613 B11R1.738 CC1(C)CCC(N)(C(=O)O)C1 Amb32652272 [0,2,0,0,0,0|2,0,0]=4 5614 B11R1.738 CC1(C)CNC(C)(C(=O)O)C1 Amb28396633 [0,2,0,0,0,0|1,0,0]=3 5615 B11R1.738 C[C@@]1(C(=O)O)CC(F)(F)CN1 Amb25891806 [0,2,0,0,0,0|1,0,0]=3 5616 B11R1.738 C[C@]1(C(=O)O)CC(F)(F)CN1 Amb24373234 [0,2,0,0,0,0|1,0,0]=3 5617 B11R1.738 NC1(C(=O)O)CCC(F)(F)C1 Amb27794955 [0,2,0,0,0,0|2,0,0]=4 5618 B11R1.738 O=C(O)C1(O)CCC(F)(F)C1 Amb28119860 [0,2,0,0,0,0|2,0,0]=4 5619 B11R1.416 CC1CCC(C#N)(C(=O)O)C1 Amb27968659 [0,2,0,0,0,0|2,0,0]=4 5620 B11R1.416 CC1CCC(CN)(C(=O)O)C1 Amb24687912 [0,2,0,0,0,0|2,0,0]=4 5621 B11R1.416 CCC1(C(=O)O)CC(O)CN1 Amb35656411 [0,2,0,0,0,0|0,0,0]=2 5622 B11R1.416 CCC1(C(=O)O)CCC(C)C1 Amb27795614 [0,2,0,0,0,0|2,0,0]=4 5623 B11R1.416 CCC1(C(=O)O)CCC(N)C1 Amb23454123 [0,2,0,0,0,0|2,0,0]=4 5624 B11R1.416 CCC1(C(=O)O)CCC(O)C1 Amb23454240 [0,2,0,0,0,0|1,0,0]=3 5625 B11R1.416 CNC1(C(=O)O)CCC(O)C1 Amb29867397 [0,2,0,0,0,0|1,0,0]=3 5626 B11R1.416 CNC1(C(N)=O)CCC(O)C1 Amb29867576 [0,2,0,0,0,0|2,0,0]=4 5627 B11R1.416 COC1(C(=O)O)CCC(C)C1 Amb25151845 [0,2,0,0,0,0|2,0,0]=4 5628 B11R1.416 CSC1(C(=O)O)CC[C@@H](C)C1 Amb27404227 [0,2,0,0,0,0|2,0,0]=4 5629 B11R1.416 O=C(O)C1(CO)CC(O)CN1 Amb35656412 [0,2,0,0,0,0|0,0,0]=2 5630 B11R1.416 O=C(O)C1(CO)CC(O)CO1 Amb27876459 [0,2,0,0,0,0|1,0,0]=3 5631 B11R1.416 O=C(O)[C@]1(CO)C[C@H](O)CO1 Amb27472047 [0,2,0,0,0,0|1,0,0]=3 5632 B9R1.5 CC1NCCCNC1=O Amb33545017 [0,0,1,1,0,0|2,0,0]=4 5633 B9R1.5 C[C@@H]1NCCCNC1=O Amb25733316 [0,0,1,1,0,0|2,0,0]=4 5634 B9R1.5 C[C@H]1NCCCNC1=O Amb25146171 [0,0,1,1,0,0|2,0,0]=4 5635 B9R1.6 C=C(C)C1COCCN1 Amb33199954 [0,0,1,1,0,0|2,0,0]=4 5636 B9R1.6 C=C(O)C1CNCCN1 Amb28286928 [0,0,1,1,0,0|2,0,0]=4 5637 B9R1.6 C=C(O)C1CNCCN1 Amb30594212 [0,0,1,1,0,0|2,0,0]=4 5638 B9R1.6 CC(=O)C1CCCCN1 Amb21962174 [0,0,1,1,0,0|2,0,0]=4 5639 B9R1.6 CC(=O)C1CCCCN1 Amb2700057 [0,0,1,1,0,0|2,0,0]=4 5640 B9R1.6 CC(=O)C1CCCOC1 Amb26932950 [0,0,1,1,0,0|2,0,0]=4 5641 B9R1.6 CC(=O)C1COCCN1 Amb24761214 [0,0,1,1,0,0|1,0,0]=3 5642 B9R1.6 CC(=O)C1COCCO1 Amb20669104 [0,0,1,1,0,0|2,0,0]=4 5643 B9R1.6 CC(=O)C1CSCCN1 Amb25305093 [0,0,1,1,0,0|1,1,0]=4 5644 B9R1.6 CC(=O)[C@@H]1CCCCN1 Amb26891406 [0,0,1,1,0,0|2,0,0]=4 5645 B9R1.6 CC(=O)[C@@H]1CCCCN1 Amb28555630 [0,0,1,1,0,0|2,0,0]=4 5646 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb25072730 [0,0,1,1,0,0|2,0,0]=4 5647 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb28935031 [0,0,1,1,0,0|2,0,0]=4 5648 B9R1.6 CC(O)C1COCCN1 Amb35740516 [0,0,1,1,0,0|1,0,1]=4 5649 B9R1.6 N=C(N)C1COCCN1 Amb35666157 [0,0,1,1,0,0|2,0,0]=4 5650 B9R1.6 NC(=O)C1CCCCN1 Amb2370929 [0,0,1,1,0,0|2,0,0]=4 5651 B9R1.6 NC(=O)C1CCCCN1 Amb433771 [0,0,1,1,0,0|2,0,0]=4 5652 B9R1.6 NC(=O)C1CCCOC1 Amb9173672 [0,0,1,1,0,0|2,0,0]=4 5653 B9R1.6 NC(=O)C1CNCCN1 Amb1158016 [0,0,1,1,0,0|2,0,0]=4 5654 B9R1.6 NC(=O)C1COCCN1 Amb22059486 [0,0,1,1,0,0|1,0,0]=3 5655 B9R1.6 NC(=O)C1COCCN1 Amb31308018 [0,0,1,1,0,0|1,0,0]=3 5656 B9R1.6 NC(=O)C1CSCCN1 Amb4004499 [0,0,1,1,0,0|1,1,0]=4 5657 B9R1.6 NC(=O)[C@@H]1CCCCN1 Amb25315367 [0,0,1,1,0,0|2,0,0]=4 5658 B9R1.6 NC(=O)[C@@H]1CNCCN1 Amb24183728 [0,0,1,1,0,0|2,0,0]=4 5659 B9R1.6 NC(=O)[C@@H]1CSCCN1 Amb27950510 [0,0,1,1,0,0|1,1,0]=4 5660 B9R1.6 NC(=O)[C@H]1CCCCN1 Amb27490731 [0,0,1,1,0,0|2,0,0]=4 5661 B9R1.6 NC(=O)[C@H]1CNCCN1 Amb27355135 [0,0,1,1,0,0|2,0,0]=4 5662 B9R1.6 NC(=O)[C@H]1CNCCN1 Amb8420820 [0,0,1,1,0,0|2,0,0]=4 5663 B9R1.6 NC(=O)[C@H]1COCCN1 Amb27591943 [0,0,1,1,0,0|1,0,0]=3 5664 B9R1.6 NC(=O)[C@H]1COCCN1 Amb27838503 [0,0,1,1,0,0|1,0,0]=3 5665 B9R1.6 NC(=S)C1COCCN1 Amb35662700 [0,0,1,1,0,0|1,1,0]=4 5666 B9R1.6 O=C(Cl)C1CCCOC1 Amb18280558 [0,0,1,1,0,0|2,0,0]=4 5667 B9R1.6 O=C(O)C1=CCCOC1 Amb19958529 [0,0,1,1,0,0|1,0,1]=4 5668 B9R1.6 O=C(O)C1=NCCOC1 Amb28398697 [0,0,1,1,0,0|0,0,2]=4 5669 B9R1.6 O=C(O)C1C=CCCN1 Amb25145978 [0,0,1,1,0,0|1,0,1]=4 5670 B9R1.6 O=C(O)C1C=CCCN1 Amb35750834 [0,0,1,1,0,0|1,0,1]=4 5671 B9R1.6 O=C(O)C1CC=CCN1 Amb2698158 [0,0,1,1,0,0|1,0,1]=4 5672 B9R1.6 O=C(O)C1CCCCC1 Amb2721294 [0,0,1,1,0,0|2,0,0]=4 5673 B9R1.6 O=C(O)C1CCCCN1 Amb6754083 [0,0,1,1,0,0|1,0,0]=3 5674 B9R1.6 O=C(O)C1CCCCN1 Amb9703161 [0,0,1,1,0,0|1,0,0]=3 5675 B9R1.6 O=C(O)C1CCCCO1 Amb2723689 [0,0,1,1,0,0|2,0,0]=4 5676 B9R1.6 O=C(O)C1CCCCS1 Amb18202314 [0,0,1,1,0,0|2,0,0]=4 5677 B9R1.6 O=C(O)C1CCCNC1 Amb6239367 [0,0,1,1,0,0|2,0,0]=4 5678 B9R1.6 O=C(O)C1CCCNC1 Amb9703145 [0,0,1,1,0,0|2,0,0]=4 5679 B9R1.6 O=C(O)C1CCCOC1 Amb1102367 [0,0,1,1,0,0|1,0,0]=3 5680 B9R1.6 O=C(O)C1CCCSC1 Amb33545067 [0,0,1,1,0,0|1,1,0]=4 5681 B9R1.6 O=C(O)C1CCOCN1 Amb28042897 [0,0,1,1,0,0|2,0,0]=4 5682 B9R1.6 O=C(O)C1CCSCN1 Amb1102215 [0,0,1,1,0,0|2,0,0]=4 5683 B9R1.6 O=C(O)C1CCSCN1 Amb22284134 [0,0,1,1,0,0|2,0,0]=4 5684 B9R1.6 O=C(O)C1CNCCN1 Amb22490977 [0,0,1,1,0,0|1,0,0]=3 5685 B9R1.6 O=C(O)C1CNCCN1 Amb2690349 [0,0,1,1,0,0|1,0,0]=3 5686 B9R1.6 O=C(O)C1CNCCN1 Amb2720318 [0,0,1,1,0,0|1,0,0]=3 5687 B9R1.6 O=C(O)C1CNCCO1 Amb16232076 [0,0,1,1,0,0|2,0,0]=4 5688 B9R1.6 O=C(O)C1CNCCO1 Amb2696640 [0,0,1,1,0,0|2,0,0]=4 5689 B9R1.6 O=C(O)C1CNCCS1 Amb8631056 [0,0,1,1,0,0|2,0,0]=4 5690 B9R1.6 O=C(O)C1COCCN1 Amb10607157 [0,0,1,1,0,0|0,0,0]=2 5691 B9R1.6 O=C(O)C1COCCN1 Amb2694767 [0,0,1,1,0,0|0,0,0]=2 5692 B9R1.6 O=C(O)C1COCCO1 Amb5399760 [0,0,1,1,0,0|1,0,0]=3 5693 B9R1.6 O=C(O)C1CSCCN1 Amb19888398 [0,0,1,1,0,0|0,1,0]=3 5694 B9R1.6 O=C(O)C1CSCCN1 Amb2695006 [0,0,1,1,0,0|0,1,0]=3 5695 B9R1.6 O=C(O)C1CSCCS1 Amb20622962 [0,0,1,1,0,0|1,1,0]=4 5696 B9R1.6 O=C(O)C1C[NH2+]CC[NH2+]1 Amb5722241 [0,0,1,1,0,0|1,0,1]=4 5697 B9R1.6 O=C(O)C1NCCCN1 Amb27473323 [0,0,1,1,0,0|2,0,0]=4 5698 B9R1.6 O=C(O)C1NCCCO1 Amb33193117 [0,0,1,1,0,0|2,0,0]=4 5699 B9R1.6 O=C(O)C1NCCCS1 Amb22899084 [0,0,1,1,0,0|2,0,0]=4 5700 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb2690345 [0,0,1,1,0,0|1,0,0]=3 5701 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb8384272 [0,0,1,1,0,0|1,0,0]=3 5702 B9R1.6 O=C(O)[C@@H]1CCCCO1 Amb22746821 [0,0,1,1,0,0|2,0,0]=4 5703 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb16232354 [0,0,1,1,0,0|2,0,0]=4 5704 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb8628966 [0,0,1,1,0,0|2,0,0]=4 5705 B9R1.6 O=C(O)[C@@H]1CCCNN1 Amb30666630 [0,0,1,1,0,0|2,0,0]=4 5706 B9R1.6 O=C(O)[C@@H]1CCCOC1 Amb26885613 [0,0,1,1,0,0|1,0,0]=3 5707 B9R1.6 O=C(O)[C@@H]1CCCSC1 Amb27826589 [0,0,1,1,0,0|1,1,0]=4 5708 B9R1.6 O=C(O)[C@@H]1CNCCN1 Amb6307277 [0,0,1,1,0,0|1,0,0]=3 5709 B9R1.6 O=C(O)[C@@H]1CNCCN1 Amb6307319 [0,0,1,1,0,0|1,0,0]=3 5710 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb22737231 [0,0,1,1,0,0|2,0,0]=4 5711 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb8631069 [0,0,1,1,0,0|2,0,0]=4 5712 B9R1.6 O=C(O)[C@@H]1COCCN1 Amb10576585 [0,0,1,1,0,0|0,0,0]=2 5713 B9R1.6 O=C(O)[C@@H]1COCCN1 Amb2696709 [0,0,1,1,0,0|0,0,0]=2 5714 B9R1.6 O=C(O)[C@@H]1COCCO1 Amb23438856 [0,0,1,1,0,0|1,0,0]=3 5715 B9R1.6 O=C(O)[C@@H]1CSCCN1 Amb22386830 [0,0,1,1,0,0|0,1,0]=3 5716 B9R1.6 O=C(O)[C@@H]1CSCCN1 Amb8630483 [0,0,1,1,0,0|0,1,0]=3 5717 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb2700060 [0,0,1,1,0,0|1,0,0]=3 5718 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb8515100 [0,0,1,1,0,0|1,0,0]=3 5719 B9R1.6 O=C(O)[C@H]1CCCCO1 Amb26865454 [0,0,1,1,0,0|2,0,0]=4 5720 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8384271 [0,0,1,1,0,0|2,0,0]=4 5721 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8389307 [0,0,1,1,0,0|2,0,0]=4 5722 B9R1.6 O=C(O)[C@H]1CCCNN1 Amb27154761 [0,0,1,1,0,0|2,0,0]=4 5723 B9R1.6 O=C(O)[C@H]1CCCSC1 Amb27809148 [0,0,1,1,0,0|1,1,0]=4 5724 B9R1.6 O=C(O)[C@H]1CCSCN1 Amb25773953 [0,0,1,1,0,0|2,0,0]=4 5725 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb20241207 [0,0,1,1,0,0|1,0,0]=3 5726 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb2694998 [0,0,1,1,0,0|1,0,0]=3 5727 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb8628465 [0,0,1,1,0,0|1,0,0]=3 5728 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb10067023 [0,0,1,1,0,0|2,0,0]=4 5729 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb22737232 [0,0,1,1,0,0|2,0,0]=4 5730 B9R1.6 O=C(O)[C@H]1COCCN1 Amb16232575 [0,0,1,1,0,0|0,0,0]=2 5731 B9R1.6 O=C(O)[C@H]1COCCN1 Amb2696766 [0,0,1,1,0,0|0,0,0]=2 5732 B9R1.6 O=C(O)[C@H]1COCCO1 Amb26430807 [0,0,1,1,0,0|1,0,0]=3 5733 B9R1.6 O=C(O)[C@H]1CSCCN1 Amb2700568 [0,0,1,1,0,0|0,1,0]=3 5734 B9R1.6 O=[PH](O)C1CCCCN1 Amb28131021 [0,0,1,1,0,0|2,0,0]=4 5735 B9R1.45 CC1CC1C(C)C(=O)O Amb25708709 [0,0,1,1,0,0|2,0,0]=4 5736 B9R1.59 CCCC1CC1C(=O)O Amb19001459 [0,0,1,1,0,0|2,0,0]=4 5737 B9R1.59 CCC[C@@H]1C[C@@H]1C(=O)O Amb9901777 [0,0,1,1,0,0|2,0,0]=4 5738 B9R1.59 CCC[C@@H]1C[C@H]1C(=O)O Amb25368727 [0,0,1,1,0,0|2,0,0]=4 5739 B9R1.59 CCC[C@H]1C[C@H]1C(=O)O Amb27782329 [0,0,1,1,0,0|2,0,0]=4 5740 B9R1.59 O=C(O)C1CC1CCF Amb33196442 [0,0,1,1,0,0|2,0,0]=4 5741 B9R1.59 O=C(O)[C@@H]1C[C@H]1CCF Amb33196453 [0,0,1,1,0,0|2,0,0]=4 5742 B9R1.69 CC1CNC(C)C(=O)N1 Amb18642668 [0,0,1,1,0,0|2,0,0]=4 5743 B9R1.69 C[C@@H]1CN[C@H](C)C(=O)N1 Amb23385259 [0,0,1,1,0,0|2,0,0]=4 5744 B9R1.69 C[C@@H]1NC[C@@H](C)NC1=O Amb22587597 [0,0,1,1,0,0|2,0,0]=4 5745 B9R1.69 C[C@H]1CC[C@@H](O)CC1=O Amb27427823 [0,0,1,1,0,0|2,0,0]=4 5746 B9R1.69 C[C@H]1CN[C@@H](C)C(=O)N1 Amb23385307 [0,0,1,1,0,0|2,0,0]=4 5747 B9R1.69 C[C@H]1CN[C@H](C)C(=O)N1 Amb22587547 [0,0,1,1,0,0|2,0,0]=4 5748 B9R1.69 C[C@H]1CN[C@H](C)C(=O)N1 Amb23385266 [0,0,1,1,0,0|2,0,0]=4 5749 B9R1.93 CC1(C(=O)O)CC1CO Amb24559345 [0,0,1,1,0,0|1,0,0]=3 5750 B9R1.93 CC[C@@H]1C[C@@]1(C)C(=O)O Amb33098402 [0,0,1,1,0,0|2,0,0]=4 5751 B9R1.93 CC[C@H]1C[C@@]1(C)C(=O)O Amb33098405 [0,0,1,1,0,0|2,0,0]=4 5752 B9R1.93 C[C@@]1(C(=O)O)C[C@@H]1CO Amb33098403 [0,0,1,1,0,0|1,0,0]=3 5753 B9R1.93 C[C@@]1(C(=O)O)C[C@H]1CO Amb33098404 [0,0,1,1,0,0|1,0,0]=3 5754 B9R1.93 C[C@]1(C(=O)O)C[C@@H]1CF Amb33098429 [0,0,1,1,0,0|2,0,0]=4 5755 B9R1.93 C[C@]1(C(=O)O)C[C@@H]1CO Amb33098423 [0,0,1,1,0,0|1,0,0]=3 5756 B9R1.93 NC1(C(=O)O)CC1CO Amb25828351 [0,0,1,1,0,0|2,0,0]=4 5757 B9R1.93 N[C@@]1(C(=O)O)C[C@H]1CO Amb26405303 [0,0,1,1,0,0|2,0,0]=4 5758 B9R1.93 N[C@]1(C(=O)O)C[C@@H]1CO Amb2694928 [0,0,1,1,0,0|2,0,0]=4 5759 B9R1.93 N[C@]1(C(=O)O)C[C@H]1CO Amb25101898 [0,0,1,1,0,0|2,0,0]=4 5760 B9R1.110 CC(C(=O)O)C1CCC1 Amb33543919 [0,0,1,1,0,0|2,0,0]=4 5761 B9R1.110 CC(C(=O)O)C1CCO1 Amb26595674 [0,0,1,1,0,0|1,0,0]=3 5762 B9R1.110 CC(C(=O)O)N1CCC1 Amb24178905 [0,0,1,1,0,0|1,0,0]=3 5763 B9R1.110 CC(C(=O)O)N1CCC1 Amb33329262 [0,0,1,1,0,0|1,0,0]=3 5764 B9R1.112 CC(=O)C(C)NC1CC1 Amb25119978 [0,0,1,1,0,0|2,0,0]=4 5765 B9R1.112 CC(CC1CC1)C(=O)O Amb28075498 [0,0,1,1,0,0|2,0,0]=4 5766 B9R1.112 CC(NC1CC1)C(=O)O Amb9620653 [0,0,1,1,0,0|1,0,0]=3 5767 B9R1.112 CC(NC1CC1)C(N)=O Amb7758269 [0,0,1,1,0,0|2,0,0]=4 5768 B9R1.112 CC(OC1CC1)C(=O)O Amb27667232 [0,0,1,1,0,0|2,0,0]=4 5769 B9R1.112 C[C@@H](CC1CC1)C(=O)O Amb10844014 [0,0,1,1,0,0|2,0,0]=4 5770 B9R1.112 C[C@@H](NC1CC1)C(=O)O Amb24398132 [0,0,1,1,0,0|1,0,0]=3 5771 B9R1.112 C[C@H](CC1CC1)C(=O)O Amb33749387 [0,0,1,1,0,0|2,0,0]=4 5772 B9R1.112 N[C@@H](C[C@H]1CO1)C(=O)O Amb28252257 [0,0,1,1,0,0|2,0,0]=4 5773 B9R1.1 NCC1CCC(=O)CC1 Amb31307747 [0,0,1,1,0,0|2,0,0]=4 5774 B9R1.1 NCC1CCC(=O)NC1 Amb18832607 [0,0,1,1,0,0|2,0,0]=4 5775 B9R1.1 NCC1CCC(=O)NC1 Amb32653087 [0,0,1,1,0,0|2,0,0]=4 5776 B9R1.1 NCC1CCC(=O)NC1 Amb32653107 [0,0,1,1,0,0|2,0,0]=4 5777 B9R1.1 NCC1CCC(=O)NC1 Amb35748141 [0,0,1,1,0,0|2,0,0]=4 5778 B9R1.1 NCC1CCC(O)CO1 Amb32640405 [0,0,1,1,0,0|1,0,1]=4 5779 B9R1.1 NCC1CNC(=O)CO1 Amb22235660 [0,0,1,1,0,0|2,0,0]=4 5780 B9R1.1 NCC1CNC(=O)CO1 Amb24682214 [0,0,1,1,0,0|2,0,0]=4 5781 B9R1.1 NCC1COC(=O)CO1 Amb26575044 [0,0,1,1,0,0|2,0,0]=4 5782 B9R1.46 CC(=O)CCC1OC1C Amb28194562 [0,0,1,1,0,0|2,0,0]=4 5783 B9R1.46 CC1CC1CCC(=O)O Amb27220003 [0,0,1,1,0,0|2,0,0]=4 5784 B9R1.49 CC1CCOC(=O)CC1 Amb24059359 [0,0,1,1,0,0|2,0,0]=4 5785 B9R1.49 O=C1CCC(O)CCN1 Amb26443713 [0,0,1,1,0,0|2,0,0]=4 5786 B9R1.49 O=C1CCC(O)CCO1 Amb23598292 [0,0,1,1,0,0|1,0,0]=3 5787 B9R1.49 O=C1CCC[C@H](O)CC1 Amb27838657 [0,0,1,1,0,0|2,0,0]=4 5788 B9R1.49 O=C1CC[C@@H](Br)CCO1 Amb27447872 [0,0,1,1,0,0|2,0,0]=4 5789 B9R1.49 O=C1CC[C@H](Br)CCO1 Amb28458370 [0,0,1,1,0,0|2,0,0]=4 5790 B9R1.49 O=C1CNCC(O)CN1 Amb27838571 [0,0,1,1,0,0|2,0,0]=4 5791 B9R1.67 O=C(O)CC1CCC1F Amb33351668 [0,0,1,1,0,0|2,0,0]=4 5792 B9R1.84 CC(=O)CCC1CNC1 Amb33307594 [0,0,1,1,0,0|2,0,0]=4 5793 B9R1.84 O=C(O)CCC1CCC1 Amb8011305 [0,0,1,1,0,0|2,0,0]=4 5794 B9R1.84 O=C(O)CCC1CCO1 Amb28280741 [0,0,1,1,0,0|1,0,0]=3 5795 B9R1.84 O=C(O)CC[C@@H]1CCN1 Amb27439305 [0,0,1,1,0,0|2,0,0]=4 5796 B9R1.84 O=C(O)COC1CNC1 Amb24454311 [0,0,1,1,0,0|2,0,0]=4 5797 B9R1.84 O=C(O)COC1CNC1 Amb28555348 [0,0,1,1,0,0|2,0,0]=4 5798 B9R1.84 O=C(O)COC1CNC1 Amb32665028 [0,0,1,1,0,0|2,0,0]=4 5799 B9R1.84 O=C([O-])CCC1CCO1 Amb32663662 [0,0,1,1,0,0|1,0,1]=4 5800 B9R1.86 CCC1CC1CC(=O)O Amb27249848 [0,0,1,1,0,0|2,0,0]=4 5801 B9R1.86 O=C(O)CC1CC1CF Amb27237859 [0,0,1,1,0,0|2,0,0]=4 5802 B9R1.127 CC1(CN)CC1C(=O)O Amb27481579 [0,0,1,1,0,0|1,0,0]=3 5803 B9R1.127 CCC1(C)CC1C(=O)O Amb18285802 [0,0,1,1,0,0|2,0,0]=4 5804 B9R1.138 CC1(O)CCC(O)C1N Amb27873074 [0,0,1,1,0,0|1,0,1]=4 5805 B9R1.147 CC1(CCC(=O)O)CC1 Amb8009614 [0,0,1,1,0,0|2,0,0]=4 5806 B9R1.147 NC1(CCC(=O)O)CC1 Amb18832570 [0,0,1,1,0,0|2,0,0]=4 5807 B9R1.147 O=C(O)CCC1(Cl)CC1 Amb25865061 [0,0,1,1,0,0|2,0,0]=4 5808 B9R1.147 O=C(O)CCC1(F)CC1 Amb27423404 [0,0,1,1,0,0|2,0,0]=4 5809 B9R1.147 O=C(O)CCC1(O)CC1 Amb28325490 [0,0,1,1,0,0|1,0,0]=3 5810 B9R1.15 CCC1CCOCC1=O Amb33295409 [0,0,1,1,0,0|2,0,0]=4 5811 B9R1.15 CC[C@@H]1CCCOC1=O Amb26601602 [0,0,1,1,0,0|2,0,0]=4 5812 B9R1.15 CC[C@H]1CCCOC1=O Amb24477860 [0,0,1,1,0,0|2,0,0]=4 5813 B9R1.15 CNC1CCCCC1=O Amb28984230 [0,0,1,1,0,0|2,0,0]=4 5814 B9R1.15 CNC1CCCCC1=O Amb3644506 [0,0,1,1,0,0|2,0,0]=4 5815 B9R1.15 CNC1CCCNC1=O Amb28934961 [0,0,1,1,0,0|2,0,0]=4 5816 B9R1.25 C[C@H]1[C@H](CO)[C@@H]1C(=O)O Amb28428452 [0,0,1,1,0,0|1,0,0]=3 5817 B9R1.33 O=C1CCCC1CCO Amb27221111 [0,0,1,1,0,0|2,0,0]=4 5818 B9R1.33 O=C1CCOC1CCO Amb27838611 [0,0,1,1,0,0|2,0,0]=4 5819 B9R1.33 O=C1NCCC1CCO Amb33531266 [0,0,1,1,0,0|2,0,0]=4 5820 B9R1.33 O=C1NCC[C@@H]1CCO Amb27593854 [0,0,1,1,0,0|2,0,0]=4 5821 B9R1.33 O=C1OCCC1CCBr Amb20667717 [0,0,1,1,0,0|2,0,0]=4 5822 B9R1.33 O=C1OCCC1CCCl Amb27201250 [0,0,1,1,0,0|2,0,0]=4 5823 B9R1.33 O=C1OCCC1CCO Amb25293532 [0,0,1,1,0,0|1,0,0]=3 5824 B9R1.33 O=C1OCCN1CCO Amb2720764 [0,0,1,1,0,0|2,0,0]=4 5825 B9R1.90 CCC1C(=O)NC1CO Amb27445041 [0,0,1,1,0,0|2,0,0]=4 5826 B9R1.90 CC[C@H]1C(=O)N[C@H]1CO Amb27222345 [0,0,1,1,0,0|2,0,0]=4 5827 B9R1.116 CCC(C(=O)O)C1CC1 Amb18832627 [0,0,1,1,0,0|2,0,0]=4 5828 B9R1.116 CNC(C(=O)O)C1CC1 Amb18975569 [0,0,1,1,0,0|1,0,0]=3 5829 B9R1.116 CNC(C(N)=O)C1CC1 Amb18975566 [0,0,1,1,0,0|2,0,0]=4 5830 B9R1.116 COC(C(=O)O)C1CC1 Amb24524177 [0,0,1,1,0,0|2,0,0]=4 5831 B9R1.116 O=C(O)C(NO)C1CC1 Amb27410795 [0,0,1,1,0,0|2,0,0]=4 5832 B9R1.119 CCC1(C(=O)O)CCC1 Amb20622799 [0,0,1,1,0,0|2,0,0]=4 5833 B9R1.119 CCC1(C(=O)O)CCO1 Amb25073494 [0,0,1,1,0,0|1,0,0]=3 5834 B9R1.119 CC[C@@]1(C(=O)O)CCN1 Amb27392754 [0,0,1,1,0,0|2,0,0]=4 5835 B9R1.119 CNC1(C(=O)O)CCC1 Amb18285791 [0,0,1,1,0,0|1,0,0]=3 5836 B9R1.119 CNC1(C(=O)O)CCC1 Amb28895922 [0,0,1,1,0,0|1,0,0]=3 5837 B9R1.119 CNC1(C(=O)O)COC1 Amb25888932 [0,0,1,1,0,0|2,0,0]=4 5838 B9R1.119 CNC1(C(=O)O)COC1 Amb33295337 [0,0,1,1,0,0|2,0,0]=4 5839 B9R1.119 CNC1(C(C)=O)CCC1 Amb25694506 [0,0,1,1,0,0|2,0,0]=4 5840 B9R1.119 CNC1(C(N)=O)CCC1 Amb18523737 [0,0,1,1,0,0|2,0,0]=4 5841 B9R1.119 COC1(C(=O)O)CCC1 Amb23596685 [0,0,1,1,0,0|2,0,0]=4 5842 B9R1.119 CSC1(C(=O)O)CCC1 Amb25721376 [0,0,1,1,0,0|2,0,0]=4 5843 B9R1.119 O=C(O)C1(NO)CCC1 Amb28127460 [0,0,1,1,0,0|2,0,0]=4 5844 B9R1.130 CCC1(C(=O)O)CC1F Amb27956509 [0,0,1,1,0,0|2,0,0]=4 5845 B9R1.130 CC[C@@]1(C(=O)O)C[C@@H]1F Amb27631299 [0,0,1,1,0,0|2,0,0]=4 5846 B9R1.130 CC[C@@]1(C(=O)O)C[C@H]1F Amb27879637 [0,0,1,1,0,0|2,0,0]=4 5847 B9R1.130 CC[C@]1(C(=O)O)C[C@H]1F Amb25082106 [0,0,1,1,0,0|2,0,0]=4 5848 B9R1.130 CN[C@]1(C(=O)O)C[C@H]1C Amb28347002 [0,0,1,1,0,0|1,0,0]=3 5849 B9R1.130 CSC1(C(=O)O)CC1C Amb24540432 [0,0,1,1,0,0|2,0,0]=4 5850 B9R1.179 CC(=O)C1(CCO)CC1 Amb27969719 [0,0,1,1,0,0|2,0,0]=4 5851 B9R1.179 CCCC1(C(=O)O)CC1 Amb18062273 [0,0,1,1,0,0|2,0,0]=4 5852 B9R1.179 NCCC1(C(=O)O)CC1 Amb20668330 [0,0,1,1,0,0|2,0,0]=4 5853 B9R1.179 NCCC1(C(=O)O)CC1 Amb2694937 [0,0,1,1,0,0|2,0,0]=4 5854 B9R1.179 O=C(O)C1(CCCl)CC1 Amb26370639 [0,0,1,1,0,0|2,0,0]=4 5855 B9R1.179 O=C(O)C1(CCF)CC1 Amb24751115 [0,0,1,1,0,0|2,0,0]=4 5856 B9R1.179 O=C(O)C1(CCO)CC1 Amb27648466 [0,0,1,1,0,0|1,0,0]=3 5857 B9R1.179 O=C(O)C1(CCS)CC1 Amb27453929 [0,0,1,1,0,0|1,1,0]=4 5858 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb18124322 [0,0,1,1,0,0|1,0,0]=3 5859 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb32674857 [0,0,1,1,0,0|1,0,0]=3 5860 B9R1.36 CC1(C)C[C@@H](N)C(=O)O1 Amb28196700 [0,0,1,1,0,0|1,0,0]=3 5861 B9R1.36 CC1(C)C[C@@H](O)C(=O)O1 Amb27472564 [0,0,1,1,0,0|2,0,0]=4 5862 B9R1.36 CC1(C)C[C@H](N)C(=O)O1 Amb24476611 [0,0,1,1,0,0|1,0,0]=3 5863 B9R1.36 CC1(C)C[C@H](O)C(=O)O1 Amb28205922 [0,0,1,1,0,0|2,0,0]=4 5864 B9R1.36 CC1CC(C)(C)OC1=O Amb24444118 [0,0,1,1,0,0|2,0,0]=4 5865 B9R1.38 CC1C[C@@H](N)P(=O)(O)O1 Amb27230015 [0,0,1,1,0,0|1,0,0]=3 5866 B9R1.161 CC(C)C1CC1C(=O)O Amb18285139 [0,0,1,1,0,0|2,0,0]=4 5867 B9R1.161 CC(C)[C@@H]1C[C@H]1C(=O)O Amb33360310 [0,0,1,1,0,0|2,0,0]=4 5868 B9R1.161 CC(C)[C@@H]1O[C@H]1C(=O)O Amb28252782 [0,0,1,1,0,0|2,0,0]=4 5869 B9R1.161 CC(N)C1CC1C(=O)O Amb27441985 [0,0,1,1,0,0|2,0,0]=4 5870 B9R1.161 CC(O)C1CC1C(=O)O Amb25888760 [0,0,1,1,0,0|1,0,0]=3 5871 B9R1.161 CC(O)[C@@H]1C[C@@H]1C(=O)O Amb28457538 [0,0,1,1,0,0|1,0,0]=3 5872 B9R1.161 CC(O)[C@@H]1C[C@H]1C(=O)O Amb27489157 [0,0,1,1,0,0|1,0,0]=3 5873 B9R1.169 CC1(Br)CC1(C)C(=O)O Amb27792919 [0,0,1,1,0,0|2,0,0]=4 5874 B9R1.169 CC1(C)CC1(N)C(=O)O Amb35788491 [0,0,1,1,0,0|1,0,0]=3 5875 B9R1.169 CC1(C)CC1(N)C(=O)O Amb4296872 [0,0,1,1,0,0|1,0,0]=3 5876 B9R1.169 CC1(C)C[C@@]1(N)C(=O)O Amb4296946 [0,0,1,1,0,0|1,0,0]=3 5877 B9R1.169 CC1(C)C[C@@]1(N)C(N)=O Amb25887316 [0,0,1,1,0,0|2,0,0]=4 5878 B9R1.169 CC1(C)C[C@]1(N)C(N)=O Amb28254983 [0,0,1,1,0,0|2,0,0]=4 5879 B9R1.169 C[C@]1(Br)C[C@@]1(C)C(=O)O Amb27419957 [0,0,1,1,0,0|2,0,0]=4 5880 B9R1.169 NC1(C(=O)O)CC1(F)F Amb25233043 [0,0,1,1,0,0|2,0,0]=4 5881 B9R1.169 N[C@]1(C(=O)O)CC1(F)F Amb25874004 [0,0,1,1,0,0|2,0,0]=4 5882 B9R1.53 C=C(Cl)CN1CC(O)C1 Amb28187124 [0,0,1,1,0,0|2,0,0]=4 5883 B9R1.53 C=C1CN(CC(=O)O)C1 Amb30026788 [0,0,1,1,0,0|1,0,1]=4 5884 B9R1.53 CC(O)CC1CC(=O)N1 Amb26596056 [0,0,1,1,0,0|2,0,0]=4 5885 B9R1.53 CC(O)CN1CC(O)C1 Amb27837476 [0,0,1,1,0,0|1,0,1]=4 5886 B9R1.53 CC1CC(CC(=O)O)C1 Amb27461451 [0,0,1,1,0,0|2,0,0]=4 5887 B9R1.53 CC1CN(CC(=O)O)C1 Amb27838507 [0,0,1,1,0,0|1,0,0]=3 5888 B9R1.53 CC1CN(CC(=O)O)C1 Amb32661050 [0,0,1,1,0,0|1,0,0]=3 5889 B9R1.53 CC1CN(CC(N)=O)C1 Amb35587579 [0,0,1,1,0,0|2,0,0]=4 5890 B9R1.53 C[C@H](O)CN1CC(O)C1 Amb27660177 [0,0,1,1,0,0|1,0,1]=4 5891 B9R1.53 C[C@H]1C[C@H](CC(=O)O)C1 Amb27859343 [0,0,1,1,0,0|2,0,0]=4 5892 B9R1.53 NC(=O)CN1CC(N)C1 Amb28287183 [0,0,1,1,0,0|2,0,0]=4 5893 B9R1.53 NC(=S)CN1CC(O)C1 Amb27844080 [0,0,1,1,0,0|1,1,0]=4 5894 B9R1.53 NC1CC(CC(=O)O)C1 Amb23440231 [0,0,1,1,0,0|2,0,0]=4 5895 B9R1.53 NC1CC(CC(=O)O)C1 Amb30585228 [0,0,1,1,0,0|2,0,0]=4 5896 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 Amb23440232 [0,0,1,1,0,0|2,0,0]=4 5897 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 Amb24056536 [0,0,1,1,0,0|2,0,0]=4 5898 B9R1.53 N[C@H]1C[C@H](CC(=O)O)C1 Amb23440233 [0,0,1,1,0,0|2,0,0]=4 5899 B9R1.53 N[C@H]1C[C@H](CC(=O)O)C1 Amb31291707 [0,0,1,1,0,0|2,0,0]=4 5900 B9R1.53 O=C(O)CC1CC(F)C1 Amb27186311 [0,0,1,1,0,0|2,0,0]=4 5901 B9R1.53 O=C(O)CN1CC(O)C1 Amb25339150 [0,0,1,1,0,0|0,0,0]=2 5902 B9R1.53 O=C(O)C[C@H]1C[C@@H](O)C1 Amb26043308 [0,0,1,1,0,0|1,0,0]=3 5903 B9R1.53 O=C(O)C[C@H]1C[C@H](O)C1 Amb25204858 [0,0,1,1,0,0|1,0,0]=3 5904 B9R1.53 O=C([O-])CN1CC(O)C1 Amb35751645 [0,0,1,1,0,0|0,0,1]=3 5905 B9R1.66 CC1(C)CCCC(=O)O1 Amb25863489 [0,0,1,1,0,0|2,0,0]=4 5906 B9R1.66 CC1(C)CNCC(=O)N1 Amb25858036 [0,0,1,1,0,0|2,0,0]=4 5907 B9R1.66 CC1(C)CNCC(=O)N1 Amb32412168 [0,0,1,1,0,0|2,0,0]=4 5908 B9R1.66 CC1(C)CNCC(=O)O1 Amb28122961 [0,0,1,1,0,0|1,0,0]=3 5909 B9R1.66 CC1(O)CCCC(=O)C1 Amb28202235 [0,0,1,1,0,0|2,0,0]=4 5910 B9R1.66 OC1CNCC(O)(O)C1 Amb27233949 [0,0,1,1,0,0|0,0,2]=4 5911 B9R1.85 CC(=O)CNCC1CC1 Amb27251858 [0,0,1,1,0,0|2,0,0]=4 5912 B9R1.85 O=C(O)CCCC1CC1 Amb18832629 [0,0,1,1,0,0|2,0,0]=4 5913 B9R1.85 O=C(O)CCCC1CO1 Amb28453878 [0,0,1,1,0,0|1,0,0]=3 5914 B9R1.85 O=C(O)CCC[C@@H]1CO1 Amb27257665 [0,0,1,1,0,0|1,0,0]=3 5915 B9R1.85 O=C(O)CNCC1CC1 Amb33038298 [0,0,1,1,0,0|1,0,0]=3 5916 B9R1.85 O=C(O)CNCC1CC1 Amb7766420 [0,0,1,1,0,0|1,0,0]=3 5917 B9R1.85 O=C(O)COCC1CC1 Amb6680905 [0,0,1,1,0,0|2,0,0]=4 5918 B9R1.85 O=C(O)CSCC1CC1 Amb9173460 [0,0,1,1,0,0|2,0,0]=4 5919 B9R2.18 C=C1C2CCC(O)C12 Amb27598579 [1,0,0,1,0,0|2,0,0]=4 5920 B9R2.20 O[C@@H]1CC[C@@H]2C=C[C@H]12 Amb28435644 [1,0,0,1,0,0|2,0,0]=4 5921 B9R2.33 O[C@@H]1C[C@@H]2C=C[C@@H]2C1 Amb27595179 [1,0,0,1,0,0|2,0,0]=4 5922 B9R2.39 O=C1CC2CCC1C2 Amb6608983 [1,0,0,1,0,0|2,0,0]=4 5923 B9R2.39 O=C1CC2CNC1C2 Amb26860988 [1,0,0,1,0,0|1,0,0]=3 5924 B9R2.39 O=C1CC2COC1C2 Amb24734169 [1,0,0,1,0,0|2,0,0]=4 5925 B9R2.39 O=C1CC2CSC1C2 Amb28321970 [1,0,0,1,0,0|2,0,0]=4 5926 B9R2.39 O=C1C[C@@H]2CC[C@@H]1C2 Amb27622753 [1,0,0,1,0,0|2,0,0]=4 5927 B9R2.39 O=C1C[C@@H]2CC[C@H]1C2 Amb4605941 [1,0,0,1,0,0|2,0,0]=4 5928 B9R2.39 O=C1C[C@H]2CS[C@@H]1C2 Amb28428954 [1,0,0,1,0,0|2,0,0]=4 5929 B9R2.39 O=C1NC2CCC1C2 Amb20623082 [1,0,0,1,0,0|2,0,0]=4 5930 B9R2.39 O=C1NC2CNC1C2 Amb18641690 [1,0,0,1,0,0|1,0,0]=3 5931 B9R2.39 O=C1N[C@@H]2CC[C@H]1C2 Amb25174368 [1,0,0,1,0,0|2,0,0]=4 5932 B9R2.39 O=C1N[C@@H]2CN[C@H]1C2 Amb22587593 [1,0,0,1,0,0|1,0,0]=3 5933 B9R2.39 O=C1N[C@H]2CC[C@@H]1C2 Amb8516352 [1,0,0,1,0,0|2,0,0]=4 5934 B9R2.39 O=C1OC2CCC1C2 Amb31379084 [1,0,0,1,0,0|1,0,0]=3 5935 B9R2.39 O=C1OC2CNC1C2 Amb15692521 [1,0,0,1,0,0|0,0,0]=2 5936 B9R2.39 O=C1OC2CNC1C2 Amb28934913 [1,0,0,1,0,0|0,0,0]=2 5937 B9R2.39 O=C1OC2CN[C@H]1C2 Amb27637868 [1,0,0,1,0,0|0,0,0]=2 5938 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 Amb19516242 [1,0,0,1,0,0|0,0,0]=2 5939 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 Amb27779719 [1,0,0,1,0,0|0,0,0]=2 5940 B9R2.39 OC1CC2C=CC1C2 Amb19958337 [1,0,0,1,0,0|2,0,0]=4 5941 B9R2.39 OC1CC2CCC1N2 Amb24482057 [1,0,0,1,0,0|1,0,1]=4 5942 B9R2.39 OC1CC2CNC1C2 Amb27229775 [1,0,0,1,0,0|1,0,1]=4 5943 B9R2.39 OC1CC2CNC1C2 Amb30869322 [1,0,0,1,0,0|1,0,1]=4 5944 B9R2.39 OC1C[C@@H]2C=C[C@H]1C2 Amb26920676 [1,0,0,1,0,0|2,0,0]=4 5945 B9R2.39 OC1C[C@H]2C=C[C@@H]1C2 Amb33524064 [1,0,0,1,0,0|2,0,0]=4 5946 B9R2.39 OC1C[C@H]2C=C[C@H]1C2 Amb28428493 [1,0,0,1,0,0|2,0,0]=4 5947 B9R2.39 O[C@@H]1CC2C=C[C@@H]1C2 Amb28069705 [1,0,0,1,0,0|2,0,0]=4 5948 B9R2.39 O[C@@H]1C[C@@H]2CC[C@@H]1N2 Amb25222600 [1,0,0,1,0,0|1,0,1]=4 5949 B9R2.39 O[C@@H]1C[C@@H]2CC[C@@H]1N2 Amb34915143 [1,0,0,1,0,0|1,0,1]=4 5950 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 Amb23439253 [1,0,0,1,0,0|1,0,1]=4 5951 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 Amb31291918 [1,0,0,1,0,0|1,0,1]=4 5952 B9R2.39 O[C@@H]1C[C@H]2C=C[C@@H]1C2 Amb28369855 [1,0,0,1,0,0|2,0,0]=4 5953 B9R2.39 O[C@@H]1C[C@H]2C=C[C@@H]1O2 Amb28345331 [1,0,0,1,0,0|2,0,0]=4 5954 B9R2.39 O[C@@H]1C[C@H]2C=C[C@H]1C2 Amb28053800 [1,0,0,1,0,0|2,0,0]=4 5955 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1N2 Amb23439252 [1,0,0,1,0,0|1,0,1]=4 5956 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1N2 Amb25970068 [1,0,0,1,0,0|1,0,1]=4 5957 B9R2.39 O[C@@H]1C[C@H]2CC[C@H]1N2 Amb26918517 [1,0,0,1,0,0|1,0,1]=4 5958 B9R2.39 O[C@@H]1C[C@H]2CN[C@@H]1C2 Amb27850501 [1,0,0,1,0,0|1,0,1]=4 5959 B9R2.39 O[C@@H]1C[C@H]2CN[C@@H]1C2 Amb33210366 [1,0,0,1,0,0|1,0,1]=4 5960 B9R2.39 O[C@H]1C[C@@H]2C=C[C@H]1C2 Amb27428377 [1,0,0,1,0,0|2,0,0]=4 5961 B9R2.39 O[C@H]1C[C@@H]2CC[C@@H]1N2 Amb27201459 [1,0,0,1,0,0|1,0,1]=4 5962 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 Amb27626546 [1,0,0,1,0,0|1,0,1]=4 5963 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 Amb33801109 [1,0,0,1,0,0|1,0,1]=4 5964 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 Amb26892014 [1,0,0,1,0,0|1,0,1]=4 5965 B9R2.39 O[C@H]1C[C@@H]2CO[C@H]1C2 Amb27650456 [1,0,0,1,0,0|1,0,1]=4 5966 B9R2.39 O[C@H]1C[C@H]2C=C[C@@H]1C2 Amb27635724 [1,0,0,1,0,0|2,0,0]=4 5967 B9R2.39 O[C@H]1C[C@H]2CN[C@@H]1C2 Amb27447299 [1,0,0,1,0,0|1,0,1]=4 5968 B9R2.39 O[C@H]1C[C@H]2CO[C@@H]1C2 Amb27805102 [1,0,0,1,0,0|1,0,1]=4 5969 B9R2.39 O[C@H]1C[C@H]2CO[C@H]1C2 Amb27221642 [1,0,0,1,0,0|1,0,1]=4 5970 B9R2.47 O=CC1CC2CC2C1 Amb26505519 [1,0,0,1,0,0|2,0,0]=4 5971 B9R2.47 O=C[C@@H]1C[C@@H]2C[C@@H]2C1 Amb35741732 [1,0,0,1,0,0|2,0,0]=4 5972 B9R2.47 OC[C@@H]1C[C@@H]2O[C@@H]2C1 Amb25854390 [1,0,0,1,0,0|1,0,1]=4 5973 B9R2.47 OC[C@H]1C[C@@H]2O[C@@H]2C1 Amb28120562 [1,0,0,1,0,0|1,0,1]=4 5974 B9R2.61 OCC12CC(CN1)C2 Amb24409522 [1,0,0,1,0,0|1,0,1]=4 5975 B9R2.61 OCC12CC(CN1)C2 Amb31308371 [1,0,0,1,0,0|1,0,1]=4 5976 B9R2.68 C1=CC2CC(C1)CN2 Amb35789168 [1,0,0,1,0,0|2,0,0]=4 5977 B9R2.68 C1=CC2CC(C1)CN2 Amb35789832 [1,0,0,1,0,0|2,0,0]=4 5978 B9R2.70 OCC1NCC2CC21 Amb26896317 [1,0,0,1,0,0|1,0,1]=4 5979 B9R2.70 OCC1OCC2OC12 Amb26472451 [1,0,0,1,0,0|1,0,1]=4 5980 B9R2.70 OC[C@@H]1NC[C@@H]2C[C@@H]21 Amb13886216 [1,0,0,1,0,0|1,0,1]=4 5981 B9R2.70 OC[C@@H]1NC[C@@H]2C[C@@H]21 Amb23439459 [1,0,0,1,0,0|1,0,1]=4 5982 B9R2.70 OC[C@@H]1NC[C@H]2C[C@H]21 Amb25235945 [1,0,0,1,0,0|1,0,1]=4 5983 B9R2.70 OC[C@@H]1NC[C@H]2C[C@H]21 Amb31291327 [1,0,0,1,0,0|1,0,1]=4 5984 B9R2.70 OC[C@@H]1OC[C@@H]2O[C@H]12 Amb27775958 [1,0,0,1,0,0|1,0,1]=4 5985 B9R2.70 OC[C@H]1NC[C@@H]2C[C@H]12 Amb27841081 [1,0,0,1,0,0|1,0,1]=4 5986 B9R2.70 OC[C@H]1NC[C@@H]2C[C@H]12 Amb33801198 [1,0,0,1,0,0|1,0,1]=4 5987 B9R2.70 OC[C@H]1NC[C@H]2C[C@@H]21 Amb34915144 [1,0,0,1,0,0|1,0,1]=4 5988 B9R2.70 OC[C@H]1NC[C@H]2C[C@H]21 Amb24519421 [1,0,0,1,0,0|1,0,1]=4 5989 B9R2.70 OC[C@H]1NC[C@H]2C[C@H]21 Amb33801096 [1,0,0,1,0,0|1,0,1]=4 5990 B9R2.70 OC[C@H]1OC[C@H]2O[C@@H]12 Amb27440859 [1,0,0,1,0,0|1,0,1]=4 5991 B9R2.110 CC12CNC(CO1)C2 Amb26959630 [1,0,0,1,0,0|1,0,1]=4 5992 B9R2.7 O=C1CC2CCOC12 Amb27593836 [1,0,0,1,0,0|2,0,0]=4 5993 B9R2.7 O=C1C[C@@H]2CCC[C@H]12 Amb27427660 [1,0,0,1,0,0|2,0,0]=4 5994 B9R2.7 O=C1C[C@@H]2CCO[C@H]12 Amb22757944 [1,0,0,1,0,0|2,0,0]=4 5995 B9R2.7 O=C1NC2CCCC12 Amb2694983 [1,0,0,1,0,0|2,0,0]=4 5996 B9R2.7 O=C1N[C@@H]2CCC[C@H]12 Amb25278653 [1,0,0,1,0,0|2,0,0]=4 5997 B9R2.7 O=C1N[C@@H]2CCN[C@H]12 Amb27796913 [1,0,0,1,0,0|1,0,0]=3 5998 B9R2.7 O=C1N[C@H]2CCC[C@@H]12 Amb6366178 [1,0,0,1,0,0|2,0,0]=4 5999 B9R2.144 O=C(O)C12CCC1C2 Amb28252733 [1,0,0,1,0,0|1,0,0]=3 6000 B9R2.148 O=C(O)C1C2CCC21 Amb24350799 [1,0,0,1,0,0|1,0,0]=3 6001 B9R2.150 CC(=O)[C@@H]1C[C@@H]2C[C@@H]21 Amb25179150 [1,0,0,1,0,0|2,0,0]=4 6002 B9R2.150 CC(=O)[C@H]1C[C@@H]2C[C@@H]21 Amb27640618 [1,0,0,1,0,0|2,0,0]=4 6003 B9R2.150 O=C(O)C1CC2CC21 Amb25049722 [1,0,0,1,0,0|1,0,0]=3 6004 B9R2.19 O=C1CCC2CC1C2 Amb33547757 [0,0,0,1,1,0|2,0,0]=4 6005 B9R2.19 O=C1NCC2CC1C2 Amb25221783 [0,0,0,1,1,0|2,0,0]=4 6006 B9R2.19 O=C1NCC2CC1N2 Amb27801865 [0,0,0,1,1,0|2,0,0]=4 6007 B9R2.35 O=C1NC2C(O)CC12 Amb28368878 [0,0,0,1,1,0|1,0,0]=3 6008 B9R2.133 O=C1CC2(Cl)CC1C2 Amb28316134 [0,0,0,1,1,0|2,0,0]=4 6009 B9R2.142 CC(=O)C12CC1(C)C2 Amb27948643 [0,0,0,1,1,0|2,0,0]=4 6010 B9R2.145 CC(=O)C12CC(C1)C2 Amb25093716 [0,0,0,1,1,0|2,0,0]=4 6011 B9R2.145 NC(=O)C12CC(C1)C2 Amb24058180 [0,0,0,1,1,0|2,0,0]=4 6012 B9R2.145 O=C(O)C12CC(C1)C2 Amb22493631 [0,0,0,1,1,0|1,0,0]=3 6013 B9R2.147 O=C(O)C1C2CC1C2 Amb27634394 [0,0,0,1,1,0|2,0,0]=4 6014 B11R2.68 O=C1OC2CC1C=CC2O Amb27594683 [0,0,0,1,0,1|1,0,1]=4 6015 B11R2.68 O=C1OC2CC1CCC2I Amb24375690 [0,0,0,1,0,1|2,0,0]=4 6016 B11R2.68 O=C1OC2CC1CCC2O Amb27757409 [0,0,0,1,0,1|1,0,0]=3 6017 B11R2.68 O=C1O[C@H]2C[C@@H]1C=C[C@@H]2O Amb27210539 [0,0,0,1,0,1|1,0,1]=4 6018 B11R2.564 O=C(O)C1CC2C(F)C2C1 Amb28056630 [0,0,0,1,0,1|2,0,0]=4 6019 B11R2.746 N[C@@H]1CC[C@]2(C(=O)O)C[C@H]12 Amb32992650 [0,0,0,1,0,1|2,0,0]=4 6020 B11R2.821 O=C(O)C1CCC2CC1C2 Amb27776869 [0,0,0,1,0,1|2,0,0]=4 6021 B11R2.821 O=C(O)C1NCC2CC1C2 Amb28196614 [0,0,0,1,0,1|1,0,0]=3 6022 B11R2.839 NC(=O)C1CCC2CC2N1 Amb27186297 [0,0,0,1,0,1|2,0,0]=4 6023 B11R2.839 O=C(O)C1CCC2CC2C1 Amb27876727 [0,0,0,1,0,1|2,0,0]=4 6024 B11R2.839 O=C(O)[C@@H]1C[C@@H]2O[C@@H]2CN1 Amb27216871 [0,0,0,1,0,1|0,0,0]=2 6025 B11R2.839 O=C(O)[C@H]1CC[C@H]2O[C@H]2C1 Amb27420168 [0,0,0,1,0,1|1,0,0]=3 6026 B11R2.847 C[C@]12CN[C@H](C(=O)O)[C@H]1C2 Amb27461394 [0,0,0,1,0,1|1,0,0]=3 6027 B11R2.1827 O=C(O)C12CCC1(Cl)CC2 Amb27233572 [0,0,0,1,0,1|2,0,0]=4 6028 B11R2.1839 NC(=O)C12CCC(CC1)O2 Amb32659532 [0,0,0,1,0,1|2,0,0]=4 6029 B11R2.1839 O=C(O)C12CCC(C1)NC2 Amb32665928 [0,0,0,1,0,1|2,0,0]=4 6030 B11R2.1839 O=C(O)C12CCC(C1)OC2 Amb33620694 [0,0,0,1,0,1|2,0,0]=4 6031 B11R2.1839 O=C(O)C12CCC(CC1)C2 Amb3987516 [0,0,0,1,0,1|2,0,0]=4 6032 B11R2.1839 O=C(O)C12CCC(CC1)N2 Amb17719274 [0,0,0,1,0,1|2,0,0]=4 6033 B11R2.1839 O=C(O)C12CCC(CC1)N2 Amb2372047 [0,0,0,1,0,1|2,0,0]=4 6034 B11R2.1839 O=C(O)C12CCC(CC1)O2 Amb23452647 [0,0,0,1,0,1|1,0,0]=3 6035 B11R2.1839 O=C(O)C12CCC(CN1)C2 Amb27876491 [0,0,0,1,0,1|1,0,0]=3 6036 B11R2.1839 O=C(O)C12CCC(CN1)C2 Amb32665852 [0,0,0,1,0,1|1,0,0]=3 6037 B11R2.1839 O=C(O)C12CCC(CO1)C2 Amb33017573 [0,0,0,1,0,1|2,0,0]=4 6038 B11R2.1839 O=C(O)C12CC[C@@H](C1)NC2 Amb10610569 [0,0,0,1,0,1|2,0,0]=4 6039 B11R2.1839 O=C(O)C12CC[C@@H](C1)NC2 Amb27951998 [0,0,0,1,0,1|2,0,0]=4 6040 B11R2.1839 O=C(O)C12CC[C@H](C1)NC2 Amb28341422 [0,0,0,1,0,1|2,0,0]=4 6041 B11R2.1839 O=C(O)C12CNC(CN1)C2 Amb27225081 [0,0,0,1,0,1|1,0,0]=3 6042 B11R2.1839 O=C(O)C12CNC(CN1)C2 Amb32665962 [0,0,0,1,0,1|1,0,0]=3 6043 B11R2.1839 O=C(O)C12CNC(CO1)C2 Amb25888231 [0,0,0,1,0,1|2,0,0]=4 6044 B11R2.1839 O=C(O)C12CNC(CO1)C2 Amb33484051 [0,0,0,1,0,1|2,0,0]=4 6045 B11R2.1839 O=C(O)C12CN[C@H](CN1)C2 Amb26954452 [0,0,0,1,0,1|1,0,0]=3 6046 B11R2.1839 O=C(O)C12CN[C@H](CN1)C2 Amb32662021 [0,0,0,1,0,1|1,0,0]=3 6047 B11R2.1839 O=C(O)C12COC(CN1)C2 Amb34152470 [0,0,0,1,0,1|1,0,0]=3 6048 B11R2.1839 O=C(O)[C@@]12CC[C@@H](C1)NC2 Amb24539198 [0,0,0,1,0,1|2,0,0]=4 6049 B11R2.1839 O=C(O)[C@@]12CC[C@@H](C1)NC2 Amb33620548 [0,0,0,1,0,1|2,0,0]=4 6050 B11R2.1839 O=C(O)[C@@]12CC[C@@H](CN1)C2 Amb2372048 [0,0,0,1,0,1|1,0,0]=3 6051 B11R2.1839 O=C(O)[C@@]12CC[C@@H](CN1)C2 Amb34164310 [0,0,0,1,0,1|1,0,0]=3 6052 B11R2.1839 O=C(O)[C@]12CC[C@H](CN1)C2 Amb2372049 [0,0,0,1,0,1|1,0,0]=3 6053 B11R2.1839 O=C(O)[C@]12CNC(CN1)C2 Amb28384572 [0,0,0,1,0,1|1,0,0]=3 6054 B11R2.66 NC1=NC2OCC(O)C2O1 Amb28397438 [0,0,0,1,0,1|2,0,0]=4 6055 B11R2.66 NC1=N[C@H]2OC[C@H](O)[C@H]2O1 Amb27655602 [0,0,0,1,0,1|2,0,0]=4 6056 B11R2.66 N[C@H]1CC[C@@H]2CC(=O)O[C@H]12 Amb27470313 [0,0,0,1,0,1|2,0,0]=4 6057 B11R2.66 O=C1CC2C(CC[C@H]2O)O1 Amb28455571 [0,0,0,1,0,1|2,0,0]=4 6058 B11R2.66 O=C1CC2CCC(Br)C2O1 Amb27949602 [0,0,0,1,0,1|2,0,0]=4 6059 B11R2.66 O=C1CC2CCC(Cl)C2O1 Amb28120059 [0,0,0,1,0,1|2,0,0]=4 6060 B11R2.66 O=C1CC2CCC(O)C2O1 Amb27972610 [0,0,0,1,0,1|1,0,0]=3 6061 B11R2.66 O=C1C[C@@H]2C=C[C@@H](O)[C@@H]2O1 Amb28053482 [0,0,0,1,0,1|1,0,1]=4 6062 B11R2.66 O=C1C[C@@H]2C=C[C@H](O)[C@@H]2O1 Amb27981748 [0,0,0,1,0,1|1,0,1]=4 6063 B11R2.66 O=C1C[C@@H]2CC[C@H](O)[C@@H]2O1 Amb27632017 [0,0,0,1,0,1|1,0,0]=3 6064 B11R2.66 O=C1C[C@@H]2OC[C@H](O)[C@@H]2O1 Amb27844235 [0,0,0,1,0,1|1,0,0]=3 6065 B11R2.66 O=C1C[C@@H]2SC[C@H](O)[C@@H]2O1 Amb27420295 [0,0,0,1,0,1|1,0,0]=3 6066 B11R2.66 O=C1C[C@H]2CC[C@@H](O)[C@H]2O1 Amb27456630 [0,0,0,1,0,1|1,0,0]=3 6067 B11R2.66 O=C1C[C@H]2CC[C@H](Br)[C@H]2O1 Amb28060012 [0,0,0,1,0,1|2,0,0]=4 6068 B11R2.66 O=C1C[C@H]2CC[C@H](O)[C@H]2O1 Amb27790348 [0,0,0,1,0,1|1,0,0]=3 6069 B11R2.66 O=C1C[C@H]2CO[C@H](O)[C@H]2O1 Amb27208045 [0,0,0,1,0,1|2,0,0]=4 6070 B11R2.66 O=C1C[C@H]2NCC(O)[C@H]2O1 Amb28457551 [0,0,0,1,0,1|0,0,0]=2 6071 B11R2.66 O=C1C[C@H]2OC[C@H](O)[C@H]2O1 Amb28401107 [0,0,0,1,0,1|1,0,0]=3 6072 B11R2.66 O=C1C[C@H]2SC[C@H](O)[C@H]2O1 Amb27420380 [0,0,0,1,0,1|1,0,0]=3 6073 B11R2.66 O=C1C[C@H]2[C@H](CC[C@H]2O)N1 Amb27618778 [0,0,0,1,0,1|2,0,0]=4 6074 B11R2.66 O=C1NC2C=CC(O)C2O1 Amb27879495 [0,0,0,1,0,1|1,0,1]=4 6075 B11R2.66 O=C1N[C@@H]2CO[C@@H](O)[C@@H]2O1 Amb27428337 [0,0,0,1,0,1|2,0,0]=4 6076 B11R2.66 O=C1OC2COC(O)C2O1 Amb27219855 [0,0,0,1,0,1|2,0,0]=4 6077 B11R2.66 O=C1O[C@@H]2COC(O)[C@@H]2O1 Amb27438167 [0,0,0,1,0,1|2,0,0]=4 6078 B11R2.139 NC1C[C@@H]2OC(=O)O[C@@H]2C1 Amb35788420 [0,0,0,1,0,1|2,0,0]=4 6079 B11R2.139 NC1C[C@@H]2OC(=O)O[C@@H]2C1 Amb35788421 [0,0,0,1,0,1|2,0,0]=4 6080 B11R2.139 O=C1CC2CC(O)CC2O1 Amb27646561 [0,0,0,1,0,1|1,0,0]=3 6081 B11R2.139 O=C1CC2CC(O)CN2N1 Amb27971617 [0,0,0,1,0,1|1,0,0]=3 6082 B11R2.139 O=C1C[C@@H]2C[C@H](O)C[C@@H]2C1 Amb24654615 [0,0,0,1,0,1|2,0,0]=4 6083 B11R2.139 O=C1C[C@@H]2C[C@H](O)C[C@@H]2O1 Amb28062968 [0,0,0,1,0,1|1,0,0]=3 6084 B11R2.139 O=C1C[C@@H]2C[C@H](O)C[C@H]2O1 Amb2684309 [0,0,0,1,0,1|1,0,0]=3 6085 B11R2.139 O=C1C[C@H]2C[C@@H](O)C[C@H]2O1 Amb22801805 [0,0,0,1,0,1|1,0,0]=3 6086 B11R2.139 O=C1C[C@H]2C[C@H](O)CN2N1 Amb28139578 [0,0,0,1,0,1|1,0,0]=3 6087 B11R2.139 O=C1O[C@H]2CC(O)C[C@H]2O1 Amb35750836 [0,0,0,1,0,1|1,0,0]=3 6088 B11R2.408 O=C(O)[C@@H]1[C@H]2C[C@@H]1[C@H](O)C2 Amb28349337 [0,0,0,1,0,1|1,0,0]=3 6089 B11R2.434 O=C1CC2CC(CC2O)O1 Amb27664586 [0,0,0,1,0,1|2,0,0]=4 6090 B11R2.434 O=C1CC2CC(O)C(C1)N2 Amb33716066 [0,0,0,1,0,1|1,0,0]=3 6091 B11R2.434 O=C1C[C@@H]2C[C@@H](O)[C@H](C1)O2 Amb26451148 [0,0,0,1,0,1|2,0,0]=4 6092 B11R2.434 OC1CC2CC(O)C(C1)N2 Amb27403563 [0,0,0,1,0,1|1,0,1]=4 6093 B11R2.434 O[C@@H]1C[C@@H]2N[C@H](C1)C[C@H]2O Amb25174885 [0,0,0,1,0,1|1,0,1]=4 6094 B11R2.530 NC1CCC2C(C(=O)O)C12 Amb26946971 [0,0,0,1,0,1|2,0,0]=4 6095 B11R2.530 O=C(O)C1C2C=CC(O)C21 Amb27481641 [0,0,0,1,0,1|1,0,1]=4 6096 B11R2.823 O=C(O)C1C2CCC1(Cl)C2 Amb27605798 [0,0,0,1,0,1|2,0,0]=4 6097 B11R2.823 O=C(O)[C@@H]1[C@@H]2CC[C@@]1(Cl)C2 Amb27865665 [0,0,0,1,0,1|2,0,0]=4 6098 B11R2.845 O=C(O)C1=C[C@H]2CC[C@@H]1C2 Amb27467878 [0,0,0,1,0,1|2,0,0]=4 6099 B11R2.845 O=C(O)C1CC2CCC1C2 Amb32643951 [0,0,0,1,0,1|2,0,0]=4 6100 B11R2.845 O=C(O)C1CC2CCC1C2 Amb6335820 [0,0,0,1,0,1|2,0,0]=4 6101 B11R2.845 O=C(O)C1CC2CNC1C2 Amb33714481 [0,0,0,1,0,1|1,0,0]=3 6102 B11R2.845 O=C(O)C1CC2CNC1C2 Amb34162363 [0,0,0,1,0,1|1,0,0]=3 6103 B11R2.845 O=C(O)C1C[C@@H]2CC[C@H]1C2 Amb28068735 [0,0,0,1,0,1|2,0,0]=4 6104 B11R2.845 O=C(O)C1NC2CCC1C2 Amb2796335 [0,0,0,1,0,1|2,0,0]=4 6105 B11R2.845 O=C(O)C1NC2CCC1C2 Amb32665985 [0,0,0,1,0,1|2,0,0]=4 6106 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@H]1C2 Amb27421974 [0,0,0,1,0,1|2,0,0]=4 6107 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1C2 Amb24630346 [0,0,0,1,0,1|2,0,0]=4 6108 B11R2.845 O=C(O)[C@@H]1NC2CCC1C2 Amb27776982 [0,0,0,1,0,1|2,0,0]=4 6109 B11R2.845 O=C(O)[C@@H]1N[C@@H]2CC[C@H]1C2 Amb24560741 [0,0,0,1,0,1|2,0,0]=4 6110 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 Amb18180724 [0,0,0,1,0,1|2,0,0]=4 6111 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 Amb22748360 [0,0,0,1,0,1|2,0,0]=4 6112 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@H]1C2 Amb22745380 [0,0,0,1,0,1|2,0,0]=4 6113 B11R2.845 O=C(O)[C@H]1CC2CCC1C2 Amb27252127 [0,0,0,1,0,1|2,0,0]=4 6114 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1C2 Amb27420163 [0,0,0,1,0,1|2,0,0]=4 6115 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@@H]1C2 Amb24548859 [0,0,0,1,0,1|2,0,0]=4 6116 B11R2.845 O=C(O)[C@H]1NC2CCC1C2 Amb26570917 [0,0,0,1,0,1|2,0,0]=4 6117 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@@H]1C2 Amb26546902 [0,0,0,1,0,1|2,0,0]=4 6118 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@@H]1C2 Amb34916347 [0,0,0,1,0,1|2,0,0]=4 6119 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@H]1C2 Amb2371885 [0,0,0,1,0,1|2,0,0]=4 6120 B11R2.857 O=C(O)CC12CC(CN1)C2 Amb24615640 [0,0,0,1,0,1|1,0,0]=3 6121 B11R2.857 O=C(O)CC12CC(CN1)C2 Amb32652252 [0,0,0,1,0,1|1,0,0]=3 6122 B11R2.932 CC(=O)C[C@@H]1CC[C@H]2O[C@@H]12 Amb25179542 [0,0,0,1,0,1|2,0,0]=4 6123 B11R2.932 CC(=O)NC1CCC2OC12 Amb27617073 [0,0,0,1,0,1|2,0,0]=4 6124 B11R2.932 O=C(O)CC1CCC2CC12 Amb25766461 [0,0,0,1,0,1|2,0,0]=4 6125 B11R2.932 O=C(O)CC1NCC2CC21 Amb18831755 [0,0,0,1,0,1|1,0,0]=3 6126 B11R2.934 NC(=O)CC1CC2OC2C1 Amb27843259 [0,0,0,1,0,1|2,0,0]=4 6127 B11R2.934 O=C(O)CC1CC2CC2C1 Amb26067688 [0,0,0,1,0,1|2,0,0]=4 6128 B11R2.47 O=C1C[C@@H]2C=C[C@H]1C[C@@H]2O Amb27428328 [0,0,0,1,0,1|2,0,0]=4 6129 B11R2.47 O=C1C[C@H]2C=C[C@@H]1C[C@@H]2O Amb27854618 [0,0,0,1,0,1|2,0,0]=4 6130 B11R2.47 O=C1C[C@H]2CC[C@@H]1C[C@@H]2O Amb28052469 [0,0,0,1,0,1|2,0,0]=4 6131 B11R2.47 O=C1C[C@H]2CC[C@@H]1C[C@H]2O Amb27211926 [0,0,0,1,0,1|2,0,0]=4 6132 B11R2.47 O=C1C[C@H]2CC[C@H]1CC2O Amb27211980 [0,0,0,1,0,1|2,0,0]=4 6133 B11R2.47 O=C1NC2CCC1CC2O Amb26356211 [0,0,0,1,0,1|2,0,0]=4 6134 B11R2.47 O=C1OC2CCC1CC2Cl Amb27816305 [0,0,0,1,0,1|2,0,0]=4 6135 B11R2.47 O=C1O[C@H]2CC[C@@H]1C[C@@H]2O Amb27630933 [0,0,0,1,0,1|1,0,0]=3 6136 B11R2.357 O=C1CCC2CCNC1C2 Amb33249781 [0,0,0,1,0,1|2,0,0]=4 6137 B11R2.357 O=C1CCC2CCNC1C2 Amb33249782 [0,0,0,1,0,1|2,0,0]=4 6138 B11R2.411 NC1CC2CC2(C(=O)O)C1 Amb32654399 [0,0,0,1,0,1|2,0,0]=4 6139 B11R2.411 NC1CC2CC2(C(=O)O)C1 Amb32753234 [0,0,0,1,0,1|2,0,0]=4 6140 B11R2.411 N[C@@H]1C[C@H]2C[C@@]2(C(=O)O)C1 Amb32671170 [0,0,0,1,0,1|2,0,0]=4 6141 B11R2.411 N[C@@H]1C[C@H]2C[C@@]2(C(=O)O)C1 Amb32674773 [0,0,0,1,0,1|2,0,0]=4 6142 B11R2.587 N[C@@H]1[C@H]2CCC(C(=O)O)[C@H]21 Amb27880917 [0,0,0,1,0,1|2,0,0]=4 6143 B11R2.612 NC1CC(C(=O)O)C2CC12 Amb28436938 [0,0,0,1,0,1|2,0,0]=4 6144 B11R2.612 N[C@@H]1C[C@H](C(=O)O)[C@H]2C[C@H]21 Amb27471877 [0,0,0,1,0,1|2,0,0]=4 6145 B11R2.612 N[C@@H]1C[C@H](C(=O)O)[C@H]2C[C@H]21 Amb33097390 [0,0,0,1,0,1|2,0,0]=4 6146 B11R2.818 O=C(O)C12CCCC1(Br)C2 Amb27797171 [0,0,0,1,0,1|2,0,0]=4 6147 B11R2.846 O=C(O)C1CC2CC(C1)N2 Amb28314296 [0,0,0,1,0,1|2,0,0]=4 6148 B11R2.1826 NC(=O)C12CC(CCN1)C2 Amb27245125 [0,0,0,1,0,1|2,0,0]=4 6149 B11R2.1826 O=C(O)C12CC(CCN1)C2 Amb24479083 [0,0,0,1,0,1|1,0,0]=3 6150 B11R2.1826 O=C(O)C12CC(CCN1)C2 Amb9677536 [0,0,0,1,0,1|1,0,0]=3 6151 B11R2.1826 O=C(O)C12CCCC(C1)C2 Amb25261064 [0,0,0,1,0,1|2,0,0]=4 6152 B11R2.1826 O=C(O)C12CNCC(C1)C2 Amb30588639 [0,0,0,1,0,1|1,0,0]=3 6153 B11R2.1837 O=C(O)C1CCCC2CC21 Amb26335134 [0,0,0,1,0,1|2,0,0]=4 6154 B11R2.1837 O=C(O)C1CCCC2OC21 Amb26014539 [0,0,0,1,0,1|1,0,0]=3 6155 B11R2.1837 O=C(O)C1NCCC2CC21 Amb24758905 [0,0,0,1,0,1|1,0,0]=3 6156 B11R2.1837 O=C(O)C1NCCC2CC21 Amb33295309 [0,0,0,1,0,1|1,0,0]=3 6157 B11R2.1837 O=C(O)C1NCC[C@@H]2C[C@H]12 Amb34913022 [0,0,0,1,0,1|1,0,0]=3 6158 B11R2.1837 O=C(O)C1NCC[C@H]2C[C@@H]12 Amb34158527 [0,0,0,1,0,1|1,0,0]=3 6159 B11R2.1837 O=C(O)[C@@H]1CCC[C@@H]2O[C@@H]21 Amb27626945 [0,0,0,1,0,1|1,0,0]=3 6160 B11R2.1837 O=C(O)[C@@H]1NCC[C@H]2C[C@H]21 Amb33496159 [0,0,0,1,0,1|1,0,0]=3 6161 B11R2.1837 O=C(O)[C@@H]1NCC[C@H]2C[C@H]21 Amb33496160 [0,0,0,1,0,1|1,0,0]=3 6162 B11R2.1837 O=C(O)[C@H]1CCC[C@@H]2C[C@H]12 Amb27630509 [0,0,0,1,0,1|2,0,0]=4 6163 B11R2.60 O=C1CC[C@@H]2[C@@H](O)CC[C@H]12 Amb27880611 [0,1,0,1,0,0|2,0,0]=4 6164 B11R2.60 O=C1NC[C@H]2[C@@H]1CC[C@H]2O Amb28073804 [0,1,0,1,0,0|2,0,0]=4 6165 B11R2.60 O=C1OCC2C(O)CCN12 Amb26009574 [0,1,0,1,0,0|2,0,0]=4 6166 B11R2.60 O=C1OC[C@@H]2C(O)CC[C@H]12 Amb27981491 [0,1,0,1,0,0|1,0,0]=3 6167 B11R2.60 O=C1OC[C@@H]2[C@H](O)CCN12 Amb26389345 [0,1,0,1,0,0|2,0,0]=4 6168 B11R2.60 O=C1OC[C@H]2[C@@H](O)CC[C@@H]12 Amb27427934 [0,1,0,1,0,0|1,0,0]=3 6169 B11R2.60 O=C1OC[C@H]2[C@@H]1CC[C@H]2O Amb27851474 [0,1,0,1,0,0|1,0,0]=3 6170 B11R2.60 O=C1OC[C@H]2[C@H](O)CCN12 Amb28723653 [0,1,0,1,0,0|2,0,0]=4 6171 B11R2.60 OC1CNC2C(O)CNC12 Amb27413283 [0,1,0,1,0,0|1,0,1]=4 6172 B11R2.60 O[C@@H]1CN[C@H]2[C@H](O)CN[C@@H]12 Amb27844246 [0,1,0,1,0,0|1,0,1]=4 6173 B11R2.130 O=C1[C@H](O)C[C@H]2CC[C@@H]1C2 Amb27262851 [0,1,0,1,0,0|2,0,0]=4 6174 B11R2.162 COC1CC2CC1CC2=O Amb26362049 [0,1,0,1,0,0|2,0,0]=4 6175 B11R2.162 CO[C@@H]1C[C@H]2C[C@@H]1CC2=O Amb33743891 [0,1,0,1,0,0|2,0,0]=4 6176 B11R2.162 CO[C@H]1C[C@@H]2C[C@H]1CC2=O Amb27441565 [0,1,0,1,0,0|2,0,0]=4 6177 B11R2.162 O=C1CC2CC1CC2CO Amb27226536 [0,1,0,1,0,0|2,0,0]=4 6178 B11R2.162 O=C1CC2CC1C[C@@H]2CO Amb27433059 [0,1,0,1,0,0|2,0,0]=4 6179 B11R2.162 O\N=C1/C[C@@H]2C[C@H]1C[C@H]2O Amb27427703 [0,1,0,1,0,0|2,0,0]=4 6180 B11R2.738 O=C1C[C@@H]2O[C@H]1[C@H](Cl)[C@@H]2O Amb27788390 [0,1,0,1,0,0|2,0,0]=4 6181 B11R2.738 O=C1C[C@H]2C[C@@H]1[C@@H](O)[C@@H]2O Amb27858294 [0,1,0,1,0,0|2,0,0]=4 6182 B11R2.738 O=C1C[C@H]2O[C@@H]1[C@@H](Cl)C2O Amb27640563 [0,1,0,1,0,0|2,0,0]=4 6183 B11R2.738 O=C1C[C@H]2O[C@@H]1[C@@H](O)[C@@H]2O Amb28057554 [0,1,0,1,0,0|2,0,0]=4 6184 B11R2.738 O=C1NC2CC1C(O)C2O Amb25229024 [0,1,0,1,0,0|2,0,0]=4 6185 B11R2.738 O=C1N[C@@H]2C[C@H]1[C@@H](O)[C@H]2O Amb24669283 [0,1,0,1,0,0|2,0,0]=4 6186 B11R2.897 COC(=O)[C@@]12C[C@@H](Br)[C@@H]1C2 Amb33802822 [0,1,0,1,0,0|2,0,0]=4 6187 B11R2.901 C#CC(=O)C12CC(CN1)C2 Amb35647789 [0,1,0,1,0,0|2,0,0]=4 6188 B11R2.901 C=CC(=O)C12CC(CN1)C2 Amb35647790 [0,1,0,1,0,0|2,0,0]=4 6189 B11R2.901 CCC(=O)C12CC(CN1)C2 Amb35647793 [0,1,0,1,0,0|2,0,0]=4 6190 B11R2.901 COC(=O)C12CC(CN1)C2 Amb24181912 [0,1,0,1,0,0|1,0,0]=3 6191 B11R2.901 COC(=O)C12CC(CN1)C2 Amb27203786 [0,1,0,1,0,0|1,0,0]=3 6192 B11R2.901 NNC(=O)C12CC(CN1)C2 Amb30009240 [0,1,0,1,0,0|2,0,0]=4 6193 B11R2.901 O=C(NO)C12CC(CN1)C2 Amb30009241 [0,1,0,1,0,0|1,0,0]=3 6194 B11R2.911 COC(=O)C1CCC2OC21 Amb25918077 [0,1,0,1,0,0|1,0,0]=3 6195 B11R2.911 COC(=O)C1NCC2CC21 Amb18831779 [0,1,0,1,0,0|1,0,0]=3 6196 B11R2.911 COC(=O)[C@@H]1NC[C@@H]2C[C@@H]21 Amb24183544 [0,1,0,1,0,0|1,0,0]=3 6197 B11R2.911 COC(=O)[C@@H]1NC[C@@H]2C[C@@H]21 Amb33329069 [0,1,0,1,0,0|1,0,0]=3 6198 B11R2.911 COC(=O)[C@@H]1NC[C@H]2C[C@H]21 Amb24183490 [0,1,0,1,0,0|1,0,0]=3 6199 B11R2.911 COC(=O)[C@H]1NC[C@@H]2CC12 Amb32409416 [0,1,0,1,0,0|1,0,0]=3 6200 B11R2.911 COC(=O)[C@H]1NC[C@H]2C[C@@H]21 Amb34915586 [0,1,0,1,0,0|1,0,0]=3 6201 B11R2.911 COC(=O)[C@H]1NC[C@H]2C[C@H]21 Amb24514930 [0,1,0,1,0,0|1,0,0]=3 6202 B11R2.911 COC(=O)[C@H]1NC[C@H]2C[C@H]21 Amb33804066 [0,1,0,1,0,0|1,0,0]=3 6203 B11R2.914 COC(=O)C1CC2CC2C1 Amb27837915 [0,1,0,1,0,0|2,0,0]=4 6204 B11R2.914 COC(=O)C1CC2CC2N1 Amb18831759 [0,1,0,1,0,0|1,0,0]=3 6205 B11R2.914 COC(=O)C1CC2CC2N1 Amb32665938 [0,1,0,1,0,0|1,0,0]=3 6206 B11R2.914 COC(=O)C1CC2OC2C1 Amb18633179 [0,1,0,1,0,0|1,0,0]=3 6207 B11R2.914 COC(=O)C1C[C@@H]2O[C@@H]2C1 Amb31204614 [0,1,0,1,0,0|1,0,0]=3 6208 B11R2.914 COC(=O)C1C[C@@H]2O[C@H]2C1 Amb22756936 [0,1,0,1,0,0|1,0,0]=3 6209 B11R2.914 COC(=O)[C@@H]1C[C@@H]2C[C@@H]2C1 Amb35742003 [0,1,0,1,0,0|2,0,0]=4 6210 B11R2.914 COC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb24544766 [0,1,0,1,0,0|1,0,0]=3 6211 B11R2.914 COC(=O)[C@@H]1C[C@H]2C[C@H]2N1 Amb26600061 [0,1,0,1,0,0|1,0,0]=3 6212 B11R2.914 COC(=O)[C@H]1C[C@@H]2O[C@@H]2C1 Amb22756937 [0,1,0,1,0,0|1,0,0]=3 6213 B11R2.914 O=C(NO)[C@@H]1C[C@@H]2C[C@@H]2C1 Amb35584592 [0,1,0,1,0,0|2,0,0]=4 6214 B11R2.201 O=C1OC(=O)C2CCC1C2 Amb2221144 [0,1,0,1,0,0|1,0,1]=4 6215 B11R2.201 O=C1OC(=O)[C@@H]2CC[C@H]1C2 Amb25275974 [0,1,0,1,0,0|1,0,1]=4 6216 B11R2.221 O=C1NC2(CO)CCC1C2 Amb32863660 [0,1,0,1,0,0|2,0,0]=4 6217 B11R2.576 CC1C2CNC1(C(=O)O)C2 Amb32667608 [0,1,0,1,0,0|1,0,0]=3 6218 B11R2.576 C[C@@H]1[C@@H]2CN[C@@]1(C(=O)O)C2 Amb32667687 [0,1,0,1,0,0|1,0,0]=3 6219 B11R2.576 C[C@@H]1[C@@H]2CN[C@@]1(C(=O)O)C2 Amb32667688 [0,1,0,1,0,0|1,0,0]=3 6220 B11R2.822 O=C(O)[C@@H]1NC[C@@H]2CC[C@@H]21 Amb33743872 [0,1,0,1,0,0|1,0,0]=3 6221 B11R2.822 O=C(O)[C@@H]1NC[C@@H]2CC[C@@H]21 Amb33803658 [0,1,0,1,0,0|1,0,0]=3 6222 B11R2.822 O=C(O)[C@@H]1NC[C@H]2CC[C@H]21 Amb33714601 [0,1,0,1,0,0|1,0,0]=3 6223 B11R2.822 O=C(O)[C@@H]1NC[C@H]2CC[C@H]21 Amb33803580 [0,1,0,1,0,0|1,0,0]=3 6224 B11R2.822 O=C(O)[C@H]1OC[C@@H]2CC[C@H]12 Amb28203936 [0,1,0,1,0,0|2,0,0]=4 6225 B11R2.842 O=C(O)C1CC2CCC2C1 Amb25256091 [0,1,0,1,0,0|2,0,0]=4 6226 B11R2.842 O=C(O)[C@@H]1C[C@@H]2CC[C@@H]2N1 Amb33714602 [0,1,0,1,0,0|1,0,0]=3 6227 B11R2.972 CO[C@@H]1C[C@@]2(C(=O)O)C[C@@H]12 Amb33620687 [0,1,0,1,0,0|1,0,0]=3 6228 B11R2.1151 N#CC12CCC1(C(=O)O)C2 Amb28126783 [0,1,0,1,0,0|2,0,0]=4 6229 B11R2.1868 O=C(O)C1CC2(CC2)CN1 Amb27250425 [0,1,0,1,0,0|1,0,0]=3 6230 B11R2.1868 O=C(O)C1CC2(CC2)CO1 Amb35751162 [0,1,0,1,0,0|2,0,0]=4 6231 B11R2.1868 O=C(O)C1CCC2(C1)N=N2 Amb32415624 [0,1,0,1,0,0|2,0,0]=4 6232 B11R2.1868 O=C(O)C1CCC2(CC2)C1 Amb28423485 [0,1,0,1,0,0|2,0,0]=4 6233 B11R2.1868 O=C(O)[C@@H]1CC2(CC2)CN1 Amb24462994 [0,1,0,1,0,0|1,0,0]=3 6234 B11R2.1868 O=C(O)[C@@H]1CC2(CC2)CN1 Amb30869315 [0,1,0,1,0,0|1,0,0]=3 6235 B11R2.1868 O=C(O)[C@@H]1CC2(CN1)N=N2 Amb25707442 [0,1,0,1,0,0|1,0,0]=3 6236 B11R2.1868 O=C(O)[C@H]1CC2(CC2)CN1 Amb27214686 [0,1,0,1,0,0|1,0,0]=3 6237 B11R2.785 O=C1CC2C1C[C@@H](O)[C@@H]2Br Amb27643649 [0,1,0,1,0,0|2,0,0]=4 6238 B11R2.785 O=C1CC2C1C[C@@H](O)[C@@H]2Cl Amb28248109 [0,1,0,1,0,0|2,0,0]=4 6239 B11R2.785 O=C1C[C@@H]2C(Br)C(O)C[C@H]12 Amb27427915 [0,1,0,1,0,0|2,0,0]=4 6240 B11R2.785 O=C1C[C@H]2[C@@H]1C[C@@H](O)[C@@H]2Br Amb27195485 [0,1,0,1,0,0|2,0,0]=4 6241 B11R2.785 O=C1C[C@H]2[C@H](Br)[C@@H](O)C[C@@H]12 Amb28134631 [0,1,0,1,0,0|2,0,0]=4 6242 B11R2.785 O=C1C[C@H]2[C@H](O)[C@H](O)C[C@@H]12 Amb28052459 [0,1,0,1,0,0|2,0,0]=4 6243 B11R2.1051 O=C1NC2(C(=O)O)CC1C2 Amb34199438 [0,1,0,1,0,0|1,0,1]=4 6244 B11R2.116 CN1C[C@@H]2CCC(=O)[C@H]1C2 Amb27881874 [0,1,0,1,0,0|2,0,0]=4 6245 B11R2.608 CN1C(C(=O)O)CC2CC21 Amb18831778 [0,1,0,1,0,0|1,0,0]=3 6246 B11R2.608 NC1C(C(=O)O)CC2CC21 Amb27445578 [0,1,0,1,0,0|2,0,0]=4 6247 B11R2.730 CN1CC2CC2C1C(=O)O Amb18831780 [0,1,0,1,0,0|1,0,0]=3 6248 B11R2.740 CN1CC2CC1(C(=O)O)C2 Amb27797505 [0,1,0,1,0,0|1,0,0]=3 6249 B11R2.740 CN1CC2CC1(C(=O)O)C2 Amb33482633 [0,1,0,1,0,0|1,0,0]=3 6250 B11R2.740 O=C(O)C12CC(C[C@H]1O)C2 Amb27874073 [0,1,0,1,0,0|2,0,0]=4 6251 B11R2.2454 CC(=O)C12CC(C)(CN1)C2 Amb35641043 [0,1,0,1,0,0|2,0,0]=4 6252 B11R2.2454 CC12CNC(C(=O)O)(C1)C2 Amb28723665 [0,1,0,1,0,0|1,0,0]=3 6253 B11R2.2454 CC12CNC(C(=O)O)(C1)C2 Amb32667007 [0,1,0,1,0,0|1,0,0]=3 6254 B11R2.2454 CC12CNC(C(N)=O)(C1)C2 Amb35641109 [0,1,0,1,0,0|2,0,0]=4 6255 B11R2.2454 CC12COC(C(=O)O)(C1)C2 Amb33038509 [0,1,0,1,0,0|2,0,0]=4 6256 B11R2.2454 NC12CCC(C(=O)O)(C1)C2 Amb27149984 [0,1,0,1,0,0|2,0,0]=4 6257 B11R2.2454 NC12COC(C(=O)O)(C1)C2 Amb35750883 [0,1,0,1,0,0|2,0,0]=4 6258 B11R2.2454 NC12COC(C(=O)O)(C1)C2 Amb35752542 [0,1,0,1,0,0|2,0,0]=4 6259 B11R2.2454 O=C(O)C12CC(F)(CN1)C2 Amb27836266 [0,1,0,1,0,0|1,0,0]=3 6260 B11R2.2454 O=C(O)C12CC(F)(CN1)C2 Amb33620551 [0,1,0,1,0,0|1,0,0]=3 6261 B11R2.2454 O=C(O)C12CCC(F)(C1)C2 Amb33806351 [0,1,0,1,0,0|2,0,0]=4 6262 B11R2.756 CC12CCC(O)C1CC2=O Amb28202275 [0,1,0,1,0,0|2,0,0]=4 6263 B11R2.756 C[C@]12CC[C@@H](O)[C@H]1CC2=O Amb28054454 [0,1,0,1,0,0|2,0,0]=4 6264 B11R2.820 NC1(C(=O)O)CC2CC1C2 Amb25362310 [0,1,0,1,0,0|2,0,0]=4 6265 B11R2.820 O=C(O)[C@]1(O)CC2CC1C2 Amb27882736 [0,1,0,1,0,0|2,0,0]=4 6266 B11R2.849 NC1(C(=O)O)CCC2CC21 Amb19148505 [0,1,0,1,0,0|2,0,0]=4 6267 B11R2.849 NC1(C(=O)O)CCC2CC21 Amb33482905 [0,1,0,1,0,0|2,0,0]=4 6268 B11R2.1850 CC1(C(=O)O)CC2CC2C1 Amb25952225 [0,1,0,1,0,0|2,0,0]=4 6269 B11R3.19 O=C1C[C@@H]2C[C@@H]1[C@@H]3O[C@H]23 Amb27861169 [0,0,0,2,0,0|2,0,0]=4 6270 B11R3.19 O=C1C[C@@H]2C[C@H]1[C@@H]3O[C@H]23 Amb28430165 [0,0,0,2,0,0|2,0,0]=4 6271 B11R3.19 O=C1C[C@@H]2C[C@H]1[C@H]3O[C@@H]23 Amb27195438 [0,0,0,2,0,0|2,0,0]=4 6272 B11R3.19 O=C1C[C@H]2O[C@@H]1[C@@H]3O[C@H]23 Amb24610199 [0,0,0,2,0,0|2,0,0]=4 6273 B11R3.19 O=C1N[C@@H]2C[C@H]1[C@@H]3O[C@@H]32 Amb28401471 [0,0,0,2,0,0|2,0,0]=4 6274 B11R3.19 O=C1N[C@@H]2C[C@H]1[C@H]3O[C@@H]23 Amb25367320 [0,0,0,2,0,0|2,0,0]=4 6275 B11R3.30 O=C1C[C@@H]2[C@H]1C[C@@H]3O[C@@H]32 Amb27629422 [0,0,0,2,0,0|2,0,0]=4 6276 B11R3.30 O=C1N[C@H]2[C@@H]1C[C@@H]3O[C@@H]32 Amb27789938 [0,0,0,2,0,0|2,0,0]=4 6277 B11R3.30 O=C1N[C@H]2[C@@H]1C[C@@H]3O[C@H]32 Amb27880714 [0,0,0,2,0,0|2,0,0]=4 6278 B7R0.16 C=C(C(=O)O)[C@H](C)O Amb27410183 [0,0,1,0,1,0|1,0,1]=4 6279 B7R0.16 C=C(C)C(N)C(=O)O Amb18641831 [0,0,1,0,1,0|1,0,1]=4 6280 B7R0.16 C=C(C)[C@@H](N)C(=O)O Amb26012631 [0,0,1,0,1,0|1,0,1]=4 6281 B7R0.16 CC(=O)C(C)C(C)O Amb17593202 [0,0,1,0,1,0|2,0,0]=4 6282 B7R0.16 CC(=O)C(C)[C@@H](C)O Amb28316228 [0,0,1,0,1,0|2,0,0]=4 6283 B7R0.16 CC(=O)C(F)C(C)O Amb28437134 [0,0,1,0,1,0|2,0,0]=4 6284 B7R0.16 CC(=O)C(N)C(=O)O Amb21962887 [0,0,1,0,1,0|0,0,2]=4 6285 B7R0.16 CC(=O)C(N)C(C)C Amb23536905 [0,0,1,0,1,0|2,0,0]=4 6286 B7R0.16 CC(=O)C(O)C(C)O Amb26597030 [0,0,1,0,1,0|2,0,0]=4 6287 B7R0.16 CC(=O)[C@@H](C)[C@H](C)O Amb26966954 [0,0,1,0,1,0|2,0,0]=4 6288 B7R0.16 CC(=O)[C@@H](N)C(C)C Amb28410324 [0,0,1,0,1,0|2,0,0]=4 6289 B7R0.16 CC(=O)[C@@H](O)[C@@H](C)O Amb24481484 [0,0,1,0,1,0|2,0,0]=4 6290 B7R0.16 CC(=O)[C@@H](O)[C@H](C)O Amb28045145 [0,0,1,0,1,0|2,0,0]=4 6291 B7R0.16 CC(=O)[C@H](C)[C@H](C)O Amb28249967 [0,0,1,0,1,0|2,0,0]=4 6292 B7R0.16 CC(=O)[C@H](O)[C@@H](C)O Amb24701454 [0,0,1,0,1,0|2,0,0]=4 6293 B7R0.16 CC(Br)C(Br)C(=O)O Amb4008645 [0,0,1,0,1,0|2,0,0]=4 6294 B7R0.16 CC(C(=O)[O-])[C@H](C)O Amb27835918 [0,0,1,0,1,0|1,0,1]=4 6295 B7R0.16 CC(C)C(Br)C(=O)O Amb9703217 [0,0,1,0,1,0|2,0,0]=4 6296 B7R0.16 CC(C)C(C)C(=O)O Amb17087469 [0,0,1,0,1,0|2,0,0]=4 6297 B7R0.16 CC(C)C(Cl)C(=O)O Amb6739911 [0,0,1,0,1,0|2,0,0]=4 6298 B7R0.16 CC(C)C(F)C(=O)O Amb19957386 [0,0,1,0,1,0|2,0,0]=4 6299 B7R0.16 CC(C)C(N)C(=O)Cl Amb6740265 [0,0,1,0,1,0|2,0,0]=4 6300 B7R0.16 CC(C)C(N)C(=O)O Amb5718386 [0,0,1,0,1,0|1,0,0]=3 6301 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [0,0,1,0,1,0|2,0,0]=4 6302 B7R0.16 CC(C)C(N)C(N)=O Amb32666402 [0,0,1,0,1,0|2,0,0]=4 6303 B7R0.16 CC(C)C(N)C(N)=O Amb6271181 [0,0,1,0,1,0|2,0,0]=4 6304 B7R0.16 CC(C)C(O)C(=O)O Amb2582547 [0,0,1,0,1,0|2,0,0]=4 6305 B7R0.16 CC(C)C(S)C(=O)O Amb18282761 [0,0,1,0,1,0|2,0,0]=4 6306 B7R0.16 CC(C)[C@@H](Br)C(=O)O Amb8629113 [0,0,1,0,1,0|2,0,0]=4 6307 B7R0.16 CC(C)[C@@H](C)C(=O)O Amb10844600 [0,0,1,0,1,0|2,0,0]=4 6308 B7R0.16 CC(C)[C@@H](N)C(=O)O Amb2720566 [0,0,1,0,1,0|1,0,0]=3 6309 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [0,0,1,0,1,0|2,0,0]=4 6310 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [0,0,1,0,1,0|2,0,0]=4 6311 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb4013551 [0,0,1,0,1,0|2,0,0]=4 6312 B7R0.16 CC(C)[C@@H](O)C(=O)O Amb10071589 [0,0,1,0,1,0|2,0,0]=4 6313 B7R0.16 CC(C)[C@H](Br)C(=O)O Amb8629114 [0,0,1,0,1,0|2,0,0]=4 6314 B7R0.16 CC(C)[C@H](C)C(=O)O Amb10844601 [0,0,1,0,1,0|2,0,0]=4 6315 B7R0.16 CC(C)[C@H](N)C(=O)O Amb2725465 [0,0,1,0,1,0|1,0,0]=3 6316 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16183986 [0,0,1,0,1,0|2,0,0]=4 6317 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16231400 [0,0,1,0,1,0|2,0,0]=4 6318 B7R0.16 CC(C)[C@H](N)C(N)=O Amb30595108 [0,0,1,0,1,0|2,0,0]=4 6319 B7R0.16 CC(C)[C@H](N)[PH](=O)O Amb27814729 [0,0,1,0,1,0|2,0,0]=4 6320 B7R0.16 CC(C)[C@H](O)C(=O)O Amb2694861 [0,0,1,0,1,0|2,0,0]=4 6321 B7R0.16 CC(Cl)C(C)C(=O)O Amb28325096 [0,0,1,0,1,0|2,0,0]=4 6322 B7R0.16 CC(Cl)C(Cl)C(=O)O Amb28396619 [0,0,1,0,1,0|2,0,0]=4 6323 B7R0.16 CC(F)C(N)C(=O)O Amb10838661 [0,0,1,0,1,0|1,0,0]=3 6324 B7R0.16 CC(F)C(N)C(=O)O Amb32752736 [0,0,1,0,1,0|1,0,0]=3 6325 B7R0.16 CC(F)C(N)C(N)=O Amb28250824 [0,0,1,0,1,0|2,0,0]=4 6326 B7R0.16 CC(F)[C@@H](N)C(=O)O Amb28316197 [0,0,1,0,1,0|1,0,0]=3 6327 B7R0.16 CC(N)C(C)C(=O)O Amb18124261 [0,0,1,0,1,0|2,0,0]=4 6328 B7R0.16 CC(N)C(C)C(=O)O Amb28934866 [0,0,1,0,1,0|2,0,0]=4 6329 B7R0.16 CC(N)C(F)C(=O)O Amb27411861 [0,0,1,0,1,0|2,0,0]=4 6330 B7R0.16 CC(N)C(N)C(=O)O Amb22728051 [0,0,1,0,1,0|1,0,0]=3 6331 B7R0.16 CC(N)C(O)C(=O)O Amb18641970 [0,0,1,0,1,0|2,0,0]=4 6332 B7R0.16 CC(N)C(O)C(=O)O Amb33299223 [0,0,1,0,1,0|2,0,0]=4 6333 B7R0.16 CC(N)[C@H](N)C(=O)O Amb25083113 [0,0,1,0,1,0|1,0,0]=3 6334 B7R0.16 CC(N)[C@H](N)C(=O)O Amb33740158 [0,0,1,0,1,0|1,0,0]=3 6335 B7R0.16 CC(O)C(=O)C(=O)O Amb24481396 [0,0,1,0,1,0|1,0,1]=4 6336 B7R0.16 CC(O)C(Br)C(=O)O Amb17594710 [0,0,1,0,1,0|1,0,0]=3 6337 B7R0.16 CC(O)C(C)C(=O)O Amb17615515 [0,0,1,0,1,0|1,0,0]=3 6338 B7R0.16 CC(O)C(Cl)C(=O)O Amb17593522 [0,0,1,0,1,0|1,0,0]=3 6339 B7R0.16 CC(O)C(F)C(=O)O Amb33544667 [0,0,1,0,1,0|1,0,0]=3 6340 B7R0.16 CC(O)C(N)C(=O)Cl Amb27830226 [0,0,1,0,1,0|1,0,0]=3 6341 B7R0.16 CC(O)C(N)C(=O)O Amb32665460 [0,0,1,0,1,0|0,0,0]=2 6342 B7R0.16 CC(O)C(N)C(=O)O Amb9703096 [0,0,1,0,1,0|0,0,0]=2 6343 B7R0.16 CC(O)C(N)C(N)=O Amb18641954 [0,0,1,0,1,0|1,0,0]=3 6344 B7R0.16 CC(O)C(N)C(N)=O Amb4006836 [0,0,1,0,1,0|1,0,0]=3 6345 B7R0.16 CC(O)C(O)C(=O)O Amb18124272 [0,0,1,0,1,0|1,0,0]=3 6346 B7R0.16 CC(O)[C@H](N)C(N)=O Amb27643319 [0,0,1,0,1,0|1,0,0]=3 6347 B7R0.16 CC(S)C(N)C(=O)O Amb17593434 [0,0,1,0,1,0|0,1,0]=3 6348 B7R0.16 CC(S)[C@@H](N)C(=O)O Amb24606864 [0,0,1,0,1,0|0,1,0]=3 6349 B7R0.16 C[C@@H](Cl)[C@@H](Cl)C(=O)O Amb28343001 [0,0,1,0,1,0|2,0,0]=4 6350 B7R0.16 C[C@@H](Cl)[C@H](Cl)C(=O)O Amb28283911 [0,0,1,0,1,0|2,0,0]=4 6351 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb28286576 [0,0,1,0,1,0|1,0,0]=3 6352 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb32668519 [0,0,1,0,1,0|1,0,0]=3 6353 B7R0.16 C[C@@H](N)[C@@H](C)C(=O)O Amb25679842 [0,0,1,0,1,0|2,0,0]=4 6354 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb22745441 [0,0,1,0,1,0|1,0,0]=3 6355 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb24481409 [0,0,1,0,1,0|1,0,0]=3 6356 B7R0.16 C[C@@H](O)C(N)C(=O)O Amb26397429 [0,0,1,0,1,0|0,0,0]=2 6357 B7R0.16 C[C@@H](O)[C@@H](Cl)C(=O)O Amb27489415 [0,0,1,0,1,0|1,0,0]=3 6358 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O Amb8514159 [0,0,1,0,1,0|0,0,0]=2 6359 B7R0.16 C[C@@H](O)[C@@H](O)C(=O)O Amb27812084 [0,0,1,0,1,0|1,0,0]=3 6360 B7R0.16 C[C@@H](O)[C@H](Cl)C(=O)O Amb27188843 [0,0,1,0,1,0|1,0,0]=3 6361 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb22351168 [0,0,1,0,1,0|0,0,0]=2 6362 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb33623705 [0,0,1,0,1,0|0,0,0]=2 6363 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb6599999 [0,0,1,0,1,0|0,0,0]=2 6364 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O Amb17942942 [0,0,1,0,1,0|1,0,0]=3 6365 B7R0.16 C[C@@H](S)[C@H](N)C(=O)O Amb24117242 [0,0,1,0,1,0|0,1,0]=3 6366 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O Amb10844572 [0,0,1,0,1,0|1,0,0]=3 6367 B7R0.16 C[C@H](Cl)[C@H](Cl)C(=O)O Amb27955873 [0,0,1,0,1,0|2,0,0]=4 6368 B7R0.16 C[C@H](N)[C@@H](C)C(=O)O Amb26887656 [0,0,1,0,1,0|2,0,0]=4 6369 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O Amb27751951 [0,0,1,0,1,0|2,0,0]=4 6370 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb17678797 [0,0,1,0,1,0|1,0,0]=3 6371 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb26887696 [0,0,1,0,1,0|1,0,0]=3 6372 B7R0.16 C[C@H](O)[C@@H](Br)C(=O)O Amb27476235 [0,0,1,0,1,0|1,0,0]=3 6373 B7R0.16 C[C@H](O)[C@@H](F)C(=O)O Amb27837922 [0,0,1,0,1,0|1,0,0]=3 6374 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O Amb6297293 [0,0,1,0,1,0|0,0,0]=2 6375 B7R0.16 C[C@H](O)[C@@H](O)C(=O)O Amb25844932 [0,0,1,0,1,0|1,0,0]=3 6376 B7R0.16 C[C@H](O)[C@H](Br)C(=O)O Amb27409077 [0,0,1,0,1,0|1,0,0]=3 6377 B7R0.16 C[C@H](O)[C@H](C)C(=O)O Amb27440373 [0,0,1,0,1,0|1,0,0]=3 6378 B7R0.16 C[C@H](O)[C@H](Cl)C(=O)O Amb27410667 [0,0,1,0,1,0|1,0,0]=3 6379 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb32663639 [0,0,1,0,1,0|0,0,0]=2 6380 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb8514158 [0,0,1,0,1,0|0,0,0]=2 6381 B7R0.16 C[C@H](O)[C@H](O)C(=O)O Amb27831803 [0,0,1,0,1,0|1,0,0]=3 6382 B7R0.16 C\C(O)=C(\N)C(=O)O Amb27191761 [0,0,1,0,1,0|0,0,2]=4 6383 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,0,1,0,1,0|1,0,1]=4 6384 B7R0.16 NC(C(=O)O)C(F)F Amb24713127 [0,0,1,0,1,0|2,0,0]=4 6385 B7R0.16 NC(C(=O)O)C(F)F Amb32644474 [0,0,1,0,1,0|2,0,0]=4 6386 B7R0.16 N[C@@H](C(=O)O)S(=O)O Amb28125643 [0,0,1,0,1,0|2,0,0]=4 6387 B7R0.16 N[C@H](C(=O)O)C(O)O Amb27867398 [0,0,1,0,1,0|1,0,0]=3 6388 B7R1.8 C=CC1CCC1O Amb25848177 [1,0,0,0,1,0|2,0,0]=4 6389 B7R1.8 C=C[C@@H]1CC[C@@H]1O Amb27184314 [1,0,0,0,1,0|2,0,0]=4 6390 B7R1.8 C=C[C@@H]1CC[C@H]1O Amb27780489 [1,0,0,0,1,0|2,0,0]=4 6391 B7R1.8 C[C@@H]1CC[C@H]1C=O Amb27841156 [1,0,0,0,1,0|2,0,0]=4 6392 B7R1.8 O=CC1CCC1F Amb32943810 [1,0,0,0,1,0|2,0,0]=4 6393 B7R1.8 OCC1CCC1O Amb26956761 [1,0,0,0,1,0|1,0,1]=4 6394 B7R1.8 OCC1NC[C@@H]1O Amb27265630 [1,0,0,0,1,0|0,0,1]=3 6395 B7R1.8 OC[C@@H]1CC[C@H]1O Amb34160319 [1,0,0,0,1,0|1,0,1]=4 6396 B7R1.8 OC[C@H]1CC[C@H]1O Amb25662759 [1,0,0,0,1,0|1,0,1]=4 6397 B7R1.8 OC[C@H]1NC[C@H]1O Amb28383856 [1,0,0,0,1,0|0,0,1]=3 6398 B7R1.8 OC[C@H]1SC[C@@H]1O Amb28136441 [1,0,0,0,1,0|1,0,1]=4 6399 B7R1.8 OC[C@H]1SC[C@H]1O Amb27195387 [1,0,0,0,1,0|1,0,1]=4 6400 B7R1.10 C=C1CC(C=O)C1 Amb22896623 [1,0,0,0,1,0|1,0,1]=4 6401 B7R1.10 C=C[C@H]1C[C@@H](O)C1 Amb27981576 [1,0,0,0,1,0|1,0,0]=3 6402 B7R1.10 CC1CC(C=O)C1 Amb27827798 [1,0,0,0,1,0|1,0,0]=3 6403 B7R1.10 CC1CC(CO)C1 Amb23556375 [1,0,0,0,1,0|1,0,1]=4 6404 B7R1.10 CC1CC(CO)N1 Amb33802775 [1,0,0,0,1,0|1,0,1]=4 6405 B7R1.10 CC1CN(C=O)C1 Amb35587584 [1,0,0,0,1,0|2,0,0]=4 6406 B7R1.10 CNC1CC(O)C1 Amb19149003 [1,0,0,0,1,0|2,0,0]=4 6407 B7R1.10 CNC1CC(O)C1 Amb20623567 [1,0,0,0,1,0|2,0,0]=4 6408 B7R1.10 CN[C@H]1C[C@@H](O)C1 Amb23440266 [1,0,0,0,1,0|2,0,0]=4 6409 B7R1.10 CN[C@H]1C[C@H](O)C1 Amb23440035 [1,0,0,0,1,0|2,0,0]=4 6410 B7R1.10 CN[C@H]1C[C@H](O)C1 Amb25173769 [1,0,0,0,1,0|2,0,0]=4 6411 B7R1.10 COC1CC(O)C1 Amb26975414 [1,0,0,0,1,0|2,0,0]=4 6412 B7R1.10 CO[C@H]1C[C@@H](O)C1 Amb26045464 [1,0,0,0,1,0|2,0,0]=4 6413 B7R1.10 CO[C@H]1C[C@H](O)C1 Amb26642540 [1,0,0,0,1,0|2,0,0]=4 6414 B7R1.10 CSC1CC(O)C1 Amb24581791 [1,0,0,0,1,0|2,0,0]=4 6415 B7R1.10 CS[C@H]1C[C@@H](O)C1 Amb32660479 [1,0,0,0,1,0|2,0,0]=4 6416 B7R1.10 N#CC1CC(O)C1 Amb21857679 [1,0,0,0,1,0|1,0,1]=4 6417 B7R1.10 N#C[C@H]1C[C@@H](O)C1 Amb24480982 [1,0,0,0,1,0|1,0,1]=4 6418 B7R1.10 NC1CC(CO)C1 Amb21960726 [1,0,0,0,1,0|1,0,1]=4 6419 B7R1.10 NC1CC(CO)C1 Amb23570501 [1,0,0,0,1,0|1,0,1]=4 6420 B7R1.10 NCC1CC(O)C1 Amb21962033 [1,0,0,0,1,0|1,0,1]=4 6421 B7R1.10 NCC1CC(O)C1 Amb22405901 [1,0,0,0,1,0|1,0,1]=4 6422 B7R1.10 NC[C@H]1C[C@@H](O)C1 Amb22831753 [1,0,0,0,1,0|1,0,1]=4 6423 B7R1.10 NC[C@H]1C[C@@H](O)C1 Amb22899743 [1,0,0,0,1,0|1,0,1]=4 6424 B7R1.10 NC[C@H]1C[C@H](O)C1 Amb22899712 [1,0,0,0,1,0|1,0,1]=4 6425 B7R1.10 NC[C@H]1C[C@H](O)C1 Amb22899737 [1,0,0,0,1,0|1,0,1]=4 6426 B7R1.10 NN[C@H]1C[C@@H](O)C1 Amb34151267 [1,0,0,0,1,0|2,0,0]=4 6427 B7R1.10 NN[C@H]1C[C@H](O)C1 Amb34161650 [1,0,0,0,1,0|2,0,0]=4 6428 B7R1.10 N[C@H]1C[C@@H](CO)C1 Amb22745997 [1,0,0,0,1,0|1,0,1]=4 6429 B7R1.10 N[C@H]1C[C@@H](CO)C1 Amb22747308 [1,0,0,0,1,0|1,0,1]=4 6430 B7R1.10 N[C@H]1C[C@H](CO)C1 Amb23439196 [1,0,0,0,1,0|1,0,1]=4 6431 B7R1.10 N[C@H]1C[C@H](CO)C1 Amb25124019 [1,0,0,0,1,0|1,0,1]=4 6432 B7R1.10 O=CC1CC(F)C1 Amb28198994 [1,0,0,0,1,0|1,0,0]=3 6433 B7R1.10 O=CC1CC(O)C1 Amb33512133 [1,0,0,0,1,0|0,0,0]=2 6434 B7R1.10 OC1CC(CBr)C1 Amb25986866 [1,0,0,0,1,0|1,0,1]=4 6435 B7R1.10 OC1CC(CF)C1 Amb34138419 [1,0,0,0,1,0|1,0,1]=4 6436 B7R1.10 OCC1CC(Br)C1 Amb35747688 [1,0,0,0,1,0|1,0,1]=4 6437 B7R1.10 OCC1CC(Cl)C1 Amb21962428 [1,0,0,0,1,0|1,0,1]=4 6438 B7R1.10 OCC1CC(F)C1 Amb22886692 [1,0,0,0,1,0|1,0,1]=4 6439 B7R1.10 OCC1CC(O)C1 Amb22284484 [1,0,0,0,1,0|0,0,1]=3 6440 B7R1.10 OC[C@H]1C[C@H](O)C1 Amb27490798 [1,0,0,0,1,0|0,0,1]=3 6441 B7R1.10 O[C@H]1C[C@@H](CBr)C1 Amb27850666 [1,0,0,0,1,0|1,0,1]=4 6442 B7R1.10 O[C@H]1C[C@@H](CF)C1 Amb34136579 [1,0,0,0,1,0|1,0,1]=4 6443 B7R1.10 O[C@H]1C[C@H](CBr)C1 Amb34164797 [1,0,0,0,1,0|1,0,1]=4 6444 B7R1.18 C=C(C)C1CCC1 Amb25662691 [1,0,0,0,1,0|2,0,0]=4 6445 B7R1.18 C=C(C)C1CCN1 Amb33199611 [1,0,0,0,1,0|2,0,0]=4 6446 B7R1.18 C=C(F)C1CCC1 Amb27403200 [1,0,0,0,1,0|2,0,0]=4 6447 B7R1.18 CC(=O)C1CCC1 Amb4037098 [1,0,0,0,1,0|1,0,0]=3 6448 B7R1.18 CC(=O)C1CCN1 Amb28142364 [1,0,0,0,1,0|1,0,0]=3 6449 B7R1.18 CC(=O)C1CNC1 Amb23400009 [1,0,0,0,1,0|2,0,0]=4 6450 B7R1.18 CC(=O)C1CNC1 Amb23401240 [1,0,0,0,1,0|2,0,0]=4 6451 B7R1.18 CC(=O)C1CNC1 Amb33473586 [1,0,0,0,1,0|2,0,0]=4 6452 B7R1.18 CC(=O)C1COC1 Amb27397483 [1,0,0,0,1,0|2,0,0]=4 6453 B7R1.18 CC(=O)C1CSC1 Amb29849423 [1,0,0,0,1,0|2,0,0]=4 6454 B7R1.18 CC(=O)N1CCC1 Amb22008358 [1,0,0,0,1,0|2,0,0]=4 6455 B7R1.18 CC(O)C1CCC1 Amb10603414 [1,0,0,0,1,0|1,0,1]=4 6456 B7R1.18 C[C@@H](O)C1CCC1 Amb24478546 [1,0,0,0,1,0|1,0,1]=4 6457 B7R1.18 C[C@H](O)C1CCC1 Amb25145632 [1,0,0,0,1,0|1,0,1]=4 6458 B7R1.18 N=C(N)C1CCC1 Amb2695056 [1,0,0,0,1,0|2,0,0]=4 6459 B7R1.18 N=C(N)C1CCC1 Amb33528962 [1,0,0,0,1,0|2,0,0]=4 6460 B7R1.18 N=C(N)C1CCN1 Amb28410949 [1,0,0,0,1,0|2,0,0]=4 6461 B7R1.18 N=C(N)[C@@H]1CCN1 Amb27790002 [1,0,0,0,1,0|2,0,0]=4 6462 B7R1.18 NC(=O)C1CCC1 Amb33552668 [1,0,0,0,1,0|1,0,0]=3 6463 B7R1.18 NC(=O)C1CCN1 Amb22230240 [1,0,0,0,1,0|1,0,0]=3 6464 B7R1.18 NC(=O)C1CCN1 Amb22491865 [1,0,0,0,1,0|1,0,0]=3 6465 B7R1.18 NC(=O)C1CNC1 Amb10976072 [1,0,0,0,1,0|2,0,0]=4 6466 B7R1.18 NC(=O)C1CNC1 Amb20061301 [1,0,0,0,1,0|2,0,0]=4 6467 B7R1.18 NC(=O)C1CNC1 Amb21960249 [1,0,0,0,1,0|2,0,0]=4 6468 B7R1.18 NC(=O)C1CSC1 Amb27209831 [1,0,0,0,1,0|2,0,0]=4 6469 B7R1.18 NC(=O)N1CCC1 Amb25326782 [1,0,0,0,1,0|2,0,0]=4 6470 B7R1.18 NC(=O)[C@@H]1CCN1 Amb27454228 [1,0,0,0,1,0|1,0,0]=3 6471 B7R1.18 NC(=S)C1CCC1 Amb18108358 [1,0,0,0,1,0|1,1,0]=4 6472 B7R1.18 NS(=O)C1CCC1 Amb32720395 [1,0,0,0,1,0|2,0,0]=4 6473 B7R1.18 O=C(Br)C1CCC1 Amb28291328 [1,0,0,0,1,0|1,0,0]=3 6474 B7R1.18 O=C(Cl)C1CCC1 Amb33528386 [1,0,0,0,1,0|1,0,0]=3 6475 B7R1.18 O=C(Cl)N1CCC1 Amb28144777 [1,0,0,0,1,0|2,0,0]=4 6476 B7R1.18 O=C(O)C1=CCC1 Amb17593068 [1,0,0,0,1,0|0,0,2]=4 6477 B7R1.18 O=C(O)C1CCC1 Amb2686619 [1,0,0,0,1,0|0,0,0]=2 6478 B7R1.18 O=C(O)C1CCN1 Amb2371568 [1,0,0,0,1,0|0,0,0]=2 6479 B7R1.18 O=C(O)C1CCN1 Amb8391098 [1,0,0,0,1,0|0,0,0]=2 6480 B7R1.18 O=C(O)C1CCO1 Amb2383526 [1,0,0,0,1,0|1,0,0]=3 6481 B7R1.18 O=C(O)C1CCS1 Amb27209836 [1,0,0,0,1,0|1,0,0]=3 6482 B7R1.18 O=C(O)C1CNC1 Amb2444164 [1,0,0,0,1,0|1,0,0]=3 6483 B7R1.18 O=C(O)C1CNC1 Amb8384273 [1,0,0,0,1,0|1,0,0]=3 6484 B7R1.18 O=C(O)C1COC1 Amb33542663 [1,0,0,0,1,0|1,0,0]=3 6485 B7R1.18 O=C(O)C1CSC1 Amb20171470 [1,0,0,0,1,0|1,0,0]=3 6486 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [1,0,0,0,1,0|0,0,0]=2 6487 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [1,0,0,0,1,0|0,0,0]=2 6488 B7R1.18 O=C(O)[C@@H]1CCO1 Amb33482870 [1,0,0,0,1,0|1,0,0]=3 6489 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [1,0,0,0,1,0|0,0,0]=2 6490 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [1,0,0,0,1,0|0,0,0]=2 6491 B7R1.18 O=C(O)[C@H]1CCO1 Amb33483353 [1,0,0,0,1,0|1,0,0]=3 6492 B7R1.18 O=S(Cl)C1CCC1 Amb32720394 [1,0,0,0,1,0|2,0,0]=4 6493 B7R1.18 O=S([O-])C1CCC1 Amb32755305 [1,0,0,0,1,0|1,0,1]=4 6494 B7R1.18 O=[N+]([O-])C1CCC1 Amb13883563 [1,0,0,0,1,0|1,0,1]=4 6495 B7R1.18 OB(O)C1CCC1 Amb10071491 [1,0,0,0,1,0|1,0,1]=4 6496 B7R1.12 C=C1CC1C(=O)O Amb9774969 [0,0,0,0,2,0|1,0,1]=4 6497 B7R1.12 CC(=O)C1CC1C Amb25720437 [0,0,0,0,2,0|2,0,0]=4 6498 B7R1.12 CC(=O)[C@@H]1C[C@H]1C Amb27262976 [0,0,0,0,2,0|2,0,0]=4 6499 B7R1.12 CC(=O)[C@H]1C[C@@H]1C Amb27493483 [0,0,0,0,2,0|2,0,0]=4 6500 B7R1.12 CC1CC1C(=O)Cl Amb33528387 [0,0,0,0,2,0|2,0,0]=4 6501 B7R1.12 CC1CC1C(=O)O Amb9703126 [0,0,0,0,2,0|1,0,0]=3 6502 B7R1.12 CC1CC1C(N)=O Amb8858378 [0,0,0,0,2,0|2,0,0]=4 6503 B7R1.12 CC1OC1C(=O)O Amb17593088 [0,0,0,0,2,0|2,0,0]=4 6504 B7R1.12 CC1SC1C(=O)O Amb27195238 [0,0,0,0,2,0|2,0,0]=4 6505 B7R1.12 CC1S[C@H]1C(=O)O Amb27399596 [0,0,0,0,2,0|2,0,0]=4 6506 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [0,0,0,0,2,0|1,0,0]=3 6507 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [0,0,0,0,2,0|2,0,0]=4 6508 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [0,0,0,0,2,0|1,0,0]=3 6509 B7R1.12 C[C@@H]1C[C@H]1C(N)=O Amb27201134 [0,0,0,0,2,0|2,0,0]=4 6510 B7R1.12 C[C@@H]1N[C@H]1C(=O)O Amb24120621 [0,0,0,0,2,0|1,0,0]=3 6511 B7R1.12 C[C@@H]1O[C@@H]1C(=O)O Amb28347451 [0,0,0,0,2,0|2,0,0]=4 6512 B7R1.12 C[C@@H]1O[C@H]1C(=O)O Amb25738149 [0,0,0,0,2,0|2,0,0]=4 6513 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [0,0,0,0,2,0|1,0,0]=3 6514 B7R1.12 C[C@H]1C[C@@H]1C(N)=O Amb27213992 [0,0,0,0,2,0|2,0,0]=4 6515 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [0,0,0,0,2,0|1,0,0]=3 6516 B7R1.12 C[C@H]1O[C@@H]1C(=O)O Amb27420167 [0,0,0,0,2,0|2,0,0]=4 6517 B7R1.12 C[C@H]1O[C@H]1C(=O)O Amb27237050 [0,0,0,0,2,0|2,0,0]=4 6518 B7R1.12 NC(=O)C1CC1Br Amb27838278 [0,0,0,0,2,0|2,0,0]=4 6519 B7R1.12 NC(=O)C1CC1F Amb26026786 [0,0,0,0,2,0|2,0,0]=4 6520 B7R1.12 NC(=O)C1CC1N Amb18279694 [0,0,0,0,2,0|2,0,0]=4 6521 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F Amb27758752 [0,0,0,0,2,0|2,0,0]=4 6522 B7R1.12 NC(=O)[C@@H]1C[C@H]1F Amb27403700 [0,0,0,0,2,0|2,0,0]=4 6523 B7R1.12 NC1CC1C(=O)O Amb7762823 [0,0,0,0,2,0|1,0,0]=3 6524 B7R1.12 N[C@@H]1C[C@@H]1C(=O)O Amb25708637 [0,0,0,0,2,0|1,0,0]=3 6525 B7R1.12 N[C@H]1C[C@H]1C(=O)O Amb27630656 [0,0,0,0,2,0|1,0,0]=3 6526 B7R1.12 O=C(Cl)C1CC1Cl Amb27865442 [0,0,0,0,2,0|2,0,0]=4 6527 B7R1.12 O=C(Cl)C1CC1F Amb8389490 [0,0,0,0,2,0|2,0,0]=4 6528 B7R1.12 O=C(Cl)[C@@H]1C[C@@H]1Cl Amb28291528 [0,0,0,0,2,0|2,0,0]=4 6529 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [0,0,0,0,2,0|2,0,0]=4 6530 B7R1.12 O=C(O)C1CC1Br Amb27760446 [0,0,0,0,2,0|1,0,0]=3 6531 B7R1.12 O=C(O)C1CC1Cl Amb28289730 [0,0,0,0,2,0|1,0,0]=3 6532 B7R1.12 O=C(O)C1CC1F Amb22490547 [0,0,0,0,2,0|1,0,0]=3 6533 B7R1.12 O=C(O)C1CC1I Amb26047069 [0,0,0,0,2,0|1,0,0]=3 6534 B7R1.12 O=C(O)C1CC1S Amb20246988 [0,0,0,0,2,0|0,1,0]=3 6535 B7R1.12 O=C(O)[C@@H]1CC1I Amb27616342 [0,0,0,0,2,0|1,0,0]=3 6536 B7R1.12 O=C(O)[C@@H]1C[C@@H]1Br Amb27232903 [0,0,0,0,2,0|1,0,0]=3 6537 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb22737600 [0,0,0,0,2,0|1,0,0]=3 6538 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb33716967 [0,0,0,0,2,0|1,0,0]=3 6539 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I Amb22756600 [0,0,0,0,2,0|1,0,0]=3 6540 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br Amb24570997 [0,0,0,0,2,0|1,0,0]=3 6541 B7R1.12 O=C(O)[C@@H]1C[C@H]1Cl Amb28252777 [0,0,0,0,2,0|1,0,0]=3 6542 B7R1.12 O=C(O)[C@@H]1C[C@H]1F Amb22737604 [0,0,0,0,2,0|1,0,0]=3 6543 B7R1.12 O=C(O)[C@@H]1C[C@H]1I Amb26636211 [0,0,0,0,2,0|1,0,0]=3 6544 B7R1.12 O=C(O)[C@H]1C[C@@H]1Cl Amb27655606 [0,0,0,0,2,0|1,0,0]=3 6545 B7R1.12 O=C(O)[C@H]1C[C@@H]1F Amb22736113 [0,0,0,0,2,0|1,0,0]=3 6546 B7R1.12 O=C(O)[C@H]1C[C@@H]1I Amb27968689 [0,0,0,0,2,0|1,0,0]=3 6547 B7R1.12 O=C(O)[C@H]1C[C@H]1F Amb22738580 [0,0,0,0,2,0|1,0,0]=3 6548 B7R1.12 O=C(O)[C@H]1C[C@H]1I Amb22736654 [0,0,0,0,2,0|1,0,0]=3 6549 B9R0.4 CC(=O)NC(C)CCCO Amb28120258 [0,0,1,0,0,1|2,0,0]=4 6550 B9R0.4 CC(=O)\C=C(\C)NCCO Amb24358034 [0,0,1,0,0,1|1,0,1]=4 6551 B9R0.4 CC(CC(=O)O)NCCF Amb28144859 [0,0,1,0,0,1|1,0,0]=3 6552 B9R0.4 CC(CC(=O)O)NCCO Amb9398895 [0,0,1,0,0,1|0,0,0]=2 6553 B9R0.4 CC(CC(=O)O)SCCN Amb18788220 [0,0,1,0,0,1|2,0,0]=4 6554 B9R0.4 CC(CC(=O)O)SCCO Amb9481722 [0,0,1,0,0,1|1,0,0]=3 6555 B9R0.4 CC(CCCCl)CC(=O)O Amb18646190 [0,0,1,0,0,1|2,0,0]=4 6556 B9R0.4 CC(CCCO)CC(=O)O Amb28050163 [0,0,1,0,0,1|1,0,0]=3 6557 B9R0.4 CC(CCCS)CC(=O)O Amb27443015 [0,0,1,0,0,1|1,1,0]=4 6558 B9R0.4 CC(O)CC(C)NCCO Amb27974890 [0,0,1,0,0,1|1,0,1]=4 6559 B9R0.4 CCCCC(C)CC(=O)O Amb6740296 [0,0,1,0,0,1|2,0,0]=4 6560 B9R0.4 CCCC[C@@H](C)CC(=O)O Amb25887593 [0,0,1,0,0,1|2,0,0]=4 6561 B9R0.4 CCCC[C@H](C)CC(=O)O Amb27424971 [0,0,1,0,0,1|2,0,0]=4 6562 B9R0.4 CCONC(C)CC(=O)O Amb28137486 [0,0,1,0,0,1|2,0,0]=4 6563 B9R0.14 CCC(CCO)CC(=O)O Amb27216253 [0,0,1,0,0,1|1,0,0]=3 6564 B9R0.14 CCC(CCO)OC(C)=O Amb28050736 [0,0,1,0,0,1|2,0,0]=4 6565 B9R0.14 CCCC(CC(=O)O)SC Amb27660749 [0,0,1,0,0,1|2,0,0]=4 6566 B9R0.14 CCCC(CC)CC(=O)O Amb18124694 [0,0,1,0,0,1|2,0,0]=4 6567 B9R0.14 CCN(CCO)CC(=O)O Amb5761133 [0,0,1,0,0,1|2,0,0]=4 6568 B9R0.14 CO\C(=C\C(=O)O)CCO Amb27153734 [0,0,1,0,0,1|1,0,1]=4 6569 B9R0.55 C=C(C)CCNC[C@@H](C)O Amb27232911 [0,0,1,0,0,1|2,0,0]=4 6570 B9R0.55 C=C(C)CONCC(=O)O Amb27969663 [0,0,1,0,0,1|1,0,1]=4 6571 B9R0.55 CC(=O)CCCCC(C)O Amb27838002 [0,0,1,0,0,1|2,0,0]=4 6572 B9R0.55 CC(=O)CCNCC(=O)O Amb32675828 [0,0,1,0,0,1|0,0,2]=4 6573 B9R0.55 CC(=O)CCNCC(C)C Amb26410166 [0,0,1,0,0,1|2,0,0]=4 6574 B9R0.55 CC(=O)NCCCC(C)O Amb28076577 [0,0,1,0,0,1|2,0,0]=4 6575 B9R0.55 CC(=O)OCCC[C@@H](C)O Amb27775430 [0,0,1,0,0,1|2,0,0]=4 6576 B9R0.55 CC(Br)COCCC(=O)O Amb28255646 [0,0,1,0,0,1|2,0,0]=4 6577 B9R0.55 CC(C)CC#CCC(=O)O Amb27754079 [0,0,1,0,0,1|2,0,0]=4 6578 B9R0.55 CC(C)CCCCC(=O)O Amb10576144 [0,0,1,0,0,1|2,0,0]=4 6579 B9R0.55 CC(C)CCNCC(=O)O Amb1111021 [0,0,1,0,0,1|1,0,0]=3 6580 B9R0.55 CC(C)CCNCC(N)=O Amb1112311 [0,0,1,0,0,1|2,0,0]=4 6581 B9R0.55 CC(C)CCOCC(=O)O Amb6268007 [0,0,1,0,0,1|2,0,0]=4 6582 B9R0.55 CC(C)CCSCC(=O)O Amb1137397 [0,0,1,0,0,1|2,0,0]=4 6583 B9R0.55 CC(C)CNCCC(=O)O Amb10609230 [0,0,1,0,0,1|1,0,0]=3 6584 B9R0.55 CC(C)CNCCC(=O)O Amb2372367 [0,0,1,0,0,1|1,0,0]=3 6585 B9R0.55 CC(C)COCCC(=O)O Amb6280020 [0,0,1,0,0,1|2,0,0]=4 6586 B9R0.55 CC(C)CSCCC(=O)O Amb6278798 [0,0,1,0,0,1|2,0,0]=4 6587 B9R0.55 CC(C)CSSCC(=O)O Amb27865411 [0,0,1,0,0,1|2,0,0]=4 6588 B9R0.55 CC(C)NCCCC(=O)O Amb1111231 [0,0,1,0,0,1|2,0,0]=4 6589 B9R0.55 CC(C)NCCCC(=O)O Amb528115 [0,0,1,0,0,1|2,0,0]=4 6590 B9R0.55 CC(C)OCCCC(=O)O Amb6274334 [0,0,1,0,0,1|2,0,0]=4 6591 B9R0.55 CC(C)OCOCC(=O)O Amb26370232 [0,0,1,0,0,1|2,0,0]=4 6592 B9R0.55 CC(C)OCSCC(=O)O Amb28241661 [0,0,1,0,0,1|2,0,0]=4 6593 B9R0.55 CC(C)SCCCC(=O)O Amb17503621 [0,0,1,0,0,1|2,0,0]=4 6594 B9R0.55 CC(F)CCOCC(=O)O Amb27613091 [0,0,1,0,0,1|2,0,0]=4 6595 B9R0.55 CC(F)CCSCC(=O)O Amb27777659 [0,0,1,0,0,1|2,0,0]=4 6596 B9R0.55 CC(N)CCCCC(=O)O Amb18644199 [0,0,1,0,0,1|2,0,0]=4 6597 B9R0.55 CC(N)CCCCC(=O)O Amb19515386 [0,0,1,0,0,1|2,0,0]=4 6598 B9R0.55 CC(N)CCSCC(=O)O Amb27436369 [0,0,1,0,0,1|2,0,0]=4 6599 B9R0.55 CC(O)CCNCC(C)O Amb28382659 [0,0,1,0,0,1|1,0,1]=4 6600 B9R0.55 CC(O)CNNCC(C)O Amb27839323 [0,0,1,0,0,1|1,0,1]=4 6601 B9R0.55 CC(O)CSCCC(=O)O Amb18792572 [0,0,1,0,0,1|1,0,0]=3 6602 B9R0.55 CC(O)CSCCC(N)=O Amb27976132 [0,0,1,0,0,1|2,0,0]=4 6603 B9R0.55 CC(O)\C=C\CCC(=O)O Amb24453133 [0,0,1,0,0,1|1,0,1]=4 6604 B9R0.55 CN(C)CCNCC(=O)O Amb31292878 [0,0,1,0,0,1|2,0,0]=4 6605 B9R0.55 C[C@@H](N)CCCCC(=O)O Amb25877255 [0,0,1,0,0,1|2,0,0]=4 6606 B9R0.55 C[C@@H](O)CSCCC(N)=O Amb27795743 [0,0,1,0,0,1|2,0,0]=4 6607 B9R0.55 C[C@H](O)CNCCC(N)=O Amb27464472 [0,0,1,0,0,1|1,0,0]=3 6608 B9R0.55 C[C@H](O)CSCCC(N)=O Amb28195669 [0,0,1,0,0,1|2,0,0]=4 6609 B9R0.55 O=C(O)CCCCC(O)O Amb28143854 [0,0,1,0,0,1|2,0,0]=4 6610 B9R0.55 O=C(O)CCNCC(=O)O Amb18098292 [0,0,1,0,0,1|1,0,1]=4 6611 B9R0.55 O=C(O)CNNCC(=O)O Amb23438062 [0,0,1,0,0,1|1,0,1]=4 6612 B9R1.2 C=CC1CCCC(O)C1 Amb25846990 [1,0,0,0,0,1|2,0,0]=4 6613 B9R1.2 C=C[C@@H]1CCC[C@H](O)C1 Amb27631254 [1,0,0,0,0,1|2,0,0]=4 6614 B9R1.2 C=C[C@H]1CCC[C@@H](O)C1 Amb25205028 [1,0,0,0,0,1|2,0,0]=4 6615 B9R1.2 CC1CC(C=O)CCO1 Amb18642617 [1,0,0,0,0,1|2,0,0]=4 6616 B9R1.2 CC1CCCC(C=O)C1 Amb22059519 [1,0,0,0,0,1|2,0,0]=4 6617 B9R1.2 CC1CCNC(CO)C1 Amb24571948 [1,0,0,0,0,1|1,0,1]=4 6618 B9R1.2 CC1CCNC(CO)C1 Amb32668395 [1,0,0,0,0,1|1,0,1]=4 6619 B9R1.2 CC1CCOC(C=O)C1 Amb25032291 [1,0,0,0,0,1|2,0,0]=4 6620 B9R1.2 CC1CNCC(CO)C1 Amb24554370 [1,0,0,0,0,1|1,0,1]=4 6621 B9R1.2 CC1CNCC(NO)C1 Amb30018267 [1,0,0,0,0,1|2,0,0]=4 6622 B9R1.2 CC[C@@H]1C[C@@H](O)CCN1 Amb32434781 [1,0,0,0,0,1|1,0,1]=4 6623 B9R1.2 CC[C@@H]1C[C@H](O)CCN1 Amb27460205 [1,0,0,0,0,1|1,0,1]=4 6624 B9R1.2 CC[C@@H]1C[C@H](O)CCN1 Amb32434779 [1,0,0,0,0,1|1,0,1]=4 6625 B9R1.2 COC1CNCC(O)C1 Amb35746222 [1,0,0,0,0,1|2,0,0]=4 6626 B9R1.2 COC1CNCC(O)C1 Amb35750373 [1,0,0,0,0,1|2,0,0]=4 6627 B9R1.2 CO[C@H]1CNC[C@H](O)C1 Amb35752798 [1,0,0,0,0,1|2,0,0]=4 6628 B9R1.2 CO[C@H]1CNC[C@H](O)C1 Amb35753121 [1,0,0,0,0,1|2,0,0]=4 6629 B9R1.2 C[C@@H]1C[C@@H](C=O)CCO1 Amb27966706 [1,0,0,0,0,1|2,0,0]=4 6630 B9R1.2 C[C@@H]1C[C@H](C=O)OCO1 Amb28287271 [1,0,0,0,0,1|2,0,0]=4 6631 B9R1.2 C[C@H]1CCN[C@@H](CO)C1 Amb28429761 [1,0,0,0,0,1|1,0,1]=4 6632 B9R1.2 C[C@H]1CCN[C@@H](CO)C1 Amb32668515 [1,0,0,0,0,1|1,0,1]=4 6633 B9R1.2 C[C@H]1CCOC(C=O)C1 Amb26406399 [1,0,0,0,0,1|2,0,0]=4 6634 B9R1.2 C[C@H]1CCO[C@H](C=O)C1 Amb25914480 [1,0,0,0,0,1|2,0,0]=4 6635 B9R1.2 C[C@H]1C[C@@H](C=O)CCO1 Amb27194769 [1,0,0,0,0,1|2,0,0]=4 6636 B9R1.2 C[C@H]1C[C@H](C=O)CCO1 Amb27629806 [1,0,0,0,0,1|2,0,0]=4 6637 B9R1.2 NCC1CNCC(O)C1 Amb32685179 [1,0,0,0,0,1|1,0,1]=4 6638 B9R1.2 O=CC1CCCC(Cl)C1 Amb28456028 [1,0,0,0,0,1|2,0,0]=4 6639 B9R1.2 O=CC1CCCC(F)C1 Amb24541768 [1,0,0,0,0,1|2,0,0]=4 6640 B9R1.2 O=CC1CCNC(Br)C1 Amb8629163 [1,0,0,0,0,1|2,0,0]=4 6641 B9R1.2 O=CN1CCCC(O)C1 Amb27401500 [1,0,0,0,0,1|2,0,0]=4 6642 B9R1.2 O=C[C@@H]1CC=C[C@@H](O)C1 Amb28143998 [1,0,0,0,0,1|1,0,1]=4 6643 B9R1.2 O=C[C@@H]1CC=C[C@H](O)C1 Amb28130446 [1,0,0,0,0,1|1,0,1]=4 6644 B9R1.2 OCC1CC(O)CCO1 Amb28197542 [1,0,0,0,0,1|1,0,1]=4 6645 B9R1.2 OCC1CNCC(F)C1 Amb13889103 [1,0,0,0,0,1|1,0,1]=4 6646 B9R1.2 OCC1CNCC(F)C1 Amb22886258 [1,0,0,0,0,1|1,0,1]=4 6647 B9R1.2 OCC1CNCC(O)C1 Amb27199658 [1,0,0,0,0,1|0,0,1]=3 6648 B9R1.2 OC[C@@H]1CCC[C@@H](O)C1 Amb28076813 [1,0,0,0,0,1|1,0,1]=4 6649 B9R1.2 OC[C@@H]1CCC[C@H](O)C1 Amb28344623 [1,0,0,0,0,1|1,0,1]=4 6650 B9R1.2 OC[C@@H]1C[C@H](O)CCN1 Amb25911166 [1,0,0,0,0,1|0,0,1]=3 6651 B9R1.2 OC[C@H]1CCC[C@@H](O)C1 Amb26435184 [1,0,0,0,0,1|1,0,1]=4 6652 B9R1.13 C=C(C)CC1CCCN1 Amb25162820 [1,0,0,0,0,1|2,0,0]=4 6653 B9R1.13 CC(=O)CC1CCCC1 Amb2721149 [1,0,0,0,0,1|2,0,0]=4 6654 B9R1.13 CC(=O)CC1CCCN1 Amb24064067 [1,0,0,0,0,1|1,0,0]=3 6655 B9R1.13 CC(=O)CC1CCCO1 Amb13952621 [1,0,0,0,0,1|2,0,0]=4 6656 B9R1.13 CC(=O)CC1CCCS1 Amb33416251 [1,0,0,0,0,1|2,0,0]=4 6657 B9R1.13 CC(=O)C[C@H]1CCCN1 Amb25887375 [1,0,0,0,0,1|1,0,0]=3 6658 B9R1.13 CC(=O)NC1CCCC1 Amb3367351 [1,0,0,0,0,1|2,0,0]=4 6659 B9R1.13 CC(=O)NC1CCCN1 Amb28400896 [1,0,0,0,0,1|1,0,0]=3 6660 B9R1.13 CC(=O)OC1CCCO1 Amb22270198 [1,0,0,0,0,1|2,0,0]=4 6661 B9R1.13 CC(=O)SC1CCCC1 Amb22337902 [1,0,0,0,0,1|2,0,0]=4 6662 B9R1.13 CC(=O)\C=C1\CCCN1 Amb17593301 [1,0,0,0,0,1|1,0,1]=4 6663 B9R1.13 CC(C)=CC1CCCN1 Amb28437317 [1,0,0,0,0,1|2,0,0]=4 6664 B9R1.13 CC(C)=C[C@H]1CCCN1 Amb28436823 [1,0,0,0,0,1|2,0,0]=4 6665 B9R1.13 CC(O)CC1CCCN1 Amb22059496 [1,0,0,0,0,1|1,0,1]=4 6666 B9R1.13 C[C@H](O)C[C@@H]1CCCN1 Amb28428898 [1,0,0,0,0,1|1,0,1]=4 6667 B9R1.13 C[C@H](O)C[C@H]1CCCN1 Amb27786187 [1,0,0,0,0,1|1,0,1]=4 6668 B9R1.13 NC(=O)CC1CCCC1 Amb6892422 [1,0,0,0,0,1|2,0,0]=4 6669 B9R1.13 NC(=O)CC1CCCN1 Amb18282785 [1,0,0,0,0,1|1,0,0]=3 6670 B9R1.13 NC(=O)CC1CCCN1 Amb28934952 [1,0,0,0,0,1|1,0,0]=3 6671 B9R1.13 NC(=O)NC1CCCC1 Amb1151267 [1,0,0,0,0,1|2,0,0]=4 6672 B9R1.13 NC(=O)NC1NCCN1 Amb22045018 [1,0,0,0,0,1|2,0,0]=4 6673 B9R1.13 NC(=O)OC1CCCC1 Amb2617542 [1,0,0,0,0,1|2,0,0]=4 6674 B9R1.13 NC(=O)\N=C1/CCCN1 Amb22349282 [1,0,0,0,0,1|1,0,1]=4 6675 B9R1.13 O=C(Cl)CC1CCCC1 Amb3939570 [1,0,0,0,0,1|2,0,0]=4 6676 B9R1.13 O=C(Cl)CC1CCCN1 Amb27792098 [1,0,0,0,0,1|1,0,0]=3 6677 B9R1.13 O=C(Cl)CC1CCCO1 Amb25921099 [1,0,0,0,0,1|2,0,0]=4 6678 B9R1.13 O=C(Cl)NC1CCCC1 Amb35637068 [1,0,0,0,0,1|2,0,0]=4 6679 B9R1.13 O=C(Cl)OC1CCCC1 Amb10070029 [1,0,0,0,0,1|2,0,0]=4 6680 B9R1.13 O=C(O)C=C1CCCC1 Amb4036043 [1,0,0,0,0,1|1,0,1]=4 6681 B9R1.13 O=C(O)C=C1NCCN1 Amb18832637 [1,0,0,0,0,1|1,0,1]=4 6682 B9R1.13 O=C(O)CC1=CCCC1 Amb18642404 [1,0,0,0,0,1|1,0,1]=4 6683 B9R1.13 O=C(O)CC1=NCCN1 Amb28256209 [1,0,0,0,0,1|1,0,1]=4 6684 B9R1.13 O=C(O)CC1C=CCC1 Amb9703199 [1,0,0,0,0,1|1,0,1]=4 6685 B9R1.13 O=C(O)CC1CCCC1 Amb16192937 [1,0,0,0,0,1|1,0,0]=3 6686 B9R1.13 O=C(O)CC1CCCC1 Amb3939847 [1,0,0,0,0,1|1,0,0]=3 6687 B9R1.13 O=C(O)CC1CCCN1 Amb20668514 [1,0,0,0,0,1|0,0,0]=2 6688 B9R1.13 O=C(O)CC1CCCN1 Amb8387921 [1,0,0,0,0,1|0,0,0]=2 6689 B9R1.13 O=C(O)CC1CCCO1 Amb9713389 [1,0,0,0,0,1|1,0,0]=3 6690 B9R1.13 O=C(O)CC1CCNC1 Amb2695002 [1,0,0,0,0,1|2,0,0]=4 6691 B9R1.13 O=C(O)CC1CCNC1 Amb33549788 [1,0,0,0,0,1|2,0,0]=4 6692 B9R1.13 O=C(O)CC1CCOC1 Amb2696440 [1,0,0,0,0,1|2,0,0]=4 6693 B9R1.13 O=C(O)CC1CCSC1 Amb18202318 [1,0,0,0,0,1|2,0,0]=4 6694 B9R1.13 O=C(O)CC1CCSS1 Amb8388096 [1,0,0,0,0,1|2,0,0]=4 6695 B9R1.13 O=C(O)CC1CSCN1 Amb32990250 [1,0,0,0,0,1|1,0,0]=3 6696 B9R1.13 O=C(O)CC1NCCS1 Amb18644340 [1,0,0,0,0,1|1,0,0]=3 6697 B9R1.13 O=C(O)CC1OCCO1 Amb22740193 [1,0,0,0,0,1|2,0,0]=4 6698 B9R1.13 O=C(O)CN1CCCC1 Amb535912 [1,0,0,0,0,1|2,0,0]=4 6699 B9R1.13 O=C(O)CN1CCCC1 Amb9677391 [1,0,0,0,0,1|2,0,0]=4 6700 B9R1.13 O=C(O)C[C@@H]1CCCN1 Amb13891876 [1,0,0,0,0,1|0,0,0]=2 6701 B9R1.13 O=C(O)C[C@@H]1CCCN1 Amb8630792 [1,0,0,0,0,1|0,0,0]=2 6702 B9R1.13 O=C(O)C[C@@H]1CCCO1 Amb24271115 [1,0,0,0,0,1|1,0,0]=3 6703 B9R1.13 O=C(O)C[C@@H]1CCNC1 Amb10067024 [1,0,0,0,0,1|2,0,0]=4 6704 B9R1.13 O=C(O)C[C@@H]1CCNC1 Amb26948232 [1,0,0,0,0,1|2,0,0]=4 6705 B9R1.13 O=C(O)C[C@@H]1CCOC1 Amb25887272 [1,0,0,0,0,1|2,0,0]=4 6706 B9R1.13 O=C(O)C[C@H]1CCCN1 Amb16184011 [1,0,0,0,0,1|0,0,0]=2 6707 B9R1.13 O=C(O)C[C@H]1CCCN1 Amb33295230 [1,0,0,0,0,1|0,0,0]=2 6708 B9R1.13 O=C(O)C[C@H]1CCCO1 Amb24271109 [1,0,0,0,0,1|1,0,0]=3 6709 B9R1.13 O=C(O)C[C@H]1CCNC1 Amb2696648 [1,0,0,0,0,1|2,0,0]=4 6710 B9R1.13 O=C(O)C[C@H]1CCNC1 Amb8384306 [1,0,0,0,0,1|2,0,0]=4 6711 B9R1.13 O=C(O)C[C@H]1CCOC1 Amb23401495 [1,0,0,0,0,1|2,0,0]=4 6712 B11R1.20 CC(=O)CC1CCC(C)CN1 Amb28421909 [0,0,0,0,0,2|2,0,0]=4 6713 B11R1.20 CC(=O)C[C@H]1CC[C@@H](O)CC1 Amb28284896 [0,0,0,0,0,2|2,0,0]=4 6714 B11R1.20 CC(=O)NC1CCC(O)CC1 Amb9242511 [0,0,0,0,0,2|2,0,0]=4 6715 B11R1.20 CC(=O)N[C@H]1CC[C@@H](O)CC1 Amb10067907 [0,0,0,0,0,2|2,0,0]=4 6716 B11R1.20 CC(=O)N[C@H]1CC[C@H](O)CC1 Amb17938052 [0,0,0,0,0,2|2,0,0]=4 6717 B11R1.20 CC(=O)OC1CCC(O)CC1 Amb4004946 [0,0,0,0,0,2|2,0,0]=4 6718 B11R1.20 CC1CCC(CC(=O)O)CC1 Amb3939873 [0,0,0,0,0,2|2,0,0]=4 6719 B11R1.20 CC1CCC(CC(=O)O)CO1 Amb29866063 [0,0,0,0,0,2|2,0,0]=4 6720 B11R1.20 CC1CCC(CC(=O)O)CS1 Amb35717578 [0,0,0,0,0,2|2,0,0]=4 6721 B11R1.20 CC1CCC(CC(=O)O)NC1 Amb8387929 [0,0,0,0,0,2|1,0,0]=3 6722 B11R1.20 CC1CNC(CC(=O)O)CO1 Amb27462541 [0,0,0,0,0,2|1,0,0]=3 6723 B11R1.20 CC1CNC(CC(N)=O)CO1 Amb27638735 [0,0,0,0,0,2|2,0,0]=4 6724 B11R1.20 C[C@@H]1CO[C@@H](CC(=O)O)CN1 Amb28053647 [0,0,0,0,0,2|2,0,0]=4 6725 B11R1.20 C[C@@H]1CO[C@H](CC(=O)O)CN1 Amb28055660 [0,0,0,0,0,2|2,0,0]=4 6726 B11R1.20 C[C@H]1CC[C@H](CC(=O)O)CC1 Amb8631139 [0,0,0,0,0,2|2,0,0]=4 6727 B11R1.20 C[C@H]1CO[C@@H](CC(=O)O)CN1 Amb27664042 [0,0,0,0,0,2|2,0,0]=4 6728 B11R1.20 C[C@H]1CS[C@@H](CC(=O)O)CN1 Amb28061584 [0,0,0,0,0,2|2,0,0]=4 6729 B11R1.20 NC(=O)NC1CCC(O)CC1 Amb9248136 [0,0,0,0,0,2|2,0,0]=4 6730 B11R1.20 N[C@H]1CC[C@@H](CC(=O)O)CC1 Amb34150446 [0,0,0,0,0,2|2,0,0]=4 6731 B11R1.20 N[C@H]1CC[C@H](CC(=O)O)CC1 Amb22746078 [0,0,0,0,0,2|2,0,0]=4 6732 B11R1.20 O=C(O)C=C1CCC(O)CC1 Amb28239820 [0,0,0,0,0,2|1,0,1]=4 6733 B11R1.20 O=C(O)CC1=CCC(O)CC1 Amb27409091 [0,0,0,0,0,2|1,0,1]=4 6734 B11R1.20 O=C(O)CC1C=CC(O)CC1 Amb27858906 [0,0,0,0,0,2|1,0,1]=4 6735 B11R1.20 O=C(O)CC1CCC(Br)CC1 Amb27813326 [0,0,0,0,0,2|2,0,0]=4 6736 B11R1.20 O=C(O)CC1CCC(Cl)CC1 Amb27841820 [0,0,0,0,0,2|2,0,0]=4 6737 B11R1.20 O=C(O)CC1CCC(F)CC1 Amb27782078 [0,0,0,0,0,2|2,0,0]=4 6738 B11R1.20 O=C(O)CC1CCC(O)CC1 Amb18126157 [0,0,0,0,0,2|1,0,0]=3 6739 B11R1.20 O=C(O)CC1CNC(=O)CN1 Amb24655930 [0,0,0,0,0,2|0,0,2]=4 6740 B11R1.20 O=C(O)CN1CCC(O)CC1 Amb10609681 [0,0,0,0,0,2|2,0,0]=4 6741 B11R1.20 O=C(O)CN1CCC(O)CC1 Amb6649512 [0,0,0,0,0,2|2,0,0]=4 6742 B11R1.20 O=C(O)C[C@H]1CC[C@@H](F)CC1 Amb34912967 [0,0,0,0,0,2|2,0,0]=4 6743 B11R1.20 O=C(O)C[C@H]1CC[C@H](F)CC1 Amb34912971 [0,0,0,0,0,2|2,0,0]=4 6744 B11R1.20 O=C(O)C[C@H]1CC[C@H](O)CN1 Amb27629758 [0,0,0,0,0,2|0,0,0]=2 6745 B11R1.20 O=C(O)C[C@H]1CNC(=O)CN1 Amb27473255 [0,0,0,0,0,2|0,0,2]=4 6746 B11R1.20 [NH3+]C1CCC(CC(=O)O)CC1 Amb9805882 [0,0,0,0,0,2|2,0,0]=4 6747 B11R1.565 CC1CCCC(C(=O)O)CC1 Amb24487583 [0,0,0,0,0,2|2,0,0]=4 6748 B11R1.565 CC1CCNC(C(=O)O)CC1 Amb27441897 [0,0,0,0,0,2|1,0,0]=3 6749 B11R1.565 CC1CCNC(C(N)=O)CC1 Amb27962650 [0,0,0,0,0,2|2,0,0]=4 6750 B11R1.565 CN1CCNC(C(=O)O)CC1 Amb27246780 [0,0,0,0,0,2|2,0,0]=4 6751 B11R1.565 NC1CCCC(C(=O)O)CC1 Amb33743493 [0,0,0,0,0,2|2,0,0]=4 6752 B11R1.565 NC1CCCC(C(=O)O)CC1 Amb33743673 [0,0,0,0,0,2|2,0,0]=4 6753 B11R1.75 CC1CCC(C#CC(=O)O)C1 Amb33169018 [0,0,0,0,0,2|2,0,0]=4 6754 B11R1.75 O=C(O)CCN1CC(O)CO1 Amb27865953 [0,0,0,0,0,2|2,0,0]=4 6755 B11R1.75 O=C(O)CCN1CC[C@H](O)C1 Amb28287639 [0,0,0,0,0,2|2,0,0]=4 6756 B11R1.75 O=C(O)CCN1C[C@@H](O)CO1 Amb28199259 [0,0,0,0,0,2|2,0,0]=4 6757 B11R1.75 O=C(O)CC[C@@H]1C[C@@H](O)CN1 Amb27421983 [0,0,0,0,0,2|0,0,0]=2 6758 B11R1.157 CC(=O)CC1CC(C)CCN1 Amb25746124 [0,0,0,0,0,2|2,0,0]=4 6759 B11R1.157 CC(=O)N[C@@H]1CCC[C@@H](O)C1 Amb27841320 [0,0,0,0,0,2|2,0,0]=4 6760 B11R1.157 CC(=O)N[C@@H]1CCC[C@H](O)C1 Amb28064067 [0,0,0,0,0,2|2,0,0]=4 6761 B11R1.157 CC(=O)O[C@H]1CCC[C@H](O)C1 Amb28318845 [0,0,0,0,0,2|2,0,0]=4 6762 B11R1.157 CC1CC(CC(=O)O)CCN1 Amb8387924 [0,0,0,0,0,2|2,0,0]=4 6763 B11R1.157 CC1CC(CC(=O)O)CCO1 Amb27865036 [0,0,0,0,0,2|2,0,0]=4 6764 B11R1.157 CC1CC=CC(CC(=O)O)C1 Amb18125730 [0,0,0,0,0,2|2,0,0]=4 6765 B11R1.157 CC1CCCC(CC(=O)O)C1 Amb6749251 [0,0,0,0,0,2|2,0,0]=4 6766 B11R1.157 CC1CCNC(CC(=O)O)C1 Amb8387930 [0,0,0,0,0,2|1,0,0]=3 6767 B11R1.157 CC1CCNC(CC(N)=O)C1 Amb28051754 [0,0,0,0,0,2|2,0,0]=4 6768 B11R1.157 CC1CNCC(CC(=O)O)C1 Amb28652860 [0,0,0,0,0,2|1,0,0]=3 6769 B11R1.157 CC1CNCC(CC(=O)O)C1 Amb8387927 [0,0,0,0,0,2|1,0,0]=3 6770 B11R1.157 CC1CNCC(NC(N)=O)C1 Amb27951115 [0,0,0,0,0,2|2,0,0]=4 6771 B11R1.157 CN1CCNC(CC(=O)O)C1 Amb18830480 [0,0,0,0,0,2|2,0,0]=4 6772 B11R1.157 O=C(O)CC1CCCC(F)C1 Amb24651233 [0,0,0,0,0,2|2,0,0]=4 6773 B11R1.157 O=C(O)CC1CCCC(O)C1 Amb18645020 [0,0,0,0,0,2|1,0,0]=3 6774 B11R1.157 O=C(O)CN1CCCC(O)C1 Amb15701257 [0,0,0,0,0,2|2,0,0]=4 6775 B11R1.157 O=C(O)CN1CCC[C@@H](O)C1 Amb22224754 [0,0,0,0,0,2|2,0,0]=4 6776 B11R1.157 O=C(O)CN1CCC[C@H](O)C1 Amb22224789 [0,0,0,0,0,2|2,0,0]=4 6777 B11R1.157 O=C(O)C[C@@H]1CCC[C@@H](F)C1 Amb34912969 [0,0,0,0,0,2|2,0,0]=4 6778 B11R1.157 O=C(O)C[C@H]1CCC[C@@H](F)C1 Amb34912973 [0,0,0,0,0,2|2,0,0]=4 6779 B11R1.497 CC(=O)N1CCNCC(O)C1 Amb22261486 [0,0,0,0,0,2|2,0,0]=4 6780 B11R1.497 CC(=O)N1CCNCC(O)C1 Amb22587605 [0,0,0,0,0,2|2,0,0]=4