0 B9R1.35 C=C1CC(=CC1)C(O)=O Amb25093101 [0,0,0,0,0,0|2,0,2]=4 1 B9R1.35 C=C1CNC(C1)C(O)=O Amb24594868 [0,0,0,0,0,0|1,0,1]=2 2 B9R1.35 CC(=C)C1CCC(O)O1 Amb24379966 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.35 CC(=C)[C@@H]1CC[C@@H](O)C1 Amb24688273 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.35 CC(=C)[C@H]1CC[C@@H](O)C1 Amb25235646 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.35 CC(=C)[C@H]1CC[C@H](O)C1 Amb25357163 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.35 CC(=C)[C@H]1C[C@H](O)C=C1 Amb25256682 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.35 CC(=O)C1=CCC(O)O1 Amb25092439 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.35 CC(=O)C1CC(=O)CC1 Amb24423910 [0,0,0,0,0,0|2,0,2]=4 9 B9R1.35 CC(=O)C1CC(=O)CS1 Amb24061575 [0,0,0,0,0,0|2,0,2]=4 10 B9R1.35 CC(=O)C1CC(Br)CO1 Amb24391544 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.35 CC(=O)C1CC(O)C=C1 Amb25350260 [0,0,0,0,0,0|2,0,1]=3 12 B9R1.35 CC(=O)C1CCC(Cl)C1 Amb24064130 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.35 CC(=O)C1CCC(O)C1 Amb24364135 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.35 CC(=O)C=1CC(O)CC1 Amb25134091 [0,0,0,0,0,0|2,0,1]=3 15 B9R1.35 CC(=O)N1CC(Br)CC1 Amb21861126 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.35 CC(=O)N1CC(Cl)CC1 Amb21861140 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.35 CC(=O)N1CC(I)CC1 Amb21861147 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.35 CC(=O)N1CC(N)CC1 Amb20669217 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.35 CC(=O)N1CC(O)CC1 Amb20622704 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.35 CC(=O)N1CC(O)CO1 Amb24372186 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.35 CC(=O)N1CC(S)CN1 Amb24099494 [0,0,0,0,0,0|2,1,0]=3 22 B9R1.35 CC(=O)N1CCC(N)C1 Amb17739841 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.35 CC(=O)N1CC[C@@H](O)C1 Amb17935744 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.35 CC(=O)N1CC[C@H](O)C1 Amb17935745 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.35 CC(=O)N1C[C@@H](Br)CC1 Amb22227522 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.35 CC(=O)N1C[C@@H](Cl)CC1 Amb22227524 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.35 CC(=O)N1C[C@@H](I)CC1 Amb22227531 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.35 CC(=O)N1C[C@@H](N)CC1 Amb19890016 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.35 CC(=O)N1C[C@@H](N)CC1 Amb22227520 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.35 CC(=O)N1C[C@H](Br)CC1 Amb22227483 [0,0,0,0,0,0|4,0,0]=4 31 B9R1.35 CC(=O)N1C[C@H](Cl)CC1 Amb22227481 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.35 CC(=O)N1C[C@H](I)CC1 Amb22227495 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.35 CC(=O)N1C[C@H](N)CC1 Amb19891343 [0,0,0,0,0,0|4,0,0]=4 34 B9R1.35 CC(=O)N1C[C@H](N)CC1 Amb22227487 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.35 CC(=O)[C@@H]1C[C@H](O)C=C1 Amb25061613 [0,0,0,0,0,0|2,0,1]=3 36 B9R1.35 CC(=O)[C@H]1CC(=O)CC1 Amb24407171 [0,0,0,0,0,0|2,0,2]=4 37 B9R1.35 CC(C)C1CC(O)CC1 Amb25795756 [0,0,0,0,0,0|3,0,1]=4 38 B9R1.35 CC(C)[C@H]1C[C@@H](O)CC1 Amb24661016 [0,0,0,0,0,0|3,0,1]=4 39 B9R1.35 CC(O)C1CC(Br)CO1 Amb25774998 [0,0,0,0,0,0|3,0,1]=4 40 B9R1.35 CC(O)C1CC(F)CN1 Amb23536931 [0,0,0,0,0,0|2,0,1]=3 41 B9R1.35 CC(O)C1CC(N)CO1 Amb25262373 [0,0,0,0,0,0|3,0,1]=4 42 B9R1.35 CC(O)C1CC(O)CN1 Amb24424058 [0,0,0,0,0,0|1,0,1]=2 43 B9R1.35 CC(O)C1CCC(O)O1 Amb25317288 [0,0,0,0,0,0|3,0,1]=4 44 B9R1.35 CC1=CC(SC1)C(=O)O Amb10809142 [0,0,0,0,0,0|2,0,2]=4 45 B9R1.35 CC1C=CC(O1)C(O)=O Amb18642586 [0,0,0,0,0,0|3,0,1]=4 46 B9R1.35 CC1C=CC(S1)C(O)=O Amb18644111 [0,0,0,0,0,0|3,0,1]=4 47 B9R1.35 CC1CC(=CC1)C(O)=O Amb18642398 [0,0,0,0,0,0|2,0,1]=3 48 B9R1.35 CC1CC(=NO1)C(O)=O Amb25694020 [0,0,0,0,0,0|2,0,2]=4 49 B9R1.35 CC1CC(CC1)C(N)=N Amb25825672 [0,0,0,0,0,0|4,0,0]=4 50 B9R1.35 CC1CC(CC1)C(N)=O Amb24763749 [0,0,0,0,0,0|3,0,0]=3 51 B9R1.35 CC1CC(CC1)C(N)=S Amb25140648 [0,0,0,0,0,0|3,1,0]=4 52 B9R1.35 CC1CC(CC1)C(O)=O Amb18642624 [0,0,0,0,0,0|2,0,0]=2 53 B9R1.35 CC1CC(CN1)C(O)=O Amb18832566 [0,0,0,0,0,0|3,0,0]=3 54 B9R1.35 CC1CC(CO1)C(=O)Cl Amb25832627 [0,0,0,0,0,0|4,0,0]=4 55 B9R1.35 CC1CC(N=C1)C(O)=O Amb24650545 [0,0,0,0,0,0|1,0,2]=3 56 B9R1.35 CC1CCC(=C1)C(O)=O Amb18642397 [0,0,0,0,0,0|2,0,2]=4 57 B9R1.35 CC1CCC(C1)C(C)=O Amb25077503 [0,0,0,0,0,0|3,0,0]=3 58 B9R1.35 CC1CCC(C1)C(C)O Amb24447243 [0,0,0,0,0,0|3,0,1]=4 59 B9R1.35 CC1CCC(N1)C(N)=O Amb18642667 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.35 CC1CCC(N1)C(O)=O Amb18832572 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.35 CC1CCC(O1)C(=O)O Amb17593370 [0,0,0,0,0,0|3,0,0]=3 62 B9R1.35 CC1CCC(O1)C(C)=O Amb24580538 [0,0,0,0,0,0|4,0,0]=4 63 B9R1.35 CC1CCC(S1)C(O)=O Amb25719281 [0,0,0,0,0,0|3,0,0]=3 64 B9R1.35 CC1CCC([NH2+]1)C(O)=O Amb22372047 [0,0,0,0,0,0|3,0,0]=3 65 B9R1.35 CC1CC[C@@H](N1)C(O)=O Amb22748252 [0,0,0,0,0,0|3,0,0]=3 66 B9R1.35 CC1CC[C@H](N1)C(N)=O Amb24696154 [0,0,0,0,0,0|4,0,0]=4 67 B9R1.35 CC1CN(CC1)C(N)=O Amb25692037 [0,0,0,0,0,0|4,0,0]=4 68 B9R1.35 CC1CNC(O1)C(O)=O Amb25737834 [0,0,0,0,0,0|2,0,0]=2 69 B9R1.35 CC1CSC(=C1)C(O)=O Amb25044433 [0,0,0,0,0,0|2,0,2]=4 70 B9R1.35 CC1CSC(S1)C(C)=O Amb24676738 [0,0,0,0,0,0|4,0,0]=4 71 B9R1.35 CC1CSC(S1)C(O)=O Amb24608602 [0,0,0,0,0,0|3,0,0]=3 72 B9R1.35 CC1C[C@H](N=C1)C(O)=O Amb24394037 [0,0,0,0,0,0|1,0,2]=3 73 B9R1.35 CC1N[C@@H](CS1)C(=O)O Amb16203706 [0,0,0,0,0,0|4,0,0]=4 74 B9R1.35 CC=1CC(CC1)C(O)=O Amb18642425 [0,0,0,0,0,0|2,0,2]=4 75 B9R1.35 CC=1CC(NC1)C(O)=O Amb25772613 [0,0,0,0,0,0|1,0,2]=3 76 B9R1.35 CC=1CCC(N1)C(O)=O Amb23438203 [0,0,0,0,0,0|3,0,1]=4 77 B9R1.35 CC=1CCC([NH+]1)C(O)=O Amb22372048 [0,0,0,0,0,0|3,0,1]=4 78 B9R1.35 CC=1C[C@H](CC1)C(O)=O Amb24350803 [0,0,0,0,0,0|2,0,2]=4 79 B9R1.35 CC=1C[C@H](ON1)C(O)=O Amb25189709 [0,0,0,0,0,0|3,0,1]=4 80 B9R1.35 CN(C)C1CCC(O)C1 Amb25311037 [0,0,0,0,0,0|4,0,0]=4 81 B9R1.35 CN(C)[C@@H]1CC[C@@H](O)C1 Amb25338336 [0,0,0,0,0,0|4,0,0]=4 82 B9R1.35 CN(C)[C@@H]1CC[C@H](O)C1 Amb24516012 [0,0,0,0,0,0|4,0,0]=4 83 B9R1.35 CN1CC(=CC1)C(O)=O Amb25032089 [0,0,0,0,0,0|3,0,1]=4 84 B9R1.35 CN1CC(CC1)C(N)=O Amb25144200 [0,0,0,0,0,0|4,0,0]=4 85 B9R1.35 CN1CCC(N1)C(O)=O Amb25854311 [0,0,0,0,0,0|4,0,0]=4 86 B9R1.35 CN1C[C@@H](CC1)C(O)=O Amb22746030 [0,0,0,0,0,0|3,0,0]=3 87 B9R1.35 CN1C[C@@H](CC1)C(O)=O Amb22756448 [0,0,0,0,0,0|3,0,0]=3 88 B9R1.35 CS(=O)N1CC(O)CC1 Amb24738289 [0,0,0,0,0,0|4,0,0]=4 89 B9R1.35 CS(=O)N1CC(O)CO1 Amb24707641 [0,0,0,0,0,0|4,0,0]=4 90 B9R1.35 CS(=O)N1C[C@@H](O)CO1 Amb24691481 [0,0,0,0,0,0|4,0,0]=4 91 B9R1.35 CS(=O)N1C[C@H](O)CC1 Amb24663060 [0,0,0,0,0,0|4,0,0]=4 92 B9R1.35 C[C@@H]1CC[C@@H](C1)C(=O)O Amb10843961 [0,0,0,0,0,0|2,0,0]=2 93 B9R1.35 C[C@@H]1CC[C@@H](N1)C(N)=O Amb24572556 [0,0,0,0,0,0|4,0,0]=4 94 B9R1.35 C[C@@H]1CC[C@@H](N1)C(O)=O Amb24399449 [0,0,0,0,0,0|3,0,0]=3 95 B9R1.35 C[C@@H]1CC[C@@H](O1)C(O)=O Amb22886534 [0,0,0,0,0,0|3,0,0]=3 96 B9R1.35 C[C@@H]1CS[C@H](S1)C(=O)Cl Amb25110654 [0,0,0,0,0,0|4,0,0]=4 97 B9R1.35 C[C@@H]1C[C@@H](NC1)C(O)=O Amb19887682 [0,0,0,0,0,0|1,0,0]=1 98 B9R1.35 C[C@@H]1C[C@@H](NC1)C(O)=O Amb23439040 [0,0,0,0,0,0|1,0,0]=1 99 B9R1.35 C[C@@H]1C[C@@H](ON1)C(O)=O Amb24680946 [0,0,0,0,0,0|3,0,0]=3 100 B9R1.35 C[C@@H]1C[C@H](NC1)C(O)=O Amb22008683 [0,0,0,0,0,0|1,0,0]=1 101 B9R1.35 C[C@@H]1C[C@H](NC1)C(O)=O Amb22752452 [0,0,0,0,0,0|1,0,0]=1 102 B9R1.35 C[C@@H]1N[C@H](CS1)C(O)=O Amb25294278 [0,0,0,0,0,0|4,0,0]=4 103 B9R1.35 C[C@H](O)[C@@H]1CC[C@H](O)O1 Amb24613838 [0,0,0,0,0,0|3,0,1]=4 104 B9R1.35 C[C@H]1CC[C@@H](N1)C(O)=O Amb25260830 [0,0,0,0,0,0|3,0,0]=3 105 B9R1.35 C[C@H]1CC[C@H](C1)C(=O)O Amb10843955 [0,0,0,0,0,0|2,0,0]=2 106 B9R1.35 C[C@H]1CC[C@H](N1)C(O)=O Amb24598417 [0,0,0,0,0,0|3,0,0]=3 107 B9R1.35 C[C@H]1CC[C@H](O1)C(O)=O Amb24651587 [0,0,0,0,0,0|3,0,0]=3 108 B9R1.35 C[C@H]1C[C@@H](CC1)C(N)=O Amb24612116 [0,0,0,0,0,0|3,0,0]=3 109 B9R1.35 C[C@H]1C[C@@H](NC1)C(O)=O Amb24752952 [0,0,0,0,0,0|1,0,0]=1 110 B9R1.35 C[C@H]1C[C@H](CN1)C(O)=O Amb24715999 [0,0,0,0,0,0|3,0,0]=3 111 B9R1.35 C[C@H]1C[C@H](NC1)C(O)=O Amb19888348 [0,0,0,0,0,0|1,0,0]=1 112 B9R1.35 C[C@H]1N[C@@H](CS1)C(O)=O Amb25347352 [0,0,0,0,0,0|4,0,0]=4 113 B9R1.35 C[C@H]1O[C@H](CS1)C(O)=O Amb24625718 [0,0,0,0,0,0|4,0,0]=4 114 B9R1.35 FC(F)C1CC(F)CN1 Amb24656775 [0,0,0,0,0,0|3,0,1]=4 115 B9R1.35 N=C1CCC(N1)C(O)=O Amb18642592 [0,0,0,0,0,0|3,0,1]=4 116 B9R1.35 NC(=N)N1CC(O)CC1 Amb25696246 [0,0,0,0,0,0|4,0,0]=4 117 B9R1.35 NC(=O)C1CC(CN1)O Amb1152420 [0,0,0,0,0,0|1,0,0]=1 118 B9R1.35 NC(=O)C1CC(F)CN1 Amb21963545 [0,0,0,0,0,0|2,0,0]=2 119 B9R1.35 NC(=O)C1CC(S)C=N1 Amb25145958 [0,0,0,0,0,0|1,1,2]=4 120 B9R1.35 NC(=O)C1CCC(O)C1 Amb25230928 [0,0,0,0,0,0|2,0,0]=2 121 B9R1.35 NC(=O)C=1CC(N)CC1 Amb25741188 [0,0,0,0,0,0|3,0,1]=4 122 B9R1.35 NC(=O)N1CC(O)CC1 Amb24635585 [0,0,0,0,0,0|3,0,0]=3 123 B9R1.35 NC(=O)N1CC(O)CO1 Amb25732644 [0,0,0,0,0,0|3,0,0]=3 124 B9R1.35 NC(=O)N1C[C@@H](O)CC1 Amb24478790 [0,0,0,0,0,0|3,0,0]=3 125 B9R1.35 NC(=O)[C@@H]1CC(F)CN1 Amb22747998 [0,0,0,0,0,0|2,0,0]=2 126 B9R1.35 NC(=O)[C@@H]1CC(F)CN1 Amb22748232 [0,0,0,0,0,0|2,0,0]=2 127 B9R1.35 NC(=O)[C@@H]1CC[C@H](S)C1 Amb25290990 [0,0,0,0,0,0|2,1,0]=3 128 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F Amb10808100 [0,0,0,0,0,0|2,0,0]=2 129 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745766 [0,0,0,0,0,0|2,0,0]=2 130 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745768 [0,0,0,0,0,0|2,0,0]=2 131 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 Amb24061354 [0,0,0,0,0,0|1,0,0]=1 132 B9R1.35 NC(=O)[C@@H]1C[C@H](F)CN1 Amb22745753 [0,0,0,0,0,0|2,0,0]=2 133 B9R1.35 NC(=O)[C@H]1C[C@@H](F)CN1 Amb25256284 [0,0,0,0,0,0|2,0,0]=2 134 B9R1.35 NC(=O)[C@H]1C[C@H](O)CN1 Amb24575802 [0,0,0,0,0,0|1,0,0]=1 135 B9R1.35 NC(=O)[C@H]1C[C@H](O)CN1 Amb24586279 [0,0,0,0,0,0|1,0,0]=1 136 B9R1.35 NC1CC(=CC1)C(O)=O Amb18642495 [0,0,0,0,0,0|2,0,1]=3 137 B9R1.35 NC1CC(C=C1)C(N)=O Amb24624553 [0,0,0,0,0,0|3,0,1]=4 138 B9R1.35 NC1CC(C=C1)C(O)=O Amb20622377 [0,0,0,0,0,0|2,0,1]=3 139 B9R1.35 NC1CC(C=C1)C(O)=O Amb20623555 [0,0,0,0,0,0|2,0,1]=3 140 B9R1.35 NC1CC(NC1)C(=O)O Amb10608922 [0,0,0,0,0,0|1,0,0]=1 141 B9R1.35 NC1CC(OC1)C(O)=O Amb18642828 [0,0,0,0,0,0|2,0,0]=2 142 B9R1.35 NC1CC(SC1)C(O)=O Amb18831415 [0,0,0,0,0,0|2,0,0]=2 143 B9R1.35 NC1CCC(=C1)C(O)=O Amb18642496 [0,0,0,0,0,0|2,0,2]=4 144 B9R1.35 NC1CCC(C1)C(=O)O Amb10066880 [0,0,0,0,0,0|2,0,0]=2 145 B9R1.35 NC1CCC(C1)C(N)=O Amb25104222 [0,0,0,0,0,0|3,0,0]=3 146 B9R1.35 NC1CN(CC1)C(N)=O Amb18943828 [0,0,0,0,0,0|4,0,0]=4 147 B9R1.35 NC1CN(CC1)C(N)=O Amb19373727 [0,0,0,0,0,0|4,0,0]=4 148 B9R1.35 NC1COC(=C1)C(O)=O Amb18642690 [0,0,0,0,0,0|2,0,2]=4 149 B9R1.35 NC1CSC(=C1)C(O)=O Amb18124742 [0,0,0,0,0,0|2,0,2]=4 150 B9R1.35 NC1CSC(C1)C(N)=O Amb24638225 [0,0,0,0,0,0|3,0,0]=3 151 B9R1.35 NC1NC(CS1)C(O)=O Amb25703132 [0,0,0,0,0,0|4,0,0]=4 152 B9R1.35 NC=1CC[C@H](N1)C(O)=O Amb25346757 [0,0,0,0,0,0|3,0,1]=4 153 B9R1.35 N[C@@H]1CC(=CC1)C(O)=O Amb25143919 [0,0,0,0,0,0|2,0,1]=3 154 B9R1.35 N[C@@H]1CC(CC1)C(O)=O Amb25700807 [0,0,0,0,0,0|2,0,0]=2 155 B9R1.35 N[C@@H]1CC[C@@H](C1)C(N)=O Amb25321319 [0,0,0,0,0,0|3,0,0]=3 156 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O Amb10066881 [0,0,0,0,0,0|2,0,0]=2 157 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O Amb10070446 [0,0,0,0,0,0|1,0,0]=1 158 B9R1.35 N[C@@H]1CSC(=C1)C(O)=O Amb25372960 [0,0,0,0,0,0|2,0,2]=4 159 B9R1.35 N[C@@H]1C[C@@H](C=C1)C(=O)O Amb16232675 [0,0,0,0,0,0|2,0,1]=3 160 B9R1.35 N[C@@H]1C[C@@H](C=C1)C(O)=O Amb19515761 [0,0,0,0,0,0|2,0,1]=3 161 B9R1.35 N[C@@H]1C[C@@H](CC1)C(O)=O Amb22746692 [0,0,0,0,0,0|2,0,0]=2 162 B9R1.35 N[C@@H]1C[C@@H](NC1)C(O)=O Amb22008702 [0,0,0,0,0,0|1,0,0]=1 163 B9R1.35 N[C@@H]1C[C@@H](OC1)C(O)=O Amb24548389 [0,0,0,0,0,0|2,0,0]=2 164 B9R1.35 N[C@@H]1C[C@H](C=C1)C(O)=O Amb22746212 [0,0,0,0,0,0|2,0,1]=3 165 B9R1.35 N[C@@H]1C[C@H](CC1)C(O)=O Amb22756038 [0,0,0,0,0,0|2,0,0]=2 166 B9R1.35 N[C@@H]1C[C@H](NC1)C(=O)O Amb10603131 [0,0,0,0,0,0|1,0,0]=1 167 B9R1.35 N[C@@H]1C[C@H](NC1)C(O)=O Amb22224945 [0,0,0,0,0,0|1,0,0]=1 168 B9R1.35 N[C@@H]1C[C@H](OC1)C(O)=O Amb24117069 [0,0,0,0,0,0|2,0,0]=2 169 B9R1.35 N[C@H]1CC(=CC1)C(O)=O Amb25824589 [0,0,0,0,0,0|2,0,1]=3 170 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O Amb10066883 [0,0,0,0,0,0|2,0,0]=2 171 B9R1.35 N[C@H]1CN(CC1)C(N)=O Amb25688167 [0,0,0,0,0,0|4,0,0]=4 172 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O Amb10070445 [0,0,0,0,0,0|1,0,0]=1 173 B9R1.35 N[C@H]1COC(=C1)C(O)=O Amb24640906 [0,0,0,0,0,0|2,0,2]=4 174 B9R1.35 N[C@H]1CSC(=C1)C(O)=O Amb24641605 [0,0,0,0,0,0|2,0,2]=4 175 B9R1.35 N[C@H]1C[C@@H](C=C1)C(O)=O Amb24632574 [0,0,0,0,0,0|2,0,1]=3 176 B9R1.35 N[C@H]1C[C@@H](NC1)C(O)=O Amb19515889 [0,0,0,0,0,0|1,0,0]=1 177 B9R1.35 N[C@H]1C[C@@H](OC1)C(O)=O Amb25691536 [0,0,0,0,0,0|2,0,0]=2 178 B9R1.35 N[C@H]1C[C@H](C=C1)C(O)=O Amb22232858 [0,0,0,0,0,0|2,0,1]=3 179 B9R1.35 N[C@H]1C[C@H](NC1)C(=O)O Amb10603136 [0,0,0,0,0,0|1,0,0]=1 180 B9R1.35 N[C@H]1C[C@H](NC1)C(O)=O Amb22386834 [0,0,0,0,0,0|1,0,0]=1 181 B9R1.35 N[C@H]1C[C@H](OC1)C(O)=O Amb25799075 [0,0,0,0,0,0|2,0,0]=2 182 B9R1.35 O=C(Cl)C1CC(Cl)CC1 Amb24707520 [0,0,0,0,0,0|3,0,0]=3 183 B9R1.35 O=C(Cl)C1CCC(F)C1 Amb25071689 [0,0,0,0,0,0|3,0,0]=3 184 B9R1.35 O=C1CC(NN1)C(=O)Cl Amb24062251 [0,0,0,0,0,0|2,0,2]=4 185 B9R1.35 O=C1CCC(C1)C(=O)Cl Amb25282784 [0,0,0,0,0,0|2,0,2]=4 186 B9R1.35 O=C1CC[C@H](N1)C(=O)O Amb1995036 [0,0,0,0,0,0|2,0,2]=4 187 B9R1.35 O=C1NCC(C1)C(=O)O Amb1129202 [0,0,0,0,0,0|2,0,2]=4 188 B9R1.35 O=C1SCC(C1)C(=O)O Amb10073724 [0,0,0,0,0,0|2,0,2]=4 189 B9R1.35 OC(=O)C1CC(=O)CS1 Amb24061425 [0,0,0,0,0,0|1,0,2]=3 190 B9R1.35 OC(=O)C1CC(=O)NN1 Amb18642739 [0,0,0,0,0,0|1,0,2]=3 191 B9R1.35 OC(=O)C1CC(=O)OC1 Amb22642307 [0,0,0,0,0,0|2,0,2]=4 192 B9R1.35 OC(=O)C1CC(Br)CN1 Amb25239348 [0,0,0,0,0,0|1,0,0]=1 193 B9R1.35 OC(=O)C1CC(CN1)F Amb10608925 [0,0,0,0,0,0|1,0,0]=1 194 B9R1.35 OC(=O)C1CC(CN1)S Amb10608928 [0,0,0,0,0,0|0,1,0]=1 195 B9R1.35 OC(=O)C1CC(Cl)=CC1 Amb23594523 [0,0,0,0,0,0|2,0,2]=4 196 B9R1.35 OC(=O)C1CCC(=O)N1 Amb22282321 [0,0,0,0,0,0|2,0,2]=4 197 B9R1.35 OC(=O)C1CCC(=O)O1 Amb20623076 [0,0,0,0,0,0|2,0,2]=4 198 B9R1.35 OC(=O)C1CCC(=O)S1 Amb23439315 [0,0,0,0,0,0|2,0,2]=4 199 B9R1.35 OC(=O)C1CCC(=S)N1 Amb24477679 [0,0,0,0,0,0|2,1,1]=4 200 B9R1.35 OC(=O)C1CCC(F)C1 Amb22886545 [0,0,0,0,0,0|2,0,0]=2 201 B9R1.35 OC(=O)C1CCC(F)N1 Amb24423850 [0,0,0,0,0,0|3,0,0]=3 202 B9R1.35 OC(=O)C1CCC(I)C1 Amb23456141 [0,0,0,0,0,0|2,0,0]=2 203 B9R1.35 OC(=O)C1C[C@H](F)CN1 Amb24598689 [0,0,0,0,0,0|1,0,0]=1 204 B9R1.35 OC(=O)C1OC(=O)CS1 Amb25063335 [0,0,0,0,0,0|2,0,2]=4 205 B9R1.35 OC(=O)C=1CC(O)CN1 Amb25141429 [0,0,0,0,0,0|0,0,2]=2 206 B9R1.35 OC(=O)[C@@H]1CC(=O)CC1 Amb22746923 [0,0,0,0,0,0|1,0,2]=3 207 B9R1.35 OC(=O)[C@@H]1CC(=O)CN1 Amb19516117 [0,0,0,0,0,0|0,0,2]=2 208 B9R1.35 OC(=O)[C@@H]1CC(=O)CN1 Amb22747440 [0,0,0,0,0,0|0,0,2]=2 209 B9R1.35 OC(=O)[C@@H]1CC(=O)NC1 Amb23439643 [0,0,0,0,0,0|2,0,2]=4 210 B9R1.35 OC(=O)[C@@H]1CC(F)CN1 Amb25123838 [0,0,0,0,0,0|1,0,0]=1 211 B9R1.35 OC(=O)[C@@H]1CCC(=O)N1 Amb24099403 [0,0,0,0,0,0|2,0,2]=4 212 B9R1.35 OC(=O)[C@@H]1CCC(F)N1 Amb25032254 [0,0,0,0,0,0|3,0,0]=3 213 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)Br Amb10603137 [0,0,0,0,0,0|1,0,0]=1 214 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)F Amb10603139 [0,0,0,0,0,0|1,0,0]=1 215 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)I Amb10603140 [0,0,0,0,0,0|1,0,0]=1 216 B9R1.35 OC(=O)[C@@H]1C[C@@H](Cl)CN1 Amb24582915 [0,0,0,0,0,0|1,0,0]=1 217 B9R1.35 OC(=O)[C@@H]1C[C@@H](S)CN1 Amb22831348 [0,0,0,0,0,0|0,1,0]=1 218 B9R1.35 OC(=O)[C@@H]1C[C@@H](S)CN1 Amb25245369 [0,0,0,0,0,0|0,1,0]=1 219 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)Br Amb10603132 [0,0,0,0,0,0|1,0,0]=1 220 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)F Amb16232298 [0,0,0,0,0,0|1,0,0]=1 221 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)I Amb10603134 [0,0,0,0,0,0|1,0,0]=1 222 B9R1.35 OC(=O)[C@@H]1C[C@H](F)CN1 Amb22757085 [0,0,0,0,0,0|1,0,0]=1 223 B9R1.35 OC(=O)[C@H]1CC(=O)CN1 Amb25360885 [0,0,0,0,0,0|0,0,2]=2 224 B9R1.35 OC(=O)[C@H]1C[C@@H](CN1)F Amb10067741 [0,0,0,0,0,0|1,0,0]=1 225 B9R1.35 OC(=O)[C@H]1C[C@H](CN1)F Amb10839999 [0,0,0,0,0,0|1,0,0]=1 226 B9R1.35 OC1=CC(NN1)C(O)=O Amb25224097 [0,0,0,0,0,0|1,0,2]=3 227 B9R1.35 OC1CC(C=C1)C(O)=O Amb25078348 [0,0,0,0,0,0|1,0,1]=2 228 B9R1.35 OC1CC(N=C1)C(O)=O Amb24083052 [0,0,0,0,0,0|0,0,2]=2 229 B9R1.35 OC1CCC(C1)C(O)=O Amb21963572 [0,0,0,0,0,0|1,0,0]=1 230 B9R1.35 OC1CCN(C1)C(=N)N Amb16232231 [0,0,0,0,0,0|4,0,0]=4 231 B9R1.35 OC1CN(CC1)C(=O)Cl Amb25740939 [0,0,0,0,0,0|3,0,0]=3 232 B9R1.35 OC1CNC(=C1)C(=O)O Amb16232008 [0,0,0,0,0,0|0,0,2]=2 233 B9R1.35 OC1CNC(C1)C(=O)O Amb1151287 [0,0,0,0,0,0|0,0,0]=0 234 B9R1.35 OC1CN[C@@H](C1)C(O)=O Amb25743296 [0,0,0,0,0,0|0,0,0]=0 235 B9R1.35 OC1COC(C1)C(O)=O Amb18642869 [0,0,0,0,0,0|1,0,0]=1 236 B9R1.35 OC1CSC(O1)C(=O)O Amb2432252 [0,0,0,0,0,0|2,0,0]=2 237 B9R1.35 OC1NC(CS1)C(O)=O Amb25759113 [0,0,0,0,0,0|3,0,0]=3 238 B9R1.35 O[C@@H]1CC[C@@H](C1)C(O)=O Amb22746073 [0,0,0,0,0,0|1,0,0]=1 239 B9R1.35 O[C@@H]1CC[C@H](C1)C(O)=O Amb22746558 [0,0,0,0,0,0|1,0,0]=1 240 B9R1.35 O[C@@H]1CC[C@H](N1)C(O)=O Amb24515622 [0,0,0,0,0,0|2,0,0]=2 241 B9R1.35 O[C@@H]1CNC(C1)C(O)=O Amb25118054 [0,0,0,0,0,0|0,0,0]=0 242 B9R1.35 O[C@@H]1CN[C@@H](C1)C(O)=O Amb22748218 [0,0,0,0,0,0|0,0,0]=0 243 B9R1.35 O[C@@H]1CN[C@H](C1)C(=O)O Amb16230723 [0,0,0,0,0,0|0,0,0]=0 244 B9R1.35 O[C@@H]1CO[C@@H](C1)C(O)=O Amb24501449 [0,0,0,0,0,0|1,0,0]=1 245 B9R1.35 O[C@@H]1CO[C@H](C1)C(O)=O Amb24501448 [0,0,0,0,0,0|1,0,0]=1 246 B9R1.35 O[C@@H]1CS[C@H](O1)C(O)=O Amb25288477 [0,0,0,0,0,0|2,0,0]=2 247 B9R1.35 O[C@@H]1C[C@H](NC1)C(=O)Cl Amb25174893 [0,0,0,0,0,0|1,0,0]=1 248 B9R1.35 O[C@H]1CNC(C1)C(O)=O Amb24682710 [0,0,0,0,0,0|0,0,0]=0 249 B9R1.35 O[C@H]1CN[C@@H](C1)C(=O)O Amb1994991 [0,0,0,0,0,0|0,0,0]=0 250 B9R1.35 O[C@H]1C[C@@H](NC1)C(=O)Cl Amb25175003 [0,0,0,0,0,0|1,0,0]=1 251 B9R1.35 Oc1c[nH]c(c1)C(O)=O Amb24649356 [0,0,0,0,0,0|0,0,4]=4 252 B8R1.1 C=CC1CC(Br)CO1 Amb24425482 [1,0,0,0,0,0|3,0,0]=4 253 B8R1.1 C=CC1CC(O)CO1 Amb25040394 [1,0,0,0,0,0|2,0,0]=3 254 B8R1.1 C=CC1CCC(Br)C1 Amb25835103 [1,0,0,0,0,0|3,0,0]=4 255 B8R1.1 C=CC1CCC(O)O1 Amb22752546 [1,0,0,0,0,0|3,0,0]=4 256 B8R1.1 C=C[C@@H]1CC[C@H](N)C1 Amb25246562 [1,0,0,0,0,0|3,0,0]=4 257 B8R1.1 C=C[C@@H]1CO[C@H](O)C1 Amb24684119 [1,0,0,0,0,0|3,0,0]=4 258 B8R1.1 C=C[C@@H]1C[C@H](O)CN1 Amb24517175 [1,0,0,0,0,0|1,0,0]=2 259 B8R1.1 C=C[C@H]1CC[C@@H](N)C1 Amb25179797 [1,0,0,0,0,0|3,0,0]=4 260 B8R1.1 CC1CC(CC1)C=O Amb24483120 [1,0,0,0,0,0|2,0,0]=3 261 B8R1.1 CC1CC(CC1)CO Amb22886865 [1,0,0,0,0,0|2,0,1]=4 262 B8R1.1 CC1CC(CO)NC1 Amb23441155 [1,0,0,0,0,0|1,0,1]=3 263 B8R1.1 CC1CC(CO)OC1 Amb25856417 [1,0,0,0,0,0|2,0,1]=4 264 B8R1.1 CC1CC(CO1)C=O Amb25296463 [1,0,0,0,0,0|3,0,0]=4 265 B8R1.1 CC1CCC(O1)C=O Amb17593184 [1,0,0,0,0,0|3,0,0]=4 266 B8R1.1 CC1CN(CC1)C=O Amb24406673 [1,0,0,0,0,0|3,0,0]=4 267 B8R1.1 CC1CNC(C1)CC Amb19375396 [1,0,0,0,0,0|2,0,1]=4 268 B8R1.1 CCC1CC(O)CO1 Amb24340231 [1,0,0,0,0,0|2,0,1]=4 269 B8R1.1 CCC1CCC(O)C1 Amb24471617 [1,0,0,0,0,0|2,0,1]=4 270 B8R1.1 CC[C@@H]1CC[C@@H](O)C1 Amb24587422 [1,0,0,0,0,0|2,0,1]=4 271 B8R1.1 CN1CC(CC1)C=O Amb18833062 [1,0,0,0,0,0|3,0,0]=4 272 B8R1.1 CN1CC(CC1)C=O Amb24331341 [1,0,0,0,0,0|3,0,0]=4 273 B8R1.1 COC1C[C@H](O)CO1 Amb25144073 [1,0,0,0,0,0|3,0,0]=4 274 B8R1.1 CO[C@@H]1CC[C@@H](O)C1 Amb25283262 [1,0,0,0,0,0|3,0,0]=4 275 B8R1.1 C[C@@H]1CN[C@@H](C1)CC Amb18833051 [1,0,0,0,0,0|2,0,1]=4 276 B8R1.1 C[C@@H]1C[C@H](CO)NC1 Amb22886264 [1,0,0,0,0,0|1,0,1]=3 277 B8R1.1 C[C@H]1CC(CC1)C=O Amb24483030 [1,0,0,0,0,0|2,0,0]=3 278 B8R1.1 C[C@H]1CC(CC1)CO Amb25676567 [1,0,0,0,0,0|2,0,1]=4 279 B8R1.1 C[C@H]1CN[C@@H](C1)CC Amb25026435 [1,0,0,0,0,0|2,0,1]=4 280 B8R1.1 C[C@H]1C[C@@H](CF)NC1 Amb22886265 [1,0,0,0,0,0|2,0,1]=4 281 B8R1.1 FC1CC(NC1)C=O Amb10608926 [1,0,0,0,0,0|1,0,0]=2 282 B8R1.1 F[C@@H]1CN[C@@H](C1)CF Amb22886228 [1,0,0,0,0,0|2,0,1]=4 283 B8R1.1 N#CC1CCC(O)C1 Amb22059665 [1,0,0,0,0,0|2,0,1]=4 284 B8R1.1 N#C[C@@H]1CC[C@@H](O)C1 Amb22886830 [1,0,0,0,0,0|2,0,1]=4 285 B8R1.1 N#C[C@@H]1CC[C@H](O)C1 Amb22886829 [1,0,0,0,0,0|2,0,1]=4 286 B8R1.1 N#C[C@H]1CC[C@@H](O)C1 Amb24540761 [1,0,0,0,0,0|2,0,1]=4 287 B8R1.1 N#C[C@H]1C[C@H](F)CN1 Amb25685866 [1,0,0,0,0,0|2,0,1]=4 288 B8R1.1 NC1CC(CC1)CO Amb18641837 [1,0,0,0,0,0|2,0,1]=4 289 B8R1.1 NC1CC(CC1)NO Amb25677421 [1,0,0,0,0,0|3,0,0]=4 290 B8R1.1 NC1CC(NC1)C=O Amb10608923 [1,0,0,0,0,0|1,0,0]=2 291 B8R1.1 NC1CC(NC1)CO Amb10608924 [1,0,0,0,0,0|1,0,1]=3 292 B8R1.1 NC1CN(CC1)C=O Amb25131292 [1,0,0,0,0,0|3,0,0]=4 293 B8R1.1 NCC1CC(O)CN1 Amb22059798 [1,0,0,0,0,0|1,0,1]=3 294 B8R1.1 NCC1CCC(O)C1 Amb18641846 [1,0,0,0,0,0|2,0,1]=4 295 B8R1.1 NCC1CCC(O)C1 Amb22886211 [1,0,0,0,0,0|2,0,1]=4 296 B8R1.1 NCC1C[C@@H](O)CN1 Amb24622815 [1,0,0,0,0,0|1,0,1]=3 297 B8R1.1 NC[C@@H]1CC[C@@H](C1)O Amb10066982 [1,0,0,0,0,0|2,0,1]=4 298 B8R1.1 NC[C@@H]1CC[C@H](C1)O Amb10066974 [1,0,0,0,0,0|2,0,1]=4 299 B8R1.1 NC[C@H]1CC[C@@H](C1)O Amb10066981 [1,0,0,0,0,0|2,0,1]=4 300 B8R1.1 NC[C@H]1CC[C@H](C1)O Amb10066975 [1,0,0,0,0,0|2,0,1]=4 301 B8R1.1 N[C@@H]1C[C@@H](CO)NC1 Amb22232855 [1,0,0,0,0,0|1,0,1]=3 302 B8R1.1 N[C@H]1C[C@@H](CC1)CO Amb24603976 [1,0,0,0,0,0|2,0,1]=4 303 B8R1.1 N[C@H]1C[C@@H](CO)NC1 Amb22232864 [1,0,0,0,0,0|1,0,1]=3 304 B8R1.1 N[C@H]1C[C@@H](CO)OC1 Amb25313373 [1,0,0,0,0,0|2,0,1]=4 305 B8R1.1 N[C@H]1C[C@H](CC1)CO Amb24526904 [1,0,0,0,0,0|2,0,1]=4 306 B8R1.1 O=CC1CC(=O)CC1 Amb18124240 [1,0,0,0,0,0|1,0,2]=4 307 B8R1.1 O=CC1CC(Br)CO1 Amb22730623 [1,0,0,0,0,0|2,0,0]=3 308 B8R1.1 O=CN1CC(S)CC1 Amb25337191 [1,0,0,0,0,0|2,1,0]=4 309 B8R1.1 O=CN1CC(S)CN1 Amb20621388 [1,0,0,0,0,0|1,1,0]=3 310 B8R1.1 O=C[C@@H]1CC(=O)CC1 Amb24481518 [1,0,0,0,0,0|1,0,2]=4 311 B8R1.1 O=C[C@H]1CC(=O)CC1 Amb25759704 [1,0,0,0,0,0|1,0,2]=4 312 B8R1.1 OC1CC(CC1)C=O Amb18641801 [1,0,0,0,0,0|1,0,0]=2 313 B8R1.1 OC1CC(CC1)CS Amb25853014 [1,0,0,0,0,0|1,1,1]=4 314 B8R1.1 OC1CC(CF)NC1 Amb25245240 [1,0,0,0,0,0|1,0,1]=3 315 B8R1.1 OC1CC(CI)OC1 Amb22229903 [1,0,0,0,0,0|2,0,1]=4 316 B8R1.1 OC1CC(CO)C=C1 Amb25715824 [1,0,0,0,0,0|1,0,2]=4 317 B8R1.1 OC1CCC(C1)CO Amb22168730 [1,0,0,0,0,0|1,0,1]=3 318 B8R1.1 OC1CCC(CO)O1 Amb22492783 [1,0,0,0,0,0|2,0,1]=4 319 B8R1.1 OC1CCC(CO)S1 Amb25346247 [1,0,0,0,0,0|2,0,1]=4 320 B8R1.1 OC1CN(CC1)C=O Amb24501609 [1,0,0,0,0,0|2,0,0]=3 321 B8R1.1 OC1CN(CC1)N=O Amb25781793 [1,0,0,0,0,0|3,0,0]=4 322 B8R1.1 OC1CNC(C1)CO Amb24268900 [1,0,0,0,0,0|0,0,1]=2 323 B8R1.1 OC1COC(C1)CO Amb22229902 [1,0,0,0,0,0|1,0,1]=3 324 B8R1.1 OC1COC(CO)O1 Amb25811023 [1,0,0,0,0,0|2,0,1]=4 325 B8R1.1 OC1CO[C@@H](CO)O1 Amb24660474 [1,0,0,0,0,0|2,0,1]=4 326 B8R1.1 OC1CSC(C1)CO Amb25169321 [1,0,0,0,0,0|1,0,1]=3 327 B8R1.1 OC1CSC(CO)S1 Amb24332689 [1,0,0,0,0,0|2,0,1]=4 328 B8R1.1 OCC1CC(CN1)F Amb10608927 [1,0,0,0,0,0|1,0,1]=3 329 B8R1.1 OCC1CC(CN1)S Amb10608930 [1,0,0,0,0,0|0,1,1]=3 330 B8R1.1 OCC1CC(Cl)CN1 Amb25702816 [1,0,0,0,0,0|1,0,1]=3 331 B8R1.1 OCC1CC(S)CO1 Amb24718475 [1,0,0,0,0,0|1,1,1]=4 332 B8R1.1 OCC1CCC(F)C1 Amb23455679 [1,0,0,0,0,0|2,0,1]=4 333 B8R1.1 OCC1NCC(C1)O Amb1102176 [1,0,0,0,0,0|0,0,1]=2 334 B8R1.1 OC[C@@H]1C[C@@H](CN1)F Amb10844960 [1,0,0,0,0,0|1,0,1]=3 335 B8R1.1 OC[C@@H]1C[C@@H](F)CN1 Amb22886257 [1,0,0,0,0,0|1,0,1]=3 336 B8R1.1 OC[C@@H]1C[C@H](Cl)CN1 Amb24117113 [1,0,0,0,0,0|1,0,1]=3 337 B8R1.1 OC[C@@H]1C[C@H](F)CN1 Amb22886229 [1,0,0,0,0,0|1,0,1]=3 338 B8R1.1 OC[C@H]1C[C@H](S)CO1 Amb24573537 [1,0,0,0,0,0|1,1,1]=4 339 B8R1.1 O[C@@H]1CC[C@H](C1)CO Amb22748539 [1,0,0,0,0,0|1,0,1]=3 340 B8R1.1 O[C@@H]1CN[C@@H](C1)CO Amb24117087 [1,0,0,0,0,0|0,0,1]=2 341 B8R1.1 O[C@@H]1CN[C@H](C1)CO Amb22756284 [1,0,0,0,0,0|0,0,1]=2 342 B8R1.1 O[C@@H]1CO[C@@H](C1)CO Amb22224993 [1,0,0,0,0,0|1,0,1]=3 343 B8R1.1 O[C@@H]1CO[C@H](C1)CO Amb22224992 [1,0,0,0,0,0|1,0,1]=3 344 B8R1.1 O[C@H]1CC[C@@H](C1)CO Amb24544575 [1,0,0,0,0,0|1,0,1]=3 345 B8R1.1 O[C@H]1CC[C@H](C1)CO Amb24619136 [1,0,0,0,0,0|1,0,1]=3 346 B8R1.1 O[C@H]1CN(CC1)C=O Amb25771374 [1,0,0,0,0,0|2,0,0]=3 347 B8R1.1 O[C@H]1CN[C@@H](C1)CO Amb19929426 [1,0,0,0,0,0|0,0,1]=2 348 B8R1.1 O[C@H]1CN[C@H](C1)CO Amb24763113 [1,0,0,0,0,0|0,0,1]=2 349 B8R1.1 O[C@H]1CON(C1)C=O Amb25364785 [1,0,0,0,0,0|2,0,0]=3 350 B8R1.1 O[C@H]1CO[C@@H](C1)CO Amb22224988 [1,0,0,0,0,0|1,0,1]=3 351 B8R1.1 O[C@H]1CO[C@@H](CO)O1 Amb24592891 [1,0,0,0,0,0|2,0,1]=4 352 B8R1.1 O[C@H]1CO[C@H](C1)CO Amb22224987 [1,0,0,0,0,0|1,0,1]=3 353 B8R1.1 O[C@H]1C[C@@H](CC1)C=O Amb24617244 [1,0,0,0,0,0|1,0,0]=2 354 B8R1.1 O[C@H]1C[C@H](CO)C=C1 Amb25317230 [1,0,0,0,0,0|1,0,2]=4 355 B8R1.7 C=C(F)C1CCCN1 Amb24526874 [1,0,0,0,0,0|2,0,0]=3 356 B8R1.7 C=C(F)[C@@H]1CCCN1 Amb25232471 [1,0,0,0,0,0|2,0,0]=3 357 B8R1.7 CC(=C)C1CCCN1 Amb23536664 [1,0,0,0,0,0|2,0,0]=3 358 B8R1.7 CC(=O)C1CCC=C1 Amb25373909 [1,0,0,0,0,0|2,0,1]=4 359 B8R1.7 CC(=O)C1CCC=N1 Amb22496787 [1,0,0,0,0,0|1,0,2]=4 360 B8R1.7 CC(=O)C1CCCN1 Amb17231815 [1,0,0,0,0,0|1,0,0]=2 361 B8R1.7 CC(=O)C1CCCO1 Amb23590167 [1,0,0,0,0,0|2,0,0]=3 362 B8R1.7 CC(=O)C1CCN=N1 Amb24086404 [1,0,0,0,0,0|2,0,1]=4 363 B8R1.7 CC(=O)C1CCSS1 Amb24584425 [1,0,0,0,0,0|3,0,0]=4 364 B8R1.7 CC(=O)C1CNCC1 Amb18833067 [1,0,0,0,0,0|3,0,0]=4 365 B8R1.7 CC(=O)C1CNCC1 Amb22899078 [1,0,0,0,0,0|3,0,0]=4 366 B8R1.7 CC(=O)C1COCC1 Amb18833038 [1,0,0,0,0,0|3,0,0]=4 367 B8R1.7 CC(=O)C1NCCS1 Amb22757393 [1,0,0,0,0,0|2,0,0]=3 368 B8R1.7 CC(=O)C1NCCS1 Amb25127993 [1,0,0,0,0,0|2,0,0]=3 369 B8R1.7 CC(=O)C1OCCO1 Amb24053150 [1,0,0,0,0,0|3,0,0]=4 370 B8R1.7 CC(=O)C1SCCS1 Amb25173435 [1,0,0,0,0,0|3,0,0]=4 371 B8R1.7 CC(=O)C=1CCCC1 Amb22338190 [1,0,0,0,0,0|2,0,1]=4 372 B8R1.7 CC(=O)C=1CCCN1 Amb21962890 [1,0,0,0,0,0|1,0,2]=4 373 B8R1.7 CC(=O)N1CCCN1 Amb25213247 [1,0,0,0,0,0|2,0,0]=3 374 B8R1.7 CC(=O)N1CCCO1 Amb24354493 [1,0,0,0,0,0|3,0,0]=4 375 B8R1.7 CC(=O)[C@@H]1CCCO1 Amb22746525 [1,0,0,0,0,0|2,0,0]=3 376 B8R1.7 CC(=O)[C@H]1CCCO1 Amb25173839 [1,0,0,0,0,0|2,0,0]=3 377 B8R1.7 CC(C)C1CCCN1 Amb17659149 [1,0,0,0,0,0|2,0,1]=4 378 B8R1.7 CC(C)[C@@H]1CCCN1 Amb24183507 [1,0,0,0,0,0|2,0,1]=4 379 B8R1.7 CC(C1CCCN1)C Amb2234804 [1,0,0,0,0,0|2,0,1]=4 380 B8R1.7 CC(C1CCCN1)C Amb2237165 [1,0,0,0,0,0|2,0,1]=4 381 B8R1.7 CC(C1CCCN1)N Amb10609840 [1,0,0,0,0,0|2,0,1]=4 382 B8R1.7 CC(C1CCCN1)N Amb10610386 [1,0,0,0,0,0|2,0,1]=4 383 B8R1.7 CC(C1CCCN1)O Amb17231822 [1,0,0,0,0,0|1,0,1]=3 384 B8R1.7 CC(F)C1CCCN1 Amb23454743 [1,0,0,0,0,0|2,0,1]=4 385 B8R1.7 CC(O)C1CCCS1 Amb25694920 [1,0,0,0,0,0|2,0,1]=4 386 B8R1.7 CC(O)[C@@H]1CCCN1 Amb24685154 [1,0,0,0,0,0|1,0,1]=3 387 B8R1.7 CN(C)C1CCCN1 Amb25202091 [1,0,0,0,0,0|3,0,0]=4 388 B8R1.7 CN(C)[C@H]1CCCN1 Amb24629712 [1,0,0,0,0,0|3,0,0]=4 389 B8R1.7 C[C@@H](O)C1CCCC1 Amb19515558 [1,0,0,0,0,0|2,0,1]=4 390 B8R1.7 C[C@@H](O)[C@H]1CCCO1 Amb24592408 [1,0,0,0,0,0|2,0,1]=4 391 B8R1.7 C[C@H](O)C1CCCC1 Amb25842291 [1,0,0,0,0,0|2,0,1]=4 392 B8R1.7 ClC(=O)C1CSCN1 Amb17142875 [1,0,0,0,0,0|2,0,0]=3 393 B8R1.7 FC(F)C1CCCN1 Amb23439426 [1,0,0,0,0,0|2,0,1]=4 394 B8R1.7 FC(F)[C@@H]1CCCN1 Amb19148414 [1,0,0,0,0,0|2,0,1]=4 395 B8R1.7 FC(F)[C@@H]1CCCN1 Amb23439427 [1,0,0,0,0,0|2,0,1]=4 396 B8R1.7 FC(F)[C@H]1CCCN1 Amb25760268 [1,0,0,0,0,0|2,0,1]=4 397 B8R1.7 NC(=N)C1CCCN1 Amb24549144 [1,0,0,0,0,0|2,0,0]=3 398 B8R1.7 NC(=N)C1CCCO1 Amb22059430 [1,0,0,0,0,0|3,0,0]=4 399 B8R1.7 NC(=N)C1CCCS1 Amb24470321 [1,0,0,0,0,0|3,0,0]=4 400 B8R1.7 NC(=O)C1=NCCN1 Amb1068371 [1,0,0,0,0,0|2,0,1]=4 401 B8R1.7 NC(=O)C1CC=NN1 Amb24482182 [1,0,0,0,0,0|2,0,1]=4 402 B8R1.7 NC(=O)C1CCC=C1 Amb25063981 [1,0,0,0,0,0|2,0,1]=4 403 B8R1.7 NC(=O)C1CCCN1 Amb1152272 [1,0,0,0,0,0|1,0,0]=2 404 B8R1.7 NC(=O)C1CCCS1 Amb24461593 [1,0,0,0,0,0|2,0,0]=3 405 B8R1.7 NC(=O)C1CCSS1 Amb24060539 [1,0,0,0,0,0|3,0,0]=4 406 B8R1.7 NC(=O)C1CNCC1 Amb19373271 [1,0,0,0,0,0|3,0,0]=4 407 B8R1.7 NC(=O)C1CNCO1 Amb25276465 [1,0,0,0,0,0|3,0,0]=4 408 B8R1.7 NC(=O)C1CNCS1 Amb24481531 [1,0,0,0,0,0|3,0,0]=4 409 B8R1.7 NC(=O)C1COCN1 Amb24740220 [1,0,0,0,0,0|2,0,0]=3 410 B8R1.7 NC(=O)C1SCCS1 Amb25097480 [1,0,0,0,0,0|3,0,0]=4 411 B8R1.7 NC(=O)C=1CCCC1 Amb20622488 [1,0,0,0,0,0|2,0,1]=4 412 B8R1.7 NC(=O)N1CCCC1 Amb1107229 [1,0,0,0,0,0|3,0,0]=4 413 B8R1.7 NC(=O)N1CCCN1 Amb24563074 [1,0,0,0,0,0|2,0,0]=3 414 B8R1.7 NC(=O)N1CCCO1 Amb24465577 [1,0,0,0,0,0|3,0,0]=4 415 B8R1.7 NC(=O)[C@@H]1C=CCN1 Amb22801274 [1,0,0,0,0,0|1,0,2]=4 416 B8R1.7 NC(=O)[C@@H]1CC=NN1 Amb25201424 [1,0,0,0,0,0|2,0,1]=4 417 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb20240600 [1,0,0,0,0,0|1,0,0]=2 418 B8R1.7 NC(=O)[C@@H]1CCON1 Amb24542870 [1,0,0,0,0,0|2,0,0]=3 419 B8R1.7 NC(=O)[C@@H]1CNCC1 Amb20671395 [1,0,0,0,0,0|3,0,0]=4 420 B8R1.7 NC(=O)[C@@H]1CNCC1 Amb22405893 [1,0,0,0,0,0|3,0,0]=4 421 B8R1.7 NC(=O)[C@@H]1CSCN1 Amb25111427 [1,0,0,0,0,0|2,0,0]=3 422 B8R1.7 NC(=O)[C@H]1C=CCN1 Amb24386015 [1,0,0,0,0,0|1,0,2]=4 423 B8R1.7 NC(=O)[C@H]1CCCN1 Amb17942785 [1,0,0,0,0,0|1,0,0]=2 424 B8R1.7 NC(=O)[C@H]1CNCC1 Amb20671394 [1,0,0,0,0,0|3,0,0]=4 425 B8R1.7 NC(=O)[C@H]1CNCC1 Amb22405894 [1,0,0,0,0,0|3,0,0]=4 426 B8R1.7 NC(=S)C1CCCN1 Amb19148043 [1,0,0,0,0,0|1,1,0]=3 427 B8R1.7 NC(=S)C1CCCO1 Amb18108094 [1,0,0,0,0,0|2,1,0]=4 428 B8R1.7 NC(=S)[C@@H]1CCCN1 Amb24588473 [1,0,0,0,0,0|1,1,0]=3 429 B8R1.7 NC(=S)[C@H]1CCCN1 Amb24469314 [1,0,0,0,0,0|1,1,0]=3 430 B8R1.7 NC(O)C1CCCC1 Amb24351467 [1,0,0,0,0,0|2,0,1]=4 431 B8R1.7 O=C(Cl)C1CCCS1 Amb25189766 [1,0,0,0,0,0|2,0,0]=3 432 B8R1.7 O=C(Cl)C=1NCCN1 Amb25215918 [1,0,0,0,0,0|2,0,1]=4 433 B8R1.7 O=C(Cl)[C@H]1CCCN1 Amb24655823 [1,0,0,0,0,0|1,0,0]=2 434 B8R1.7 O=C(S)N1CCCC1 Amb25827611 [1,0,0,0,0,0|2,1,0]=4 435 B8R1.7 O=C(S)[C@@H]1CCCO1 Amb24117867 [1,0,0,0,0,0|1,1,0]=3 436 B8R1.7 OB(C1CCCC1)O Amb2447144 [1,0,0,0,0,0|2,0,1]=4 437 B8R1.7 OB(O)C1CCCN1 Amb25333023 [1,0,0,0,0,0|1,0,1]=3 438 B8R1.7 OB(O)C1CCCO1 Amb24317356 [1,0,0,0,0,0|2,0,1]=4 439 B8R1.7 OB(O)[C@@H]1CCCN1 Amb24333761 [1,0,0,0,0,0|1,0,1]=3 440 B8R1.7 OC(=O)C1=CCCN1 Amb17593173 [1,0,0,0,0,0|0,0,2]=3 441 B8R1.7 OC(=O)C1=CCCO1 Amb19148920 [1,0,0,0,0,0|1,0,2]=4 442 B8R1.7 OC(=O)C1=CCCS1 Amb18642795 [1,0,0,0,0,0|1,0,2]=4 443 B8R1.7 OC(=O)C1=NCCS1 Amb18642837 [1,0,0,0,0,0|1,0,2]=4 444 B8R1.7 OC(=O)C1C=CCN1 Amb22899488 [1,0,0,0,0,0|0,0,2]=3 445 B8R1.7 OC(=O)C1C=CCO1 Amb18641762 [1,0,0,0,0,0|1,0,2]=4 446 B8R1.7 OC(=O)C1C=CCS1 Amb18642794 [1,0,0,0,0,0|1,0,2]=4 447 B8R1.7 OC(=O)C1CC=NN1 Amb18641765 [1,0,0,0,0,0|1,0,1]=3 448 B8R1.7 OC(=O)C1CCC=C1 Amb18641680 [1,0,0,0,0,0|1,0,1]=3 449 B8R1.7 OC(=O)C1CCCN1 Amb22040086 [1,0,0,0,0,0|0,0,0]=1 450 B8R1.7 OC(=O)C1CCCN1 Amb2542766 [1,0,0,0,0,0|0,0,0]=1 451 B8R1.7 OC(=O)C1CCCS1 Amb18124363 [1,0,0,0,0,0|1,0,0]=2 452 B8R1.7 OC(=O)C1CCNN1 Amb18641878 [1,0,0,0,0,0|1,0,0]=2 453 B8R1.7 OC(=O)C1CCON1 Amb24351403 [1,0,0,0,0,0|1,0,0]=2 454 B8R1.7 OC(=O)C1CN=CS1 Amb25829554 [1,0,0,0,0,0|2,0,1]=4 455 B8R1.7 OC(=O)C1CNC=N1 Amb25247319 [1,0,0,0,0,0|1,0,2]=4 456 B8R1.7 OC(=O)C1CNCC1 Amb16230724 [1,0,0,0,0,0|2,0,0]=3 457 B8R1.7 OC(=O)C1CNCC1 Amb16233446 [1,0,0,0,0,0|2,0,0]=3 458 B8R1.7 OC(=O)C1CNCO1 Amb24359881 [1,0,0,0,0,0|2,0,0]=3 459 B8R1.7 OC(=O)C1CNOC1 Amb24560626 [1,0,0,0,0,0|3,0,0]=4 460 B8R1.7 OC(=O)C1CSC=C1 Amb18642796 [1,0,0,0,0,0|2,0,1]=4 461 B8R1.7 OC(=O)C1CSCC1 Amb18124360 [1,0,0,0,0,0|2,0,0]=3 462 B8R1.7 OC(=O)C1CSCN1 Amb2549799 [1,0,0,0,0,0|1,0,0]=2 463 B8R1.7 OC(=O)C1CSSC1 Amb17593735 [1,0,0,0,0,0|3,0,0]=4 464 B8R1.7 OC(=O)C1C[13CH2]CN1 Amb22367338 [1,0,0,0,0,0|0,0,0]=1 465 B8R1.7 OC(=O)C1NCCO1 Amb24760849 [1,0,0,0,0,0|1,0,0]=2 466 B8R1.7 OC(=O)C1NCCS1 Amb2444644 [1,0,0,0,0,0|1,0,0]=2 467 B8R1.7 OC(=O)C1OCCO1 Amb24349582 [1,0,0,0,0,0|2,0,0]=3 468 B8R1.7 OC(=O)C1SCCS1 Amb20669087 [1,0,0,0,0,0|2,0,0]=3 469 B8R1.7 OC(=O)C=1CCCN1 Amb18641721 [1,0,0,0,0,0|0,0,2]=3 470 B8R1.7 OC(=O)C=1CCOC1 Amb18124248 [1,0,0,0,0,0|2,0,1]=4 471 B8R1.7 OC(=O)C=1CCON1 Amb24353499 [1,0,0,0,0,0|1,0,2]=4 472 B8R1.7 OC(=O)C=1COCC1 Amb24434391 [1,0,0,0,0,0|2,0,1]=4 473 B8R1.7 OC(=O)C=1CSCC1 Amb18642797 [1,0,0,0,0,0|2,0,1]=4 474 B8R1.7 OC(=O)[C@@H]1C=CCN1 Amb22750611 [1,0,0,0,0,0|0,0,2]=3 475 B8R1.7 OC(=O)[C@@H]1CCC=N1 Amb25075457 [1,0,0,0,0,0|0,0,2]=3 476 B8R1.7 OC(=O)[C@@H]1COCC1 Amb22226787 [1,0,0,0,0,0|2,0,0]=3 477 B8R1.7 OC(=O)[C@@H]1COCN1 Amb19515958 [1,0,0,0,0,0|1,0,0]=2 478 B8R1.7 OC(=O)[C@@H]1NCCS1 Amb24383041 [1,0,0,0,0,0|1,0,0]=2 479 B8R1.7 OC(=O)[C@H]1C=CCN1 Amb19515991 [1,0,0,0,0,0|0,0,2]=3 480 B8R1.7 OC(=O)[C@H]1CCC=C1 Amb25304679 [1,0,0,0,0,0|1,0,1]=3 481 B8R1.7 OC(=O)[C@H]1CCCS1 Amb24481353 [1,0,0,0,0,0|1,0,0]=2 482 B8R1.7 OC(=O)[C@H]1CCSS1 Amb24738509 [1,0,0,0,0,0|2,0,0]=3 483 B8R1.7 OC(=O)[C@H]1COCC1 Amb10603235 [1,0,0,0,0,0|2,0,0]=3 484 B8R1.7 OC(=O)[C@H]1COCN1 Amb25733088 [1,0,0,0,0,0|1,0,0]=2 485 B8R1.7 OC(=O)[C@H]1NCC=C1 Amb16183937 [1,0,0,0,0,0|0,0,2]=3 486 B8R1.7 OC(O)C1CCCN1 Amb24557296 [1,0,0,0,0,0|0,0,2]=3 487 B8R1.7 OS(=O)C1COCC1 Amb25713371 [1,0,0,0,0,0|3,0,0]=4 488 B8R1.7 O[13C](=O)C1CCCN1 Amb22367492 [1,0,0,0,0,0|0,0,0]=1 489 B8R1.7 O[13C](=O)[13C@@H]1[13CH2][13CH2][13CH2][15NH]1 Amb19133705 [1,0,0,0,0,0|0,0,0]=1 490 B8R1.7 O[13C](=O)[C@@H]1CCCN1 Amb22336891 [1,0,0,0,0,0|0,0,0]=1 491 B8R1.7 [13CH3][13C](=O)C1=NCCC1 Amb17607638 [1,0,0,0,0,0|1,0,2]=4 492 B8R1.7 [O-]C(=O)C1CSCN1 Amb10072986 [1,0,0,0,0,0|1,0,1]=3 493 B10R1.14 C#CC(=O)N1CC(O)CC1 Amb24716631 [0,1,0,0,0,0|3,0,0]=4 494 B10R1.14 C#CC(=O)N1C[C@@H](O)CO1 Amb25201661 [0,1,0,0,0,0|3,0,0]=4 495 B10R1.14 C#CC(=O)N1C[C@H](O)CC1 Amb25042987 [0,1,0,0,0,0|3,0,0]=4 496 B10R1.14 C=C(CO)C1CC(O)CC1 Amb24354324 [0,1,0,0,0,0|2,0,0]=3 497 B10R1.14 C=C(CO)[C@H]1C[C@@H](O)CC1 Amb25221366 [0,1,0,0,0,0|2,0,0]=3 498 B10R1.14 C=CC(=O)C1CCC(N)C1 Amb25074117 [0,1,0,0,0,0|3,0,0]=4 499 B10R1.14 C=CC(=O)N1CC(O)CC1 Amb25280638 [0,1,0,0,0,0|3,0,0]=4 500 B10R1.14 C=CC(=O)N1CC(O)CO1 Amb24504823 [0,1,0,0,0,0|3,0,0]=4 501 B10R1.14 CC(CO)C1CC(O)CC1 Amb25316308 [0,1,0,0,0,0|2,0,1]=4 502 B10R1.14 CC1CC(CC1)C(=O)C#C Amb24482034 [0,1,0,0,0,0|3,0,0]=4 503 B10R1.14 CC1CC(CN1)C(=O)OC Amb18831572 [0,1,0,0,0,0|3,0,0]=4 504 B10R1.14 CC1CC(CO1)C(=O)OC Amb25380910 [0,1,0,0,0,0|3,0,0]=4 505 B10R1.14 CC1CCC(C1)C(=O)NC Amb24386581 [0,1,0,0,0,0|3,0,0]=4 506 B10R1.14 CC1CCC(N1)C(=O)OC Amb23440861 [0,1,0,0,0,0|3,0,0]=4 507 B10R1.14 CC1CCC([NH2+]1)C(=O)OC Amb23440874 [0,1,0,0,0,0|3,0,0]=4 508 B10R1.14 CC1CC[C@H](N1)C(=O)OC Amb25843220 [0,1,0,0,0,0|3,0,0]=4 509 B10R1.14 CC1CNC(S1)C(=O)OC Amb25696343 [0,1,0,0,0,0|2,0,0]=3 510 B10R1.14 CC=1CNC(C1)C(=O)OC Amb24455170 [0,1,0,0,0,0|1,0,2]=4 511 B10R1.14 CCC(=O)N1CC(O)CC1 Amb20669201 [0,1,0,0,0,0|3,0,0]=4 512 B10R1.14 CCC(=O)N1C[C@@H](O)CC1 Amb25240174 [0,1,0,0,0,0|3,0,0]=4 513 B10R1.14 CCC(=O)N1C[C@H](O)CC1 Amb25083757 [0,1,0,0,0,0|3,0,0]=4 514 B10R1.14 CNC(=O)C1CC(=C)CN1 Amb24398434 [0,1,0,0,0,0|2,0,1]=4 515 B10R1.14 CNC(=O)C1CCC(F)C1 Amb25105701 [0,1,0,0,0,0|3,0,0]=4 516 B10R1.14 CNC(=O)N1C[C@@H](O)CO1 Amb24392320 [0,1,0,0,0,0|3,0,0]=4 517 B10R1.14 CNC(=O)N1C[C@H](O)CO1 Amb24644473 [0,1,0,0,0,0|3,0,0]=4 518 B10R1.14 COC(=O)C1CC(=C)CC1 Amb25853444 [0,1,0,0,0,0|2,0,1]=4 519 B10R1.14 COC(=O)C1CC(=O)CO1 Amb22755134 [0,1,0,0,0,0|1,0,2]=4 520 B10R1.14 COC(=O)C1CC(=O)CS1 Amb18199422 [0,1,0,0,0,0|1,0,2]=4 521 B10R1.14 COC(=O)C1CC(CN1)O Amb1088852 [0,1,0,0,0,0|0,0,0]=1 522 B10R1.14 COC(=O)C1CC(CN1)O Amb1152079 [0,1,0,0,0,0|0,0,0]=1 523 B10R1.14 COC(=O)C1CC(F)CN1 Amb23597507 [0,1,0,0,0,0|1,0,0]=2 524 B10R1.14 COC(=O)C1CC(N)C=C1 Amb23597961 [0,1,0,0,0,0|2,0,1]=4 525 B10R1.14 COC(=O)C1CC(N)CN1 Amb24728843 [0,1,0,0,0,0|1,0,0]=2 526 B10R1.14 COC(=O)C1CC(N)CO1 Amb23454155 [0,1,0,0,0,0|2,0,0]=3 527 B10R1.14 COC(=O)C1CC(N)CS1 Amb18199086 [0,1,0,0,0,0|2,0,0]=3 528 B10R1.14 COC(=O)C1CC(O)CO1 Amb24648233 [0,1,0,0,0,0|1,0,0]=2 529 B10R1.14 COC(=O)C1CC(S)CN1 Amb25222862 [0,1,0,0,0,0|0,1,0]=2 530 B10R1.14 COC(=O)C1CCC(=O)C1 Amb10067354 [0,1,0,0,0,0|1,0,2]=4 531 B10R1.14 COC(=O)C1CCC(C)O1 Amb17939078 [0,1,0,0,0,0|3,0,0]=4 532 B10R1.14 COC(=O)C1CCC(Cl)C1 Amb24482447 [0,1,0,0,0,0|2,0,0]=3 533 B10R1.14 COC(=O)C1CCC(F)C1 Amb23456070 [0,1,0,0,0,0|2,0,0]=3 534 B10R1.14 COC(=O)C1CCC(N)C1 Amb22001889 [0,1,0,0,0,0|2,0,0]=3 535 B10R1.14 COC(=O)C1CCC(N)C1 Amb22491847 [0,1,0,0,0,0|2,0,0]=3 536 B10R1.14 COC(=O)C1CCC(O)C1 Amb22755872 [0,1,0,0,0,0|1,0,0]=2 537 B10R1.14 COC(=O)C1CCC(O)O1 Amb24440696 [0,1,0,0,0,0|2,0,0]=3 538 B10R1.14 COC(=O)C1C[C@@H](F)CN1 Amb25723900 [0,1,0,0,0,0|1,0,0]=2 539 B10R1.14 COC(=O)C1C[C@@H](O)CN1 Amb24729826 [0,1,0,0,0,0|0,0,0]=1 540 B10R1.14 COC(=O)C1OC(O)CS1 Amb25137201 [0,1,0,0,0,0|2,0,0]=3 541 B10R1.14 COC(=O)C=1CC(C)CC1 Amb24694113 [0,1,0,0,0,0|2,0,1]=4 542 B10R1.14 COC(=O)C=1CC(O)ON1 Amb24479190 [0,1,0,0,0,0|1,0,2]=4 543 B10R1.14 COC(=O)C=1CCC(O)C1 Amb25373876 [0,1,0,0,0,0|1,0,2]=4 544 B10R1.14 COC(=O)N1CC(N)CC1 Amb18279589 [0,1,0,0,0,0|3,0,0]=4 545 B10R1.14 COC(=O)N1CC(N)CC1 Amb19305569 [0,1,0,0,0,0|3,0,0]=4 546 B10R1.14 COC(=O)N1CC(O)CC1 Amb24457006 [0,1,0,0,0,0|2,0,0]=3 547 B10R1.14 COC(=O)N1C[C@H](O)CC1 Amb24479237 [0,1,0,0,0,0|2,0,0]=3 548 B10R1.14 COC(=O)[C@@H]1CC(=O)CC1 Amb23440273 [0,1,0,0,0,0|1,0,2]=4 549 B10R1.14 COC(=O)[C@@H]1CC(F)CN1 Amb23536935 [0,1,0,0,0,0|1,0,0]=2 550 B10R1.14 COC(=O)[C@@H]1CC(O)CN1 Amb25045942 [0,1,0,0,0,0|0,0,0]=1 551 B10R1.14 COC(=O)[C@@H]1CC[C@@H](N)C1 Amb24183379 [0,1,0,0,0,0|2,0,0]=3 552 B10R1.14 COC(=O)[C@@H]1CC[C@@H](O)N1 Amb25247552 [0,1,0,0,0,0|2,0,0]=3 553 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 Amb23440272 [0,1,0,0,0,0|2,0,0]=3 554 B10R1.14 COC(=O)[C@@H]1CC[C@H](O)C1 Amb22746119 [0,1,0,0,0,0|1,0,0]=2 555 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)N Amb10603141 [0,1,0,0,0,0|1,0,0]=2 556 B10R1.14 COC(=O)[C@@H]1C[C@@H](F)CN1 Amb22739014 [0,1,0,0,0,0|1,0,0]=2 557 B10R1.14 COC(=O)[C@@H]1C[C@@H](N)CN1 Amb22585338 [0,1,0,0,0,0|1,0,0]=2 558 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)N Amb10603135 [0,1,0,0,0,0|1,0,0]=2 559 B10R1.14 COC(=O)[C@@H]1C[C@H](C[NH2+]1)O Amb10601653 [0,1,0,0,0,0|0,0,1]=2 560 B10R1.14 COC(=O)[C@@H]1C[C@H](C[NH2+]1)O Amb10604591 [0,1,0,0,0,0|0,0,1]=2 561 B10R1.14 COC(=O)[C@@H]1C[C@H](Cl)CN1 Amb25202432 [0,1,0,0,0,0|1,0,0]=2 562 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 Amb22587327 [0,1,0,0,0,0|1,0,0]=2 563 B10R1.14 COC(=O)[C@@H]1C[C@H](N)C=C1 Amb22274549 [0,1,0,0,0,0|2,0,1]=4 564 B10R1.14 COC(=O)[C@@H]1C[C@H](N)C=C1 Amb22504308 [0,1,0,0,0,0|2,0,1]=4 565 B10R1.14 COC(=O)[C@@H]1C[C@H](N)C=C1 Amb22746484 [0,1,0,0,0,0|2,0,1]=4 566 B10R1.14 COC(=O)[C@@H]1C[C@H](O)CN1 Amb22230437 [0,1,0,0,0,0|0,0,0]=1 567 B10R1.14 COC(=O)[C@@H]1O[C@@H](O)CS1 Amb24613917 [0,1,0,0,0,0|2,0,0]=3 568 B10R1.14 COC(=O)[C@H]1CC(=O)CN1 Amb24642943 [0,1,0,0,0,0|0,0,2]=3 569 B10R1.14 COC(=O)[C@H]1CC(O)CN1 Amb24544095 [0,1,0,0,0,0|0,0,0]=1 570 B10R1.14 COC(=O)[C@H]1CC[C@@H](N)C1 Amb25230396 [0,1,0,0,0,0|2,0,0]=3 571 B10R1.14 COC(=O)[C@H]1CC[C@H](F)N1 Amb25174995 [0,1,0,0,0,0|3,0,0]=4 572 B10R1.14 COC(=O)[C@H]1CN(C)CC1 Amb24334710 [0,1,0,0,0,0|3,0,0]=4 573 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O Amb10069258 [0,1,0,0,0,0|0,0,0]=1 574 B10R1.14 COC(=O)[C@H]1C[C@@H](F)CN1 Amb22886953 [0,1,0,0,0,0|1,0,0]=2 575 B10R1.14 COC(=O)[C@H]1C[C@@H](N)C=C1 Amb22504520 [0,1,0,0,0,0|2,0,1]=4 576 B10R1.14 COC(=O)[C@H]1C[C@@H](O)CO1 Amb25176771 [0,1,0,0,0,0|1,0,0]=2 577 B10R1.14 COC(=O)[C@H]1C[C@H](F)CN1 Amb24631116 [0,1,0,0,0,0|1,0,0]=2 578 B10R1.14 COC(=O)[C@H]1C[C@H](N)C=C1 Amb24697876 [0,1,0,0,0,0|2,0,1]=4 579 B10R1.14 COC(=O)[C@H]1C[C@H](O)CO1 Amb25176770 [0,1,0,0,0,0|1,0,0]=2 580 B10R1.14 COC(O)C1CC(O)CN1 Amb24604832 [0,1,0,0,0,0|0,0,2]=3 581 B10R1.14 COC(O)[C@H]1C[C@@H](O)CN1 Amb24540918 [0,1,0,0,0,0|0,0,2]=3 582 B10R1.14 C[C@@H]1CC[C@@H](O1)C(=O)OC Amb24630211 [0,1,0,0,0,0|3,0,0]=4 583 B10R1.14 C[C@H]1CC[C@H](C1)C(=O)OC Amb24578320 [0,1,0,0,0,0|2,0,0]=3 584 B10R1.14 C[C@H]1CC[C@H](O1)C(=O)OC Amb25366304 [0,1,0,0,0,0|3,0,0]=4 585 B10R1.14 C[C@H]1CN[C@@H](C1)C(=O)OC Amb25367357 [0,1,0,0,0,0|1,0,0]=2 586 B10R1.14 NC1CC(CC1)C(=O)NO Amb25100730 [0,1,0,0,0,0|2,0,0]=3 587 B10R1.14 NC1CCC(C1)C(=O)NN Amb24609331 [0,1,0,0,0,0|3,0,0]=4 588 B10R1.14 NC1CN(CC1)C(=O)CO Amb24477210 [0,1,0,0,0,0|3,0,0]=4 589 B10R1.14 NC1CNC(C1)C(O)CO Amb24477014 [0,1,0,0,0,0|1,0,2]=4 590 B10R1.14 NCC(=O)N1CC(O)CC1 Amb18280753 [0,1,0,0,0,0|3,0,0]=4 591 B10R1.14 NCC(=O)N1CC(O)CC1 Amb21957773 [0,1,0,0,0,0|3,0,0]=4 592 B10R1.14 NNC(=O)N1CC(O)CC1 Amb24438205 [0,1,0,0,0,0|3,0,0]=4 593 B10R1.14 NNC(=O)[C@H]1C[C@H](F)CN1 Amb25792781 [0,1,0,0,0,0|2,0,0]=3 594 B10R1.14 N[C@@H]1CN(CC1)C(=O)CO Amb24401501 [0,1,0,0,0,0|3,0,0]=4 595 B10R1.14 OC1CN(CC1)C(=O)CCl Amb18788242 [0,1,0,0,0,0|3,0,0]=4 596 B10R1.14 OC1CN(CC1)C(=O)CS Amb24704044 [0,1,0,0,0,0|2,1,0]=4 597 B10R1.14 OCC(=O)N1C[C@@H](O)CC1 Amb25279840 [0,1,0,0,0,0|2,0,0]=3 598 B10R1.14 OC[C@H](O)[C@@H]1C[C@@H](O)CN1 Amb24515106 [0,1,0,0,0,0|0,0,2]=3 599 B10R1.14 O[C@H]1CN(CC1)C(=O)CBr Amb25235285 [0,1,0,0,0,0|3,0,0]=4 600 B10R1.14 O[C@H]1CN(CC1)C(=O)CCl Amb25686405 [0,1,0,0,0,0|3,0,0]=4 601 B10R1.31 C=CC1CC(CC1)C(O)=O Amb18643554 [0,1,0,0,0,0|2,0,0]=3 602 B10R1.31 C=CC1CCC(N1)C(O)=O Amb24477091 [0,1,0,0,0,0|3,0,0]=4 603 B10R1.31 C=C[C@@H]1C[C@@H](CC1)C(O)=O Amb25259819 [0,1,0,0,0,0|2,0,0]=3 604 B10R1.31 CC(=O)C1CCC(CO)O1 Amb25146767 [0,1,0,0,0,0|3,0,0]=4 605 B10R1.31 CC(=O)N1CC(CO)CC1 Amb20668834 [0,1,0,0,0,0|3,0,0]=4 606 B10R1.31 CC(=O)N1C[C@@H](CO)CC1 Amb25801989 [0,1,0,0,0,0|3,0,0]=4 607 B10R1.31 CC(=O)N1C[C@H](CO)CC1 Amb24504845 [0,1,0,0,0,0|3,0,0]=4 608 B10R1.31 CC(C)C1CC(CN1)OC Amb23453855 [0,1,0,0,0,0|2,0,1]=4 609 B10R1.31 CCC1CC(CO1)C(O)=O Amb25127111 [0,1,0,0,0,0|3,0,0]=4 610 B10R1.31 CCC1CC(NC1)C(O)=O Amb22496300 [0,1,0,0,0,0|1,0,0]=2 611 B10R1.31 CCC1CCC(N1)C(O)=O Amb24694112 [0,1,0,0,0,0|3,0,0]=4 612 B10R1.31 CCC1CCC(O1)C(O)=O Amb20668759 [0,1,0,0,0,0|3,0,0]=4 613 B10R1.31 CCC1CC[C@H](N1)C(O)=O Amb24376251 [0,1,0,0,0,0|3,0,0]=4 614 B10R1.31 CCC1C[C@H](NC1)C(N)=O Amb25095764 [0,1,0,0,0,0|2,0,0]=3 615 B10R1.31 CCN1CCC(C1)C(=O)O Amb10607746 [0,1,0,0,0,0|3,0,0]=4 616 B10R1.31 CCN1C[C@@H](CC1)C(O)=O Amb24733745 [0,1,0,0,0,0|3,0,0]=4 617 B10R1.31 CC[C@@H]1C[C@@H](CC1)C(C)=O Amb24577776 [0,1,0,0,0,0|3,0,0]=4 618 B10R1.31 CC[C@@H]1C[C@H](NC1)C(O)=O Amb24629222 [0,1,0,0,0,0|1,0,0]=2 619 B10R1.31 CC[C@H]1C[C@@H](CC1)C(C)=O Amb24575928 [0,1,0,0,0,0|3,0,0]=4 620 B10R1.31 CNC1CC(CC1)C(O)=O Amb23454119 [0,1,0,0,0,0|2,0,0]=3 621 B10R1.31 CNC1CNC(C1)C(O)=O Amb24449826 [0,1,0,0,0,0|1,0,0]=2 622 B10R1.31 CN[C@@H]1CN[C@H](C1)C(O)=O Amb24514864 [0,1,0,0,0,0|1,0,0]=2 623 B10R1.31 COC1CC(C=C1)C(O)=O Amb18643833 [0,1,0,0,0,0|1,0,1]=3 624 B10R1.31 COC1CC(CC1)C(O)=O Amb24399167 [0,1,0,0,0,0|1,0,0]=2 625 B10R1.31 COC1CCC(O1)C(C)=O Amb24645446 [0,1,0,0,0,0|3,0,0]=4 626 B10R1.31 COC1CN(CC1)C(C)=O Amb24408750 [0,1,0,0,0,0|3,0,0]=4 627 B10R1.31 COC1CN(CC1)C(N)=O Amb25723572 [0,1,0,0,0,0|3,0,0]=4 628 B10R1.31 COC1CNC(C1)C(N)=O Amb18951799 [0,1,0,0,0,0|1,0,0]=2 629 B10R1.31 COC1CNC(C1)C(O)=O Amb18124718 [0,1,0,0,0,0|0,0,0]=1 630 B10R1.31 CO[C@@H]1CN(CC1)C(C)=O Amb25163280 [0,1,0,0,0,0|3,0,0]=4 631 B10R1.31 CO[C@@H]1CN(CC1)C(C)=O Amb25848809 [0,1,0,0,0,0|3,0,0]=4 632 B10R1.31 CO[C@@H]1CN(CC1)C(N)=O Amb24465991 [0,1,0,0,0,0|3,0,0]=4 633 B10R1.31 CO[C@@H]1CN[C@@H](C1)C(O)=O Amb24514992 [0,1,0,0,0,0|0,0,0]=1 634 B10R1.31 CO[C@@H]1CN[C@H](C1)C(O)=O Amb24112984 [0,1,0,0,0,0|0,0,0]=1 635 B10R1.31 CO[C@H]1CN(CC1)C(C)=O Amb25092730 [0,1,0,0,0,0|3,0,0]=4 636 B10R1.31 CO[C@H]1CN(CC1)C(N)=O Amb25796771 [0,1,0,0,0,0|3,0,0]=4 637 B10R1.31 CO[C@H]1CN[C@H](C1)C(O)=O Amb25231723 [0,1,0,0,0,0|0,0,0]=1 638 B10R1.31 N#CC1CCC(N1)C(O)=O Amb25342936 [0,1,0,0,0,0|3,0,0]=4 639 B10R1.31 N#C[C@@H]1CN[C@@H](C1)C(=O)O Amb10603138 [0,1,0,0,0,0|1,0,0]=2 640 B10R1.31 N#C[C@@H]1CN[C@H](C1)C(O)=O Amb22745851 [0,1,0,0,0,0|1,0,0]=2 641 B10R1.31 N#C[C@H]1CN[C@@H](C1)C(=O)O Amb10603133 [0,1,0,0,0,0|1,0,0]=2 642 B10R1.31 NC(=O)C1CCC(CO)O1 Amb25147557 [0,1,0,0,0,0|3,0,0]=4 643 B10R1.31 NC(=O)[C@@H]1CC[C@H](CO)C1 Amb25708732 [0,1,0,0,0,0|2,0,0]=3 644 B10R1.31 NC(=O)[C@@H]1C[C@H](CN1)C#N Amb24544768 [0,1,0,0,0,0|2,0,0]=3 645 B10R1.31 NC[C@@H]1CC[C@@H](C1)C(=O)O Amb10066951 [0,1,0,0,0,0|2,0,0]=3 646 B10R1.31 NC[C@@H]1CC[C@H](C1)C(=O)O Amb10066932 [0,1,0,0,0,0|2,0,0]=3 647 B10R1.31 NC[C@@H]1C[C@H](NC1)C(O)=O Amb24117205 [0,1,0,0,0,0|1,0,0]=2 648 B10R1.31 NC[C@H]1CC[C@@H](C1)C(=O)O Amb10066933 [0,1,0,0,0,0|2,0,0]=3 649 B10R1.31 NC[C@H]1CC[C@H](C1)C(=O)O Amb10066930 [0,1,0,0,0,0|2,0,0]=3 650 B10R1.31 NC[C@H]1C[C@H](NC1)C(O)=O Amb24117206 [0,1,0,0,0,0|1,0,0]=2 651 B10R1.31 NN=C1CCC(C1)C(O)=O Amb25734466 [0,1,0,0,0,0|2,0,1]=4 652 B10R1.31 NOC1CNC(C1)C(O)=O Amb24356547 [0,1,0,0,0,0|0,0,0]=1 653 B10R1.31 NO[C@@H]1CN[C@@H](C1)C(O)=O Amb25188204 [0,1,0,0,0,0|0,0,0]=1 654 B10R1.31 N\N=C\1/CCC(C1)C(O)=O Amb23453110 [0,1,0,0,0,0|2,0,1]=4 655 B10R1.31 OC(=O)C1CC(C=C1)C=O Amb24480688 [0,1,0,0,0,0|1,0,2]=4 656 B10R1.31 OC(=O)C1CC(C=O)=NN1 Amb25721545 [0,1,0,0,0,0|1,0,2]=4 657 B10R1.31 OC(=O)C1CC(CC1)=NO Amb24569321 [0,1,0,0,0,0|1,0,1]=3 658 B10R1.31 OC(=O)C1CC(CCl)NN1 Amb24542379 [0,1,0,0,0,0|2,0,0]=3 659 B10R1.31 OC(=O)C1CCC(CS)O1 Amb18285066 [0,1,0,0,0,0|2,1,0]=4 660 B10R1.31 OC(=O)C1CCC(CS)S1 Amb25689446 [0,1,0,0,0,0|2,1,0]=4 661 B10R1.31 OC(=O)C1CN(CC1)C=O Amb18280900 [0,1,0,0,0,0|2,0,1]=4 662 B10R1.31 OC(=O)C1CSC(CS)C1 Amb24482254 [0,1,0,0,0,0|2,1,0]=4 663 B10R1.31 OC(=O)C1C\C(\CC1)=N\O Amb23453115 [0,1,0,0,0,0|1,0,1]=3 664 B10R1.31 OC(=O)[C@@H]1C\C(\CN1)=C/F Amb25141421 [0,1,0,0,0,0|1,0,1]=3 665 B10R1.31 OC(=O)[C@H]1CC(CC1)=NO Amb25367253 [0,1,0,0,0,0|1,0,1]=3 666 B10R1.31 OC(=O)[C@H]1C[C@H](CCl)NN1 Amb24605620 [0,1,0,0,0,0|2,0,0]=3 667 B10R1.31 OCC1CC(C=C1)C(=O)Cl Amb25795610 [0,1,0,0,0,0|2,0,1]=4 668 B10R1.31 OCC1CC(C=C1)C(O)=O Amb25764434 [0,1,0,0,0,0|1,0,1]=3 669 B10R1.31 OCC1CC(CC1)C(O)=O Amb25697003 [0,1,0,0,0,0|1,0,0]=2 670 B10R1.31 OCC1CC(NC1)C(O)=O Amb25685963 [0,1,0,0,0,0|0,0,0]=1 671 B10R1.31 OCC1CCC(N1)C(O)=O Amb24502434 [0,1,0,0,0,0|2,0,0]=3 672 B10R1.31 OCC1CCC(O1)C(O)=O Amb18285041 [0,1,0,0,0,0|2,0,0]=3 673 B10R1.31 OCC1N[C@@H](CS1)C(O)=O Amb24594995 [0,1,0,0,0,0|3,0,0]=4 674 B10R1.31 OC[C@@H]1CC[C@@H](N1)C(O)=O Amb25328970 [0,1,0,0,0,0|2,0,0]=3 675 B10R1.31 OC[C@@H]1C[C@@H](CC1)C(=O)Cl Amb24658298 [0,1,0,0,0,0|2,0,0]=3 676 B10R1.31 OC[C@@H]1C[C@H](NC1)C(O)=O Amb24514873 [0,1,0,0,0,0|0,0,0]=1 677 B10R1.31 OC[C@H]1CC[C@H](N1)C(O)=O Amb25213618 [0,1,0,0,0,0|2,0,0]=3 678 B10R1.31 OC[C@H]1C[C@@H](CC1)C(O)=O Amb24514835 [0,1,0,0,0,0|1,0,0]=2 679 B10R1.31 OC[C@H]1C[C@H](NC1)C(O)=O Amb25304927 [0,1,0,0,0,0|0,0,0]=1 680 B10R1.55 CC(C)(C)C1CC(O)CN1 Amb25756554 [0,1,0,0,0,0|2,0,1]=4 681 B10R1.55 CC(C)(O)C1CC(O)CN1 Amb25326745 [0,1,0,0,0,0|1,0,1]=3 682 B10R1.55 CP(O)(=O)C1CCC(N)C1 Amb24435529 [0,1,0,0,0,0|3,0,0]=4 683 B10R1.55 CP(O)(=O)[C@@H]1CC[C@H](N)C1 Amb24656054 [0,1,0,0,0,0|3,0,0]=4 684 B10R1.55 CS(=O)(=O)C1CCC(O)C1 Amb20624006 [0,1,0,0,0,0|2,0,1]=4 685 B10R1.58 C=C1C[C@@H](C[C@@H]1N)C(O)=O Amb25229776 [0,1,0,0,0,0|2,0,1]=4 686 B10R1.58 C=C1C[C@@H](NC1=O)C(O)=O Amb25821844 [0,1,0,0,0,0|1,0,2]=4 687 B10R1.58 C=C1C[C@H](C[C@H]1N)C(O)=O Amb25175067 [0,1,0,0,0,0|2,0,1]=4 688 B10R1.58 CC(=O)N1C[C@H](O)[C@H](O)C1 Amb25714132 [0,1,0,0,0,0|3,0,0]=4 689 B10R1.58 CC(C)C1CC(O)C(C)N1 Amb23453904 [0,1,0,0,0,0|2,0,1]=4 690 B10R1.58 CC1CC(CC1O)C(O)=O Amb25072588 [0,1,0,0,0,0|1,0,0]=2 691 B10R1.58 CC1CC(CN1C)C(O)=O Amb18831573 [0,1,0,0,0,0|3,0,0]=4 692 B10R1.58 CC1CC(NC1=O)C(O)=O Amb24561629 [0,1,0,0,0,0|1,0,1]=3 693 B10R1.58 CC1C[C@H](NC1=O)C(O)=O Amb24425935 [0,1,0,0,0,0|1,0,1]=3 694 B10R1.58 CC1C[C@H](NC1O)C(O)=O Amb25759035 [0,1,0,0,0,0|1,0,0]=2 695 B10R1.58 CC1NC(CC1=O)C(O)=O Amb24681544 [0,1,0,0,0,0|0,0,2]=3 696 B10R1.58 CC1NC(CC1C)C(O)=O Amb18831587 [0,1,0,0,0,0|1,0,0]=2 697 B10R1.58 CC1NC(C[C@@H]1O)C(O)=O Amb25111979 [0,1,0,0,0,0|0,0,0]=1 698 B10R1.58 CC1N[C@@H](CC1O)C(O)=O Amb24481172 [0,1,0,0,0,0|0,0,0]=1 699 B10R1.58 CC1OC(CC1C)C(O)=O Amb24368255 [0,1,0,0,0,0|2,0,0]=3 700 B10R1.58 CC1OC(CC1O)C(O)=O Amb24366663 [0,1,0,0,0,0|1,0,0]=2 701 B10R1.58 CC1SC(CC1=O)C(O)=O Amb24061426 [0,1,0,0,0,0|1,0,2]=4 702 B10R1.58 CC1SC(SC1C)C(O)=O Amb24444633 [0,1,0,0,0,0|3,0,0]=4 703 B10R1.58 CN1C[C@@H](NC1=O)C(O)=O Amb23598492 [0,1,0,0,0,0|2,0,1]=4 704 B10R1.58 CN1NC(C=C1O)C(O)=O Amb25216375 [0,1,0,0,0,0|1,0,2]=4 705 B10R1.58 C[C@@H](O)[C@@H]1C[C@H](O)[C@@H](O)O1 Amb24520305 [0,1,0,0,0,0|2,0,1]=4 706 B10R1.58 C[C@@H]1C[C@H](NC1=O)C(O)=O Amb25294315 [0,1,0,0,0,0|1,0,1]=3 707 B10R1.58 C[C@@H]1N[C@@H](CC1=O)C(O)=O Amb25176921 [0,1,0,0,0,0|0,0,2]=3 708 B10R1.58 C[C@@H]1O[C@H](C[C@H]1O)C(O)=O Amb24599918 [0,1,0,0,0,0|1,0,0]=2 709 B10R1.58 C[C@H](O)[C@H]1C[C@@H](O)C(O)O1 Amb25306291 [0,1,0,0,0,0|2,0,1]=4 710 B10R1.58 C[C@H]1CC(C[C@@H]1C)C(O)=O Amb24745797 [0,1,0,0,0,0|2,0,0]=3 711 B10R1.58 C[C@H]1CC(C[C@@H]1O)C(C)=C Amb25176799 [0,1,0,0,0,0|3,0,0]=4 712 B10R1.58 C[C@H]1O[C@H](C[C@@H]1O)C(O)=O Amb25323977 [0,1,0,0,0,0|1,0,0]=2 713 B10R1.58 NC(=O)[C@@H]1C[C@@H](F)C(=O)N1 Amb25201106 [0,1,0,0,0,0|2,0,1]=4 714 B10R1.58 NC(=O)[C@@H]1C[C@H](N)[C@H](N)C1 Amb24447183 [0,1,0,0,0,0|3,0,0]=4 715 B10R1.58 NC1CC(C=C1F)C(O)=O Amb25054018 [0,1,0,0,0,0|2,0,1]=4 716 B10R1.58 NC1CC(CC1Br)C(O)=O Amb24760064 [0,1,0,0,0,0|2,0,0]=3 717 B10R1.58 NC1CC(CC1O)C(O)=O Amb25690425 [0,1,0,0,0,0|1,0,0]=2 718 B10R1.58 NC1CC(OC1=O)C(O)=O Amb25147458 [0,1,0,0,0,0|2,0,1]=4 719 B10R1.58 NC1CC(SC1=O)C(O)=O Amb25317929 [0,1,0,0,0,0|2,0,1]=4 720 B10R1.58 N[C@@H]1CC(C[C@H]1O)C(O)=O Amb23456138 [0,1,0,0,0,0|1,0,0]=2 721 B10R1.58 N[C@@H]1C[C@@H](C[C@@H]1N)C(O)=O Amb24120362 [0,1,0,0,0,0|2,0,0]=3 722 B10R1.58 N[C@H]1CC(SC1=O)C(O)=O Amb25297996 [0,1,0,0,0,0|2,0,1]=4 723 B10R1.58 N[C@H]1C[C@H](C=C1F)C(O)=O Amb24587744 [0,1,0,0,0,0|2,0,1]=4 724 B10R1.58 N[C@H]1C[C@H](C[C@@H]1F)C(O)=O Amb24568879 [0,1,0,0,0,0|2,0,0]=3 725 B10R1.58 OC(=O)C1CC(F)C(=O)N1 Amb24696741 [0,1,0,0,0,0|1,0,1]=3 726 B10R1.58 OC(=O)C1CC(F)C(F)C1 Amb24593924 [0,1,0,0,0,0|2,0,0]=3 727 B10R1.58 OC(=O)C1CC(O)C(=O)N1 Amb24505111 [0,1,0,0,0,0|0,0,1]=2 728 B10R1.58 OC(=O)C1CC(O)C(=O)O1 Amb18644233 [0,1,0,0,0,0|1,0,1]=3 729 B10R1.58 OC(=O)C1C[C@@H](Br)[C@H](Br)C1 Amb19297771 [0,1,0,0,0,0|2,0,0]=3 730 B10R1.58 OC(=O)[C@@H]1CC(F)C(=O)N1 Amb25360897 [0,1,0,0,0,0|1,0,1]=3 731 B10R1.58 OC(=O)[C@@H]1C[C@@H](O)C(=O)O1 Amb24514914 [0,1,0,0,0,0|1,0,1]=3 732 B10R1.58 OC(=O)[C@@H]1C[C@H](O)C(=O)O1 Amb25230626 [0,1,0,0,0,0|1,0,1]=3 733 B10R1.58 OC(=O)[C@H]1C[C@@H](F)C(=O)N1 Amb25259244 [0,1,0,0,0,0|1,0,1]=3 734 B10R1.58 OC(=O)[C@H]1NC(=O)[C@@H](C1)F Amb10839466 [0,1,0,0,0,0|1,0,1]=3 735 B10R1.58 OC(=O)[C@H]1NC(=O)[C@H](C1)F Amb10838332 [0,1,0,0,0,0|1,0,1]=3 736 B10R1.59 C=C1C[C@@H](N)[C@H](C1)C(O)=O Amb24560213 [0,1,0,0,0,0|2,0,1]=4 737 B10R1.59 C=C1C[C@@H]([C@H](C1)C(=O)O)N Amb10071928 [0,1,0,0,0,0|2,0,1]=4 738 B10R1.59 CC(=O)C1CC(C)CC1=O Amb25146505 [0,1,0,0,0,0|3,0,0]=4 739 B10R1.59 CC(=O)C1CC(F)CN1C Amb24618579 [0,1,0,0,0,0|2,0,0]=3 740 B10R1.59 CC(=O)N1CC(O)CC1=O Amb25725756 [0,1,0,0,0,0|3,0,0]=4 741 B10R1.59 CC(C)C1CC(O)CN1C Amb23453991 [0,1,0,0,0,0|2,0,1]=4 742 B10R1.59 CC1CC(=O)CC1C(O)=O Amb25281943 [0,1,0,0,0,0|1,0,2]=4 743 B10R1.59 CC1CC(C(O)=O)N(C)C1 Amb25359118 [0,1,0,0,0,0|1,0,0]=2 744 B10R1.59 CC1CC(C)NC1C(O)=O Amb25126900 [0,1,0,0,0,0|3,0,0]=4 745 B10R1.59 CC1CC(N)C(O1)C(O)=O Amb24609573 [0,1,0,0,0,0|3,0,0]=4 746 B10R1.59 CC1CC(O)C(N1)C(O)=O Amb25737391 [0,1,0,0,0,0|3,0,0]=4 747 B10R1.59 CC1CC(O)CN1C(C)=O Amb25056732 [0,1,0,0,0,0|3,0,0]=4 748 B10R1.59 CC1CC(O)CN1C(N)=O Amb25222182 [0,1,0,0,0,0|3,0,0]=4 749 B10R1.59 CC1CC(O)NC1C(O)=O Amb24505217 [0,1,0,0,0,0|2,0,0]=3 750 B10R1.59 CC1CN(C)CC1C(O)=O Amb24478023 [0,1,0,0,0,0|3,0,0]=4 751 B10R1.59 CC1NC(C)CC1C(O)=O Amb24586145 [0,1,0,0,0,0|3,0,0]=4 752 B10R1.59 CC=1CC(C(O)=O)N(C)C1 Amb25122140 [0,1,0,0,0,0|1,0,2]=4 753 B10R1.59 CC=1CC(C(O)=O)N(C)N1 Amb25309741 [0,1,0,0,0,0|2,0,1]=4 754 B10R1.59 CN1CC(N)CC1C(N)=O Amb25258785 [0,1,0,0,0,0|2,0,0]=3 755 B10R1.59 CN1CC(O)CC1C(N)=O Amb25300409 [0,1,0,0,0,0|1,0,0]=2 756 B10R1.59 CN1CC(S)CC1C(O)=O Amb25217631 [0,1,0,0,0,0|0,1,0]=2 757 B10R1.59 CN1C[C@@H](F)C[C@@H]1C(O)=O Amb25328928 [0,1,0,0,0,0|1,0,0]=2 758 B10R1.59 CN1C[C@@H](F)C[C@H]1C(O)=O Amb25305695 [0,1,0,0,0,0|1,0,0]=2 759 B10R1.59 CN1C[C@@H](N)C[C@H]1C(O)=O Amb19516794 [0,1,0,0,0,0|1,0,0]=2 760 B10R1.59 CN1C[C@@H](O)C[C@@H]1C(O)=O Amb23592288 [0,1,0,0,0,0|0,0,0]=1 761 B10R1.59 CN1C[C@@H](O)C[C@H]1C(O)=O Amb22757084 [0,1,0,0,0,0|0,0,0]=1 762 B10R1.59 CN1C[C@@H](S)C[C@H]1C(N)=O Amb24617357 [0,1,0,0,0,0|1,1,0]=3 763 B10R1.59 CN1C[C@H](F)C[C@H]1C(N)=O Amb25298012 [0,1,0,0,0,0|2,0,0]=3 764 B10R1.59 CN1C[C@H](F)C[C@H]1C(O)=O Amb25175012 [0,1,0,0,0,0|1,0,0]=2 765 B10R1.59 CN1C[C@H](N)C[C@H]1C(O)=O Amb22587284 [0,1,0,0,0,0|1,0,0]=2 766 B10R1.59 CN1C[C@H](N)C[C@H]1C(O)=O Amb23385233 [0,1,0,0,0,0|1,0,0]=2 767 B10R1.59 CN1C[C@H](O)C[C@@H]1C(O)=O Amb24669003 [0,1,0,0,0,0|0,0,0]=1 768 B10R1.59 CN1C[C@H](O)C[C@H]1C(N)=O Amb25259453 [0,1,0,0,0,0|1,0,0]=2 769 B10R1.59 CN1NC(=O)CC1C(O)=O Amb25761701 [0,1,0,0,0,0|1,0,2]=4 770 B10R1.59 C[C@@H]1CC(=O)C[C@@H]1C(O)=O Amb25174905 [0,1,0,0,0,0|1,0,2]=4 771 B10R1.59 C[C@@H]1CN(C)C[C@H]1C(O)=O Amb24643115 [0,1,0,0,0,0|3,0,0]=4 772 B10R1.59 C[C@@H]1C[C@@H](C(O)=O)C(=O)O1 Amb25174800 [0,1,0,0,0,0|3,0,0]=4 773 B10R1.59 C[C@@H]1C[C@H](Cl)[C@H](O1)C(O)=O Amb24628935 [0,1,0,0,0,0|3,0,0]=4 774 B10R1.59 C[C@H]1C[C@@H](C(O)=O)C(=O)O1 Amb25174799 [0,1,0,0,0,0|3,0,0]=4 775 B10R1.59 NC1CC(=O)CC1C(O)=O Amb24523031 [0,1,0,0,0,0|1,0,2]=4 776 B10R1.59 NC1CC(C(N)C1)C(O)=O Amb25200055 [0,1,0,0,0,0|2,0,0]=3 777 B10R1.59 N[C@@H]1CC(=O)C[C@@H]1C(O)=O Amb24391186 [0,1,0,0,0,0|1,0,2]=4 778 B10R1.59 N[C@H]1CC(=C)C[C@H]1C(O)=O Amb17938168 [0,1,0,0,0,0|2,0,1]=4 779 B10R1.194 C=C1CCC(C1N)C(O)=O Amb25690409 [0,1,0,0,0,0|2,0,1]=4 780 B10R1.194 CC(=C)[C@H]1OC[C@H](O)[C@H]1O Amb25219298 [0,1,0,0,0,0|3,0,0]=4 781 B10R1.194 CC(=O)[C@H]1NC[C@H](O)[C@H]1O Amb24515084 [0,1,0,0,0,0|1,0,0]=2 782 B10R1.194 CC(O)[C@H]1NC[C@@H](O)[C@@H]1O Amb24668688 [0,1,0,0,0,0|1,0,1]=3 783 B10R1.194 CC1C(CCC1=O)C(O)=O Amb18643836 [0,1,0,0,0,0|1,0,2]=4 784 B10R1.194 CC1C(CCC1O)C(O)=O Amb24543785 [0,1,0,0,0,0|1,0,0]=2 785 B10R1.194 CC1C(NCC1=O)C(N)=O Amb24598927 [0,1,0,0,0,0|1,0,2]=4 786 B10R1.194 CC1C(NCC1=O)C(O)=O Amb25054606 [0,1,0,0,0,0|0,0,2]=3 787 B10R1.194 CC1C(NCC1C)C(C)=O Amb25684648 [0,1,0,0,0,0|2,0,0]=3 788 B10R1.194 CC1C(O)CCC1C(C)=C Amb25234666 [0,1,0,0,0,0|3,0,0]=4 789 B10R1.194 CC1C(OCC1O)C(O)=O Amb25738059 [0,1,0,0,0,0|1,0,0]=2 790 B10R1.194 CC1CCC(C(O)=O)N1C Amb25141608 [0,1,0,0,0,0|3,0,0]=4 791 B10R1.194 CC1CCC(C1N)C(O)=O Amb20623936 [0,1,0,0,0,0|2,0,0]=3 792 B10R1.194 CC1CC[C@@H](C1C)C(N)=O Amb25147387 [0,1,0,0,0,0|3,0,0]=4 793 B10R1.194 CC1CNC(C1O)C(O)=O Amb25778105 [0,1,0,0,0,0|1,0,0]=2 794 B10R1.194 CC1NNC(C1C)C(O)=O Amb25733163 [0,1,0,0,0,0|2,0,0]=3 795 B10R1.194 CC1SCC(C1N)C(O)=O Amb24741225 [0,1,0,0,0,0|3,0,0]=4 796 B10R1.194 CC1[C@@H](NCC1O)C(O)=O Amb24120643 [0,1,0,0,0,0|0,0,0]=1 797 B10R1.194 CC1[C@H](CCC1=O)C(O)=O Amb24538053 [0,1,0,0,0,0|1,0,2]=4 798 B10R1.194 CC1[C@H](O)CCC1C(C)=C Amb25271457 [0,1,0,0,0,0|3,0,0]=4 799 B10R1.194 CN1C(CCC1O)C(O)=O Amb24669369 [0,1,0,0,0,0|2,0,0]=3 800 B10R1.194 C[C@@H](O)C1NCC(O)C1O Amb25680643 [0,1,0,0,0,0|1,0,1]=3 801 B10R1.194 C[C@@H](O)[C@@H]1NC[C@@H](O)[C@H]1O Amb24631870 [0,1,0,0,0,0|1,0,1]=3 802 B10R1.194 C[C@@H](O)[C@@H]1NC[C@H](O)[C@H]1O Amb24515086 [0,1,0,0,0,0|1,0,1]=3 803 B10R1.194 C[C@@H](O)[C@H]1NC[C@@H](O)[C@@H]1O Amb25340483 [0,1,0,0,0,0|1,0,1]=3 804 B10R1.194 C[C@@H](O)[C@H]1NC[C@@H](O)[C@H]1O Amb25294384 [0,1,0,0,0,0|1,0,1]=3 805 B10R1.194 C[C@@H](O)[C@H]1NC[C@H](O)[C@H]1O Amb25339738 [0,1,0,0,0,0|1,0,1]=3 806 B10R1.194 C[C@@H](O)[C@H]1OC[C@@H](O)[C@H]1O Amb25239371 [0,1,0,0,0,0|2,0,1]=4 807 B10R1.194 C[C@@H]1C(O)CC[C@@H]1C(C)=C Amb25175332 [0,1,0,0,0,0|3,0,0]=4 808 B10R1.194 C[C@@H]1C(O)OC[C@@H]1C(C)=O Amb25359001 [0,1,0,0,0,0|3,0,0]=4 809 B10R1.194 C[C@@H]1CC[C@@H](C(O)=O)N1C Amb24715908 [0,1,0,0,0,0|3,0,0]=4 810 B10R1.194 C[C@@H]1CC[C@@H]([C@H]1C)C(N)=O Amb24724378 [0,1,0,0,0,0|3,0,0]=4 811 B10R1.194 C[C@@H]1CC[C@@H]([C@H]1C)C(O)=O Amb24562854 [0,1,0,0,0,0|2,0,0]=3 812 B10R1.194 C[C@@H]1CC[C@@H]([C@H]1N)C(O)=O Amb24618144 [0,1,0,0,0,0|2,0,0]=3 813 B10R1.194 C[C@@H]1CC[C@H](C(O)=O)N1C Amb24667763 [0,1,0,0,0,0|3,0,0]=4 814 B10R1.194 C[C@@H]1CN[C@H]([C@@H]1O)C(O)=O Amb24540945 [0,1,0,0,0,0|1,0,0]=2 815 B10R1.194 C[C@@H]1[C@@H](CCN1C)C(O)=O Amb24545060 [0,1,0,0,0,0|3,0,0]=4 816 B10R1.194 C[C@@H]1[C@H](CCN1C)C(O)=O Amb18202481 [0,1,0,0,0,0|3,0,0]=4 817 B10R1.194 C[C@@H]1[C@H](NCC1=O)C(N)=O Amb25189706 [0,1,0,0,0,0|1,0,2]=4 818 B10R1.194 C[C@@H]1[C@H](NCC1=O)C(O)=O Amb18831599 [0,1,0,0,0,0|0,0,2]=3 819 B10R1.194 C[C@@H]1[C@H](NC[C@@H]1O)C(O)=O Amb24120648 [0,1,0,0,0,0|0,0,0]=1 820 B10R1.194 C[C@@H]1[C@H](O)CC[C@@H]1C(C)=C Amb25176800 [0,1,0,0,0,0|3,0,0]=4 821 B10R1.194 C[C@H](O)[C@@H]1NC[C@H](O)[C@@H]1O Amb24618614 [0,1,0,0,0,0|1,0,1]=3 822 B10R1.194 C[C@H](O)[C@H]1CC[C@@H](O)[C@H]1O Amb25213099 [0,1,0,0,0,0|2,0,1]=4 823 B10R1.194 C[C@H](O)[C@H]1CC[C@H](O)[C@@H]1O Amb24600001 [0,1,0,0,0,0|2,0,1]=4 824 B10R1.194 C[C@H]1C(OC[C@H]1O)C(O)=O Amb25278272 [0,1,0,0,0,0|1,0,0]=2 825 B10R1.194 C[C@H]1CC=C([C@@H]1C)C(O)=O Amb24560934 [0,1,0,0,0,0|2,0,1]=4 826 B10R1.194 C[C@H]1CC[C@@H](C(O)=O)N1C Amb24715909 [0,1,0,0,0,0|3,0,0]=4 827 B10R1.194 C[C@H]1CC[C@@H]([C@@H]1C)C(N)=O Amb24746479 [0,1,0,0,0,0|3,0,0]=4 828 B10R1.194 C[C@H]1CC[C@H](C(O)=O)N1C Amb24539499 [0,1,0,0,0,0|3,0,0]=4 829 B10R1.194 C[C@H]1CC[C@H]([C@H]1C)C(C)=O Amb24723003 [0,1,0,0,0,0|3,0,0]=4 830 B10R1.194 C[C@H]1CC[C@H]([C@H]1C)C(N)=O Amb24678444 [0,1,0,0,0,0|3,0,0]=4 831 B10R1.194 C[C@H]1CC[C@H]([C@H]1C)C(O)=O Amb25260395 [0,1,0,0,0,0|2,0,0]=3 832 B10R1.194 C[C@H]1CN[C@@H]([C@H]1O)C(O)=O Amb25174982 [0,1,0,0,0,0|1,0,0]=2 833 B10R1.194 C[C@H]1[C@@H](CC[C@@H]1O)C(O)=O Amb25174798 [0,1,0,0,0,0|1,0,0]=2 834 B10R1.194 C[C@H]1[C@H](CCN1C)C(O)=O Amb25227695 [0,1,0,0,0,0|3,0,0]=4 835 B10R1.194 C[C@H]1[C@H](NC[C@@H]1O)C(O)=O Amb24519749 [0,1,0,0,0,0|0,0,0]=1 836 B10R1.194 C[C@H]1[C@H](O)CC[C@@H]1C(C)=C Amb25206349 [0,1,0,0,0,0|3,0,0]=4 837 B10R1.194 C[C@H]1[C@H](O)OC[C@H]1C(C)=O Amb24646508 [0,1,0,0,0,0|3,0,0]=4 838 B10R1.194 NC(=O)C1OCC(O)C1O Amb24375304 [0,1,0,0,0,0|2,0,0]=3 839 B10R1.194 NC(=O)[C@@H]1OC[C@@H](O)[C@H]1O Amb24683290 [0,1,0,0,0,0|2,0,0]=3 840 B10R1.194 NC1CCC(C1Br)C(O)=O Amb24403336 [0,1,0,0,0,0|2,0,0]=3 841 B10R1.194 N[C@@H]1CC[C@@H]([C@H]1Br)C(O)=O Amb24592123 [0,1,0,0,0,0|2,0,0]=3 842 B10R1.194 N[C@@H]1[C@H](NC[C@H]1O)C(O)=O Amb24579561 [0,1,0,0,0,0|0,0,0]=1 843 B10R1.194 OC(O)C1NCC(O)C1O Amb25806653 [0,1,0,0,0,0|0,0,2]=3 844 B10R1.194 OC1C(Cl)CNC1C(O)=O Amb25232612 [0,1,0,0,0,0|1,0,0]=2 845 B10R1.194 OC1C(NCC1O)C(O)=O Amb24120646 [0,1,0,0,0,0|0,0,0]=1 846 B10R1.194 OC1CCC(C1O)C(O)=O Amb24480401 [0,1,0,0,0,0|1,0,0]=2 847 B10R1.194 O[C@@H]1C(NC[C@H]1O)C(O)=O Amb24515069 [0,1,0,0,0,0|0,0,0]=1 848 B10R1.194 O[C@@H]1CC[C@@H]([C@H]1O)C(O)=O Amb24655021 [0,1,0,0,0,0|1,0,0]=2 849 B10R1.194 O[C@@H]1[C@@H](NC[C@@H]1O)C(O)=O Amb24605220 [0,1,0,0,0,0|0,0,0]=1 850 B10R1.194 O[C@@H]1[C@H](NC[C@@H]1O)C(O)=O Amb24120647 [0,1,0,0,0,0|0,0,0]=1 851 B10R1.194 O[C@H]1[C@@H](NC[C@@H]1O)C(O)=O Amb25259269 [0,1,0,0,0,0|0,0,0]=1 852 B10R1.194 O[C@H]1[C@@H](NC[C@H]1O)C(O)=O Amb24546981 [0,1,0,0,0,0|0,0,0]=1 853 B10R1.194 O[C@H]1[C@H](Cl)CN[C@@H]1C(O)=O Amb25172928 [0,1,0,0,0,0|1,0,0]=2 854 B10R1.194 [O-]C(=O)C1OCC(O)C1O Amb24705667 [0,1,0,0,0,0|1,0,1]=3 855 B10R1.194 [O-]C(=O)[C@@H]1OC[C@@H](O)[C@H]1O Amb24705947 [0,1,0,0,0,0|1,0,1]=3 856 B10R1.359 CC(=O)C1CC(C)(C)CC1 Amb25136434 [0,1,0,0,0,0|3,0,0]=4 857 B10R1.359 CC(=O)C1CC(C)(C)CO1 Amb25194641 [0,1,0,0,0,0|3,0,0]=4 858 B10R1.359 CC(O)C1CC(F)(F)CN1 Amb23536917 [0,1,0,0,0,0|2,0,1]=4 859 B10R1.359 CC1(C)CC(=CC1)C(O)=O Amb18643597 [0,1,0,0,0,0|2,0,1]=4 860 B10R1.359 CC1(C)CC(C=C1)C(O)=O Amb18643602 [0,1,0,0,0,0|2,0,1]=4 861 B10R1.359 CC1(C)CC(CC1)C(N)=O Amb24449433 [0,1,0,0,0,0|3,0,0]=4 862 B10R1.359 CC1(C)CC(CC1)C(O)=O Amb18643933 [0,1,0,0,0,0|2,0,0]=3 863 B10R1.359 CC1(C)CC(CN1)C(O)=O Amb23589283 [0,1,0,0,0,0|3,0,0]=4 864 B10R1.359 CC1(C)CC(CO1)C(O)=O Amb24312661 [0,1,0,0,0,0|3,0,0]=4 865 B10R1.359 CC1(C)CCC(N1)C(O)=O Amb22755806 [0,1,0,0,0,0|3,0,0]=4 866 B10R1.359 CC1(C)CCC(O1)C(O)=O Amb23455423 [0,1,0,0,0,0|3,0,0]=4 867 B10R1.359 CC1(C)CNC(C1)C(O)=O Amb22756172 [0,1,0,0,0,0|1,0,0]=2 868 B10R1.359 CC1(C)CN[C@@H](C1)C(O)=O Amb20671421 [0,1,0,0,0,0|1,0,0]=2 869 B10R1.359 CC1(C)CN[C@@H](C1)C(O)=O Amb22751658 [0,1,0,0,0,0|1,0,0]=2 870 B10R1.359 CC1(C)CN[C@H](C1)C(O)=O Amb24620405 [0,1,0,0,0,0|1,0,0]=2 871 B10R1.359 CC1(C)CSC(N1)C(O)=O Amb25258404 [0,1,0,0,0,0|3,0,0]=4 872 B10R1.359 CC1(F)CC(CC1)C(O)=O Amb25740509 [0,1,0,0,0,0|2,0,0]=3 873 B10R1.359 CC1(F)CNC(C1)C(O)=O Amb25354396 [0,1,0,0,0,0|1,0,0]=2 874 B10R1.359 CC1(O)CC(CC1)C(O)=O Amb23454111 [0,1,0,0,0,0|1,0,0]=2 875 B10R1.359 CC1(O)CCC(N1)C(O)=O Amb25840357 [0,1,0,0,0,0|2,0,0]=3 876 B10R1.359 C[C@@]1(O)CN[C@@H](C1)C(O)=O Amb24578804 [0,1,0,0,0,0|0,0,0]=1 877 B10R1.359 C[N+]1(C)CC(CC1)C(O)=O Amb24533109 [0,1,0,0,0,0|3,0,0]=4 878 B10R1.359 C[Si]1(C)CN[C@@H](C1)C(O)=O Amb25679908 [0,1,0,0,0,0|1,1,0]=3 879 B10R1.359 NC(=O)C1CC(F)(F)CN1 Amb24444154 [0,1,0,0,0,0|2,0,0]=3 880 B10R1.359 NC(=O)[C@@H]1CC(F)(F)CN1 Amb22388433 [0,1,0,0,0,0|2,0,0]=3 881 B10R1.359 NC(=O)[C@H]1CC(F)(F)CN1 Amb22739011 [0,1,0,0,0,0|2,0,0]=3 882 B10R1.359 NC(=O)[C@H]1NCC(C1)(F)F Amb10807711 [0,1,0,0,0,0|2,0,0]=3 883 B10R1.359 OC(=O)C1CC(F)(F)CC1 Amb22406172 [0,1,0,0,0,0|2,0,0]=3 884 B10R1.359 OC(=O)C1CC(F)(F)CN1 Amb19148521 [0,1,0,0,0,0|1,0,0]=2 885 B10R1.359 OC(=O)C1CC(F)(F)CN1 Amb19149214 [0,1,0,0,0,0|1,0,0]=2 886 B10R1.359 OC(=O)C1CCC(N1)(C)C Amb17593611 [0,1,0,0,0,0|3,0,0]=4 887 B10R1.359 OC(=O)C1CCS(=O)(=O)C1 Amb2568469 [0,1,0,0,0,0|2,0,1]=4 888 B10R1.359 OC(=O)C1CC[S+](=O)(C1)[O-] Amb10236346 [0,1,0,0,0,0|2,0,1]=4 889 B10R1.359 OC(=O)[C@@H]1CC(F)(F)CC1 Amb23440260 [0,1,0,0,0,0|2,0,0]=3 890 B10R1.359 OC(=O)[C@@H]1CC(F)(F)CN1 Amb19374734 [0,1,0,0,0,0|1,0,0]=2 891 B10R1.359 OC(=O)[C@@H]1CC(F)(F)CN1 Amb22169907 [0,1,0,0,0,0|1,0,0]=2 892 B10R1.359 OC(=O)[C@@H]1CC(F)(F)CN1 Amb22747185 [0,1,0,0,0,0|1,0,0]=2 893 B10R1.359 OC(=O)[C@@H]1CC(F)(F)CN1 Amb22748266 [0,1,0,0,0,0|1,0,0]=2 894 B10R1.359 OC(=O)[C@H]1CC(F)(F)CC1 Amb24757593 [0,1,0,0,0,0|2,0,0]=3 895 B10R1.470 CC(=O)C1(C)CC(O)CC1 Amb25145527 [0,1,0,0,0,0|2,0,0]=3 896 B10R1.470 CC(=O)[C@@]1(C)CC[C@H](O)O1 Amb24374168 [0,1,0,0,0,0|3,0,0]=4 897 B10R1.470 CC1(CC(=C)CN1)C(O)=O Amb25082757 [0,1,0,0,0,0|1,0,1]=3 898 B10R1.470 CC1(CC(=O)CC1)C(O)=O Amb23454199 [0,1,0,0,0,0|1,0,2]=4 899 B10R1.470 CC1(CC(N)CC1)C(O)=O Amb23454122 [0,1,0,0,0,0|2,0,0]=3 900 B10R1.470 CC1(CC(O)CC1)C(O)=O Amb23454235 [0,1,0,0,0,0|1,0,0]=2 901 B10R1.470 CC1(CC(O)CN1)C(N)=O Amb24477071 [0,1,0,0,0,0|1,0,0]=2 902 B10R1.470 CC1(CCC(=C)C1)C(O)=O Amb25789474 [0,1,0,0,0,0|2,0,1]=4 903 B10R1.470 CC1(CCC(O)N1)C(O)=O Amb25123888 [0,1,0,0,0,0|2,0,0]=3 904 B10R1.470 CC1(CCC(O1)C)C(=O)O Amb17593620 [0,1,0,0,0,0|3,0,0]=4 905 B10R1.470 CC1CC(C)(CC1)C(N)=O Amb23454043 [0,1,0,0,0,0|3,0,0]=4 906 B10R1.470 CC1CC(C)(N=N1)C(O)=O Amb25757931 [0,1,0,0,0,0|2,0,1]=4 907 B10R1.470 CC1CC(N)(CC1)C(N)=O Amb24334951 [0,1,0,0,0,0|3,0,0]=4 908 B10R1.470 CC1CC(N)(CN1)C(O)=O Amb25291117 [0,1,0,0,0,0|3,0,0]=4 909 B10R1.470 CC1CC(N)(CS1)C(O)=O Amb24436009 [0,1,0,0,0,0|3,0,0]=4 910 B10R1.470 CC1COC(C)(O1)C(O)=O Amb25056199 [0,1,0,0,0,0|3,0,0]=4 911 B10R1.470 CN1CC(N)(CC1)C(O)=O Amb18280237 [0,1,0,0,0,0|3,0,0]=4 912 B10R1.470 CN1CC(O)(CC1)C(O)=O Amb18279342 [0,1,0,0,0,0|3,0,0]=4 913 B10R1.470 C[C@@H]1CC(O)(CC1)C(O)=O Amb24480707 [0,1,0,0,0,0|2,0,0]=3 914 B10R1.470 C[C@@H]1CN[C@@](C)(O1)C(C)=O Amb25055322 [0,1,0,0,0,0|3,0,0]=4 915 B10R1.470 C[C@@H]1CN[C@](C)(O1)C(C)=O Amb24590151 [0,1,0,0,0,0|3,0,0]=4 916 B10R1.470 C[C@@H]1C[C@@](N)(CS1)C(O)=O Amb24612036 [0,1,0,0,0,0|3,0,0]=4 917 B10R1.470 C[C@@]1(C[C@H](O)CN1)C(O)=O Amb24117149 [0,1,0,0,0,0|0,0,0]=1 918 B10R1.470 C[C@H]1C[C@@](N)(CC1)C(O)=O Amb24373352 [0,1,0,0,0,0|2,0,0]=3 919 B10R1.470 C[C@H]1C[C@](N)(CC1)C(O)=O Amb24515052 [0,1,0,0,0,0|2,0,0]=3 920 B10R1.470 C[C@]1(CC(=C)CN1)C(O)=O Amb24677121 [0,1,0,0,0,0|1,0,1]=3 921 B10R1.470 C[C@]1(CC(=O)CC1)C(O)=O Amb25693811 [0,1,0,0,0,0|1,0,2]=4 922 B10R1.470 NC(=O)C1(O)CC(O)C=C1 Amb25103655 [0,1,0,0,0,0|2,0,1]=4 923 B10R1.470 NC1CC(F)(CC1)C(O)=O Amb24352012 [0,1,0,0,0,0|2,0,0]=3 924 B10R1.470 NC1CC(O)(CC1)C(O)=O Amb18124716 [0,1,0,0,0,0|2,0,0]=3 925 B10R1.470 OC1CC(O)(CC1)C(O)=O Amb25213061 [0,1,0,0,0,0|1,0,0]=2 926 B10R1.470 OC1CCC(O)(O1)C(O)=O Amb25066503 [0,1,0,0,0,0|2,0,0]=3 927 B10R1.470 O[C@@H]1CC[C@@](C1)(N)C(=O)O Amb10066916 [0,1,0,0,0,0|1,0,0]=2 928 B10R1.470 O[C@@H]1CO[C@@](O)(C1)C(O)=O Amb24601415 [0,1,0,0,0,0|1,0,0]=2 929 B10R1.470 O[C@H]1CC[C@](C1)(N)C(=O)O Amb10066913 [0,1,0,0,0,0|1,0,0]=2 930 B8R0.8 CC(=CCCF)C(O)=O Amb24359141 [0,0,1,0,0,0|2,0,1]=4 931 B8R0.8 CC(=O)C(=O)NCCO Amb25803555 [0,0,1,0,0,0|2,0,1]=4 932 B8R0.8 CC(=O)C(Br)CCCO Amb25146214 [0,0,1,0,0,0|3,0,0]=4 933 B8R0.8 CC(=O)C(C)=CCCO Amb24617765 [0,0,1,0,0,0|2,0,1]=4 934 B8R0.8 CC(=O)C(C)=NCCO Amb24625306 [0,0,1,0,0,0|1,0,2]=4 935 B8R0.8 CC(=O)C(Cl)OCCO Amb25696998 [0,0,1,0,0,0|3,0,0]=4 936 B8R0.8 CC(=O)C(O)CCCO Amb24364072 [0,0,1,0,0,0|3,0,0]=4 937 B8R0.8 CC(=O)\C(\C)=C\CCO Amb25735231 [0,0,1,0,0,0|2,0,1]=4 938 B8R0.8 CC(C(=O)O)CNCC Amb13952782 [0,0,1,0,0,0|3,0,0]=4 939 B8R0.8 CC(C(=O)O)SCCN Amb17500447 [0,0,1,0,0,0|2,0,0]=3 940 B8R0.8 CC(CCC#N)C(O)=O Amb24462559 [0,0,1,0,0,0|2,0,1]=4 941 B8R0.8 CC(CCC=C)C(O)=O Amb18642656 [0,0,1,0,0,0|2,0,1]=4 942 B8R0.8 CC(CCC=O)C(O)=O Amb18642767 [0,0,1,0,0,0|1,0,2]=4 943 B8R0.8 CC(CCCBr)C(=O)Cl Amb24722839 [0,0,1,0,0,0|3,0,0]=4 944 B8R0.8 CC(CCCBr)C(C)=O Amb25362168 [0,0,1,0,0,0|3,0,0]=4 945 B8R0.8 CC(CCCBr)C(O)=O Amb25321670 [0,0,1,0,0,0|2,0,0]=3 946 B8R0.8 CC(CCCF)C(O)=O Amb25244585 [0,0,1,0,0,0|2,0,0]=3 947 B8R0.8 CC(CCCN)C(C)=O Amb25774001 [0,0,1,0,0,0|3,0,0]=4 948 B8R0.8 CC(CCCN)C(O)=O Amb25146072 [0,0,1,0,0,0|2,0,0]=3 949 B8R0.8 CC(CCCO)C(=O)S Amb25221473 [0,0,1,0,0,0|1,1,0]=3 950 B8R0.8 CC(CCCS)C(C)=O Amb25807409 [0,0,1,0,0,0|2,1,0]=4 951 B8R0.8 CC(NCC=C)C(C)=O Amb18642525 [0,0,1,0,0,0|2,0,1]=4 952 B8R0.8 CC(NCCCl)C(O)=O Amb25145942 [0,0,1,0,0,0|1,0,0]=2 953 B8R0.8 CC(NCCN)C(O)=O Amb18523860 [0,0,1,0,0,0|1,0,0]=2 954 B8R0.8 CC(NCCO)C(C)=O Amb18627404 [0,0,1,0,0,0|1,0,0]=2 955 B8R0.8 CC(NCCO)C(C)N Amb24476928 [0,0,1,0,0,0|2,0,1]=4 956 B8R0.8 CC(OCCCl)C(O)=O Amb24481693 [0,0,1,0,0,0|2,0,0]=3 957 B8R0.8 CC(OCCN)C(C)=O Amb18111235 [0,0,1,0,0,0|3,0,0]=4 958 B8R0.8 CC(OCCN)C(N)=O Amb19020756 [0,0,1,0,0,0|3,0,0]=4 959 B8R0.8 CC(OCCN)C(O)=O Amb18630157 [0,0,1,0,0,0|2,0,0]=3 960 B8R0.8 CC(OCCN)C(O)=O Amb22546285 [0,0,1,0,0,0|2,0,0]=3 961 B8R0.8 CC(OCCO)C(N)=S Amb25331856 [0,0,1,0,0,0|2,1,0]=4 962 B8R0.8 CC(SCCCl)C(C)=O Amb25726472 [0,0,1,0,0,0|3,0,0]=4 963 B8R0.8 CC(SCCF)C(C)=O Amb25315458 [0,0,1,0,0,0|3,0,0]=4 964 B8R0.8 CC(SCCF)C(O)=O Amb25314013 [0,0,1,0,0,0|2,0,0]=3 965 B8R0.8 CCCCC(C(=O)O)Cl Amb17593750 [0,0,1,0,0,0|3,0,0]=4 966 B8R0.8 CCCCC(F)C(O)=O Amb25238781 [0,0,1,0,0,0|3,0,0]=4 967 B8R0.8 CCCCC(S)C(O)=O Amb25323873 [0,0,1,0,0,0|3,0,0]=4 968 B8R0.8 CCCC[C@@H](Br)C(O)=O Amb24377169 [0,0,1,0,0,0|3,0,0]=4 969 B8R0.8 CCCC[C@@H](C(=O)O)N Amb1995007 [0,0,1,0,0,0|3,0,0]=4 970 B8R0.8 CCCC[C@@H](C)C(C)=O Amb25318801 [0,0,1,0,0,0|3,0,0]=4 971 B8R0.8 CCCC[C@@H](C)C(O)=O Amb24590691 [0,0,1,0,0,0|2,0,0]=3 972 B8R0.8 CCCC[C@@H](S)C(O)=O Amb24478188 [0,0,1,0,0,0|3,0,0]=4 973 B8R0.8 CCCC[C@H](C(=O)O)N Amb1995006 [0,0,1,0,0,0|3,0,0]=4 974 B8R0.8 CCCC[C@H](C)C(C)=O Amb25767789 [0,0,1,0,0,0|3,0,0]=4 975 B8R0.8 CCCC[C@H](C)C(O)=O Amb25850678 [0,0,1,0,0,0|2,0,0]=3 976 B8R0.8 CCCNC(C)C(C)=O Amb18642716 [0,0,1,0,0,0|2,0,0]=3 977 B8R0.8 CCCNC(C)C(C)O Amb25368854 [0,0,1,0,0,0|2,0,1]=4 978 B8R0.8 CCCO[C@H](C)C(O)=O Amb25721817 [0,0,1,0,0,0|2,0,0]=3 979 B8R0.8 CCOC[C@@H](C)C(O)=O Amb25790635 [0,0,1,0,0,0|3,0,0]=4 980 B8R0.8 CC\C=C\C(C)C(O)=O Amb18642633 [0,0,1,0,0,0|2,0,1]=4 981 B8R0.8 CNCCC(C)C(O)=O Amb24641803 [0,0,1,0,0,0|3,0,0]=4 982 B8R0.8 COCCC(C)C(O)=O Amb18523823 [0,0,1,0,0,0|3,0,0]=4 983 B8R0.8 COCC[C@H](C)C(O)=O Amb24392969 [0,0,1,0,0,0|3,0,0]=4 984 B8R0.8 COCO[C@@H](C)C(O)=O Amb25682837 [0,0,1,0,0,0|3,0,0]=4 985 B8R0.8 COCO[C@H](C)C(O)=O Amb25706272 [0,0,1,0,0,0|3,0,0]=4 986 B8R0.8 CSCCC(C)C(O)=O Amb24739356 [0,0,1,0,0,0|3,0,0]=4 987 B8R0.8 C[C@@H](CCCBr)C(O)=O Amb24480227 [0,0,1,0,0,0|2,0,0]=3 988 B8R0.8 C[C@@H](NCC#N)C(O)=O Amb24481672 [0,0,1,0,0,0|1,0,1]=3 989 B8R0.8 C[C@@H](NCC=C)C(O)=O Amb24481671 [0,0,1,0,0,0|1,0,1]=3 990 B8R0.8 C[C@@H](O)[C@H](C)CCCO Amb25233241 [0,0,1,0,0,0|2,0,1]=4 991 B8R0.8 C[C@@H](OCC#N)C(O)=O Amb25050099 [0,0,1,0,0,0|2,0,1]=4 992 B8R0.8 C[C@H](C(=O)O)CSCC Amb10844108 [0,0,1,0,0,0|3,0,0]=4 993 B8R0.8 C[C@H](CCC#N)C(O)=O Amb25790580 [0,0,1,0,0,0|2,0,1]=4 994 B8R0.8 C[C@H](CCC=C)C(O)=O Amb24337306 [0,0,1,0,0,0|2,0,1]=4 995 B8R0.8 C[C@H](CCCBr)C(O)=O Amb24480175 [0,0,1,0,0,0|2,0,0]=3 996 B8R0.8 C[C@H](NCC#C)C(O)=O Amb25697652 [0,0,1,0,0,0|1,0,1]=3 997 B8R0.8 C[C@H](O)[C@H](C)NCCN Amb24394469 [0,0,1,0,0,0|2,0,1]=4 998 B8R0.8 C[C@H](O)[C@H](C)SCCO Amb24412113 [0,0,1,0,0,0|2,0,1]=4 999 B8R0.8 C[C@H](OCC#C)C(O)=O Amb25852095 [0,0,1,0,0,0|2,0,1]=4 1000 B8R0.8 C\C(=C/CCC)\C(=O)O Amb10844998 [0,0,1,0,0,0|2,0,1]=4 1001 B8R0.8 C\C(=C\CCC)\C(O)=O Amb25032199 [0,0,1,0,0,0|2,0,1]=4 1002 B8R0.8 N=C(NCCO)C(O)=O Amb18124348 [0,0,1,0,0,0|1,0,1]=3 1003 B8R0.8 NC(=O)C(O)CCCO Amb25104583 [0,0,1,0,0,0|3,0,0]=4 1004 B8R0.8 NC(=O)[C@@H](O)CCCO Amb25804971 [0,0,1,0,0,0|3,0,0]=4 1005 B8R0.8 NC(C#CCO)C(O)=O Amb24585112 [0,0,1,0,0,0|2,0,1]=4 1006 B8R0.8 NC(CCCBr)C(O)=O Amb24480263 [0,0,1,0,0,0|3,0,0]=4 1007 B8R0.8 NC(CCCCl)C(O)=O Amb24472387 [0,0,1,0,0,0|3,0,0]=4 1008 B8R0.8 NC(CCCF)C(O)=O Amb25366994 [0,0,1,0,0,0|3,0,0]=4 1009 B8R0.8 NC(CCCO)C(O)=O Amb18642915 [0,0,1,0,0,0|2,0,0]=3 1010 B8R0.8 NC(CCCO)C(O)=O Amb22900028 [0,0,1,0,0,0|2,0,0]=3 1011 B8R0.8 NC(CCCO)P(O)=O Amb25726221 [0,0,1,0,0,0|3,0,0]=4 1012 B8R0.8 NC(COCO)C(O)=O Amb24731952 [0,0,1,0,0,0|3,0,0]=4 1013 B8R0.8 NC(\C=C\CO)C(O)=O Amb24586215 [0,0,1,0,0,0|2,0,1]=4 1014 B8R0.8 NCCCC(C(=O)O)Br Amb17595166 [0,0,1,0,0,0|3,0,0]=4 1015 B8R0.8 NCCCC(Cl)C(O)=O Amb24626933 [0,0,1,0,0,0|3,0,0]=4 1016 B8R0.8 NCCCC(N)C(O)=O Amb22489477 [0,0,1,0,0,0|3,0,0]=4 1017 B8R0.8 NCCCC(N)C(O)=O Amb22492665 [0,0,1,0,0,0|3,0,0]=4 1018 B8R0.8 NCCCC(O)C(O)=O Amb18124377 [0,0,1,0,0,0|3,0,0]=4 1019 B8R0.8 NCCC[C@@H](N)C(O)=O Amb22801212 [0,0,1,0,0,0|3,0,0]=4 1020 B8R0.8 NCCC[C@@H](O)C(O)=O Amb24459740 [0,0,1,0,0,0|3,0,0]=4 1021 B8R0.8 NCCC[C@@H]([NH3+])C(=O)O Amb10807472 [0,0,1,0,0,0|3,0,0]=4 1022 B8R0.8 NCCC[C@H](N)C(O)=O Amb20240598 [0,0,1,0,0,0|3,0,0]=4 1023 B8R0.8 NCCNC(=O)C(O)=O Amb18977789 [0,0,1,0,0,0|2,0,1]=4 1024 B8R0.8 NCCSC(F)C(O)=O Amb24478685 [0,0,1,0,0,0|3,0,0]=4 1025 B8R0.8 N[C@@H](CCCN)C(O)=O Amb22746434 [0,0,1,0,0,0|3,0,0]=4 1026 B8R0.8 N[C@@H](CCNO)C(O)=O Amb24117852 [0,0,1,0,0,0|3,0,0]=4 1027 B8R0.8 N[C@@H](CCNO)C(O)=O Amb24666196 [0,0,1,0,0,0|3,0,0]=4 1028 B8R0.8 OC(=O)C(=O)NCCO Amb24117944 [0,0,1,0,0,0|1,0,1]=3 1029 B8R0.8 OC(=O)C(Br)CCCBr Amb22001929 [0,0,1,0,0,0|3,0,0]=4 1030 B8R0.8 OC(=O)C(CCCCl)Br Amb17595866 [0,0,1,0,0,0|3,0,0]=4 1031 B8R0.8 OC(=O)C(F)CCCCl Amb24683810 [0,0,1,0,0,0|3,0,0]=4 1032 B8R0.8 OCCCC(Cl)C(O)=O Amb25760339 [0,0,1,0,0,0|2,0,0]=3 1033 B8R0.8 OCCCC(O)C(O)=O Amb18642939 [0,0,1,0,0,0|2,0,0]=3 1034 B8R0.8 OCCC[C@@H](C(=O)O)N Amb16183887 [0,0,1,0,0,0|2,0,0]=3 1035 B8R0.8 OCCC[C@H](O)C(O)=O Amb24744314 [0,0,1,0,0,0|2,0,0]=3 1036 B8R0.9 C#CC(N)CCC(O)=O Amb22352566 [0,0,1,0,0,0|2,0,1]=4 1037 B8R0.9 C=CC(N)CCC(O)=O Amb22056347 [0,0,1,0,0,0|2,0,1]=4 1038 B8R0.9 C=CC(O)CCC(O)=O Amb25785193 [0,0,1,0,0,0|1,0,1]=3 1039 B8R0.9 C=C[C@H](N)CCC(O)=O Amb25694354 [0,0,1,0,0,0|2,0,1]=4 1040 B8R0.9 CC(=C)CCC(O)CBr Amb25101568 [0,0,1,0,0,0|3,0,0]=4 1041 B8R0.9 CC(=C)CCC(O)CCl Amb25378826 [0,0,1,0,0,0|3,0,0]=4 1042 B8R0.9 CC(=C)CC[C@@H](O)CO Amb25099425 [0,0,1,0,0,0|3,0,0]=4 1043 B8R0.9 CC(=C)CC[C@H](O)CO Amb24732167 [0,0,1,0,0,0|3,0,0]=4 1044 B8R0.9 CC(=O)CCC(Br)CCl Amb24480346 [0,0,1,0,0,0|3,0,0]=4 1045 B8R0.9 CC(=O)CCC(Cl)CO Amb25274671 [0,0,1,0,0,0|3,0,0]=4 1046 B8R0.9 CC(=O)CCC(F)CBr Amb25201516 [0,0,1,0,0,0|3,0,0]=4 1047 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,0,1,0,0,0|3,0,0]=4 1048 B8R0.9 CC(=O)CCC(N)CO Amb25257834 [0,0,1,0,0,0|3,0,0]=4 1049 B8R0.9 CC(=O)CCC(O)C=C Amb24614737 [0,0,1,0,0,0|2,0,1]=4 1050 B8R0.9 CC(=O)CCC(O)CCl Amb25118823 [0,0,1,0,0,0|2,0,0]=3 1051 B8R0.9 CC(=O)NCC(O)CCl Amb22235217 [0,0,1,0,0,0|3,0,0]=4 1052 B8R0.9 CC(=O)NCC(O)CN Amb25139837 [0,0,1,0,0,0|2,0,0]=3 1053 B8R0.9 CC(=O)NCC(O)CO Amb24359036 [0,0,1,0,0,0|3,0,0]=4 1054 B8R0.9 CC(=O)NC[C@@H](O)CCl Amb22746506 [0,0,1,0,0,0|3,0,0]=4 1055 B8R0.9 CC(=O)NC[C@H](O)CCl Amb25760218 [0,0,1,0,0,0|3,0,0]=4 1056 B8R0.9 CC(=O)OCC(CCl)O Amb17593815 [0,0,1,0,0,0|3,0,0]=4 1057 B8R0.9 CC(=O)OCC(O)CBr Amb24443015 [0,0,1,0,0,0|3,0,0]=4 1058 B8R0.9 CC(=O)OCC(O)CF Amb24386984 [0,0,1,0,0,0|3,0,0]=4 1059 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,0,1,0,0,0|3,0,0]=4 1060 B8R0.9 CC(=O)OC[C@@H](O)CBr Amb25232647 [0,0,1,0,0,0|3,0,0]=4 1061 B8R0.9 CC(=O)SCC(O)CO Amb25105864 [0,0,1,0,0,0|3,0,0]=4 1062 B8R0.9 CC(CBr)CCC(O)=O Amb25806134 [0,0,1,0,0,0|2,0,0]=3 1063 B8R0.9 CC(CCC(N)=O)CN Amb24745140 [0,0,1,0,0,0|2,0,0]=3 1064 B8R0.9 CC(CCC(O)=O)=NN Amb24579336 [0,0,1,0,0,0|2,0,1]=4 1065 B8R0.9 CC(CCC(O)=O)C#N Amb18642500 [0,0,1,0,0,0|1,0,2]=4 1066 B8R0.9 CC(CCC(O)=O)C=C Amb18642631 [0,0,1,0,0,0|2,0,1]=4 1067 B8R0.9 CC(CN)CCC(O)=O Amb22059189 [0,0,1,0,0,0|1,0,0]=2 1068 B8R0.9 CC(CN)CNC(C)=O Amb18300590 [0,0,1,0,0,0|3,0,0]=4 1069 B8R0.9 CC(CN)OCC(C)=O Amb18110559 [0,0,1,0,0,0|3,0,0]=4 1070 B8R0.9 CC(CN)OCC(O)=O Amb18629591 [0,0,1,0,0,0|2,0,0]=3 1071 B8R0.9 CC(CN)SCC(N)=O Amb24753382 [0,0,1,0,0,0|3,0,0]=4 1072 B8R0.9 CC(CNC(N)=O)CN Amb18994081 [0,0,1,0,0,0|3,0,0]=4 1073 B8R0.9 CC(CO)OCC(O)=O Amb25675017 [0,0,1,0,0,0|3,0,0]=4 1074 B8R0.9 CC(CO)SCC(O)=O Amb18644427 [0,0,1,0,0,0|3,0,0]=4 1075 B8R0.9 CC(O)CCC(O)CC Amb25090764 [0,0,1,0,0,0|2,0,1]=4 1076 B8R0.9 CC(O)CCC(O)CF Amb24536636 [0,0,1,0,0,0|2,0,1]=4 1077 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,0,1,0,0,0|1,0,2]=4 1078 B8R0.9 CCC(Br)CCC(=O)Cl Amb25352038 [0,0,1,0,0,0|3,0,0]=4 1079 B8R0.9 CCC(Br)CCC(C)=O Amb24480025 [0,0,1,0,0,0|3,0,0]=4 1080 B8R0.9 CCC(C)CCC(C)=O Amb22229980 [0,0,1,0,0,0|3,0,0]=4 1081 B8R0.9 CCC(C)CCC(O)=O Amb22352932 [0,0,1,0,0,0|2,0,0]=3 1082 B8R0.9 CCC(C)OCC(O)=O Amb18307944 [0,0,1,0,0,0|3,0,0]=4 1083 B8R0.9 CCC(Cl)CCC(=O)Cl Amb24524189 [0,0,1,0,0,0|3,0,0]=4 1084 B8R0.9 CCC(N)CCC(O)=O Amb21961489 [0,0,1,0,0,0|2,0,0]=3 1085 B8R0.9 CCC(O)CCB(O)O Amb24353745 [0,0,1,0,0,0|2,0,1]=4 1086 B8R0.9 CCC(O)CCC(C)=C Amb25073903 [0,0,1,0,0,0|3,0,0]=4 1087 B8R0.9 CCC(O)CCC(C)=O Amb24586292 [0,0,1,0,0,0|2,0,0]=3 1088 B8R0.9 CCC(O)CNC(C)=O Amb24715716 [0,0,1,0,0,0|3,0,0]=4 1089 B8R0.9 CCC(O)NCC(O)=O Amb24445948 [0,0,1,0,0,0|2,0,0]=3 1090 B8R0.9 CCC(O)\C=C\C(O)=O Amb25328660 [0,0,1,0,0,0|1,0,2]=4 1091 B8R0.9 CC[C@@H](C)CCC(C)=O Amb24749043 [0,0,1,0,0,0|3,0,0]=4 1092 B8R0.9 CC[C@@H](N)CCC(O)=O Amb25065764 [0,0,1,0,0,0|2,0,0]=3 1093 B8R0.9 CC[C@@H](O)C#CC(O)=O Amb25785824 [0,0,1,0,0,0|1,0,2]=4 1094 B8R0.9 CC[C@H](C)NCC(O)=O Amb25076151 [0,0,1,0,0,0|3,0,0]=4 1095 B8R0.9 CC[C@H](C)OCC(O)=O Amb25320561 [0,0,1,0,0,0|3,0,0]=4 1096 B8R0.9 CC[C@H](N)CCC(O)=O Amb25835678 [0,0,1,0,0,0|2,0,0]=3 1097 B8R0.9 CC[C@H](O)CCC(N)=O Amb25785287 [0,0,1,0,0,0|2,0,0]=3 1098 B8R0.9 CC[S+](C)CCC(O)=O Amb25794477 [0,0,1,0,0,0|3,0,0]=4 1099 B8R0.9 CN(C)CCC(O)CN Amb18124365 [0,0,1,0,0,0|3,0,0]=4 1100 B8R0.9 CNC(C)CCC(O)=O Amb25339418 [0,0,1,0,0,0|3,0,0]=4 1101 B8R0.9 COC(C)CCC(O)=O Amb24271104 [0,0,1,0,0,0|3,0,0]=4 1102 B8R0.9 COP(O)CCC(O)=O Amb22734636 [0,0,1,0,0,0|3,0,0]=4 1103 B8R0.9 CO[C@H](C)CCC(O)=O Amb24383667 [0,0,1,0,0,0|3,0,0]=4 1104 B8R0.9 CSC(C)CCC(O)=O Amb22059071 [0,0,1,0,0,0|3,0,0]=4 1105 B8R0.9 C[C@@H](CBr)CCC(O)=O Amb24458738 [0,0,1,0,0,0|2,0,0]=3 1106 B8R0.9 C[C@@H](CC)CCC(=O)O Amb16231507 [0,0,1,0,0,0|2,0,0]=3 1107 B8R0.9 C[C@@H](CCC(O)=O)C=C Amb25859365 [0,0,1,0,0,0|2,0,1]=4 1108 B8R0.9 C[C@@H](O)CC[C@H](O)CO Amb25346392 [0,0,1,0,0,0|2,0,1]=4 1109 B8R0.9 C[C@H](CCC(O)=O)C#C Amb25250566 [0,0,1,0,0,0|2,0,1]=4 1110 B8R0.9 C[C@H](O)CC[C@H](O)CC Amb25794691 [0,0,1,0,0,0|2,0,1]=4 1111 B8R0.9 C[C@H](O)CC[C@H](O)CO Amb24363660 [0,0,1,0,0,0|2,0,1]=4 1112 B8R0.9 C\C(\CCC(O)=O)=N\N Amb24382718 [0,0,1,0,0,0|2,0,1]=4 1113 B8R0.9 NC(=O)NCC(O)CO Amb25146091 [0,0,1,0,0,0|3,0,0]=4 1114 B8R0.9 NC(=O)OCC(O)CO Amb24683881 [0,0,1,0,0,0|3,0,0]=4 1115 B8R0.9 NC(C=C)CCC(=O)O Amb10843623 [0,0,1,0,0,0|2,0,1]=4 1116 B8R0.9 NC(CCC(O)=O)CO Amb18642916 [0,0,1,0,0,0|2,0,0]=3 1117 B8R0.9 NC(CF)CCC(N)=O Amb24599972 [0,0,1,0,0,0|3,0,0]=4 1118 B8R0.9 NC(CF)CCC(O)=O Amb19148378 [0,0,1,0,0,0|2,0,0]=3 1119 B8R0.9 NCC(=O)CC[13C](O)=O Amb22367280 [0,0,1,0,0,0|0,0,2]=3 1120 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,0,1,0,0,0|1,0,2]=4 1121 B8R0.9 NCC(=O)OCC(O)=O Amb25710415 [0,0,1,0,0,0|1,0,2]=4 1122 B8R0.9 NCC(=O)[13CH2]CC(=O)O Amb17608125 [0,0,1,0,0,0|0,0,2]=3 1123 B8R0.9 NCC(=S)NCC(O)=O Amb25077168 [0,0,1,0,0,0|1,1,1]=4 1124 B8R0.9 NCC(N)CCC(O)=O Amb19328773 [0,0,1,0,0,0|1,0,0]=2 1125 B8R0.9 NCC(O)CCC(N)=O Amb24340194 [0,0,1,0,0,0|1,0,0]=2 1126 B8R0.9 NCC(O)CCC(O)=O Amb18124376 [0,0,1,0,0,0|0,0,0]=1 1127 B8R0.9 NCC(O)CCP(O)=O Amb24760103 [0,0,1,0,0,0|1,0,0]=2 1128 B8R0.9 NCC(O)CNC(S)=S Amb25365043 [0,0,1,0,0,0|1,2,0]=4 1129 B8R0.9 NC[C@H](O)CCC(O)=O Amb24383262 [0,0,1,0,0,0|0,0,0]=1 1130 B8R0.9 NNC(=O)CCC(O)=O Amb22270256 [0,0,1,0,0,0|1,0,2]=4 1131 B8R0.9 N[13CH2]C(=O)CCC(O)=O Amb22367582 [0,0,1,0,0,0|0,0,2]=3 1132 B8R0.9 N[C@@H](CCC(O)=O)C=O Amb24347675 [0,0,1,0,0,0|2,0,1]=4 1133 B8R0.9 N[C@@H](CCC(O)=O)CO Amb24685421 [0,0,1,0,0,0|2,0,0]=3 1134 B8R0.9 N[C@H](C=C)CCC(=O)O Amb17621248 [0,0,1,0,0,0|2,0,1]=4 1135 B8R0.9 N[C@H](CCC(O)=O)CO Amb25352213 [0,0,1,0,0,0|2,0,0]=3 1136 B8R0.9 N[C@H](CF)CCC(O)=O Amb25339395 [0,0,1,0,0,0|2,0,0]=3 1137 B8R0.9 N[C@H](CO)CCC(N)=O Amb24368577 [0,0,1,0,0,0|3,0,0]=4 1138 B8R0.9 N[C@H](CS)CCC(O)=O Amb25348403 [0,0,1,0,0,0|2,0,0]=3 1139 B8R0.9 OC(=O)CCC(=O)CBr Amb18652012 [0,0,1,0,0,0|1,0,2]=4 1140 B8R0.9 OC(=O)CCC(=O)CCl Amb25736440 [0,0,1,0,0,0|1,0,2]=4 1141 B8R0.9 OC(=O)CCC(=O)CO Amb18642867 [0,0,1,0,0,0|1,0,2]=4 1142 B8R0.9 OC(=O)CCC(Br)CBr Amb24575822 [0,0,1,0,0,0|2,0,0]=3 1143 B8R0.9 OC(=O)CCC([NH3+])C=C Amb10845648 [0,0,1,0,0,0|2,0,1]=4 1144 B8R0.9 OC(CBr)\C=C\C(O)=O Amb18647817 [0,0,1,0,0,0|1,0,2]=4 1145 B8R0.9 OC(CCC(O)=O)=NO Amb24745795 [0,0,1,0,0,0|2,0,1]=4 1146 B8R0.9 OC(CCl)COS(O)=O Amb24726370 [0,0,1,0,0,0|3,0,0]=4 1147 B8R0.9 OC(CS)COP(O)=O Amb24523020 [0,0,1,0,0,0|3,0,0]=4 1148 B8R0.9 OCC(O)CCC(O)=O Amb18124400 [0,0,1,0,0,0|1,0,0]=2 1149 B8R0.9 OCC(O)COP(O)=O Amb25071391 [0,0,1,0,0,0|3,0,0]=4 1150 B8R0.9 OCC(O)\C=C\C(O)=O Amb18642875 [0,0,1,0,0,0|1,0,2]=4 1151 B8R0.9 OC[C@H](O)CCC(O)=O Amb24528896 [0,0,1,0,0,0|1,0,0]=2 1152 B8R0.15 C=CC[C@@H](NO)C(O)=O Amb25328715 [0,0,1,0,0,0|2,0,1]=4 1153 B8R0.15 CC(O)C(CCO)CC Amb25344024 [0,0,1,0,0,0|2,0,1]=4 1154 B8R0.15 CCC(=CCO)C(O)=O Amb24478695 [0,0,1,0,0,0|1,0,2]=4 1155 B8R0.15 CCC(CC#C)C(O)=O Amb18115864 [0,0,1,0,0,0|2,0,1]=4 1156 B8R0.15 CCC(CC#N)C(O)=O Amb25760267 [0,0,1,0,0,0|2,0,1]=4 1157 B8R0.15 CCC(CC=C)C(O)=O Amb18642632 [0,0,1,0,0,0|2,0,1]=4 1158 B8R0.15 CCC(CCBr)C(C)=O Amb25109972 [0,0,1,0,0,0|3,0,0]=4 1159 B8R0.15 CCC(CCC)C(C)=O Amb25683405 [0,0,1,0,0,0|3,0,0]=4 1160 B8R0.15 CCC(CCC)C(N)=O Amb24678022 [0,0,1,0,0,0|3,0,0]=4 1161 B8R0.15 CCC(CCC)C(O)=O Amb19009626 [0,0,1,0,0,0|2,0,0]=3 1162 B8R0.15 CCC(CCCl)C(C)=O Amb25112721 [0,0,1,0,0,0|3,0,0]=4 1163 B8R0.15 CCC(CCN)C(O)=O Amb24699884 [0,0,1,0,0,0|2,0,0]=3 1164 B8R0.15 CCC(CCN)P(O)=O Amb24478799 [0,0,1,0,0,0|3,0,0]=4 1165 B8R0.15 CCC(CCO)C(O)=O Amb18642884 [0,0,1,0,0,0|1,0,0]=2 1166 B8R0.15 CCC(COC)C(O)=O Amb18124352 [0,0,1,0,0,0|3,0,0]=4 1167 B8R0.15 CCCC(C#C)C(O)=O Amb25280471 [0,0,1,0,0,0|2,0,1]=4 1168 B8R0.15 CCCC(CN)C(O)=O Amb19373497 [0,0,1,0,0,0|3,0,0]=4 1169 B8R0.15 CCCC(NBr)C(O)=O Amb24634034 [0,0,1,0,0,0|2,0,0]=3 1170 B8R0.15 CCCC(NC)C(N)=O Amb19006602 [0,0,1,0,0,0|2,0,0]=3 1171 B8R0.15 CCCC(NC)C(O)=O Amb21961534 [0,0,1,0,0,0|1,0,0]=2 1172 B8R0.15 CCCC(NC)C(O)=O Amb22587444 [0,0,1,0,0,0|1,0,0]=2 1173 B8R0.15 CCCC(NCl)C(O)=O Amb25032132 [0,0,1,0,0,0|2,0,0]=3 1174 B8R0.15 CCCC(NO)C(O)=O Amb22372057 [0,0,1,0,0,0|2,0,0]=3 1175 B8R0.15 CCC[C@@H](CO)C(O)=O Amb24571859 [0,0,1,0,0,0|3,0,0]=4 1176 B8R0.15 CCC[C@@H](NC)C(O)=O Amb25771939 [0,0,1,0,0,0|1,0,0]=2 1177 B8R0.15 CCC[C@H](CO)C(O)=O Amb25063310 [0,0,1,0,0,0|3,0,0]=4 1178 B8R0.15 CCC[C@H](NC)C(O)=O Amb25062610 [0,0,1,0,0,0|1,0,0]=2 1179 B8R0.15 CCC[C@H](NO)C(O)=O Amb25744829 [0,0,1,0,0,0|2,0,0]=3 1180 B8R0.15 CC[C@@H](CCC)C(N)=O Amb24393313 [0,0,1,0,0,0|3,0,0]=4 1181 B8R0.15 CC[C@@H](CCC)C(O)=O Amb24529114 [0,0,1,0,0,0|2,0,0]=3 1182 B8R0.15 CC[C@H](CC#N)C(O)=O Amb24358365 [0,0,1,0,0,0|2,0,1]=4 1183 B8R0.15 CC[C@H](CC=C)C(O)=O Amb25145662 [0,0,1,0,0,0|2,0,1]=4 1184 B8R0.15 CC[C@H](CCC)C(O)=O Amb24376457 [0,0,1,0,0,0|2,0,0]=3 1185 B8R0.15 CNC(CNC)C(O)=O Amb25066748 [0,0,1,0,0,0|2,0,0]=3 1186 B8R0.15 CNC(COC)C(N)=O Amb24120142 [0,0,1,0,0,0|3,0,0]=4 1187 B8R0.15 CNC(COC)C(O)=O Amb19304133 [0,0,1,0,0,0|2,0,0]=3 1188 B8R0.15 CNC(COC)C(O)=O Amb22059040 [0,0,1,0,0,0|2,0,0]=3 1189 B8R0.15 CNCC(OC)C(O)=O Amb25744334 [0,0,1,0,0,0|3,0,0]=4 1190 B8R0.15 CN[C@@H](CCS)C(O)=O Amb24533728 [0,0,1,0,0,0|0,1,0]=2 1191 B8R0.15 CN[C@@H](CNC)C(O)=O Amb24361748 [0,0,1,0,0,0|2,0,0]=3 1192 B8R0.15 CN[C@@H](COC)C(O)=O Amb25075397 [0,0,1,0,0,0|2,0,0]=3 1193 B8R0.15 CN[C@@H](CSC)C(O)=O Amb24377120 [0,0,1,0,0,0|2,0,0]=3 1194 B8R0.15 COC(CC=C)C(O)=O Amb24428233 [0,0,1,0,0,0|2,0,1]=4 1195 B8R0.15 COC(CCN)C(N)=O Amb25219688 [0,0,1,0,0,0|3,0,0]=4 1196 B8R0.15 COC(CCO)C(C)=C Amb25106365 [0,0,1,0,0,0|3,0,0]=4 1197 B8R0.15 COC(CCO)C([O-])=O Amb24362009 [0,0,1,0,0,0|1,0,1]=3 1198 B8R0.15 COC(CSC)C(O)=O Amb25309562 [0,0,1,0,0,0|3,0,0]=4 1199 B8R0.15 COC(OCC)C(O)=O Amb25367206 [0,0,1,0,0,0|3,0,0]=4 1200 B8R0.15 COC[C@H](NO)C(O)=O Amb24671375 [0,0,1,0,0,0|3,0,0]=4 1201 B8R0.15 CO[C@@H](CCN)C(O)=O Amb25146111 [0,0,1,0,0,0|2,0,0]=3 1202 B8R0.15 CO[C@@H](CCO)C([O-])=O Amb24421624 [0,0,1,0,0,0|1,0,1]=3 1203 B8R0.15 CO[C@H](COC)C(O)=O Amb25122791 [0,0,1,0,0,0|3,0,0]=4 1204 B8R0.15 CSC(CC=C)C(O)=O Amb18644287 [0,0,1,0,0,0|2,0,1]=4 1205 B8R0.15 CSC(CSC)C(O)=O Amb24595007 [0,0,1,0,0,0|3,0,0]=4 1206 B8R0.15 C[C@@H](O)[C@@H](CCO)NC Amb24459756 [0,0,1,0,0,0|1,0,1]=3 1207 B8R0.15 C\C=C(/CCO)\C(O)=O Amb18642783 [0,0,1,0,0,0|1,0,1]=3 1208 B8R0.15 C\C=C(\CCO)/C(O)=O Amb24568883 [0,0,1,0,0,0|1,0,1]=3 1209 B8R0.15 NCCC(CF)C(O)=O Amb25174518 [0,0,1,0,0,0|3,0,0]=4 1210 B8R0.15 OC(=O)\C(\CCO)=N/O Amb25104712 [0,0,1,0,0,0|1,0,2]=4 1211 B8R0.15 OCNC(CS)C(O)=O Amb24369164 [0,0,1,0,0,0|3,0,0]=4 1212 B8R0.23 BrC(C(=O)O)CC(C)C Amb16233356 [0,0,1,0,0,0|2,0,0]=3 1213 B8R0.23 C=C(Br)CC(N)C(O)=O Amb24557771 [0,0,1,0,0,0|1,0,2]=4 1214 B8R0.23 C=C(Br)C[C@@H](N)C(O)=O Amb22746251 [0,0,1,0,0,0|1,0,2]=4 1215 B8R0.23 C=C(Cl)CC(N)C(O)=O Amb24411473 [0,0,1,0,0,0|1,0,2]=4 1216 B8R0.23 C=C(F)CC(N)C(O)=O Amb24580886 [0,0,1,0,0,0|1,0,2]=4 1217 B8R0.23 C=C(I)CC(N)C(O)=O Amb25842052 [0,0,1,0,0,0|1,0,2]=4 1218 B8R0.23 CC(=C)CC(C)C(O)=O Amb24471924 [0,0,1,0,0,0|2,0,1]=4 1219 B8R0.23 CC(=C)CC(O)C(O)=O Amb24534477 [0,0,1,0,0,0|2,0,1]=4 1220 B8R0.23 CC(=C)C[C@@H](C(=O)O)C Amb10843988 [0,0,1,0,0,0|2,0,1]=4 1221 B8R0.23 CC(=C)C[C@@H](C)C(O)=O Amb24340253 [0,0,1,0,0,0|2,0,1]=4 1222 B8R0.23 CC(=C)C[C@@H](N)C(O)=O Amb22801689 [0,0,1,0,0,0|1,0,1]=3 1223 B8R0.23 CC(=C)C[C@H](N)C(O)=O Amb25757900 [0,0,1,0,0,0|1,0,1]=3 1224 B8R0.23 CC(=O)CC(Br)C(O)=O Amb24710683 [0,0,1,0,0,0|1,0,2]=4 1225 B8R0.23 CC(=O)CC(N)C(O)=O Amb18832532 [0,0,1,0,0,0|0,0,2]=3 1226 B8R0.23 CC(=O)CC(N)C(O)=O Amb22546289 [0,0,1,0,0,0|0,0,2]=3 1227 B8R0.23 CC(=O)CC(O)C(O)=O Amb22500917 [0,0,1,0,0,0|1,0,2]=4 1228 B8R0.23 CC(=O)C[C@@H](C)C(O)=O Amb24369598 [0,0,1,0,0,0|1,0,2]=4 1229 B8R0.23 CC(=O)C[C@@H](N)C(O)=O Amb22745939 [0,0,1,0,0,0|0,0,2]=3 1230 B8R0.23 CC(=O)C[C@H](O)C(O)=O Amb24358758 [0,0,1,0,0,0|1,0,2]=4 1231 B8R0.23 CC(=O)[C@@H](N)CC(O)=O Amb25064775 [0,0,1,0,0,0|2,0,1]=4 1232 B8R0.23 CC(=S)CC(C)C(O)=O Amb24588975 [0,0,1,0,0,0|1,1,1]=4 1233 B8R0.23 CC(C(=O)O)NC(C)C Amb10199874 [0,0,1,0,0,0|3,0,0]=4 1234 B8R0.23 CC(C(=O)O)NC(C)C Amb1110769 [0,0,1,0,0,0|3,0,0]=4 1235 B8R0.23 CC(C(=O)O)OC(C)C Amb10607866 [0,0,1,0,0,0|3,0,0]=4 1236 B8R0.23 CC(C)=C[C@H](N)C(O)=O Amb24629144 [0,0,1,0,0,0|1,0,2]=4 1237 B8R0.23 CC(C)CC(=C)C(O)=O Amb18642603 [0,0,1,0,0,0|2,0,1]=4 1238 B8R0.23 CC(C)CC(Br)C(N)=O Amb24423796 [0,0,1,0,0,0|3,0,0]=4 1239 B8R0.23 CC(C)CC(C)C(C)=O Amb24640121 [0,0,1,0,0,0|3,0,0]=4 1240 B8R0.23 CC(C)CC(C)C(N)=O Amb25733229 [0,0,1,0,0,0|3,0,0]=4 1241 B8R0.23 CC(C)CC(C)C(O)=O Amb18975244 [0,0,1,0,0,0|2,0,0]=3 1242 B8R0.23 CC(C)CC(Cl)C(N)=O Amb24534175 [0,0,1,0,0,0|3,0,0]=4 1243 B8R0.23 CC(C)CC(F)C(O)=O Amb24565634 [0,0,1,0,0,0|2,0,0]=3 1244 B8R0.23 CC(C)CC(N)B(O)O Amb25125820 [0,0,1,0,0,0|2,0,1]=4 1245 B8R0.23 CC(C)CC(N)C(C)=C Amb25764676 [0,0,1,0,0,0|3,0,0]=4 1246 B8R0.23 CC(C)CC(N)C(C)=O Amb18203220 [0,0,1,0,0,0|2,0,0]=3 1247 B8R0.23 CC(C)CC(N)C(C)=O Amb22899479 [0,0,1,0,0,0|2,0,0]=3 1248 B8R0.23 CC(C)CC(N)C(C)O Amb18642850 [0,0,1,0,0,0|2,0,1]=4 1249 B8R0.23 CC(C)CC(N)C(O)=O Amb22001061 [0,0,1,0,0,0|1,0,0]=2 1250 B8R0.23 CC(C)CC(N)[13C](O)=O Amb22363198 [0,0,1,0,0,0|1,0,0]=2 1251 B8R0.23 CC(C)CC(S)C(O)=O Amb18296292 [0,0,1,0,0,0|2,0,0]=3 1252 B8R0.23 CC(C)CC([15NH2])C(O)=O Amb22351200 [0,0,1,0,0,0|1,0,0]=2 1253 B8R0.23 CC(C)C[13CH](N)C(O)=O Amb22351309 [0,0,1,0,0,0|1,0,0]=2 1254 B8R0.23 CC(C)C[13CH](N)[13C](O)=O Amb22367336 [0,0,1,0,0,0|1,0,0]=2 1255 B8R0.23 CC(C)C[C@@H](Br)C(=O)Cl Amb25290167 [0,0,1,0,0,0|3,0,0]=4 1256 B8R0.23 CC(C)C[C@@H](Br)C(N)=O Amb25310991 [0,0,1,0,0,0|3,0,0]=4 1257 B8R0.23 CC(C)C[C@@H](Br)C(O)=O Amb24648832 [0,0,1,0,0,0|2,0,0]=3 1258 B8R0.23 CC(C)C[C@@H](Cl)C(O)=O Amb22800398 [0,0,1,0,0,0|2,0,0]=3 1259 B8R0.23 CC(C)C[C@@H](F)C(O)=O Amb24616998 [0,0,1,0,0,0|2,0,0]=3 1260 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [0,0,1,0,0,0|2,0,0]=3 1261 B8R0.23 CC(C)C[C@@H]([15NH2])C(O)=O Amb22801141 [0,0,1,0,0,0|1,0,0]=2 1262 B8R0.23 CC(C)C[C@H](Br)C(O)=O Amb22226489 [0,0,1,0,0,0|2,0,0]=3 1263 B8R0.23 CC(C)C[C@H](Cl)C(N)=O Amb25145996 [0,0,1,0,0,0|3,0,0]=4 1264 B8R0.23 CC(C)C[C@H](Cl)C(O)=O Amb22388637 [0,0,1,0,0,0|2,0,0]=3 1265 B8R0.23 CC(C)C[C@H](N)B(O)O Amb24578467 [0,0,1,0,0,0|2,0,1]=4 1266 B8R0.23 CC(C)C[C@H](N)C(=O)Cl Amb25842766 [0,0,1,0,0,0|2,0,0]=3 1267 B8R0.23 CC(C)C[C@H](N)C(O)=O Amb22351113 [0,0,1,0,0,0|1,0,0]=2 1268 B8R0.23 CC(C)C[C@H](N)C(O)O Amb24353011 [0,0,1,0,0,0|1,0,2]=4 1269 B8R0.23 CC(C)C[C@H](N)[C@@H](C)O Amb25851073 [0,0,1,0,0,0|2,0,1]=4 1270 B8R0.23 CC(C)C[C@H](O)C(N)=O Amb24548495 [0,0,1,0,0,0|3,0,0]=4 1271 B8R0.23 CC(C)C[C@H](S)C(O)=O Amb24457027 [0,0,1,0,0,0|2,0,0]=3 1272 B8R0.23 CC(C)SC(F)C(O)=O Amb24671129 [0,0,1,0,0,0|3,0,0]=4 1273 B8R0.23 CC(C)S[C@@H](C)C(O)=O Amb25108429 [0,0,1,0,0,0|3,0,0]=4 1274 B8R0.23 CC(CC(C)N)C(O)=O Amb20620336 [0,0,1,0,0,0|2,0,0]=3 1275 B8R0.23 CC(CC(C)O)C(C)=O Amb25682085 [0,0,1,0,0,0|2,0,0]=3 1276 B8R0.23 CC(CC(F)F)C(O)=O Amb22896466 [0,0,1,0,0,0|3,0,0]=4 1277 B8R0.23 CC(CN(C)O)C(O)=O Amb24540617 [0,0,1,0,0,0|2,0,0]=3 1278 B8R0.23 CC(CS(C)=O)C(O)=O Amb18974546 [0,0,1,0,0,0|2,0,1]=4 1279 B8R0.23 CC(Cl)CC(Cl)C(C)=O Amb25700978 [0,0,1,0,0,0|3,0,0]=4 1280 B8R0.23 CC(F)CC(N)C(O)=O Amb25803619 [0,0,1,0,0,0|1,0,0]=2 1281 B8R0.23 CC(O)C(C)CC(C)O Amb25308000 [0,0,1,0,0,0|2,0,1]=4 1282 B8R0.23 CC(O)CC(=O)C(O)=O Amb25789747 [0,0,1,0,0,0|1,0,1]=3 1283 B8R0.23 CC(O)CC(C)C(O)=O Amb18293277 [0,0,1,0,0,0|1,0,0]=2 1284 B8R0.23 CC(O)CC(N)C(O)=O Amb18642918 [0,0,1,0,0,0|0,0,0]=1 1285 B8R0.23 CC(O)CC(O)C(N)=O Amb24523077 [0,0,1,0,0,0|2,0,0]=3 1286 B8R0.23 CC(O)CN(C)C(C)=O Amb24072011 [0,0,1,0,0,0|3,0,0]=4 1287 B8R0.23 CC(O)CN(C)C(N)=O Amb25214415 [0,0,1,0,0,0|3,0,0]=4 1288 B8R0.23 CC(S)CC(O)C(O)=O Amb25032270 [0,0,1,0,0,0|1,1,0]=3 1289 B8R0.23 CN(C)CC(F)C(O)=O Amb25178248 [0,0,1,0,0,0|3,0,0]=4 1290 B8R0.23 CN(C)CC(N)C(N)=O Amb18984335 [0,0,1,0,0,0|3,0,0]=4 1291 B8R0.23 CN(C)CC(N)C(O)=O Amb22352274 [0,0,1,0,0,0|2,0,0]=3 1292 B8R0.23 CN(C)CC(N)C(O)=O Amb23558085 [0,0,1,0,0,0|2,0,0]=3 1293 B8R0.23 CN(C)C[C@@H](N)C(O)=O Amb19889770 [0,0,1,0,0,0|2,0,0]=3 1294 B8R0.23 CN(C)C[C@@H](N)C(O)=O Amb22800468 [0,0,1,0,0,0|2,0,0]=3 1295 B8R0.23 CN(C)C[C@H](N)C(O)=O Amb24078627 [0,0,1,0,0,0|2,0,0]=3 1296 B8R0.23 CN(C)C[C@H](O)C(O)=O Amb24372674 [0,0,1,0,0,0|3,0,0]=4 1297 B8R0.23 CS(=N)CC(N)C(O)=O Amb24374643 [0,0,1,0,0,0|2,0,0]=3 1298 B8R0.23 CS(=O)CC(N)C(O)=O Amb18125279 [0,0,1,0,0,0|1,0,1]=3 1299 B8R0.23 CS(=O)CC(O)C(O)=O Amb24692848 [0,0,1,0,0,0|2,0,1]=4 1300 B8R0.23 CS(=O)C[C@@H](C(=O)O)N Amb16232229 [0,0,1,0,0,0|1,0,1]=3 1301 B8R0.23 CS(=O)C[C@@H](N)C(O)=O Amb22745418 [0,0,1,0,0,0|1,0,1]=3 1302 B8R0.23 C[C@@H](C(=O)O)CC(C)C Amb10844070 [0,0,1,0,0,0|2,0,0]=3 1303 B8R0.23 C[C@@H](CC(O)=O)C(O)=O Amb22226742 [0,0,1,0,0,0|2,0,1]=4 1304 B8R0.23 C[C@@H](O)CC(=O)C(O)=O Amb25239377 [0,0,1,0,0,0|1,0,1]=3 1305 B8R0.23 C[C@@H](O)CN(C)C(C)=O Amb24416218 [0,0,1,0,0,0|3,0,0]=4 1306 B8R0.23 C[C@@H](O)C[C@H](N)C(O)=O Amb25162814 [0,0,1,0,0,0|0,0,0]=1 1307 B8R0.23 C[C@H](C(=O)O)CC(C)C Amb10844071 [0,0,1,0,0,0|2,0,0]=3 1308 B8R0.23 C[C@H](C(=O)O)CN(C)C Amb10844031 [0,0,1,0,0,0|3,0,0]=4 1309 B8R0.23 C[C@H](CC(O)=O)C(O)=O Amb22225399 [0,0,1,0,0,0|2,0,1]=4 1310 B8R0.23 C[C@H](Cl)C[C@H](N)C(O)=O Amb25849347 [0,0,1,0,0,0|1,0,0]=2 1311 B8R0.23 C[C@H](O)CC(=O)C(O)=O Amb25859340 [0,0,1,0,0,0|1,0,1]=3 1312 B8R0.23 C[C@H](O)CN(C)C(C)=O Amb24553313 [0,0,1,0,0,0|3,0,0]=4 1313 B8R0.23 C[C@H](O)C[C@@H](C)C(O)=O Amb25114249 [0,0,1,0,0,0|1,0,0]=2 1314 B8R0.23 C[C@H](O)C[C@H](N)C(O)=O Amb24461394 [0,0,1,0,0,0|0,0,0]=1 1315 B8R0.23 C[S+](C)CC(N)C([O-])=O Amb25242630 [0,0,1,0,0,0|2,0,1]=4 1316 B8R0.23 C[S+](C)CC(O)C(O)=O Amb24373144 [0,0,1,0,0,0|3,0,0]=4 1317 B8R0.23 C\C(=C/C(C)O)\C(O)=O Amb18642769 [0,0,1,0,0,0|1,0,2]=4 1318 B8R0.23 C\C(=C\C(C)O)\C(O)=O Amb24548753 [0,0,1,0,0,0|1,0,2]=4 1319 B8R0.23 ClC(C(=O)O)CC(C)C Amb17593753 [0,0,1,0,0,0|2,0,0]=3 1320 B8R0.23 F[C@H](C(=O)O)CC(C)C Amb10841083 [0,0,1,0,0,0|2,0,0]=3 1321 B8R0.23 NC(=O)C(N)CC(O)=O Amb18124347 [0,0,1,0,0,0|2,0,1]=4 1322 B8R0.23 NC(=O)C[C@H](C(=O)O)N Amb10071271 [0,0,1,0,0,0|1,0,2]=4 1323 B8R0.23 NC(=O)C[C@H]([15NH2])C(O)=O Amb22338491 [0,0,1,0,0,0|1,0,2]=4 1324 B8R0.23 NC(=O)[C@@H](N)CC(O)=O Amb19334954 [0,0,1,0,0,0|2,0,1]=4 1325 B8R0.23 NC(=S)CC(N)C(O)=O Amb24728838 [0,0,1,0,0,0|1,1,1]=4 1326 B8R0.23 NC(C(=O)O)CC(F)F Amb13952714 [0,0,1,0,0,0|2,0,0]=3 1327 B8R0.23 NC(C(=O)O)CC(F)F Amb13952720 [0,0,1,0,0,0|2,0,0]=3 1328 B8R0.23 NC(CC(F)Cl)C(O)=O Amb24339513 [0,0,1,0,0,0|2,0,0]=3 1329 B8R0.23 NC(CC(O)=O)C(O)=O Amb22730002 [0,0,1,0,0,0|1,0,1]=3 1330 B8R0.23 NC(CC(O)=O)C([O-])=O Amb20241398 [0,0,1,0,0,0|1,0,2]=4 1331 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22167994 [0,0,1,0,0,0|1,0,2]=4 1332 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22330537 [0,0,1,0,0,0|1,0,2]=4 1333 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22337568 [0,0,1,0,0,0|1,0,2]=4 1334 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22349433 [0,0,1,0,0,0|1,0,2]=4 1335 B8R0.23 NC(CC(O)=O)[13C](O)=O Amb22351321 [0,0,1,0,0,0|1,0,1]=3 1336 B8R0.23 NC(CC([O-])=O)C(O)=O Amb22731484 [0,0,1,0,0,0|1,0,2]=4 1337 B8R0.23 NC(CN(S)S)C(O)=O Amb24655070 [0,0,1,0,0,0|2,1,0]=4 1338 B8R0.23 NC(CS(=O)=O)C(O)=O Amb24480078 [0,0,1,0,0,0|2,0,1]=4 1339 B8R0.23 NC(CS(N)=O)C(O)=O Amb25139436 [0,0,1,0,0,0|2,0,1]=4 1340 B8R0.23 NC(CS(O)=O)C(O)=O Amb21913242 [0,0,1,0,0,0|2,0,0]=3 1341 B8R0.23 NC(C[13C](O)=O)C(O)=O Amb22362630 [0,0,1,0,0,0|1,0,1]=3 1342 B8R0.23 NC(C[13C](O)=O)[13C](O)=O Amb22353605 [0,0,1,0,0,0|1,0,1]=3 1343 B8R0.23 NC(C[N+]([O-])=O)C(O)=O Amb24642660 [0,0,1,0,0,0|2,0,1]=4 1344 B8R0.23 NC([13CH2]C(O)=O)C(O)=O Amb22336729 [0,0,1,0,0,0|1,0,1]=3 1345 B8R0.23 N[13C@@H](CC(O)=O)[13C](O)=O Amb22353606 [0,0,1,0,0,0|1,0,1]=3 1346 B8R0.23 N[13C](=O)[13CH2][13C@H](N)[13C](O)=O Amb22367522 [0,0,1,0,0,0|1,0,2]=4 1347 B8R0.23 N[C@@H](C(=O)N)CC(C)C Amb16183944 [0,0,1,0,0,0|2,0,0]=3 1348 B8R0.23 N[C@@H](CB(O)O)C(O)=O Amb25844412 [0,0,1,0,0,0|2,0,0]=3 1349 B8R0.23 N[C@@H](CC(Cl)Cl)C(O)=O Amb24746791 [0,0,1,0,0,0|2,0,0]=3 1350 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb20241378 [0,0,1,0,0,0|1,0,2]=4 1351 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22337725 [0,0,1,0,0,0|1,0,2]=4 1352 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22352336 [0,0,1,0,0,0|1,0,2]=4 1353 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22748705 [0,0,1,0,0,0|1,0,2]=4 1354 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22801032 [0,0,1,0,0,0|1,0,2]=4 1355 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb20240565 [0,0,1,0,0,0|1,0,2]=4 1356 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb22748769 [0,0,1,0,0,0|1,0,2]=4 1357 B8R0.23 N[C@@H](C[13C](N)=O)C(O)=O Amb22353613 [0,0,1,0,0,0|1,0,2]=4 1358 B8R0.23 N[C@@H](C[N+]([O-])=O)C(O)=O Amb25710255 [0,0,1,0,0,0|2,0,1]=4 1359 B8R0.23 N[C@@H]([13CH2][13C](O)=O)C(O)=O Amb22367550 [0,0,1,0,0,0|1,0,1]=3 1360 B8R0.23 N[C@H](C(=O)N)CC(C)C Amb10670112 [0,0,1,0,0,0|2,0,0]=3 1361 B8R0.23 N[C@H](CC(F)F)C(O)=O Amb25117310 [0,0,1,0,0,0|2,0,0]=3 1362 B8R0.23 N[C@H](CC(N)=O)C(O)=O Amb17749060 [0,0,1,0,0,0|1,0,2]=4 1363 B8R0.23 N[C@H](CC(O)=O)P(O)=O Amb25838846 [0,0,1,0,0,0|2,0,1]=4 1364 B8R0.23 N[C@H](CN(S)S)C(O)=O Amb24564540 [0,0,1,0,0,0|2,1,0]=4 1365 B8R0.23 N[C@H](CS(O)=O)C(O)=O Amb24366002 [0,0,1,0,0,0|2,0,0]=3 1366 B8R0.23 OC(=O)C(Cl)CC(Cl)Cl Amb25350003 [0,0,1,0,0,0|3,0,0]=4 1367 B8R0.23 OC(=O)C(Cl)CS(O)=O Amb25708099 [0,0,1,0,0,0|3,0,0]=4 1368 B8R0.23 OC(=O)C(F)CC(O)=O Amb25077170 [0,0,1,0,0,0|2,0,1]=4 1369 B8R0.23 OC(=O)C(O)CC(O)=O Amb21935660 [0,0,1,0,0,0|2,0,1]=4 1370 B8R0.23 OC(=O)C(S)CC(O)=O Amb22729564 [0,0,1,0,0,0|2,0,1]=4 1371 B8R0.23 OC(=O)CC(C(=O)O)C Amb1935053 [0,0,1,0,0,0|2,0,1]=4 1372 B8R0.23 OC(=O)CC(O)C(O)=O Amb22734584 [0,0,1,0,0,0|2,0,1]=4 1373 B8R0.23 OC(=O)C[C@@H](C(=O)O)N Amb16232085 [0,0,1,0,0,0|1,0,1]=3 1374 B8R0.23 OC(=O)[13CH](O)CC(O)=O Amb22367337 [0,0,1,0,0,0|2,0,1]=4 1375 B8R0.23 OC(=O)[C@@H](Cl)CC(Cl)Cl Amb25061364 [0,0,1,0,0,0|3,0,0]=4 1376 B8R0.23 OC(=O)[C@@H](Cl)CC(O)=O Amb20242425 [0,0,1,0,0,0|2,0,1]=4 1377 B8R0.23 OC(=O)[C@@H](S)CC(O)=O Amb22504526 [0,0,1,0,0,0|2,0,1]=4 1378 B8R0.23 OC(=O)[C@H](Br)CC(O)=O Amb22504149 [0,0,1,0,0,0|2,0,1]=4 1379 B8R0.23 OC(=O)[C@H](Cl)CC(O)=O Amb20242424 [0,0,1,0,0,0|2,0,1]=4 1380 B8R0.23 OC(=O)[C@H](S)CC(O)=O Amb25124090 [0,0,1,0,0,0|2,0,1]=4 1381 B8R0.23 OC(CC(F)F)C(O)=O Amb25274709 [0,0,1,0,0,0|3,0,0]=4 1382 B8R0.23 OC(O)C[C@@H](O)C(O)=O Amb24524214 [0,0,1,0,0,0|2,0,0]=3 1383 B8R0.23 O[13C](=O)[13CH2][13CH]([13C](=O)O)O Amb17616665 [0,0,1,0,0,0|2,0,1]=4 1384 B8R0.23 O[C@H](C(=O)O)CC(C)C Amb16232074 [0,0,1,0,0,0|2,0,0]=3 1385 B8R0.23 O[C@H](CC(F)F)C(O)=O Amb24641140 [0,0,1,0,0,0|3,0,0]=4 1386 B8R0.23 [13CH3][13CH]([13CH3])[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337118 [0,0,1,0,0,0|1,0,0]=2 1387 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22337484 [0,0,1,0,0,0|1,0,2]=4 1388 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22351412 [0,0,1,0,0,0|1,0,2]=4 1389 B8R0.23 [15NH2]C(CC(O)=O)C(O)=O Amb22731529 [0,0,1,0,0,0|1,0,1]=3 1390 B8R0.23 [15NH2][13C@@H]([13CH2][13C](O)=O)[13C](O)=O Amb22353584 [0,0,1,0,0,0|1,0,1]=3 1391 B8R0.23 [15NH2][13CH](CC(O)=O)C(O)=O Amb22351286 [0,0,1,0,0,0|1,0,1]=3 1392 B8R0.23 [15NH2][13C](=O)[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337495 [0,0,1,0,0,0|1,0,2]=4 1393 B8R0.23 [15NH2][C@@H](CC(O)=O)[13C](O)=O Amb22367524 [0,0,1,0,0,0|1,0,1]=3 1394 B8R0.28 C=C(Br)CNCC(O)=O Amb18303844 [0,0,1,0,0,0|1,0,2]=4 1395 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [0,0,1,0,0,0|1,0,2]=4 1396 B8R0.28 CC(=O)CNCC(C)=O Amb22168687 [0,0,1,0,0,0|1,0,2]=4 1397 B8R0.28 CC(=O)CNCC(O)=O Amb24375747 [0,0,1,0,0,0|0,0,2]=3 1398 B8R0.28 CC(Br)CCCC(=O)Cl Amb25364942 [0,0,1,0,0,0|3,0,0]=4 1399 B8R0.28 CC(Br)CCCC(C)=O Amb24340312 [0,0,1,0,0,0|3,0,0]=4 1400 B8R0.28 CC(Br)CCCC(O)=O Amb24480052 [0,0,1,0,0,0|2,0,0]=3 1401 B8R0.28 CC(C)/C=C/CC(O)=O Amb17844074 [0,0,1,0,0,0|2,0,1]=4 1402 B8R0.28 CC(C)CCCC(=O)Cl Amb24477882 [0,0,1,0,0,0|3,0,0]=4 1403 B8R0.28 CC(C)CCCC(N)=O Amb24579456 [0,0,1,0,0,0|3,0,0]=4 1404 B8R0.28 CC(C)CNCC(=C)Br Amb19005215 [0,0,1,0,0,0|3,0,0]=4 1405 B8R0.28 CC(C)CNCC(=C)Cl Amb19004837 [0,0,1,0,0,0|3,0,0]=4 1406 B8R0.28 CC(C)CNCC(C)=O Amb25067661 [0,0,1,0,0,0|2,0,0]=3 1407 B8R0.28 CC(C)CNCC(O)=O Amb19373106 [0,0,1,0,0,0|1,0,0]=2 1408 B8R0.28 CC(C)CNCS(O)=O Amb24478690 [0,0,1,0,0,0|2,0,0]=3 1409 B8R0.28 CC(C)CNC[C@@H](C)O Amb25135487 [0,0,1,0,0,0|2,0,1]=4 1410 B8R0.28 CC(C)CNC[C@H](C)O Amb25079110 [0,0,1,0,0,0|2,0,1]=4 1411 B8R0.28 CC(C)CNNC(N)=O Amb24359844 [0,0,1,0,0,0|3,0,0]=4 1412 B8R0.28 CC(C)CSCC(N)=O Amb25283648 [0,0,1,0,0,0|3,0,0]=4 1413 B8R0.28 CC(C)ONCC(O)=O Amb24690245 [0,0,1,0,0,0|2,0,0]=3 1414 B8R0.28 CC(C)SNCC(N)=O Amb25118863 [0,0,1,0,0,0|3,0,0]=4 1415 B8R0.28 CC(C)SSCC(O)=O Amb24425479 [0,0,1,0,0,0|3,0,0]=4 1416 B8R0.28 CC(CCCC(=O)O)O Amb2371277 [0,0,1,0,0,0|1,0,0]=2 1417 B8R0.28 CC(CCCC(=O)[O-])O Amb17615415 [0,0,1,0,0,0|1,0,1]=3 1418 B8R0.28 CC(CNCC(=C)C)C Amb17308640 [0,0,1,0,0,0|3,0,0]=4 1419 B8R0.28 CC(CNCC(=C)C)O Amb17308667 [0,0,1,0,0,0|2,0,0]=3 1420 B8R0.28 CC(CNCC(=O)N)C Amb1118171 [0,0,1,0,0,0|2,0,0]=3 1421 B8R0.28 CC(COCC(=O)N)C Amb2131093 [0,0,1,0,0,0|3,0,0]=4 1422 B8R0.28 CC(CSCC(=O)O)C Amb1134811 [0,0,1,0,0,0|2,0,0]=3 1423 B8R0.28 CC(Cl)CCCC(C)=O Amb25724389 [0,0,1,0,0,0|3,0,0]=4 1424 B8R0.28 CC(Cl)CCCC(O)=O Amb24740888 [0,0,1,0,0,0|2,0,0]=3 1425 B8R0.28 CC(Cl)COCC(O)=O Amb24480258 [0,0,1,0,0,0|2,0,0]=3 1426 B8R0.28 CC(F)COCC(C)=O Amb25178543 [0,0,1,0,0,0|3,0,0]=4 1427 B8R0.28 CC(N)CCCC(O)=O Amb22059416 [0,0,1,0,0,0|2,0,0]=3 1428 B8R0.28 CC(N)COCC(O)=O Amb25368702 [0,0,1,0,0,0|2,0,0]=3 1429 B8R0.28 CC(NCCC(=O)O)C Amb1106349 [0,0,1,0,0,0|3,0,0]=4 1430 B8R0.28 CC(O)CCCB(O)O Amb24389636 [0,0,1,0,0,0|2,0,1]=4 1431 B8R0.28 CC(O)CCCC(=C)Br Amb25058566 [0,0,1,0,0,0|3,0,0]=4 1432 B8R0.28 CC(O)CCCC(C)=C Amb24478673 [0,0,1,0,0,0|3,0,0]=4 1433 B8R0.28 CC(O)CCCC(C)=O Amb24340114 [0,0,1,0,0,0|2,0,0]=3 1434 B8R0.28 CC(O)CCCC(N)=O Amb24622764 [0,0,1,0,0,0|2,0,0]=3 1435 B8R0.28 CC(O)CCOC(N)=O Amb25293990 [0,0,1,0,0,0|3,0,0]=4 1436 B8R0.28 CC(O)CCSC(C)=O Amb25846896 [0,0,1,0,0,0|3,0,0]=4 1437 B8R0.28 CC(O)CNCC(=C)Br Amb18303322 [0,0,1,0,0,0|2,0,0]=3 1438 B8R0.28 CC(O)CNCC(=C)Cl Amb19004839 [0,0,1,0,0,0|2,0,0]=3 1439 B8R0.28 CC(O)CNCC(C)=O Amb24589662 [0,0,1,0,0,0|1,0,0]=2 1440 B8R0.28 CC(O)CNCC(C)N Amb24117888 [0,0,1,0,0,0|2,0,1]=4 1441 B8R0.28 CC(O)CNN=C(C)C Amb24355137 [0,0,1,0,0,0|3,0,0]=4 1442 B8R0.28 CC(O)CONC(N)=O Amb24604387 [0,0,1,0,0,0|3,0,0]=4 1443 B8R0.28 CC(O)CSCC(C)O Amb25144450 [0,0,1,0,0,0|2,0,1]=4 1444 B8R0.28 CC(O)CSCC(N)=O Amb25690591 [0,0,1,0,0,0|2,0,0]=3 1445 B8R0.28 CC(O)CSCC(O)=O Amb19005278 [0,0,1,0,0,0|1,0,0]=2 1446 B8R0.28 CC(O)C\C=C\C(O)=O Amb18642771 [0,0,1,0,0,0|1,0,1]=3 1447 B8R0.28 CC(O)NCCC(N)=O Amb24446895 [0,0,1,0,0,0|3,0,0]=4 1448 B8R0.28 CC(S)\C=C/CC(O)=O Amb18644289 [0,0,1,0,0,0|1,1,1]=4 1449 B8R0.28 CC(S)\C=C\CC(O)=O Amb24514919 [0,0,1,0,0,0|1,1,1]=4 1450 B8R0.28 CS(=O)CCCC(O)=O Amb18306076 [0,0,1,0,0,0|2,0,1]=4 1451 B8R0.28 C[C@@H](N)CCCC(O)=O Amb24435680 [0,0,1,0,0,0|2,0,0]=3 1452 B8R0.28 C[C@@H](N)COCC(O)=O Amb24641471 [0,0,1,0,0,0|2,0,0]=3 1453 B8R0.28 C[C@@H](O)CCCC(C)O Amb24412846 [0,0,1,0,0,0|2,0,1]=4 1454 B8R0.28 C[C@@H](O)CCOC(C)=O Amb25357488 [0,0,1,0,0,0|3,0,0]=4 1455 B8R0.28 C[C@@H](O)CNCC(C)O Amb25032285 [0,0,1,0,0,0|1,0,1]=3 1456 B8R0.28 C[C@@H](O)CNCC(F)F Amb25127842 [0,0,1,0,0,0|2,0,1]=4 1457 B8R0.28 C[C@@H](O)CNCC(N)=O Amb25260382 [0,0,1,0,0,0|1,0,0]=2 1458 B8R0.28 C[C@@H](O)COCC(C)O Amb25796323 [0,0,1,0,0,0|2,0,1]=4 1459 B8R0.28 C[C@@H](O)CSCC(N)=O Amb25799456 [0,0,1,0,0,0|2,0,0]=3 1460 B8R0.28 C[C@@H](O)C\C=C\C(O)=O Amb25250610 [0,0,1,0,0,0|1,0,1]=3 1461 B8R0.28 C[C@H](N)COCC(O)=O Amb25305053 [0,0,1,0,0,0|2,0,0]=3 1462 B8R0.28 C[C@H](N)CSCC(N)=O Amb25054209 [0,0,1,0,0,0|3,0,0]=4 1463 B8R0.28 C[C@H](O)CC#CC(O)=O Amb24627681 [0,0,1,0,0,0|1,0,1]=3 1464 B8R0.28 C[C@H](O)CCCC(O)=O Amb25842809 [0,0,1,0,0,0|1,0,0]=2 1465 B8R0.28 C[C@H](O)CCC[C@@H](C)O Amb25803331 [0,0,1,0,0,0|2,0,1]=4 1466 B8R0.28 C[C@H](O)CCC[C@H](C)O Amb25097837 [0,0,1,0,0,0|2,0,1]=4 1467 B8R0.28 C[C@H](O)CCNC(N)=O Amb25272281 [0,0,1,0,0,0|3,0,0]=4 1468 B8R0.28 C[C@H](O)COC[C@@H](C)O Amb25801708 [0,0,1,0,0,0|2,0,1]=4 1469 B8R0.28 C[C@H](O)CSCC(N)=O Amb25202527 [0,0,1,0,0,0|2,0,0]=3 1470 B8R0.28 NC(=N)CNCC(O)=O Amb25062019 [0,0,1,0,0,0|2,0,1]=4 1471 B8R0.28 NC(=O)CNCC(F)F Amb25325661 [0,0,1,0,0,0|3,0,0]=4 1472 B8R0.28 OC(=O)CCCC(Cl)Cl Amb24479944 [0,0,1,0,0,0|3,0,0]=4 1473 B8R0.28 OC(=O)CCCC(F)F Amb24117996 [0,0,1,0,0,0|3,0,0]=4 1474 B8R0.28 OC(=O)CCCC(O)=O Amb22351480 [0,0,1,0,0,0|2,0,1]=4 1475 B8R0.28 OC(=O)CCCC(O)=O Amb22351829 [0,0,1,0,0,0|2,0,1]=4 1476 B8R0.28 OC(=O)CCCP(O)=O Amb24480161 [0,0,1,0,0,0|3,0,0]=4 1477 B8R0.28 OC(=O)CNC=P(O)=O Amb24558051 [0,0,1,0,0,0|2,0,1]=4 1478 B8R0.28 OC(=O)CNCC(F)F Amb24433048 [0,0,1,0,0,0|2,0,0]=3 1479 B8R0.28 OC(=O)CNCP(O)=O Amb24557425 [0,0,1,0,0,0|2,0,0]=3 1480 B8R0.28 OC(=O)CSCC(F)F Amb18791606 [0,0,1,0,0,0|3,0,0]=4 1481 B8R0.28 OC(=S)COCC(O)=O Amb22262972 [0,0,1,0,0,0|2,0,1]=4 1482 B8R0.28 OC(O)CCCC(O)=O Amb25205498 [0,0,1,0,0,0|2,0,0]=3 1483 B8R0.28 O[13C](=O)CCC[13C](=O)O Amb17614793 [0,0,1,0,0,0|2,0,1]=4 1484 B10R2.30 CC1=CC2C(O)CCC12 Amb25835108 [0,0,0,1,0,0|3,0,0]=4 1485 B10R2.30 CC1CCC2C1CC2=O Amb25073389 [0,0,0,1,0,0|3,0,0]=4 1486 B10R2.30 C[C@@H]1CC[C@H]2[C@@H]1CC2=O Amb24617199 [0,0,0,1,0,0|3,0,0]=4 1487 B10R2.30 C[C@H]1CC[C@H]2[C@@H]1CC2=O Amb24628796 [0,0,0,1,0,0|3,0,0]=4 1488 B10R2.30 OC1CCC2C1CC2=O Amb25706231 [0,0,0,1,0,0|2,0,0]=3 1489 B10R2.30 O[C@H]1CC[C@@H]2[C@H]1CC2=O Amb24533828 [0,0,0,1,0,0|2,0,0]=3 1490 B10R2.60 CC1CC2CC1CC2=O Amb25130308 [0,0,0,1,0,0|3,0,0]=4 1491 B10R2.60 CC1C[C@H]2C[C@@H]1CC2=O Amb25262238 [0,0,0,1,0,0|3,0,0]=4 1492 B10R2.60 O=C1CC2CC1CC2Cl Amb25689472 [0,0,0,1,0,0|3,0,0]=4 1493 B10R2.60 O=C1CC2OC1CC2Br Amb24358228 [0,0,0,1,0,0|3,0,0]=4 1494 B10R2.60 O=C1C[C@@H]2C[C@@H]1C[C@@H]2Br Amb24587015 [0,0,0,1,0,0|3,0,0]=4 1495 B10R2.60 O=C1C[C@H]2C[C@@H]1C[C@@H]2Br Amb24650907 [0,0,0,1,0,0|3,0,0]=4 1496 B10R2.60 O=C1C[C@H]2C[C@@H]1C[C@H]2Cl Amb24557798 [0,0,0,1,0,0|3,0,0]=4 1497 B10R2.60 O=C1NC2CC1CC2F Amb24625529 [0,0,0,1,0,0|3,0,0]=4 1498 B10R2.60 O=C1OC2CC1CC2Br Amb24480221 [0,0,0,1,0,0|2,0,0]=3 1499 B10R2.60 OC1CC2CC1CC2=O Amb25298398 [0,0,0,1,0,0|2,0,0]=3 1500 B10R2.60 OC1CC2OC1C=C2Br Amb24529079 [0,0,0,1,0,0|3,0,0]=4 1501 B10R2.60 OC1CC2OC1CC2=O Amb24651760 [0,0,0,1,0,0|2,0,0]=3 1502 B10R2.60 OC1CC2SC1CC2O Amb24529080 [0,0,0,1,0,0|2,0,1]=4 1503 B10R2.60 O[C@@H]1C[C@@H]2C[C@@H]1C[C@H]2O Amb24520173 [0,0,0,1,0,0|2,0,1]=4 1504 B10R2.60 O[C@@H]1C[C@H]2C[C@@H]1C[C@H]2O Amb24622559 [0,0,0,1,0,0|2,0,1]=4 1505 B10R2.60 O[C@H]1C[C@@H]2C[C@H]1CC2=O Amb24631310 [0,0,0,1,0,0|2,0,0]=3 1506 B10R2.60 O[C@H]1C[C@H]2C[C@@H]1CC2=O Amb24707564 [0,0,0,1,0,0|2,0,0]=3 1507 B10R2.60 O[C@H]1C[C@H]2C[C@H]1C[C@@H]2O Amb25381066 [0,0,0,1,0,0|2,0,1]=4 1508 B10R2.60 O[C@H]1C[C@H]2O[C@@H]1CC2=O Amb24551536 [0,0,0,1,0,0|2,0,0]=3 1509 B10R2.64 OC1CC2C(C1)CC2O Amb25821934 [0,0,0,1,0,0|2,0,1]=4 1510 B10R2.64 O[C@@H]1C[C@@H]2CC(=O)[C@@H]2C1 Amb25205790 [0,0,0,1,0,0|2,0,0]=3 1511 B10R2.64 O[C@@H]1C[C@H]2[C@@H](C1)C[C@H]2O Amb24622400 [0,0,0,1,0,0|2,0,1]=4 1512 B10R2.115 CC12CC(CC1)C(=O)C2 Amb24357141 [0,0,0,1,0,0|3,0,0]=4 1513 B10R2.115 CC12COC(C1)C(=O)C2 Amb24581016 [0,0,0,1,0,0|3,0,0]=4 1514 B10R2.178 O=C1C=CC2CC1CC2 Amb22356392 [0,0,0,1,0,0|3,0,0]=4 1515 B10R2.178 O=C1C=C[C@@H]2C[C@H]1CC2 Amb24512203 [0,0,0,1,0,0|3,0,0]=4 1516 B10R2.178 O=C1C=C[C@H]2C[C@H]1CC2 Amb24513907 [0,0,0,1,0,0|3,0,0]=4 1517 B10R2.178 O=C1CC[C@@H]2C[C@@H]1CC2 Amb24602930 [0,0,0,1,0,0|3,0,0]=4 1518 B10R2.178 O=C1CC[C@H]2CO[C@@H]1C2 Amb24570402 [0,0,0,1,0,0|3,0,0]=4 1519 B10R2.178 OC1CCC2CNC1C2 Amb24443059 [0,0,0,1,0,0|2,0,1]=4 1520 B10R2.348 OC(=O)C12CCC(C1)C2 Amb17593309 [0,0,0,1,0,0|2,0,0]=3 1521 B10R2.348 OC(=O)C12NCC(C1)C2 Amb2371884 [0,0,0,1,0,0|1,0,0]=2 1522 B10R2.348 OC(=O)[C@@]12C[C@@H](CN1)C2 Amb24394032 [0,0,0,1,0,0|1,0,0]=2 1523 B10R2.348 OC(=O)[C@]12C[C@H](C1)CC2 Amb24601403 [0,0,0,1,0,0|2,0,0]=3 1524 B10R2.355 CC(=O)C1CCC2CC21 Amb25312943 [0,0,0,1,0,0|3,0,0]=4 1525 B10R2.355 NC(=O)[C@@H]1NC[C@@H]2C[C@@H]21 Amb25328113 [0,0,0,1,0,0|2,0,0]=3 1526 B10R2.355 O=C(Cl)C1NCC2CC21 Amb25273890 [0,0,0,1,0,0|2,0,0]=3 1527 B10R2.355 OC(=O)C1NCC2C1C2 Amb2444163 [0,0,0,1,0,0|1,0,0]=2 1528 B10R2.355 OC(=O)C1NCC2OC12 Amb24398573 [0,0,0,1,0,0|0,0,0]=1 1529 B10R2.355 OC(=O)C1NC[C@@H]2[C@@H]1C2 Amb10068967 [0,0,0,1,0,0|1,0,0]=2 1530 B10R2.355 OC(=O)C1SCC2CC21 Amb18202403 [0,0,0,1,0,0|2,0,0]=3 1531 B10R2.355 OC(=O)[C@@H]1NC[C@@H]2C[C@@H]21 Amb22737256 [0,0,0,1,0,0|1,0,0]=2 1532 B10R2.355 OC(=O)[C@@H]1NC[C@H]2C[C@H]21 Amb18792526 [0,0,0,1,0,0|1,0,0]=2 1533 B10R2.355 OC(=O)[C@@H]1NC[C@H]2C[C@H]21 Amb23440593 [0,0,0,1,0,0|1,0,0]=2 1534 B10R2.355 OC(=O)[C@H]1NCC2CC21 Amb25854292 [0,0,0,1,0,0|1,0,0]=2 1535 B10R2.355 OC(=O)[C@H]1NC[C@@H]2C[C@H]12 Amb17913042 [0,0,0,1,0,0|1,0,0]=2 1536 B10R2.355 OC(=O)[C@H]1NC[C@@H]2O[C@H]12 Amb25175074 [0,0,0,1,0,0|0,0,0]=1 1537 B10R2.355 OC(=O)[C@H]1NC[C@@H]2[C@H]1C2 Amb2372044 [0,0,0,1,0,0|1,0,0]=2 1538 B10R2.355 OC(=O)[C@H]1NC[C@H]2O[C@@H]12 Amb24567662 [0,0,0,1,0,0|0,0,0]=1 1539 B10R2.355 OC(=O)[C@H]1NC[C@H]2[C@@H]1C2 Amb2372045 [0,0,0,1,0,0|1,0,0]=2 1540 B10R2.355 [C@H]12C[C@H]1C(NC2)C(O)=O Amb17872475 [0,0,0,1,0,0|1,0,0]=2 1541 B10R2.357 NC(=O)C1CC2CC2N1 Amb25066699 [0,0,0,1,0,0|2,0,0]=3 1542 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb22504301 [0,0,0,1,0,0|2,0,0]=3 1543 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb22746576 [0,0,0,1,0,0|2,0,0]=3 1544 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb22746662 [0,0,0,1,0,0|2,0,0]=3 1545 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb22746663 [0,0,0,1,0,0|2,0,0]=3 1546 B10R2.357 NC(=O)[C@@H]1C[C@H]2C[C@H]2N1 Amb22745970 [0,0,0,1,0,0|2,0,0]=3 1547 B10R2.357 NC(=O)[C@@H]1C[C@H]2C[C@H]2N1 Amb22755779 [0,0,0,1,0,0|2,0,0]=3 1548 B10R2.357 O=C(Cl)C1CC2CC2C1 Amb25040422 [0,0,0,1,0,0|3,0,0]=4 1549 B10R2.357 OC(=O)C1CC2C(C1)O2 Amb16233359 [0,0,0,1,0,0|1,0,0]=2 1550 B10R2.357 OC(=O)C1CC2CC2C1 Amb23439567 [0,0,0,1,0,0|2,0,0]=3 1551 B10R2.357 OC(=O)C1CC2CC2N1 Amb18203281 [0,0,0,1,0,0|1,0,0]=2 1552 B10R2.357 OC(=O)C1CC2CC2S1 Amb18202402 [0,0,0,1,0,0|2,0,0]=3 1553 B10R2.357 OC(=O)[C@@H]1CC2C[C@@H]2N1 Amb24745752 [0,0,0,1,0,0|1,0,0]=2 1554 B10R2.357 OC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb18792527 [0,0,0,1,0,0|1,0,0]=2 1555 B10R2.357 OC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb23439721 [0,0,0,1,0,0|1,0,0]=2 1556 B10R2.357 OC(=O)[C@@H]1C[C@@H]2[C@H](N1)C2 Amb2372046 [0,0,0,1,0,0|1,0,0]=2 1557 B10R2.357 OC(=O)[C@@H]1C[C@H]2C[C@H]2C1 Amb24532832 [0,0,0,1,0,0|2,0,0]=3 1558 B10R2.357 OC(=O)[C@@H]1C[C@H]2C[C@H]2N1 Amb17719277 [0,0,0,1,0,0|1,0,0]=2 1559 B10R2.357 OC(=O)[C@@H]1C[C@H]2[C@@H](N1)C2 Amb2372541 [0,0,0,1,0,0|1,0,0]=2 1560 B8R1.23 C=C1CC(C1)C(N)=O Amb22896664 [0,0,0,0,1,0|2,0,1]=4 1561 B8R1.23 CC(=O)C1CC(O)C1 Amb25718423 [0,0,0,0,1,0|1,0,0]=2 1562 B8R1.23 CC(=O)N1CC(F)C1 Amb25106122 [0,0,0,0,1,0|3,0,0]=4 1563 B8R1.23 CC(=O)N1CC(N)C1 Amb19329932 [0,0,0,0,1,0|3,0,0]=4 1564 B8R1.23 CC(=O)N1CC(N)C1 Amb22406088 [0,0,0,0,1,0|3,0,0]=4 1565 B8R1.23 CC(=O)N1CC(O)C1 Amb17935746 [0,0,0,0,1,0|2,0,0]=3 1566 B8R1.23 CC(N)C1CC(O)C1 Amb24413900 [0,0,0,0,1,0|2,0,1]=4 1567 B8R1.23 CC(N)[C@@H]1C[C@H](O)C1 Amb22899694 [0,0,0,0,1,0|2,0,1]=4 1568 B8R1.23 CC1CC(C1)C(=O)Cl Amb24361916 [0,0,0,0,1,0|2,0,0]=3 1569 B8R1.23 CC1CC(C1)C(C)=O Amb23590280 [0,0,0,0,1,0|2,0,0]=3 1570 B8R1.23 CC1CC(C1)C(C)O Amb23590278 [0,0,0,0,1,0|2,0,1]=4 1571 B8R1.23 CC1CC(C1)C(O)=O Amb19515989 [0,0,0,0,1,0|1,0,0]=2 1572 B8R1.23 CC1CN(C1)C(C)=O Amb25044287 [0,0,0,0,1,0|3,0,0]=4 1573 B8R1.23 CN1CC(C1)C(O)=O Amb19958116 [0,0,0,0,1,0|2,0,0]=3 1574 B8R1.23 CS(=O)N1CC(O)C1 Amb25177147 [0,0,0,0,1,0|3,0,0]=4 1575 B8R1.23 C[C@@H]1C[C@@H](C1)C(O)=O Amb22746374 [0,0,0,0,1,0|1,0,0]=2 1576 B8R1.23 C[C@@H]1C[C@H](C1)C(O)=O Amb22746375 [0,0,0,0,1,0|1,0,0]=2 1577 B8R1.23 C[C@H]1C[C@H](N1)C(O)=O Amb24514390 [0,0,0,0,1,0|1,0,0]=2 1578 B8R1.23 ClC(=O)C1CC(=C)C1 Amb10071441 [0,0,0,0,1,0|2,0,1]=4 1579 B8R1.23 ClC1CC(C1)C(=O)O Amb16233600 [0,0,0,0,1,0|1,0,0]=2 1580 B8R1.23 NC(=O)C1CC(=O)C1 Amb22896730 [0,0,0,0,1,0|1,0,2]=4 1581 B8R1.23 NC(=O)C1CC(O)C1 Amb23570502 [0,0,0,0,1,0|1,0,0]=2 1582 B8R1.23 NC(=O)N1CC(F)C1 Amb25739433 [0,0,0,0,1,0|3,0,0]=4 1583 B8R1.23 NC1CC(C1)C(=O)O Amb10610660 [0,0,0,0,1,0|1,0,0]=2 1584 B8R1.23 NC1CC(C1)C(N)=O Amb20622654 [0,0,0,0,1,0|2,0,0]=3 1585 B8R1.23 NC1CC(C1)C(O)=O Amb21963541 [0,0,0,0,1,0|1,0,0]=2 1586 B8R1.23 N[C@@H]1C[C@@H](C1)C(=O)O Amb10604131 [0,0,0,0,1,0|1,0,0]=2 1587 B8R1.23 N[C@@H]1C[C@@H](C1)C(N)=O Amb22896793 [0,0,0,0,1,0|2,0,0]=3 1588 B8R1.23 N[C@@H]1C[C@H](C1)C(=O)O Amb10604102 [0,0,0,0,1,0|1,0,0]=2 1589 B8R1.23 N[C@@H]1C[C@H](C1)C(N)=O Amb22896794 [0,0,0,0,1,0|2,0,0]=3 1590 B8R1.23 N[C@@H]1C[C@H](C1)C(O)=O Amb19514893 [0,0,0,0,1,0|1,0,0]=2 1591 B8R1.23 O=C(Cl)C1CC(Cl)C1 Amb24739809 [0,0,0,0,1,0|2,0,0]=3 1592 B8R1.23 O=C1CC(C1)C(=O)Cl Amb16230813 [0,0,0,0,1,0|1,0,2]=4 1593 B8R1.23 O=C1CC(C1)C(=O)O Amb1106387 [0,0,0,0,1,0|0,0,2]=3 1594 B8R1.23 O=C1CC(N1)C(=O)O Amb16232079 [0,0,0,0,1,0|0,0,2]=3 1595 B8R1.23 OC(=O)C1CC(F)C1 Amb20621267 [0,0,0,0,1,0|1,0,0]=2 1596 B8R1.23 OC(=O)[C@@H]1CC(=O)N1 Amb22367070 [0,0,0,0,1,0|0,0,2]=3 1597 B8R1.23 OC(=O)[C@@H]1C[C@@H](Br)C1 Amb24339433 [0,0,0,0,1,0|1,0,0]=2 1598 B8R1.23 OC(=O)[C@H]1CC(=O)O1 Amb25705638 [0,0,0,0,1,0|1,0,2]=4 1599 B8R1.23 OC1CC(C1)C(=O)Cl Amb24661280 [0,0,0,0,1,0|1,0,0]=2 1600 B8R1.23 O[C@@H]1C[C@H](C1)C(O)=O Amb19516178 [0,0,0,0,1,0|0,0,0]=1 1601 B8R1.23 O[C@H]1C[C@H](C1)C(O)=O Amb19516179 [0,0,0,0,1,0|0,0,0]=1 1602 B8R1.23 [O-][N+](=O)N1CC(O)C1 Amb25804866 [0,0,0,0,1,0|2,0,1]=4 1603 B8R1.31 CC(=C)[C@@H]1CC[C@H]1O Amb24625276 [0,0,0,0,1,0|3,0,0]=4 1604 B8R1.31 CC1CCC1C(=O)Cl Amb25123268 [0,0,0,0,1,0|3,0,0]=4 1605 B8R1.31 CC1CCC1C(C)=O Amb25101506 [0,0,0,0,1,0|3,0,0]=4 1606 B8R1.31 CC1CCC1C(N)=O Amb24481452 [0,0,0,0,1,0|3,0,0]=4 1607 B8R1.31 CC1CCC1C(O)=O Amb21857447 [0,0,0,0,1,0|2,0,0]=3 1608 B8R1.31 CN1CCC1C(O)=O Amb22011586 [0,0,0,0,1,0|3,0,0]=4 1609 B8R1.31 CN1CC[C@@H]1C(O)=O Amb24183372 [0,0,0,0,1,0|3,0,0]=4 1610 B8R1.31 CN1CC[C@H]1C(O)=O Amb24699921 [0,0,0,0,1,0|3,0,0]=4 1611 B8R1.31 C[C@@H]1CC[C@H]1C(O)=O Amb25174793 [0,0,0,0,1,0|2,0,0]=3 1612 B8R1.31 C[C@@H]1CN[C@@H]1C(O)=O Amb24597629 [0,0,0,0,1,0|1,0,0]=2 1613 B8R1.31 C[C@H]1CC[C@@H]1C(O)=O Amb24561899 [0,0,0,0,1,0|2,0,0]=3 1614 B8R1.31 C[C@H]1CC[C@H]1C(O)=O Amb25259513 [0,0,0,0,1,0|2,0,0]=3 1615 B8R1.31 C[C@H]1CN[C@@H]1C(O)=O Amb24629618 [0,0,0,0,1,0|1,0,0]=2 1616 B8R1.31 NC(=O)C1CCC1Cl Amb24482516 [0,0,0,0,1,0|3,0,0]=4 1617 B8R1.31 NC(=O)[C@@H]1CC[C@@H]1Cl Amb25174435 [0,0,0,0,1,0|3,0,0]=4 1618 B8R1.31 NC(=O)[C@@H]1CC[C@H]1Cl Amb25024326 [0,0,0,0,1,0|3,0,0]=4 1619 B8R1.31 NC1CCC1C(N)=O Amb20248288 [0,0,0,0,1,0|3,0,0]=4 1620 B8R1.31 NC1COC1C(N)=O Amb25309396 [0,0,0,0,1,0|3,0,0]=4 1621 B8R1.31 NN1CCC1C(O)=O Amb25189887 [0,0,0,0,1,0|3,0,0]=4 1622 B8R1.31 N[C@@H]1CC[C@@H]1C(N)=O Amb24670123 [0,0,0,0,1,0|3,0,0]=4 1623 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24117048 [0,0,0,0,1,0|2,0,0]=3 1624 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24183584 [0,0,0,0,1,0|2,0,0]=3 1625 B8R1.31 N[C@@H]1CO[C@@H]1C(O)=O Amb24568133 [0,0,0,0,1,0|2,0,0]=3 1626 B8R1.31 N[C@@H]1CO[C@H]1C(O)=O Amb24681491 [0,0,0,0,1,0|2,0,0]=3 1627 B8R1.31 N[C@H]1CC[C@H]1C(N)=O Amb25326921 [0,0,0,0,1,0|3,0,0]=4 1628 B8R1.31 N[C@H]1CO[C@@H]1C(O)=O Amb25324265 [0,0,0,0,1,0|2,0,0]=3 1629 B8R1.31 O=C(Cl)C1CCC1Cl Amb25718688 [0,0,0,0,1,0|3,0,0]=4 1630 B8R1.31 O=C(Cl)[C@@H]1CC[C@@H]1Cl Amb25361006 [0,0,0,0,1,0|3,0,0]=4 1631 B8R1.31 OC(=O)C1C=CC1Cl Amb24482989 [0,0,0,0,1,0|2,0,1]=4 1632 B8R1.31 OC(=O)C1CCC1S Amb25830696 [0,0,0,0,1,0|1,1,0]=3 1633 B8R1.31 OC(=O)[C@@H]1CC[C@@H]1Cl Amb24514834 [0,0,0,0,1,0|2,0,0]=3 1634 B8R1.31 OC(=O)[C@@H]1CC[C@H]1Cl Amb24580965 [0,0,0,0,1,0|2,0,0]=3 1635 B8R1.31 OC1CCC1C(O)=O Amb24481384 [0,0,0,0,1,0|1,0,0]=2 1636 B8R1.31 OC=1CCC1C(O)=O Amb25119748 [0,0,0,0,1,0|1,0,2]=4 1637 B10R1.13 CC(=C)C1OCC(O)CO1 Amb25842582 [0,0,0,0,0,1|3,0,0]=4 1638 B10R1.13 CC(=O)C1CCC(Cl)CC1 Amb24433457 [0,0,0,0,0,1|3,0,0]=4 1639 B10R1.13 CC(=O)C1CCC(F)CC1 Amb25127678 [0,0,0,0,0,1|3,0,0]=4 1640 B10R1.13 CC(=O)C1CCC(N)CN1 Amb24086446 [0,0,0,0,0,1|2,0,0]=3 1641 B10R1.13 CC(=O)C1CCN(O)CC1 Amb25134063 [0,0,0,0,0,1|3,0,0]=4 1642 B10R1.13 CC(=O)C1CNC(Cl)CN1 Amb25338446 [0,0,0,0,0,1|2,0,0]=3 1643 B10R1.13 CC(=O)[C@H]1CC[C@@H](O)CC1 Amb24689931 [0,0,0,0,0,1|2,0,0]=3 1644 B10R1.13 CC(O)C1CCC(O)CC1 Amb25741333 [0,0,0,0,0,1|2,0,1]=4 1645 B10R1.13 CC(O)[C@@H]1CC[C@H](O)CC1 Amb25234713 [0,0,0,0,0,1|2,0,1]=4 1646 B10R1.13 CC1CC=C(CN1)C(O)=O Amb18831771 [0,0,0,0,0,1|2,0,1]=4 1647 B10R1.13 CC1CCC(=CC1)C(O)=O Amb18124589 [0,0,0,0,0,1|2,0,1]=4 1648 B10R1.13 CC1CCC(C=C1)C(O)=O Amb18124590 [0,0,0,0,0,1|2,0,1]=4 1649 B10R1.13 CC1CCC(CC1)C(C)=O Amb24518062 [0,0,0,0,0,1|3,0,0]=4 1650 B10R1.13 CC1CCC(CN1)C(O)=O Amb18643999 [0,0,0,0,0,1|2,0,0]=3 1651 B10R1.13 CC1CCC(NC1)C(O)=O Amb25324436 [0,0,0,0,0,1|1,0,0]=2 1652 B10R1.13 CC1OCC(CO1)C(O)=O Amb25723862 [0,0,0,0,0,1|3,0,0]=4 1653 B10R1.13 CC=1CCC(CC1)C(O)=O Amb18124574 [0,0,0,0,0,1|2,0,1]=4 1654 B10R1.13 CC=1CC[C@@H](CC1)C(O)=O Amb24746758 [0,0,0,0,0,1|2,0,1]=4 1655 B10R1.13 CC=1CC[C@H](CC1)C(O)=O Amb24505311 [0,0,0,0,0,1|2,0,1]=4 1656 B10R1.13 CC=1COC(CC1)C(O)=O Amb25836036 [0,0,0,0,0,1|2,0,1]=4 1657 B10R1.13 CN1CCC(CC1)C(=O)O Amb2236137 [0,0,0,0,0,1|3,0,0]=4 1658 B10R1.13 CN1CCC(CC1)C(=O)O Amb2237314 [0,0,0,0,0,1|3,0,0]=4 1659 B10R1.13 CN1CCC(CC1)C(O)=O Amb22491433 [0,0,0,0,0,1|3,0,0]=4 1660 B10R1.13 CN1CCC(CC1)C(O)=O Amb22491939 [0,0,0,0,0,1|3,0,0]=4 1661 B10R1.13 CN1CCC(CN1)C(O)=O Amb25311512 [0,0,0,0,0,1|3,0,0]=4 1662 B10R1.13 C[C@@H]1CCC(=CC1)C(O)=O Amb24349868 [0,0,0,0,0,1|2,0,1]=4 1663 B10R1.13 C[C@@H]1CC[C@@H](CC1)C(=O)O Amb10843977 [0,0,0,0,0,1|2,0,0]=3 1664 B10R1.13 C[C@@H]1CC[C@@H](CC1)C(N)=O Amb24385858 [0,0,0,0,0,1|3,0,0]=4 1665 B10R1.13 C[C@@H]1CC[C@@H](CN1)C(O)=O Amb24620510 [0,0,0,0,0,1|2,0,0]=3 1666 B10R1.13 C[C@@H]1CC[C@H](CC1)C(=O)Cl Amb24052918 [0,0,0,0,0,1|3,0,0]=4 1667 B10R1.13 C[C@@H]1CC[C@H](CC1)C(C)=O Amb25093628 [0,0,0,0,0,1|3,0,0]=4 1668 B10R1.13 C[C@@H]1CC[C@H](CN1)C(O)=O Amb24059653 [0,0,0,0,0,1|2,0,0]=3 1669 B10R1.13 C[C@@H]1CC[C@H](NC1)C(C)O Amb25259205 [0,0,0,0,0,1|2,0,1]=4 1670 B10R1.13 C[C@@H]1CN[C@@H](CO1)C(O)=O Amb24694579 [0,0,0,0,0,1|1,0,0]=2 1671 B10R1.13 C[C@H]1CC[C@H](CC1)C(C)=O Amb24505101 [0,0,0,0,0,1|3,0,0]=4 1672 B10R1.13 C[C@H]1CC[C@H](CN1)C(O)=O Amb24580654 [0,0,0,0,0,1|2,0,0]=3 1673 B10R1.13 C[C@H]1CC[C@H](NC1)C(C)O Amb24682778 [0,0,0,0,0,1|2,0,1]=4 1674 B10R1.13 C[C@H]1CN[C@@H](CO1)C(O)=O Amb24699378 [0,0,0,0,0,1|1,0,0]=2 1675 B10R1.13 NC(=O)C1CCC(S)CC1 Amb25288304 [0,0,0,0,0,1|2,1,0]=4 1676 B10R1.13 NC(=O)[C@@H]1CC[C@@H](O)CC1 Amb24351197 [0,0,0,0,0,1|2,0,0]=3 1677 B10R1.13 NC1CCC(=CC1)C(O)=O Amb24101018 [0,0,0,0,0,1|2,0,1]=4 1678 B10R1.13 NC1CCC(CC1)C(=O)N Amb1136988 [0,0,0,0,0,1|3,0,0]=4 1679 B10R1.13 NC1CCC(CC1)C(N)=O Amb19514796 [0,0,0,0,0,1|3,0,0]=4 1680 B10R1.13 NC1CCC(OC1)C(O)=O Amb23596938 [0,0,0,0,0,1|2,0,0]=3 1681 B10R1.13 NC1CCC(SC1)C(O)=O Amb23596933 [0,0,0,0,0,1|2,0,0]=3 1682 B10R1.13 N[C@@H]1CC[C@@H](CC1)C(=O)Cl Amb24381259 [0,0,0,0,0,1|3,0,0]=4 1683 B10R1.13 N[C@@H]1CC[C@@H](CC1)C(=O)O Amb10070763 [0,0,0,0,0,1|2,0,0]=3 1684 B10R1.13 N[C@H]1CC[C@@H](OC1)C(O)=O Amb24708815 [0,0,0,0,0,1|2,0,0]=3 1685 B10R1.13 O=C(Cl)C1CCC(F)CC1 Amb24686248 [0,0,0,0,0,1|3,0,0]=4 1686 B10R1.13 OC(=O)C1CC=C(F)CN1 Amb25175831 [0,0,0,0,0,1|1,0,1]=3 1687 B10R1.13 OC(=O)C1CCC(=C)CC1 Amb15695314 [0,0,0,0,0,1|2,0,1]=4 1688 B10R1.13 OC(=O)C1CCC(=O)CN1 Amb21960863 [0,0,0,0,0,1|0,0,2]=3 1689 B10R1.13 OC(=O)C1CCC(=O)CO1 Amb23596936 [0,0,0,0,0,1|1,0,2]=4 1690 B10R1.13 OC(=O)C1CCC(=O)CS1 Amb23596925 [0,0,0,0,0,1|1,0,2]=4 1691 B10R1.13 OC(=O)C1CCC(=O)NN1 Amb23441127 [0,0,0,0,0,1|1,0,2]=4 1692 B10R1.13 OC(=O)C1CCC(=O)SC1 Amb24637279 [0,0,0,0,0,1|1,0,2]=4 1693 B10R1.13 OC(=O)C1CCC(CC1)[*] Amb20246716 [0,0,0,0,0,1|2,0,0]=3 1694 B10R1.13 OC(=O)C1CCC(Cl)=CC1 Amb18645430 [0,0,0,0,0,1|2,0,1]=4 1695 B10R1.13 OC(=O)C1CCC(Cl)C=C1 Amb18645431 [0,0,0,0,0,1|2,0,1]=4 1696 B10R1.13 OC(=O)C1CCC(Cl)CC1 Amb18126347 [0,0,0,0,0,1|2,0,0]=3 1697 B10R1.13 OC(=O)C1CCC(Cl)CN1 Amb25200089 [0,0,0,0,0,1|1,0,0]=2 1698 B10R1.13 OC(=O)C1CCC(F)CC1 Amb20670645 [0,0,0,0,0,1|2,0,0]=3 1699 B10R1.13 OC(=O)C1CCC(S)NC1 Amb24635693 [0,0,0,0,0,1|1,1,0]=3 1700 B10R1.13 OC(=O)C1CCS(=O)CC1 Amb25295426 [0,0,0,0,0,1|2,0,1]=4 1701 B10R1.13 OC(=O)C1CNC(=O)CN1 Amb22235954 [0,0,0,0,0,1|0,0,2]=3 1702 B10R1.13 OC(=O)C1CNC(=O)CN1 Amb22641428 [0,0,0,0,0,1|0,0,2]=3 1703 B10R1.13 OC(=O)C=1CCC(O)NN1 Amb25229013 [0,0,0,0,0,1|1,0,2]=4 1704 B10R1.13 OC(=O)[C@@H]1CCC(=O)CN1 Amb24655763 [0,0,0,0,0,1|0,0,2]=3 1705 B10R1.13 OC(=O)[C@@H]1CC[C@@H](Cl)CC1 Amb24482268 [0,0,0,0,0,1|2,0,0]=3 1706 B10R1.13 OC(=O)[C@@H]1CC[C@@H](F)CN1 Amb24763804 [0,0,0,0,0,1|1,0,0]=2 1707 B10R1.13 OC(=O)[C@@H]1CNC(=O)CN1 Amb22746776 [0,0,0,0,0,1|0,0,2]=3 1708 B10R1.13 OC(=O)[C@@H]1CNC(=O)CN1 Amb22756547 [0,0,0,0,0,1|0,0,2]=3 1709 B10R1.13 OC(=O)[C@H]1CC[C@@H](Cl)C=C1 Amb24512135 [0,0,0,0,0,1|2,0,1]=4 1710 B10R1.13 OC(=O)[C@H]1CC[C@@H](Cl)CC1 Amb25295435 [0,0,0,0,0,1|2,0,0]=3 1711 B10R1.13 OC(=O)[C@H]1CC[C@@H](Cl)CN1 Amb24745771 [0,0,0,0,0,1|1,0,0]=2 1712 B10R1.13 OC(=O)[C@H]1CC[C@@H](S)CC1 Amb25109333 [0,0,0,0,0,1|1,1,0]=3 1713 B10R1.13 OC(=O)[C@H]1CNC(=O)CN1 Amb24423079 [0,0,0,0,0,1|0,0,2]=3 1714 B10R1.13 OC1CCC(=CC1)C(=O)C Amb17593547 [0,0,0,0,0,1|2,0,1]=4 1715 B10R1.13 OC1CCC(CC1)B(O)O Amb24671382 [0,0,0,0,0,1|2,0,1]=4 1716 B10R1.13 OC1CCC(CC1)C(=O)Cl Amb21961740 [0,0,0,0,0,1|2,0,0]=3 1717 B10R1.13 OC1CCC(CC1)C(=O)N Amb13951716 [0,0,0,0,0,1|2,0,0]=3 1718 B10R1.13 OC1CCC(NC1)C(O)=O Amb22034512 [0,0,0,0,0,1|0,0,0]=1 1719 B10R1.13 OC1CCC(OC1)C(O)=O Amb23596937 [0,0,0,0,0,1|1,0,0]=2 1720 B10R1.13 OC1CCC(SC1)C(O)=O Amb23596932 [0,0,0,0,0,1|1,0,0]=2 1721 B10R1.13 OC1CC[C@H](NC1)C(O)=O Amb24401087 [0,0,0,0,0,1|0,0,0]=1 1722 B10R1.13 OC1CNC(CN1)C(O)=O Amb25332404 [0,0,0,0,0,1|0,0,0]=1 1723 B10R1.13 O[C@@H]1CC[C@@H](CC1)C(=O)Cl Amb24541595 [0,0,0,0,0,1|2,0,0]=3 1724 B10R1.13 O[C@@H]1CC[C@@H](NC1)C(O)=O Amb23440007 [0,0,0,0,0,1|0,0,0]=1 1725 B10R1.13 O[C@@H]1CC[C@@H](NC1)C(O)=O Amb23440183 [0,0,0,0,0,1|0,0,0]=1 1726 B10R1.13 O[C@@H]1CC[C@H](CC1)C(O)=O Amb22387641 [0,0,0,0,0,1|1,0,0]=2 1727 B10R1.13 O[C@@H]1CC[C@H](NC1)C(O)=O Amb24120629 [0,0,0,0,0,1|0,0,0]=1 1728 B10R1.13 O[C@H]1CC[C@@H](OC1)C(O)=O Amb24725149 [0,0,0,0,0,1|1,0,0]=2 1729 B10R1.13 O[C@H]1CC[C@H](CC1)C(O)=O Amb22387642 [0,0,0,0,0,1|1,0,0]=2 1730 B10R1.54 C=C1CC(CC(O)=O)CC1 Amb25354325 [0,0,0,0,0,1|2,0,1]=4 1731 B10R1.54 CC(=O)CC1CCC(N)C1 Amb24661839 [0,0,0,0,0,1|3,0,0]=4 1732 B10R1.54 CC(=O)CN1CC(O)CC1 Amb25086092 [0,0,0,0,0,1|3,0,0]=4 1733 B10R1.54 CC(=O)C[C@H]1CC[C@@H](O)C1 Amb24631135 [0,0,0,0,0,1|2,0,0]=3 1734 B10R1.54 CC(=O)N[C@@H]1COC(O)C1 Amb24745478 [0,0,0,0,0,1|3,0,0]=4 1735 B10R1.54 CC(=O)O[C@H]1CC[C@@H](O)C1 Amb24558833 [0,0,0,0,0,1|2,0,0]=3 1736 B10R1.54 CC(=O)O[C@H]1CC[C@H](N)C1 Amb24515064 [0,0,0,0,0,1|3,0,0]=4 1737 B10R1.54 CC(=O)O[C@H]1C[C@@H](O)C=C1 Amb22363102 [0,0,0,0,0,1|2,0,1]=4 1738 B10R1.54 CC(=O)O[C@H]1C[C@H](O)C=C1 Amb25307880 [0,0,0,0,0,1|2,0,1]=4 1739 B10R1.54 CC(C)CC1CC(O)CN1 Amb25756601 [0,0,0,0,0,1|2,0,1]=4 1740 B10R1.54 CC(O)CC1CC(O)CC1 Amb25677252 [0,0,0,0,0,1|2,0,1]=4 1741 B10R1.54 CC1CC(CC(O)=O)C=C1 Amb18124581 [0,0,0,0,0,1|2,0,1]=4 1742 B10R1.54 CC1CC(CC(O)=O)SS1 Amb24438701 [0,0,0,0,0,1|3,0,0]=4 1743 B10R1.54 CC1CC(CC1)=CC(O)=O Amb20667750 [0,0,0,0,0,1|2,0,1]=4 1744 B10R1.54 CC1CC(CC1)CC(O)=O Amb18643912 [0,0,0,0,0,1|2,0,0]=3 1745 B10R1.54 CC1CCC(C1)OC(C)=O Amb25119840 [0,0,0,0,0,1|3,0,0]=4 1746 B10R1.54 CC1CCC(CC(O)=O)O1 Amb24715878 [0,0,0,0,0,1|3,0,0]=4 1747 B10R1.54 CC1CN(CC(O)=O)CC1 Amb18281107 [0,0,0,0,0,1|3,0,0]=4 1748 B10R1.54 CC1C\C(\CC1)=C\C(O)=O Amb24561263 [0,0,0,0,0,1|2,0,1]=4 1749 B10R1.54 CN1CC(CC(O)=O)CC1 Amb21857556 [0,0,0,0,0,1|3,0,0]=4 1750 B10R1.54 CN1CNC(CC(O)=O)C1 Amb24401638 [0,0,0,0,0,1|2,0,0]=3 1751 B10R1.54 CN1CN[C@@H](CC(O)=O)C1 Amb25289074 [0,0,0,0,0,1|2,0,0]=3 1752 B10R1.54 CN1CN[C@H](CC(O)=O)C1 Amb24383075 [0,0,0,0,0,1|2,0,0]=3 1753 B10R1.54 C[C@@H]1C[C@@H](CC(O)=O)C=C1 Amb25368399 [0,0,0,0,0,1|2,0,1]=4 1754 B10R1.54 NC(=N)NC1CCC(O)C1 Amb25098536 [0,0,0,0,0,1|3,0,0]=4 1755 B10R1.54 NC(=N)N[C@H]1CC[C@H](O)C1 Amb24560958 [0,0,0,0,0,1|3,0,0]=4 1756 B10R1.54 NC(=O)CN1CC(O)CC1 Amb25135545 [0,0,0,0,0,1|3,0,0]=4 1757 B10R1.54 NC(=O)NC1CCC(F)C1 Amb25295623 [0,0,0,0,0,1|3,0,0]=4 1758 B10R1.54 NC1CN(CC(O)=O)CC1 Amb22756281 [0,0,0,0,0,1|3,0,0]=4 1759 B10R1.54 N[C@@H]1CC[C@@H](C1)CC(=O)O Amb10066892 [0,0,0,0,0,1|2,0,0]=3 1760 B10R1.54 N[C@@H]1CC[C@H](C1)CC(=O)O Amb10066890 [0,0,0,0,0,1|2,0,0]=3 1761 B10R1.54 N[C@H]1CC[C@@H](C1)CC(=O)O Amb10066891 [0,0,0,0,0,1|2,0,0]=3 1762 B10R1.54 N[C@H]1CC[C@H](C1)CC(=O)O Amb10066912 [0,0,0,0,0,1|2,0,0]=3 1763 B10R1.54 OC(=O)CC1CC(=O)CC1 Amb18643816 [0,0,0,0,0,1|1,0,2]=4 1764 B10R1.54 OC(=O)CC1CCC(F)C1 Amb24679226 [0,0,0,0,0,1|2,0,0]=3 1765 B10R1.54 OC(=O)CN1CC(Br)CC1 Amb21861246 [0,0,0,0,0,1|3,0,0]=4 1766 B10R1.54 OC(=O)CN1CC(Cl)CC1 Amb21861111 [0,0,0,0,0,1|3,0,0]=4 1767 B10R1.54 OC(=O)CN1CC(I)CC1 Amb21861272 [0,0,0,0,0,1|3,0,0]=4 1768 B10R1.54 OC(=O)C[C@@H]1CC(=O)CC1 Amb22898751 [0,0,0,0,0,1|1,0,2]=4 1769 B10R1.54 OC(=O)C[C@H]1CC(=O)CC1 Amb24480441 [0,0,0,0,0,1|1,0,2]=4 1770 B10R1.54 OC1CN(CC(O)=O)CC1 Amb22001816 [0,0,0,0,0,1|2,0,0]=3 1771 B10R1.54 OC1CNC(C1)CC(O)=O Amb25082530 [0,0,0,0,0,1|0,0,0]=1 1772 B10R1.54 O[C@@H]1CN[C@@H](C1)CC(O)=O Amb24621981 [0,0,0,0,0,1|0,0,0]=1 1773 B10R1.54 O[C@@H]1CN[C@H](C1)CC(O)=O Amb22756736 [0,0,0,0,0,1|0,0,0]=1 1774 B10R1.54 O[C@@H]1CN[C@H](C1)CC(O)=O Amb25174785 [0,0,0,0,0,1|0,0,0]=1 1775 B10R1.54 O[C@@H]1CON(C1)CC(O)=O Amb24555245 [0,0,0,0,0,1|2,0,0]=3 1776 B10R1.54 O[C@H]1CN[C@H](C1)CC(O)=O Amb24597596 [0,0,0,0,0,1|0,0,0]=1 1777 B10R1.54 [O-]C(=O)C[C@H]1C[C@H](O)C=C1 Amb19515996 [0,0,0,0,0,1|1,0,2]=4 1778 B10R1.113 C=C1CC(CCC1)C(O)=O Amb24480810 [0,0,0,0,0,1|2,0,1]=4 1779 B10R1.113 CC(=O)C1CC=CC(O)C1 Amb24440988 [0,0,0,0,0,1|2,0,1]=4 1780 B10R1.113 CC(=O)C1CCCC(O)C1 Amb25859196 [0,0,0,0,0,1|2,0,0]=3 1781 B10R1.113 CC(=O)C1CCCC(O)O1 Amb25295371 [0,0,0,0,0,1|3,0,0]=4 1782 B10R1.113 CC(=O)N1C[C@@H](O)CCC1 Amb22227529 [0,0,0,0,0,1|3,0,0]=4 1783 B10R1.113 CC(=O)N1C[C@H](O)CCC1 Amb22227493 [0,0,0,0,0,1|3,0,0]=4 1784 B10R1.113 CC(=O)[C@@H]1CCC[C@@H](O)C1 Amb24533315 [0,0,0,0,0,1|2,0,0]=3 1785 B10R1.113 CC(C)C1CC(O)CCN1 Amb22754665 [0,0,0,0,0,1|2,0,1]=4 1786 B10R1.113 CC(C)[C@@H]1C[C@H](O)CCN1 Amb24573086 [0,0,0,0,0,1|2,0,1]=4 1787 B10R1.113 CC1CC(CC=C1)C(O)=O Amb24350925 [0,0,0,0,0,1|2,0,1]=4 1788 B10R1.113 CC1CC(CCC1)C(=O)Cl Amb25715458 [0,0,0,0,0,1|3,0,0]=4 1789 B10R1.113 CC1CC(CCC1)C(N)=O Amb24680794 [0,0,0,0,0,1|3,0,0]=4 1790 B10R1.113 CC1CC(CCN1)C(O)=O Amb18831574 [0,0,0,0,0,1|2,0,0]=3 1791 B10R1.113 CC1CC(CCO1)C(C)=O Amb24405718 [0,0,0,0,0,1|3,0,0]=4 1792 B10R1.113 CC1CC(CNC1)C(O)=O Amb18643998 [0,0,0,0,0,1|1,0,0]=2 1793 B10R1.113 CC1CC(NCC1)C(=O)O Amb13886199 [0,0,0,0,0,1|1,0,0]=2 1794 B10R1.113 CC1CC(NCC1)C(O)=O Amb19375550 [0,0,0,0,0,1|1,0,0]=2 1795 B10R1.113 CC1CC(NCO1)C(O)=O Amb25039959 [0,0,0,0,0,1|1,0,0]=2 1796 B10R1.113 CC1CC(OCC1)C(O)=O Amb25266110 [0,0,0,0,0,1|2,0,0]=3 1797 B10R1.113 CC1CC(OCO1)C(O)=O Amb24753574 [0,0,0,0,0,1|2,0,0]=3 1798 B10R1.113 CC1CC=CC(C1)C(C)=O Amb24736369 [0,0,0,0,0,1|3,0,0]=4 1799 B10R1.113 CC1CCCC(C1)C(C)=O Amb24505220 [0,0,0,0,0,1|3,0,0]=4 1800 B10R1.113 CC1CCCC(N1)C(O)=O Amb19959953 [0,0,0,0,0,1|3,0,0]=4 1801 B10R1.113 CC1CCCC(O1)C(O)=O Amb24529278 [0,0,0,0,0,1|3,0,0]=4 1802 B10R1.113 CC1CCNC(C1)C(C)O Amb24505239 [0,0,0,0,0,1|2,0,1]=4 1803 B10R1.113 CC1CCNC(O1)C(O)=O Amb25702339 [0,0,0,0,0,1|2,0,0]=3 1804 B10R1.113 CC1CCOC(O1)C(O)=O Amb24524607 [0,0,0,0,0,1|3,0,0]=4 1805 B10R1.113 CC1CNCC(O1)C(N)=O Amb25351035 [0,0,0,0,0,1|3,0,0]=4 1806 B10R1.113 CC1COCC(N1)C(O)=O Amb23585511 [0,0,0,0,0,1|3,0,0]=4 1807 B10R1.113 CC1CSCC(N1)C(O)=O Amb18645533 [0,0,0,0,0,1|3,0,0]=4 1808 B10R1.113 CC1NC(CCS1)C(O)=O Amb18278331 [0,0,0,0,0,1|3,0,0]=4 1809 B10R1.113 CC1OC(CCO1)C(O)=O Amb24502216 [0,0,0,0,0,1|3,0,0]=4 1810 B10R1.113 CC=1CC(CCC1)C(O)=O Amb18643566 [0,0,0,0,0,1|2,0,1]=4 1811 B10R1.113 CC=1CC(NCC1)C(O)=O Amb25761256 [0,0,0,0,0,1|1,0,1]=3 1812 B10R1.113 CN1CC(NCC1)C(=O)O Amb10602764 [0,0,0,0,0,1|2,0,0]=3 1813 B10R1.113 CN1CC(NCC1)C(N)=O Amb18124652 [0,0,0,0,0,1|3,0,0]=4 1814 B10R1.113 CN1CC(NCC1)C(N)=O Amb21960442 [0,0,0,0,0,1|3,0,0]=4 1815 B10R1.113 CN1CC(NCC1)C(O)=O Amb22587697 [0,0,0,0,0,1|2,0,0]=3 1816 B10R1.113 CN1CC(NCC1)C(O)=O Amb22754371 [0,0,0,0,0,1|2,0,0]=3 1817 B10R1.113 CN1CC(OCC1)C(O)=O Amb18946166 [0,0,0,0,0,1|3,0,0]=4 1818 B10R1.113 CN1CC(OCC1)C(O)=O Amb19514725 [0,0,0,0,0,1|3,0,0]=4 1819 B10R1.113 CN1C[C@@H](CCC1)C(O)=O Amb22751960 [0,0,0,0,0,1|3,0,0]=4 1820 B10R1.113 C[C@@H]1CC(=CCC1)C(O)=O Amb24680913 [0,0,0,0,0,1|2,0,1]=4 1821 B10R1.113 C[C@@H]1CCCC(C1)C(C)=O Amb25358902 [0,0,0,0,0,1|3,0,0]=4 1822 B10R1.113 C[C@@H]1CCC[C@@H](C1)C(=O)O Amb10843963 [0,0,0,0,0,1|2,0,0]=3 1823 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(O)=O Amb25168905 [0,0,0,0,0,1|3,0,0]=4 1824 B10R1.113 C[C@@H]1CCC[C@H](C1)C(C)=O Amb24736673 [0,0,0,0,0,1|3,0,0]=4 1825 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(O)=O Amb25378882 [0,0,0,0,0,1|2,0,0]=3 1826 B10R1.113 C[C@@H]1COC[C@@H](N1)C(O)=O Amb25102766 [0,0,0,0,0,1|3,0,0]=4 1827 B10R1.113 C[C@@H]1CSC[C@H](N1)C(O)=O Amb24565699 [0,0,0,0,0,1|3,0,0]=4 1828 B10R1.113 C[C@@H]1C[C@@H](CCN1)C(N)=O Amb24101102 [0,0,0,0,0,1|3,0,0]=4 1829 B10R1.113 C[C@@H]1C[C@@H](NCC1)C(O)=O Amb24725617 [0,0,0,0,0,1|1,0,0]=2 1830 B10R1.113 C[C@@H]1C[C@H](CNC1)C(O)=O Amb25095251 [0,0,0,0,0,1|1,0,0]=2 1831 B10R1.113 C[C@@H]1C[C@H](NCC1)C(O)=O Amb22744764 [0,0,0,0,0,1|1,0,0]=2 1832 B10R1.113 C[C@@H]1C[C@H](OCC1)C(N)=O Amb25031586 [0,0,0,0,0,1|3,0,0]=4 1833 B10R1.113 C[C@H]1CC(=CCC1)C(O)=O Amb24592586 [0,0,0,0,0,1|2,0,1]=4 1834 B10R1.113 C[C@H]1CC(CCC1)C(N)=O Amb24650556 [0,0,0,0,0,1|3,0,0]=4 1835 B10R1.113 C[C@H]1CC(CCC1)C(O)=O Amb25824115 [0,0,0,0,0,1|2,0,0]=3 1836 B10R1.113 C[C@H]1CC=C[C@@H](C1)C(C)=O Amb24721751 [0,0,0,0,0,1|3,0,0]=4 1837 B10R1.113 C[C@H]1CCC[C@H](O1)C(O)=O Amb24622482 [0,0,0,0,0,1|3,0,0]=4 1838 B10R1.113 C[C@H]1C[C@@H](CC=C1)C(O)=O Amb24514830 [0,0,0,0,0,1|2,0,1]=4 1839 B10R1.113 C[C@H]1C[C@@H](CCC1)C(O)=O Amb24657322 [0,0,0,0,0,1|2,0,0]=3 1840 B10R1.113 C[C@H]1C[C@@H](NCC1)C(N)=O Amb24514977 [0,0,0,0,0,1|2,0,0]=3 1841 B10R1.113 C[C@H]1C[C@@H](OCC1)C(O)=O Amb25168475 [0,0,0,0,0,1|2,0,0]=3 1842 B10R1.113 C[C@H]1C[C@H](CC=C1)C(O)=O Amb24514831 [0,0,0,0,0,1|2,0,1]=4 1843 B10R1.113 C[C@H]1C[C@H](CCN1)C(N)=O Amb25838380 [0,0,0,0,0,1|3,0,0]=4 1844 B10R1.113 NC(=N)C1CCCC(O)C1 Amb25239432 [0,0,0,0,0,1|3,0,0]=4 1845 B10R1.113 NC(=O)C1CC(=O)CCN1 Amb18202632 [0,0,0,0,0,1|1,0,2]=4 1846 B10R1.113 NC(=O)C1CC(O)CCN1 Amb24439182 [0,0,0,0,0,1|1,0,0]=2 1847 B10R1.113 NC(=O)C1CCCC(O)C1 Amb25067304 [0,0,0,0,0,1|2,0,0]=3 1848 B10R1.113 NC(=O)[C@@H]1C[C@@H](O)CCN1 Amb25378735 [0,0,0,0,0,1|1,0,0]=2 1849 B10R1.113 NC(=O)[C@@H]1C[C@H](O)CCN1 Amb24537178 [0,0,0,0,0,1|1,0,0]=2 1850 B10R1.113 NC1CC(COC1)C(O)=O Amb25088866 [0,0,0,0,0,1|2,0,0]=3 1851 B10R1.113 NC1CC(NCC1)C(O)=O Amb25111737 [0,0,0,0,0,1|1,0,0]=2 1852 B10R1.113 NC1CCCC(C1)C(=O)N Amb1132450 [0,0,0,0,0,1|3,0,0]=4 1853 B10R1.113 NC1CCCC(C1)C(N)=O Amb20669500 [0,0,0,0,0,1|3,0,0]=4 1854 B10R1.113 NC1CCOC(C1)C(N)=O Amb25223919 [0,0,0,0,0,1|3,0,0]=4 1855 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)N Amb10873178 [0,0,0,0,0,1|3,0,0]=4 1856 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O Amb10873166 [0,0,0,0,0,1|2,0,0]=3 1857 B10R1.113 N[C@@H]1C[C@@H](CCC1)C(O)=O Amb20241307 [0,0,0,0,0,1|2,0,0]=3 1858 B10R1.113 N[C@@H]1C[C@@H](CCC1)C(O)=O Amb23439976 [0,0,0,0,0,1|2,0,0]=3 1859 B10R1.113 N[C@@H]1C[C@@H](CNC1)C(O)=O Amb24587389 [0,0,0,0,0,1|1,0,0]=2 1860 B10R1.113 N[C@@H]1C[C@H](C=CC1)C(O)=O Amb24639997 [0,0,0,0,0,1|2,0,0]=3 1861 B10R1.113 N[C@@H]1C[C@H](CCC1)C(O)=O Amb22746829 [0,0,0,0,0,1|2,0,0]=3 1862 B10R1.113 N[C@@H]1C[C@H](CCC1)C(O)=O Amb23439848 [0,0,0,0,0,1|2,0,0]=3 1863 B10R1.113 N[C@H]1C[C@@H](C=CC1)C(O)=O Amb25230595 [0,0,0,0,0,1|2,0,0]=3 1864 B10R1.113 N[C@H]1C[C@@H](CC=C1)C(O)=O Amb24573259 [0,0,0,0,0,1|2,0,1]=4 1865 B10R1.113 N[C@H]1C[C@@H](NCC1)C(O)=O Amb25305570 [0,0,0,0,0,1|1,0,0]=2 1866 B10R1.113 N[C@H]1C[C@H](CC=C1)C(O)=O Amb24612043 [0,0,0,0,0,1|2,0,1]=4 1867 B10R1.113 N[C@H]1C[C@H](CCC1)C(O)=O Amb20241308 [0,0,0,0,0,1|2,0,0]=3 1868 B10R1.113 O=C1CCNC(C1)C(=O)O Amb13889089 [0,0,0,0,0,1|0,0,2]=3 1869 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O Amb13889084 [0,0,0,0,0,1|0,0,2]=3 1870 B10R1.113 OC(=O)C1CC(=O)CC=C1 Amb18643492 [0,0,0,0,0,1|1,0,2]=4 1871 B10R1.113 OC(=O)C1CC(=O)CCO1 Amb22496784 [0,0,0,0,0,1|1,0,2]=4 1872 B10R1.113 OC(=O)C1CC(=O)NCC1 Amb18831603 [0,0,0,0,0,1|1,0,2]=4 1873 B10R1.113 OC(=O)C1CC(=O)NNC1 Amb22546429 [0,0,0,0,0,1|1,0,2]=4 1874 B10R1.113 OC(=O)C1CC(Cl)CCN1 Amb24441476 [0,0,0,0,0,1|1,0,0]=2 1875 B10R1.113 OC(=O)C1CC(F)CCN1 Amb24423965 [0,0,0,0,0,1|1,0,0]=2 1876 B10R1.113 OC(=O)C1CC(F)CNC1 Amb13889096 [0,0,0,0,0,1|1,0,0]=2 1877 B10R1.113 OC(=O)C1CCCC(Br)C1 Amb24478263 [0,0,0,0,0,1|2,0,0]=3 1878 B10R1.113 OC(=O)C1CCCC(Cl)C1 Amb18126349 [0,0,0,0,0,1|2,0,0]=3 1879 B10R1.113 OC(=O)C1CN(Cl)CCC1 Amb25046169 [0,0,0,0,0,1|3,0,0]=4 1880 B10R1.113 OC(=O)C1CNCC(=O)N1 Amb22235985 [0,0,0,0,0,1|1,0,2]=4 1881 B10R1.113 OC(=O)[C@@H]1CC(=O)CCC1 Amb24460815 [0,0,0,0,0,1|1,0,2]=4 1882 B10R1.113 OC(=O)[C@@H]1CCC[C@@H](Br)C1 Amb25366201 [0,0,0,0,0,1|2,0,0]=3 1883 B10R1.113 OC(=O)[C@@H]1CCC[C@H](Cl)C1 Amb24511905 [0,0,0,0,0,1|2,0,0]=3 1884 B10R1.113 OC(=O)[C@@H]1CNCC(=O)N1 Amb22746774 [0,0,0,0,0,1|1,0,2]=4 1885 B10R1.113 OC(=O)[C@@H]1C[C@@H](Cl)CNN1 Amb24557811 [0,0,0,0,0,1|1,0,0]=2 1886 B10R1.113 OC(=O)[C@@H]1C[C@@H](F)CCN1 Amb25214695 [0,0,0,0,0,1|1,0,0]=2 1887 B10R1.113 OC(=O)[C@H]1CNC[C@@H](F)C1 Amb24737294 [0,0,0,0,0,1|1,0,0]=2 1888 B10R1.113 OC(=O)[C@H]1C[C@H](Cl)CNN1 Amb24710060 [0,0,0,0,0,1|1,0,0]=2 1889 B10R1.113 OC1CC(CC=C1)C(O)=O Amb18643829 [0,0,0,0,0,1|1,0,1]=3 1890 B10R1.113 OC1CCCC(C1)C(O)=O Amb18644123 [0,0,0,0,0,1|1,0,0]=2 1891 B10R1.113 OC1CCCC(O1)C(O)=O Amb24426494 [0,0,0,0,0,1|2,0,0]=3 1892 B10R1.113 OC1CCC[C@H](N1)C(O)=O Amb24479127 [0,0,0,0,0,1|2,0,0]=3 1893 B10R1.113 OC1CCNC(C1)C(O)=O Amb24117443 [0,0,0,0,0,1|0,0,0]=1 1894 B10R1.113 OC1CNNC(C1)C(O)=O Amb18644257 [0,0,0,0,0,1|0,0,0]=1 1895 B10R1.113 O[C@@H]1CCC[C@@H](C1)C(O)=O Amb22899465 [0,0,0,0,0,1|1,0,0]=2 1896 B10R1.113 O[C@@H]1CCC[C@H](C1)C(O)=O Amb22899464 [0,0,0,0,0,1|1,0,0]=2 1897 B10R1.113 O[C@@H]1CCNC(C1)C(O)=O Amb25296203 [0,0,0,0,0,1|0,0,0]=1 1898 B10R1.113 O[C@@H]1CCN[C@@H](C1)C(=O)O Amb10606703 [0,0,0,0,0,1|0,0,0]=1 1899 B10R1.113 O[C@@H]1CCN[C@@H](C1)C(O)=O Amb22386828 [0,0,0,0,0,1|0,0,0]=1 1900 B10R1.113 O[C@@H]1CCN[C@H](C1)C(O)=O Amb22748263 [0,0,0,0,0,1|0,0,0]=1 1901 B10R1.113 O[C@H]1CCC[C@@H](C1)C(O)=O Amb24546990 [0,0,0,0,0,1|1,0,0]=2 1902 B10R1.113 O[C@H]1CCN[C@@H](C1)C(O)=O Amb22388540 [0,0,0,0,0,1|0,0,0]=1 1903 B10R1.113 O[C@H]1CCN[C@H](C1)C(O)=O Amb20241913 [0,0,0,0,0,1|0,0,0]=1 1904 B10R1.113 O[C@H]1CNN[C@H](C1)C(O)=O Amb24622480 [0,0,0,0,0,1|0,0,0]=1 1905 B7R0.3 C#CCCC(O)CN Amb24483292 [1,0,1,0,0,0|1,0,1]=4 1906 B7R0.3 C=CC(O)CCC=O Amb24573986 [1,0,1,0,0,0|1,0,1]=4 1907 B7R0.3 C=CCCC(N)CN Amb20667712 [1,0,1,0,0,0|2,0,0]=4 1908 B7R0.3 C=CCCC(O)CCl Amb21962025 [1,0,1,0,0,0|2,0,0]=4 1909 B7R0.3 C=CCC[C@@H](O)CCl Amb25757947 [1,0,1,0,0,0|2,0,0]=4 1910 B7R0.3 C=CCC[C@H](O)CCl Amb24387324 [1,0,1,0,0,0|2,0,0]=4 1911 B7R0.3 C=CCC[C@H](O)CO Amb25847350 [1,0,1,0,0,0|2,0,0]=4 1912 B7R0.3 C=COCC(O)CN Amb25761004 [1,0,1,0,0,0|2,0,0]=4 1913 B7R0.3 CC(=CCCO)C=O Amb25366501 [1,0,1,0,0,0|1,0,1]=4 1914 B7R0.3 CC(C#N)NCCO Amb17044845 [1,0,1,0,0,0|1,0,1]=4 1915 B7R0.3 CC(C=C)NCCF Amb25075461 [1,0,1,0,0,0|2,0,0]=4 1916 B7R0.3 CC(C=O)CCCC Amb17593191 [1,0,1,0,0,0|2,0,0]=4 1917 B7R0.3 CC(C=O)OCCO Amb25046189 [1,0,1,0,0,0|1,0,0]=3 1918 B7R0.3 CC(CCCCl)C=O Amb24376628 [1,0,1,0,0,0|2,0,0]=4 1919 B7R0.3 CC(CCCO)C=C Amb22641468 [1,0,1,0,0,0|2,0,0]=4 1920 B7R0.3 CC(CCCO)C=O Amb24690170 [1,0,1,0,0,0|1,0,0]=3 1921 B7R0.3 CC(CCCO)CO Amb25098490 [1,0,1,0,0,0|1,0,1]=4 1922 B7R0.3 CC(CN)CCC=C Amb25189032 [1,0,1,0,0,0|2,0,0]=4 1923 B7R0.3 CC(CN)NCCO Amb24738477 [1,0,1,0,0,0|1,0,1]=4 1924 B7R0.3 CC(CO)CCC=O Amb25693017 [1,0,1,0,0,0|2,0,0]=4 1925 B7R0.3 CC(CO)NCCCl Amb24482645 [1,0,1,0,0,0|1,0,1]=4 1926 B7R0.3 CC(CO)NCCF Amb24483267 [1,0,1,0,0,0|1,0,1]=4 1927 B7R0.3 CC(NN)NCCO Amb25067826 [1,0,1,0,0,0|2,0,0]=4 1928 B7R0.3 CCC(C)CCC=O Amb25125664 [1,0,1,0,0,0|2,0,0]=4 1929 B7R0.3 CCC(O)CCC=C Amb22052608 [1,0,1,0,0,0|2,0,0]=4 1930 B7R0.3 CCC(O)COC=O Amb24642387 [1,0,1,0,0,0|2,0,0]=4 1931 B7R0.3 CCCNC(C)C=C Amb24538798 [1,0,1,0,0,0|2,0,0]=4 1932 B7R0.3 CCCNC(C)CO Amb22292469 [1,0,1,0,0,0|1,0,1]=4 1933 B7R0.3 CCCSC(C)C=O Amb18124367 [1,0,1,0,0,0|2,0,0]=4 1934 B7R0.3 CC[C@H](C)CCC=O Amb25102725 [1,0,1,0,0,0|2,0,0]=4 1935 B7R0.3 CN(C=O)CCCO Amb17593211 [1,0,1,0,0,0|2,0,0]=4 1936 B7R0.3 CSCCC(O)CN Amb25785761 [1,0,1,0,0,0|2,0,0]=4 1937 B7R0.3 C[C@@H](CCCO)CO Amb24475366 [1,0,1,0,0,0|1,0,1]=4 1938 B7R0.3 C[C@@H](CN)NCCO Amb25099589 [1,0,1,0,0,0|1,0,1]=4 1939 B7R0.3 C[C@@H](CO)CCC=O Amb24602985 [1,0,1,0,0,0|2,0,0]=4 1940 B7R0.3 C[C@@H](CO)NCCCl Amb24481379 [1,0,1,0,0,0|1,0,1]=4 1941 B7R0.3 C[C@H](CCCO)C=C Amb25675669 [1,0,1,0,0,0|2,0,0]=4 1942 B7R0.3 C[C@H](CN)CCCO Amb24426785 [1,0,1,0,0,0|1,0,1]=4 1943 B7R0.3 C\C=C\CC(O)CN Amb24349694 [1,0,1,0,0,0|1,0,1]=4 1944 B7R0.3 NCC(O)CCCO Amb18124267 [1,0,1,0,0,0|0,0,1]=3 1945 B7R0.3 NCCCC(O)CN Amb24460595 [1,0,1,0,0,0|1,0,1]=4 1946 B7R0.3 NCCC[C@H](O)CN Amb24527869 [1,0,1,0,0,0|1,0,1]=4 1947 B7R0.3 OC(CBr)CCC=O Amb24559224 [1,0,1,0,0,0|1,0,0]=3 1948 B7R0.3 OC(CCl)CNC=O Amb25137565 [1,0,1,0,0,0|2,0,0]=4 1949 B7R0.3 OC(CCl)COC=O Amb25315901 [1,0,1,0,0,0|2,0,0]=4 1950 B7R0.3 OC(CO)CCC=C Amb10071251 [1,0,1,0,0,0|2,0,0]=4 1951 B7R0.3 OC(CS)SCC=O Amb24574024 [1,0,1,0,0,0|2,0,0]=4 1952 B7R0.3 OCC(O)CCC=O Amb24669095 [1,0,1,0,0,0|1,0,0]=3 1953 B7R0.3 OCC(O)COC=O Amb25787203 [1,0,1,0,0,0|2,0,0]=4 1954 B7R0.3 OCC(O)OCC=O Amb25046498 [1,0,1,0,0,0|2,0,0]=4 1955 B7R0.3 OCCCC(Br)C=O Amb25765431 [1,0,1,0,0,0|2,0,0]=4 1956 B7R0.3 OCCCC(CC)O Amb17593216 [1,0,1,0,0,0|1,0,1]=4 1957 B7R0.3 OCCCC(CN)C Amb17569906 [1,0,1,0,0,0|1,0,1]=4 1958 B7R0.3 OCCCC(CO)O Amb17593225 [1,0,1,0,0,0|1,0,1]=4 1959 B7R0.3 OCCCC(F)C=O Amb24553890 [1,0,1,0,0,0|2,0,0]=4 1960 B7R0.3 OCCCC(O)C=O Amb18641948 [1,0,1,0,0,0|2,0,0]=4 1961 B7R0.3 OCCCC(O)CBr Amb24533940 [1,0,1,0,0,0|1,0,1]=4 1962 B7R0.3 OCCCC(O)CCl Amb24725283 [1,0,1,0,0,0|1,0,1]=4 1963 B7R0.3 OCCC[C@H](O)C=O Amb24570447 [1,0,1,0,0,0|2,0,0]=4 1964 B7R0.3 OCCC[C@H](O)CO Amb24687288 [1,0,1,0,0,0|1,0,1]=4 1965 B7R0.3 OC[C@@H](O)CCC=O Amb24482301 [1,0,1,0,0,0|1,0,0]=3 1966 B7R0.3 OC[C@H](O)CCC=O Amb25123219 [1,0,1,0,0,0|1,0,0]=3 1967 B7R0.3 OC[C@H](O)COC=O Amb25831941 [1,0,1,0,0,0|2,0,0]=4 1968 B7R0.3 O[C@@H](CBr)CCC=O Amb24390114 [1,0,1,0,0,0|1,0,0]=3 1969 B7R0.4 BrCCCCC(=O)C Amb16234126 [1,0,1,0,0,0|2,0,0]=4 1970 B7R0.4 C#CCNCC(O)C Amb17308672 [1,0,1,0,0,0|1,0,1]=4 1971 B7R0.4 C=C(Br)CNCCO Amb18523816 [1,0,1,0,0,0|2,0,0]=4 1972 B7R0.4 C=C(Cl)CNCCO Amb19004198 [1,0,1,0,0,0|2,0,0]=4 1973 B7R0.4 C=CCNCC(O)C Amb17138365 [1,0,1,0,0,0|1,0,0]=3 1974 B7R0.4 CC(=C)CCCCN Amb25142976 [1,0,1,0,0,0|2,0,0]=4 1975 B7R0.4 CC(=C)CNCCO Amb24591963 [1,0,1,0,0,0|2,0,0]=4 1976 B7R0.4 CC(=N)CCCCN Amb25076530 [1,0,1,0,0,0|2,0,0]=4 1977 B7R0.4 CC(=O)CNCCO Amb18108527 [1,0,1,0,0,0|1,0,0]=3 1978 B7R0.4 CC(=O)CNCCS Amb25328157 [1,0,1,0,0,0|1,1,0]=4 1979 B7R0.4 CC(=O)COCCN Amb18630459 [1,0,1,0,0,0|2,0,0]=4 1980 B7R0.4 CC(=O)NCCCN Amb10610286 [1,0,1,0,0,0|2,0,0]=4 1981 B7R0.4 CC(=O)OCCCN Amb18641920 [1,0,1,0,0,0|2,0,0]=4 1982 B7R0.4 CC(=O)SCCCN Amb25368304 [1,0,1,0,0,0|2,0,0]=4 1983 B7R0.4 CC(C)CCCC=O Amb17940235 [1,0,1,0,0,0|2,0,0]=4 1984 B7R0.4 CC(C)CNCCO Amb22587152 [1,0,1,0,0,0|1,0,1]=4 1985 B7R0.4 CC(F)CNCCO Amb24518852 [1,0,1,0,0,0|1,0,1]=4 1986 B7R0.4 CC(N)CNCC=C Amb18312621 [1,0,1,0,0,0|2,0,0]=4 1987 B7R0.4 CC(N)CNCCO Amb24668970 [1,0,1,0,0,0|1,0,1]=4 1988 B7R0.4 CC(O)CCCC=C Amb22059432 [1,0,1,0,0,0|2,0,0]=4 1989 B7R0.4 CC(O)CCCC=O Amb18641887 [1,0,1,0,0,0|1,0,0]=3 1990 B7R0.4 CC(O)CCCCO Amb22227757 [1,0,1,0,0,0|1,0,1]=4 1991 B7R0.4 CC(O)CCNC=O Amb24533830 [1,0,1,0,0,0|2,0,0]=4 1992 B7R0.4 CC(O)COCC=C Amb22733640 [1,0,1,0,0,0|2,0,0]=4 1993 B7R0.4 CC(O)COCCO Amb24590103 [1,0,1,0,0,0|1,0,1]=4 1994 B7R0.4 CC(O)CSCCO Amb22055428 [1,0,1,0,0,0|1,0,1]=4 1995 B7R0.4 CC(O)C\C=C\C=O Amb18641799 [1,0,1,0,0,0|1,0,1]=4 1996 B7R0.4 CC(S)CNCC=C Amb18642864 [1,0,1,0,0,0|1,1,0]=4 1997 B7R0.4 CC=NNCC(C)O Amb25712063 [1,0,1,0,0,0|2,0,0]=4 1998 B7R0.4 CCCCCC([O-])=O Amb22337624 [1,0,1,0,0,0|1,0,1]=4 1999 B7R0.4 CCCCCC([O-])=O Amb22525161 [1,0,1,0,0,0|1,0,1]=4 2000 B7R0.4 CCCCCC([O-])=O Amb22730527 [1,0,1,0,0,0|1,0,1]=4 2001 B7R0.4 CCCCCC([O-])=O Amb22731343 [1,0,1,0,0,0|1,0,1]=4 2002 B7R0.4 CCCCC[13C](O)=O Amb22353417 [1,0,1,0,0,0|1,0,0]=3 2003 B7R0.4 CCCC[13CH2][13C](O)=O Amb22367381 [1,0,1,0,0,0|1,0,0]=3 2004 B7R0.4 CCCNCC(=C)Br Amb18303968 [1,0,1,0,0,0|2,0,0]=4 2005 B7R0.4 CCCNCC(=C)C Amb17308631 [1,0,1,0,0,0|2,0,0]=4 2006 B7R0.4 CCCNCC(=C)Cl Amb19004838 [1,0,1,0,0,0|2,0,0]=4 2007 B7R0.4 CCCNCC(=O)N Amb1124632 [1,0,1,0,0,0|1,0,0]=3 2008 B7R0.4 CCCNCC(=O)O Amb10609640 [1,0,1,0,0,0|0,0,0]=2 2009 B7R0.4 CCCNCC(=O)O Amb1110628 [1,0,1,0,0,0|0,0,0]=2 2010 B7R0.4 CCCNCC(=S)N Amb17231883 [1,0,1,0,0,0|1,1,0]=4 2011 B7R0.4 CCCNCC(C)O Amb22292467 [1,0,1,0,0,0|1,0,1]=4 2012 B7R0.4 CCCNC[C@@H](C)O Amb25042630 [1,0,1,0,0,0|1,0,1]=4 2013 B7R0.4 CCCNC[C@H](C)O Amb24473274 [1,0,1,0,0,0|1,0,1]=4 2014 B7R0.4 CCCSCC(=O)O Amb1137113 [1,0,1,0,0,0|1,0,0]=3 2015 B7R0.4 CCONCC(N)=O Amb25745510 [1,0,1,0,0,0|2,0,0]=4 2016 B7R0.4 CCSSCC(O)=O Amb25233433 [1,0,1,0,0,0|2,0,0]=4 2017 B7R0.4 CNCCCC(=O)O Amb1153115 [1,0,1,0,0,0|2,0,0]=4 2018 B7R0.4 COCNCC(C)O Amb25216574 [1,0,1,0,0,0|2,0,0]=4 2019 B7R0.4 CSCCCC(=O)O Amb17503622 [1,0,1,0,0,0|2,0,0]=4 2020 B7R0.4 C[C@@H](O)CCCC=O Amb22896885 [1,0,1,0,0,0|1,0,0]=3 2021 B7R0.4 C[C@@H](O)CCCCN Amb22896886 [1,0,1,0,0,0|1,0,1]=4 2022 B7R0.4 C[C@@H](O)CNCC#C Amb25715951 [1,0,1,0,0,0|1,0,1]=4 2023 B7R0.4 C[C@@H](O)CNCCN Amb25689140 [1,0,1,0,0,0|1,0,1]=4 2024 B7R0.4 C[C@@H](O)CSCCO Amb24643786 [1,0,1,0,0,0|1,0,1]=4 2025 B7R0.4 C[C@@H](O)C\C=C\C=O Amb25310809 [1,0,1,0,0,0|1,0,1]=4 2026 B7R0.4 C[C@H](O)CCCC=C Amb24704360 [1,0,1,0,0,0|2,0,0]=4 2027 B7R0.4 C[C@H](O)CNCCN Amb25777107 [1,0,1,0,0,0|1,0,1]=4 2028 B7R0.4 C[Se]CCCC(O)=O Amb22347334 [1,0,1,0,0,0|2,0,0]=4 2029 B7R0.4 N#CCCCC(O)=O Amb18560874 [1,0,1,0,0,0|0,0,2]=4 2030 B7R0.4 NC(=O)CCCCI Amb25788033 [1,0,1,0,0,0|2,0,0]=4 2031 B7R0.4 NC(=O)CNCCF Amb24443361 [1,0,1,0,0,0|2,0,0]=4 2032 B7R0.4 NCCCCC(N)=N Amb25714813 [1,0,1,0,0,0|2,0,0]=4 2033 B7R0.4 NCCCCC(N)=O Amb18641897 [1,0,1,0,0,0|1,0,0]=3 2034 B7R0.4 NCCCCC(N)=S Amb24481404 [1,0,1,0,0,0|1,1,0]=4 2035 B7R0.4 NCCCCC(N)O Amb24333310 [1,0,1,0,0,0|1,0,1]=4 2036 B7R0.4 NCCCCC(O)C Amb17569903 [1,0,1,0,0,0|1,0,1]=4 2037 B7R0.4 NCCCCC([O-])=O Amb22753853 [1,0,1,0,0,0|0,0,1]=3 2038 B7R0.4 NCCCCP(O)=O Amb24520720 [1,0,1,0,0,0|1,0,0]=3 2039 B7R0.4 NCCCCS(=O)C Amb17617794 [1,0,1,0,0,0|2,0,0]=4 2040 B7R0.4 NCCCNC(N)=O Amb18296186 [1,0,1,0,0,0|2,0,0]=4 2041 B7R0.4 NCCCNC(N)=O Amb20622408 [1,0,1,0,0,0|2,0,0]=4 2042 B7R0.4 NCCCNC(O)=O Amb24093884 [1,0,1,0,0,0|1,0,0]=3 2043 B7R0.4 NCCNCC(=O)O Amb17608063 [1,0,1,0,0,0|1,0,0]=3 2044 B7R0.4 NCCNCC(O)=O Amb19958818 [1,0,1,0,0,0|1,0,0]=3 2045 B7R0.4 NCCOCC(N)=O Amb18523830 [1,0,1,0,0,0|2,0,0]=4 2046 B7R0.4 NCCOCC(N)=O Amb20631066 [1,0,1,0,0,0|2,0,0]=4 2047 B7R0.4 NCCOCC(O)=O Amb18630146 [1,0,1,0,0,0|1,0,0]=3 2048 B7R0.4 NCCOCC(O)=O Amb22751540 [1,0,1,0,0,0|1,0,0]=3 2049 B7R0.4 NCCSCC(=O)C Amb17500454 [1,0,1,0,0,0|2,0,0]=4 2050 B7R0.4 NCCSCC(=O)O Amb17500446 [1,0,1,0,0,0|1,0,0]=3 2051 B7R0.4 NCCSCC(O)=O Amb20622325 [1,0,1,0,0,0|1,0,0]=3 2052 B7R0.4 NCC\C=C\C(O)=O Amb25266868 [1,0,1,0,0,0|0,0,2]=4 2053 B7R0.4 NC\C=C\CC(O)=O Amb18641825 [1,0,1,0,0,0|0,0,2]=4 2054 B7R0.4 NNCCCC(O)=O Amb24455803 [1,0,1,0,0,0|1,0,0]=3 2055 B7R0.4 NOCCCC(=O)O Amb10975956 [1,0,1,0,0,0|1,0,0]=3 2056 B7R0.4 NOCCCC(O)=O Amb22011795 [1,0,1,0,0,0|1,0,0]=3 2057 B7R0.4 O=C(F)CCCCCl Amb24472276 [1,0,1,0,0,0|2,0,0]=4 2058 B7R0.4 O=CCCCC(=O)O Amb17593198 [1,0,1,0,0,0|1,0,1]=4 2059 B7R0.4 OC(=O)CNCCS Amb18124468 [1,0,1,0,0,0|0,1,0]=3 2060 B7R0.4 OC(=O)COCCBr Amb24057760 [1,0,1,0,0,0|2,0,0]=4 2061 B7R0.4 OC(=O)COCCCl Amb21857870 [1,0,1,0,0,0|2,0,0]=4 2062 B7R0.4 OC(=O)CSCCCl Amb18644703 [1,0,1,0,0,0|2,0,0]=4 2063 B7R0.4 OC(=O)CSCCS Amb24711400 [1,0,1,0,0,0|1,1,0]=4 2064 B7R0.4 OCC#CCC(O)=O Amb24395623 [1,0,1,0,0,0|1,0,1]=4 2065 B7R0.4 OCCC#CC(O)=O Amb25844914 [1,0,1,0,0,0|1,0,1]=4 2066 B7R0.4 OCCCCC(=O)C Amb10603864 [1,0,1,0,0,0|2,0,0]=4 2067 B7R0.4 OCCCCC(=O)[O-] Amb13952763 [1,0,1,0,0,0|1,0,1]=4 2068 B7R0.4 OCCCCC(O)=O Amb22351244 [1,0,1,0,0,0|1,0,0]=3 2069 B7R0.4 OCCCC[C@H](O)C Amb10605245 [1,0,1,0,0,0|1,0,1]=4 2070 B7R0.4 OCCSCC(=O)O Amb1110090 [1,0,1,0,0,0|1,0,0]=3 2071 B7R0.4 OCC\C=C\C(O)=O Amb21929352 [1,0,1,0,0,0|1,0,1]=4 2072 B7R0.4 SCCCCC(=O)O Amb17503767 [1,0,1,0,0,0|1,0,0]=3 2073 B7R0.4 [O-]C(=O)CCCCO Amb22749314 [1,0,1,0,0,0|1,0,1]=4 2074 B7R0.5 C#CCC(N)C(O)=O Amb19944472 [1,0,1,0,0,0|0,0,2]=4 2075 B7R0.5 C#CC[C@@H](N)C(O)=O Amb22748688 [1,0,1,0,0,0|0,0,2]=4 2076 B7R0.5 C=CCC(N)C(O)=O Amb21856826 [1,0,1,0,0,0|0,0,2]=4 2077 B7R0.5 C=CC[C@@H](N)C(O)=O Amb22745310 [1,0,1,0,0,0|0,0,2]=4 2078 B7R0.5 CC#CC(C)C(O)=O Amb22748425 [1,0,1,0,0,0|1,0,1]=4 2079 B7R0.5 CC(=CCO)C(O)=O Amb24730294 [1,0,1,0,0,0|0,0,2]=4 2080 B7R0.5 CC(=O)C(N)CCO Amb25087112 [1,0,1,0,0,0|1,0,0]=3 2081 B7R0.5 CC(=O)C(S)CCO Amb25831127 [1,0,1,0,0,0|2,0,0]=4 2082 B7R0.5 CC(=O)N(N)CCO Amb18641953 [1,0,1,0,0,0|2,0,0]=4 2083 B7R0.5 CC(C(=O)C)CCO Amb13881368 [1,0,1,0,0,0|1,0,0]=3 2084 B7R0.5 CC(C(=O)O)CC#N Amb17334056 [1,0,1,0,0,0|1,0,1]=4 2085 B7R0.5 CC(C(=O)O)CNC Amb13952364 [1,0,1,0,0,0|2,0,0]=4 2086 B7R0.5 CC(C=NO)C(O)=O Amb24616398 [1,0,1,0,0,0|1,0,1]=4 2087 B7R0.5 CC(CC#C)C(O)=O Amb18633959 [1,0,1,0,0,0|1,0,1]=4 2088 B7R0.5 CC(CCBr)C(=O)Cl Amb25798925 [1,0,1,0,0,0|2,0,0]=4 2089 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [1,0,1,0,0,0|2,0,0]=4 2090 B7R0.5 CC(CCCl)C(=O)F Amb25839945 [1,0,1,0,0,0|2,0,0]=4 2091 B7R0.5 CC(CCF)C(O)=O Amb24678386 [1,0,1,0,0,0|1,0,0]=3 2092 B7R0.5 CC(CCN)C(C)=O Amb18251071 [1,0,1,0,0,0|2,0,0]=4 2093 B7R0.5 CC(CCN)C(N)=O Amb18641900 [1,0,1,0,0,0|2,0,0]=4 2094 B7R0.5 CC(CCN)C(O)=O Amb20667970 [1,0,1,0,0,0|1,0,0]=3 2095 B7R0.5 CC(CCO)C(N)=N Amb24615954 [1,0,1,0,0,0|2,0,0]=4 2096 B7R0.5 CC(CCO)C(O)=O Amb18641949 [1,0,1,0,0,0|0,0,0]=2 2097 B7R0.5 CC(CCS)C(O)=O Amb25133689 [1,0,1,0,0,0|0,1,0]=3 2098 B7R0.5 CC(O)C(N)CCC Amb24656798 [1,0,1,0,0,0|1,0,1]=4 2099 B7R0.5 CC(O)[C@@H](C)CCO Amb24431016 [1,0,1,0,0,0|1,0,1]=4 2100 B7R0.5 CCCC(=C)C(O)=O Amb18641779 [1,0,1,0,0,0|1,0,1]=4 2101 B7R0.5 CCCC(=O)C(O)=O Amb22347924 [1,0,1,0,0,0|1,0,1]=4 2102 B7R0.5 CCCC(=O)C(O)=O Amb22733540 [1,0,1,0,0,0|1,0,1]=4 2103 B7R0.5 CCCC(Br)C(=O)Br Amb24369503 [1,0,1,0,0,0|2,0,0]=4 2104 B7R0.5 CCCC(C(=O)Cl)Br Amb17569837 [1,0,1,0,0,0|2,0,0]=4 2105 B7R0.5 CCCC(C(=O)O)Cl Amb17593470 [1,0,1,0,0,0|1,0,0]=3 2106 B7R0.5 CCCC(C(=O)O)O Amb2582532 [1,0,1,0,0,0|1,0,0]=3 2107 B7R0.5 CCCC(Cl)C(N)=O Amb25024550 [1,0,1,0,0,0|2,0,0]=4 2108 B7R0.5 CCCC(F)C(O)=O Amb25842008 [1,0,1,0,0,0|1,0,0]=3 2109 B7R0.5 CCCC(N)C(=O)S Amb25378817 [1,0,1,0,0,0|0,1,0]=3 2110 B7R0.5 CCCC(N)C(C)=C Amb24643425 [1,0,1,0,0,0|2,0,0]=4 2111 B7R0.5 CCCC(N)C(N)=O Amb22284825 [1,0,1,0,0,0|1,0,0]=3 2112 B7R0.5 CCCC(N)P(O)O Amb24401110 [1,0,1,0,0,0|1,0,1]=4 2113 B7R0.5 CCCC(O)C(C)=O Amb22495823 [1,0,1,0,0,0|2,0,0]=4 2114 B7R0.5 CCCC(O)C(N)=O Amb24116553 [1,0,1,0,0,0|2,0,0]=4 2115 B7R0.5 CCCC(O)C([O-])=O Amb22731263 [1,0,1,0,0,0|1,0,1]=4 2116 B7R0.5 CCCC(O)P(O)=O Amb25143218 [1,0,1,0,0,0|2,0,0]=4 2117 B7R0.5 CCCC(S)C(C)=O Amb24689502 [1,0,1,0,0,0|2,0,0]=4 2118 B7R0.5 CCCC(S)C(O)=O Amb18124440 [1,0,1,0,0,0|1,0,0]=3 2119 B7R0.5 CCC[C@@H](C)C(C)=O Amb24631887 [1,0,1,0,0,0|2,0,0]=4 2120 B7R0.5 CCC[C@@H](C)C(N)=O Amb25257881 [1,0,1,0,0,0|2,0,0]=4 2121 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [1,0,1,0,0,0|1,0,0]=3 2122 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [1,0,1,0,0,0|1,0,0]=3 2123 B7R0.5 CCC[C@@H](O)C(C)=O Amb24432580 [1,0,1,0,0,0|2,0,0]=4 2124 B7R0.5 CCC[C@@H](O)C(O)=O Amb22746731 [1,0,1,0,0,0|1,0,0]=3 2125 B7R0.5 CCC[C@H](C)C(N)=O Amb25305606 [1,0,1,0,0,0|2,0,0]=4 2126 B7R0.5 CCC[C@H](F)C(O)=O Amb24657412 [1,0,1,0,0,0|1,0,0]=3 2127 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [1,0,1,0,0,0|2,0,0]=4 2128 B7R0.5 CCC[C@H](O)C(N)=O Amb25082239 [1,0,1,0,0,0|2,0,0]=4 2129 B7R0.5 CCC[C@H](O)C(O)=O Amb22226514 [1,0,1,0,0,0|1,0,0]=3 2130 B7R0.5 CCNC(=N)C(O)=O Amb18641879 [1,0,1,0,0,0|1,0,1]=4 2131 B7R0.5 CCNC(C)C(N)=O Amb21959648 [1,0,1,0,0,0|1,0,0]=3 2132 B7R0.5 CCN[C@H](C)C(O)=O Amb24351099 [1,0,1,0,0,0|0,0,0]=2 2133 B7R0.5 CCOC(C)C(N)=O Amb19960053 [1,0,1,0,0,0|2,0,0]=4 2134 B7R0.5 CCOC(O)C(O)=O Amb24680848 [1,0,1,0,0,0|2,0,0]=4 2135 B7R0.5 CCO[C@H](C)C(O)=O Amb24660035 [1,0,1,0,0,0|1,0,0]=3 2136 B7R0.5 CCSC(O)C(O)=O Amb24444218 [1,0,1,0,0,0|2,0,0]=4 2137 B7R0.5 CCS[C@@H](C)C(O)=O Amb25083211 [1,0,1,0,0,0|1,0,0]=3 2138 B7R0.5 CCS[C@H](C)C(O)=O Amb25259517 [1,0,1,0,0,0|1,0,0]=3 2139 B7R0.5 CC\C=C(\N)/C(O)=O Amb24349496 [1,0,1,0,0,0|0,0,2]=4 2140 B7R0.5 CNCC(C(=O)O)N Amb10071505 [1,0,1,0,0,0|1,0,0]=3 2141 B7R0.5 CNCC(C(=O)O)N Amb10845350 [1,0,1,0,0,0|1,0,0]=3 2142 B7R0.5 CNCC(F)C(O)=O Amb24666017 [1,0,1,0,0,0|2,0,0]=4 2143 B7R0.5 CNCC(N)C(N)=O Amb25316352 [1,0,1,0,0,0|2,0,0]=4 2144 B7R0.5 CNC[C@@H](C(=O)O)N Amb17617148 [1,0,1,0,0,0|1,0,0]=3 2145 B7R0.5 CNC[C@@H](N)C(O)=O Amb19133072 [1,0,1,0,0,0|1,0,0]=3 2146 B7R0.5 CNC[C@@H](N)C(O)=O Amb22746009 [1,0,1,0,0,0|1,0,0]=3 2147 B7R0.5 CNC[C@@H](N)C(O)=O Amb22748835 [1,0,1,0,0,0|1,0,0]=3 2148 B7R0.5 CNC[C@H](N)C(O)=O Amb19892230 [1,0,1,0,0,0|1,0,0]=3 2149 B7R0.5 CNC[C@H](O)C(O)=O Amb25689188 [1,0,1,0,0,0|2,0,0]=4 2150 B7R0.5 CNNC(C)C(O)=O Amb24070183 [1,0,1,0,0,0|1,0,0]=3 2151 B7R0.5 COCC(C(=O)O)Br Amb17594709 [1,0,1,0,0,0|2,0,0]=4 2152 B7R0.5 COCC(C(=O)O)Cl Amb10068384 [1,0,1,0,0,0|2,0,0]=4 2153 B7R0.5 COCC(F)C(O)=O Amb24526772 [1,0,1,0,0,0|2,0,0]=4 2154 B7R0.5 COCC(N)C(N)=O Amb18984372 [1,0,1,0,0,0|2,0,0]=4 2155 B7R0.5 COCC(O)C(O)=O Amb18124273 [1,0,1,0,0,0|2,0,0]=4 2156 B7R0.5 COC[C@@H](N)C(N)=O Amb25211762 [1,0,1,0,0,0|2,0,0]=4 2157 B7R0.5 COC[C@@H](N)C(O)=O Amb22744762 [1,0,1,0,0,0|1,0,0]=3 2158 B7R0.5 COC[C@@H](O)C(O)=O Amb25829059 [1,0,1,0,0,0|2,0,0]=4 2159 B7R0.5 COC[C@H](C(=O)O)N Amb10604051 [1,0,1,0,0,0|1,0,0]=3 2160 B7R0.5 CSCC(C)C(O)=O Amb18967825 [1,0,1,0,0,0|2,0,0]=4 2161 B7R0.5 CSCC(N)C(N)=O Amb18294390 [1,0,1,0,0,0|2,0,0]=4 2162 B7R0.5 CSCC(O)C(O)=O Amb25131873 [1,0,1,0,0,0|2,0,0]=4 2163 B7R0.5 CSC[C@H](O)C(O)=O Amb24435256 [1,0,1,0,0,0|2,0,0]=4 2164 B7R0.5 CSSC(C)C(O)=O Amb25701741 [1,0,1,0,0,0|2,0,0]=4 2165 B7R0.5 C[C@@H](C(=O)O)CC#C Amb10844029 [1,0,1,0,0,0|1,0,1]=4 2166 B7R0.5 C[C@@H](C(=O)O)CC=C Amb10844040 [1,0,1,0,0,0|1,0,1]=4 2167 B7R0.5 C[C@@H](C(=O)O)CCC Amb10844028 [1,0,1,0,0,0|1,0,0]=3 2168 B7R0.5 C[C@@H](CCS)C(O)=O Amb25786376 [1,0,1,0,0,0|0,1,0]=3 2169 B7R0.5 C[C@@H](NC=O)C(O)=O Amb22746684 [1,0,1,0,0,0|0,0,2]=4 2170 B7R0.5 C[C@@H](NON)C(O)=O Amb24409085 [1,0,1,0,0,0|2,0,0]=4 2171 B7R0.5 C[C@@H](O)[C@@H](C)CCO Amb24475865 [1,0,1,0,0,0|1,0,1]=4 2172 B7R0.5 C[C@@H](O)[C@H](C)CCO Amb25206314 [1,0,1,0,0,0|1,0,1]=4 2173 B7R0.5 C[C@@H](O)[C@H](N)CCC Amb25328641 [1,0,1,0,0,0|1,0,1]=4 2174 B7R0.5 C[C@H](C(=O)O)CC#C Amb10844036 [1,0,1,0,0,0|1,0,1]=4 2175 B7R0.5 C[C@H](C(=O)O)CC=C Amb10844033 [1,0,1,0,0,0|1,0,1]=4 2176 B7R0.5 C[C@H](C(=O)O)CCC Amb10844037 [1,0,1,0,0,0|1,0,0]=3 2177 B7R0.5 C[C@H](C(=O)O)CCN Amb10844043 [1,0,1,0,0,0|1,0,0]=3 2178 B7R0.5 C[C@H](C(=O)O)COC Amb10844266 [1,0,1,0,0,0|2,0,0]=4 2179 B7R0.5 C[C@H](CC#N)C(O)=O Amb24725603 [1,0,1,0,0,0|1,0,1]=4 2180 B7R0.5 C[C@H](CCO)C(O)=O Amb24483065 [1,0,1,0,0,0|0,0,0]=2 2181 B7R0.5 C[C@H](NCC)[C@@H](C)O Amb25805873 [1,0,1,0,0,0|1,0,1]=4 2182 B7R0.5 C[C@H](NCC)[C@H](C)O Amb24559757 [1,0,1,0,0,0|1,0,1]=4 2183 B7R0.5 C[C@H](NCO)C(O)=O Amb24401217 [1,0,1,0,0,0|0,0,0]=2 2184 B7R0.5 C[C@H](O)[C@H](C)CCO Amb25143027 [1,0,1,0,0,0|1,0,1]=4 2185 B7R0.5 C[C@H](O)[C@H](N)CCC Amb24604367 [1,0,1,0,0,0|1,0,1]=4 2186 B7R0.5 C[Se]C[C@@H](C(=O)O)N Amb10601626 [1,0,1,0,0,0|1,0,0]=3 2187 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22350259 [1,0,1,0,0,0|1,0,0]=3 2188 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22745692 [1,0,1,0,0,0|1,0,0]=3 2189 B7R0.5 C\C(=C/CO)\C(O)=O Amb18641873 [1,0,1,0,0,0|0,0,2]=4 2190 B7R0.5 C\C=C\C(C)C(O)=O Amb18641786 [1,0,1,0,0,0|1,0,1]=4 2191 B7R0.5 C\C=C\C(N)C(O)=O Amb24481451 [1,0,1,0,0,0|0,0,2]=4 2192 B7R0.5 C\C=C\[C@@H](C)C(O)=O Amb25719907 [1,0,1,0,0,0|1,0,1]=4 2193 B7R0.5 C\C=C\[C@H](C)C(O)=O Amb24481336 [1,0,1,0,0,0|1,0,1]=4 2194 B7R0.5 NC(=O)C(O)CCO Amb25703294 [1,0,1,0,0,0|2,0,0]=4 2195 B7R0.5 NC(=O)C(S)CCO Amb24525295 [1,0,1,0,0,0|2,0,0]=4 2196 B7R0.5 NC(=O)N(N)CCO Amb18641972 [1,0,1,0,0,0|2,0,0]=4 2197 B7R0.5 NC(C(=O)O)CCBr Amb10576584 [1,0,1,0,0,0|1,0,0]=3 2198 B7R0.5 NC(CC#N)C(O)=O Amb18641766 [1,0,1,0,0,0|1,0,1]=4 2199 B7R0.5 NC(CCBr)C(O)=O Amb21858417 [1,0,1,0,0,0|1,0,0]=3 2200 B7R0.5 NC(CCF)C(N)=O Amb24391278 [1,0,1,0,0,0|2,0,0]=4 2201 B7R0.5 NC(CCI)C(O)=O Amb25339674 [1,0,1,0,0,0|1,0,0]=3 2202 B7R0.5 NC(CCO)C(N)=O Amb24481392 [1,0,1,0,0,0|1,0,0]=3 2203 B7R0.5 NC(CCS)C(N)=O Amb24599383 [1,0,1,0,0,0|1,1,0]=4 2204 B7R0.5 NC(CCS)C(O)=O Amb19267093 [1,0,1,0,0,0|0,1,0]=3 2205 B7R0.5 NC(CS=O)C(O)=O Amb24557184 [1,0,1,0,0,0|1,0,1]=4 2206 B7R0.5 NC(CSCl)C(O)=O Amb24482298 [1,0,1,0,0,0|2,0,0]=4 2207 B7R0.5 NC(CSO)C(O)=O Amb24746797 [1,0,1,0,0,0|1,0,0]=3 2208 B7R0.5 NC(CSS)C(O)=O Amb24614616 [1,0,1,0,0,0|1,1,0]=4 2209 B7R0.5 NCCC(C(=O)O)F Amb10838221 [1,0,1,0,0,0|2,0,0]=4 2210 B7R0.5 NCCC(C(=O)O)O Amb16232090 [1,0,1,0,0,0|2,0,0]=4 2211 B7R0.5 NCCC(Cl)C(O)=O Amb18124502 [1,0,1,0,0,0|2,0,0]=4 2212 B7R0.5 NCCC(F)C(O)=O Amb22229524 [1,0,1,0,0,0|2,0,0]=4 2213 B7R0.5 NCCC(N)C(N)=O Amb24634873 [1,0,1,0,0,0|2,0,0]=4 2214 B7R0.5 NCCC(N)C(O)=O Amb17678762 [1,0,1,0,0,0|1,0,0]=3 2215 B7R0.5 NCCC(N)C(O)=O Amb22348212 [1,0,1,0,0,0|1,0,0]=3 2216 B7R0.5 NCCC(S)C(O)=O Amb25083375 [1,0,1,0,0,0|2,0,0]=4 2217 B7R0.5 NCC[C@@H](Cl)C(O)=O Amb24481492 [1,0,1,0,0,0|2,0,0]=4 2218 B7R0.5 NCC[C@@H](F)C(O)=O Amb24055858 [1,0,1,0,0,0|2,0,0]=4 2219 B7R0.5 NCC[C@@H](N)C(O)=O Amb22750574 [1,0,1,0,0,0|1,0,0]=3 2220 B7R0.5 NCC[C@@H](N)C(O)=O Amb23438994 [1,0,1,0,0,0|1,0,0]=3 2221 B7R0.5 NCC[C@@H](O)C(O)=O Amb22225364 [1,0,1,0,0,0|2,0,0]=4 2222 B7R0.5 NCC[C@@H](O)C(O)=O Amb22748225 [1,0,1,0,0,0|2,0,0]=4 2223 B7R0.5 NCC[C@H](F)C(O)=O Amb24055857 [1,0,1,0,0,0|2,0,0]=4 2224 B7R0.5 NCC[C@H](N)C(O)=O Amb22886961 [1,0,1,0,0,0|1,0,0]=3 2225 B7R0.5 NOCC(N)C(O)=O Amb24184086 [1,0,1,0,0,0|2,0,0]=4 2226 B7R0.5 NOC[C@@H](N)C(O)=O Amb25791301 [1,0,1,0,0,0|2,0,0]=4 2227 B7R0.5 NOC[C@H](N)C(O)=O Amb24548229 [1,0,1,0,0,0|2,0,0]=4 2228 B7R0.5 N[C@@H](C(=O)O)CC#C Amb16183954 [1,0,1,0,0,0|0,0,2]=4 2229 B7R0.5 N[C@@H](C(=O)O)CCN Amb16183852 [1,0,1,0,0,0|1,0,0]=3 2230 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22746780 [1,0,1,0,0,0|0,0,2]=4 2231 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22748768 [1,0,1,0,0,0|0,0,2]=4 2232 B7R0.5 N[C@@H](CCBr)C(O)=O Amb22748283 [1,0,1,0,0,0|1,0,0]=3 2233 B7R0.5 N[C@@H](CCO)C(O)=O Amb20242705 [1,0,1,0,0,0|0,0,0]=2 2234 B7R0.5 N[C@@H](CCS)P(O)=O Amb24594746 [1,0,1,0,0,0|1,1,0]=4 2235 B7R0.5 N[C@@H](CCS)S(O)=O Amb25784628 [1,0,1,0,0,0|1,1,0]=4 2236 B7R0.5 N[C@@H](CNO)C(O)=O Amb24481412 [1,0,1,0,0,0|1,0,0]=3 2237 B7R0.5 N[C@@H](CO[SiH3])C(O)=O Amb24526864 [1,0,1,0,0,0|1,1,0]=4 2238 B7R0.5 N[C@@H](CSCl)C(O)=O Amb25055747 [1,0,1,0,0,0|2,0,0]=4 2239 B7R0.5 N[C@@H](CSO)C(O)=O Amb24481432 [1,0,1,0,0,0|1,0,0]=3 2240 B7R0.5 N[C@H](C(=O)O)CC#N Amb16183916 [1,0,1,0,0,0|1,0,1]=4 2241 B7R0.5 N[C@H](C(=O)O)CC=C Amb10982568 [1,0,1,0,0,0|0,0,2]=4 2242 B7R0.5 N[C@H](C(=O)O)CCN Amb16183862 [1,0,1,0,0,0|1,0,0]=3 2243 B7R0.5 N[C@H](CCS)C(O)=O Amb22230515 [1,0,1,0,0,0|0,1,0]=3 2244 B7R0.5 N[C@H](CNO)C(O)=O Amb24745929 [1,0,1,0,0,0|1,0,0]=3 2245 B7R0.5 O=CCC(C(=O)O)N Amb16232081 [1,0,1,0,0,0|0,0,2]=4 2246 B7R0.5 O=CNC(C(=O)O)C Amb1144629 [1,0,1,0,0,0|0,0,2]=4 2247 B7R0.5 OC(=O)C(=O)CCO Amb25677024 [1,0,1,0,0,0|1,0,1]=4 2248 B7R0.5 OC(=O)C(Br)CCBr Amb19889695 [1,0,1,0,0,0|2,0,0]=4 2249 B7R0.5 OC(=O)C(Br)CCF Amb25073798 [1,0,1,0,0,0|2,0,0]=4 2250 B7R0.5 OC(=O)C(Cl)CCCl Amb18126030 [1,0,1,0,0,0|2,0,0]=4 2251 B7R0.5 OC(=O)[C@H](S)CCS Amb24483251 [1,0,1,0,0,0|1,1,0]=4 2252 B7R0.5 OC(CCS)C(O)=O Amb24586206 [1,0,1,0,0,0|1,1,0]=4 2253 B7R0.5 OCCC(O)C(O)=O Amb24689942 [1,0,1,0,0,0|1,0,0]=3 2254 B7R0.5 O[15NH]CC(C(=O)O)N Amb17608097 [1,0,1,0,0,0|1,0,0]=3 2255 B7R0.5 O[C@@H](CCF)C(O)=O Amb24481351 [1,0,1,0,0,0|2,0,0]=4 2256 B7R0.6 CC(=C)CCC(O)=O Amb18641793 [1,0,1,0,0,0|1,0,1]=4 2257 B7R0.6 CC(Br)CCC(=O)Cl Amb24483133 [1,0,1,0,0,0|2,0,0]=4 2258 B7R0.6 CC(Br)CCC(N)=O Amb24065438 [1,0,1,0,0,0|2,0,0]=4 2259 B7R0.6 CC(Br)CCC(O)=O Amb18124528 [1,0,1,0,0,0|1,0,0]=3 2260 B7R0.6 CC(C)CC[13C](O)=O Amb22337922 [1,0,1,0,0,0|1,0,0]=3 2261 B7R0.6 CC(C)CC[13C]([O-])=O Amb22369748 [1,0,1,0,0,0|1,0,1]=4 2262 B7R0.6 CC(CCC(=O)O)C Amb1153016 [1,0,1,0,0,0|1,0,0]=3 2263 B7R0.6 CC(CCC(=O)O)N Amb17593212 [1,0,1,0,0,0|1,0,0]=3 2264 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [1,0,1,0,0,0|2,0,0]=4 2265 B7R0.6 CC(Cl)CCC(N)=O Amb24469692 [1,0,1,0,0,0|2,0,0]=4 2266 B7R0.6 CC(Cl)CCC(O)=O Amb18124448 [1,0,1,0,0,0|1,0,0]=3 2267 B7R0.6 CC(F)CCC(O)=O Amb24682772 [1,0,1,0,0,0|1,0,0]=3 2268 B7R0.6 CC(N)CCC(C)=O Amb24698356 [1,0,1,0,0,0|2,0,0]=4 2269 B7R0.6 CC(N)CCC(N)=O Amb18641901 [1,0,1,0,0,0|2,0,0]=4 2270 B7R0.6 CC(N)CCC(O)=O Amb19515603 [1,0,1,0,0,0|1,0,0]=3 2271 B7R0.6 CC(NCC(=O)O)C Amb2372347 [1,0,1,0,0,0|2,0,0]=4 2272 B7R0.6 CC(O)CCB(O)O Amb24594819 [1,0,1,0,0,0|1,0,1]=4 2273 B7R0.6 CC(O)CCC(C)=C Amb24062974 [1,0,1,0,0,0|2,0,0]=4 2274 B7R0.6 CC(O)CCC(C)=O Amb25829594 [1,0,1,0,0,0|1,0,0]=3 2275 B7R0.6 CC(O)CCC(O)=O Amb18294804 [1,0,1,0,0,0|0,0,0]=2 2276 B7R0.6 CC(O)COC(C)=O Amb24056158 [1,0,1,0,0,0|2,0,0]=4 2277 B7R0.6 CC(O)COP(O)=O Amb24591406 [1,0,1,0,0,0|2,0,0]=4 2278 B7R0.6 CC(O)NCC(O)=O Amb25141558 [1,0,1,0,0,0|1,0,0]=3 2279 B7R0.6 CC(O)\C=C\C(O)=O Amb18641876 [1,0,1,0,0,0|0,0,2]=4 2280 B7R0.6 CC(SCC(=O)O)C Amb1128460 [1,0,1,0,0,0|2,0,0]=4 2281 B7R0.6 CN(C)CCC(O)=O Amb19888182 [1,0,1,0,0,0|2,0,0]=4 2282 B7R0.6 CS(=O)CCC(O)=O Amb18523762 [1,0,1,0,0,0|1,0,1]=4 2283 B7R0.6 C[C@@H](COC(=O)O)O Amb16232417 [1,0,1,0,0,0|1,0,0]=3 2284 B7R0.6 C[C@@H](O)C#CC(O)=O Amb24334413 [1,0,1,0,0,0|0,0,2]=4 2285 B7R0.6 C[C@@H](O)CCB(O)O Amb25683632 [1,0,1,0,0,0|1,0,1]=4 2286 B7R0.6 C[C@@H](O)CCC(C)=C Amb22896943 [1,0,1,0,0,0|2,0,0]=4 2287 B7R0.6 C[C@@H](O)CCC(C)=O Amb22351150 [1,0,1,0,0,0|1,0,0]=3 2288 B7R0.6 C[C@@H](O)CCC(C)O Amb25846912 [1,0,1,0,0,0|1,0,1]=4 2289 B7R0.6 C[C@@H](O)CNC(C)=O Amb25133822 [1,0,1,0,0,0|2,0,0]=4 2290 B7R0.6 C[C@@H](O)COC(C)=O Amb25832756 [1,0,1,0,0,0|2,0,0]=4 2291 B7R0.6 C[C@@H](S)CCC(O)=O Amb24587370 [1,0,1,0,0,0|0,1,0]=3 2292 B7R0.6 C[C@H](N)CCC(O)=O Amb25047328 [1,0,1,0,0,0|1,0,0]=3 2293 B7R0.6 C[C@H](O)CNC(N)=O Amb24384732 [1,0,1,0,0,0|2,0,0]=4 2294 B7R0.6 C[C@H](O)CSC(C)=O Amb25256687 [1,0,1,0,0,0|2,0,0]=4 2295 B7R0.6 C[S+](C)CCC(O)=O Amb22730539 [1,0,1,0,0,0|2,0,0]=4 2296 B7R0.6 NC(=N)CCC(O)=O Amb25736788 [1,0,1,0,0,0|1,0,1]=4 2297 B7R0.6 NC(=S)CCC(O)=O Amb18102382 [1,0,1,0,0,0|0,1,1]=4 2298 B7R0.6 OB(O)CCC(O)=O Amb24640288 [1,0,1,0,0,0|2,0,0]=4 2299 B7R0.6 OC(=O)CCC(Cl)Cl Amb25059214 [1,0,1,0,0,0|2,0,0]=4 2300 B7R0.6 OC(=O)CCC(F)F Amb20623135 [1,0,1,0,0,0|2,0,0]=4 2301 B7R0.6 OC(=O)CCC(O)=O Amb22168124 [1,0,1,0,0,0|1,0,1]=4 2302 B7R0.6 OC(=O)CCC(O)=O Amb22349196 [1,0,1,0,0,0|1,0,1]=4 2303 B7R0.6 OC(=O)CCC(O)=O Amb22353352 [1,0,1,0,0,0|1,0,1]=4 2304 B7R0.6 OC(=O)CCC(O)=O Amb22360649 [1,0,1,0,0,0|1,0,1]=4 2305 B7R0.6 OC(=O)C[13CH2][13C](O)=O Amb22353421 [1,0,1,0,0,0|1,0,1]=4 2306 B7R0.6 OC(=O)[13CH2][13CH2]C(O)=O Amb22338081 [1,0,1,0,0,0|1,0,1]=4 2307 B7R0.6 OC(=O)[14CH2][14CH2]C(O)=O Amb22337597 [1,0,1,0,0,0|1,0,1]=4 2308 B7R0.6 OC(=S)CCC(O)=O Amb24586272 [1,0,1,0,0,0|1,0,1]=4 2309 B7R0.6 OC(O)CCC(O)=O Amb25762802 [1,0,1,0,0,0|1,0,0]=3 2310 B7R0.6 O[13C](=O)CC[13C](O)=O Amb22056173 [1,0,1,0,0,0|1,0,1]=4 2311 B7R0.6 O[13C](=O)[13CH2][13CH2][13C](O)=O Amb22056172 [1,0,1,0,0,0|1,0,1]=4 2312 B7R0.6 O[14C](=O)CC[14C](O)=O Amb22352661 [1,0,1,0,0,0|1,0,1]=4 2313 B7R0.6 [13CH3][13C](=O)[13CH2]CC(O)=O Amb22056002 [1,0,1,0,0,0|0,0,2]=4 2314 B7R0.12 CCC(CCC)C=O Amb18641811 [1,0,1,0,0,0|2,0,0]=4 2315 B7R0.12 CCC(CCO)CO Amb25069540 [1,0,1,0,0,0|1,0,1]=4 2316 B7R0.12 CCCC(C=O)OC Amb25290248 [1,0,1,0,0,0|2,0,0]=4 2317 B7R0.12 CCCC(C=O)SC Amb25143339 [1,0,1,0,0,0|2,0,0]=4 2318 B7R0.12 CCCC(CO)NC Amb19009091 [1,0,1,0,0,0|1,0,1]=4 2319 B7R0.12 CCC[C@@H](C=O)SC Amb24481556 [1,0,1,0,0,0|2,0,0]=4 2320 B7R0.12 CCC[C@H](C=O)OC Amb24444373 [1,0,1,0,0,0|2,0,0]=4 2321 B7R0.12 CCN(CCO)C=O Amb24640141 [1,0,1,0,0,0|2,0,0]=4 2322 B7R0.12 CC[C@@H](CCC)C=O Amb25702349 [1,0,1,0,0,0|2,0,0]=4 2323 B7R0.12 CC[C@H](CCC)C=O Amb25689432 [1,0,1,0,0,0|2,0,0]=4 2324 B7R0.12 CN[C@H](CCO)CO Amb24402324 [1,0,1,0,0,0|0,0,1]=3 2325 B7R0.12 CO[C@@H](CCO)CO Amb24544061 [1,0,1,0,0,0|1,0,1]=4 2326 B7R0.12 CSC(CCCl)C=O Amb25350588 [1,0,1,0,0,0|2,0,0]=4 2327 B7R0.15 CC(O)=C(CO)NC Amb25210013 [1,0,1,0,0,0|1,0,1]=4 2328 B7R0.15 CCC(=CC)C(O)=O Amb25781700 [1,0,1,0,0,0|1,0,1]=4 2329 B7R0.15 CCC(C#C)C(O)=O Amb25777159 [1,0,1,0,0,0|1,0,1]=4 2330 B7R0.15 CCC(C(=O)N)NC Amb15701261 [1,0,1,0,0,0|1,0,0]=3 2331 B7R0.15 CCC(C(=O)N)OC Amb2027289 [1,0,1,0,0,0|2,0,0]=4 2332 B7R0.15 CCC(C(=O)O)C#N Amb17210513 [1,0,1,0,0,0|2,0,0]=4 2333 B7R0.15 CCC(C(=O)O)NC Amb10610245 [1,0,1,0,0,0|0,0,0]=2 2334 B7R0.15 CCC(C(=O)O)SC Amb17501348 [1,0,1,0,0,0|1,0,0]=3 2335 B7R0.15 CCC(CBr)C(O)=O Amb25173840 [1,0,1,0,0,0|2,0,0]=4 2336 B7R0.15 CCC(CC)C(=O)Br Amb25280424 [1,0,1,0,0,0|2,0,0]=4 2337 B7R0.15 CCC(CC)C([O-])=O Amb22585838 [1,0,1,0,0,0|1,0,1]=4 2338 B7R0.15 CCC(CN)C(O)=O Amb18987934 [1,0,1,0,0,0|2,0,0]=4 2339 B7R0.15 CCC(CN)C(O)=O Amb19514932 [1,0,1,0,0,0|2,0,0]=4 2340 B7R0.15 CCC(CO)C(C)=O Amb24709237 [1,0,1,0,0,0|2,0,0]=4 2341 B7R0.15 CCC(CO)C(O)=O Amb18641947 [1,0,1,0,0,0|1,0,0]=3 2342 B7R0.15 CCC(CS)C(O)=O Amb24435402 [1,0,1,0,0,0|1,1,0]=4 2343 B7R0.15 CCC(NN)C(O)=O Amb18641955 [1,0,1,0,0,0|1,0,0]=3 2344 B7R0.15 CCC(ON)C(O)=O Amb25697895 [1,0,1,0,0,0|2,0,0]=4 2345 B7R0.15 CC[C@@H](C(=O)O)CO Amb16232065 [1,0,1,0,0,0|1,0,0]=3 2346 B7R0.15 CC[C@@H](CO)C(O)=O Amb22745321 [1,0,1,0,0,0|1,0,0]=3 2347 B7R0.15 CC[C@@H](CS)C(O)=O Amb24429203 [1,0,1,0,0,0|1,1,0]=4 2348 B7R0.15 CC[C@@H](NN)C(O)=O Amb25746090 [1,0,1,0,0,0|1,0,0]=3 2349 B7R0.15 CC[C@H](C=C)C(O)=O Amb24524256 [1,0,1,0,0,0|1,0,1]=4 2350 B7R0.15 CC[C@H](CN)C(O)=O Amb25790771 [1,0,1,0,0,0|2,0,0]=4 2351 B7R0.15 CC[C@H](CS)C(O)=O Amb25131908 [1,0,1,0,0,0|1,1,0]=4 2352 B7R0.15 CC[C@H](NC)C(N)=O Amb25745002 [1,0,1,0,0,0|1,0,0]=3 2353 B7R0.15 CC[C@H](NC)C(O)=O Amb24505225 [1,0,1,0,0,0|0,0,0]=2 2354 B7R0.15 CC\C(=C/C)\C(O)=O Amb18641780 [1,0,1,0,0,0|1,0,1]=4 2355 B7R0.15 CNC(C=C)C(O)=O Amb25847721 [1,0,1,0,0,0|0,0,2]=4 2356 B7R0.15 CNC(CF)C(O)=O Amb25695388 [1,0,1,0,0,0|1,0,0]=3 2357 B7R0.15 CNC(CN)C(O)=O Amb23515020 [1,0,1,0,0,0|1,0,0]=3 2358 B7R0.15 CNC(CO)C(N)=O Amb18641957 [1,0,1,0,0,0|1,0,0]=3 2359 B7R0.15 CNC(SC)C(O)=O Amb25745282 [1,0,1,0,0,0|1,0,0]=3 2360 B7R0.15 CN[C@@H](CF)C(O)=O Amb25367323 [1,0,1,0,0,0|1,0,0]=3 2361 B7R0.15 CN[C@@H](CN)C(O)=O Amb24397074 [1,0,1,0,0,0|1,0,0]=3 2362 B7R0.15 CN[C@@H](CO)C(N)=O Amb25025437 [1,0,1,0,0,0|1,0,0]=3 2363 B7R0.15 CN[C@H](C(=O)O)CO Amb16183860 [1,0,1,0,0,0|0,0,0]=2 2364 B7R0.15 CN[C@H](CF)C(O)=O Amb25367324 [1,0,1,0,0,0|1,0,0]=3 2365 B7R0.15 COC(CCl)C(O)=O Amb18643355 [1,0,1,0,0,0|2,0,0]=4 2366 B7R0.15 COC(CN)C(O)=O Amb22059584 [1,0,1,0,0,0|2,0,0]=4 2367 B7R0.15 COC(CN)C(O)=O Amb24271092 [1,0,1,0,0,0|2,0,0]=4 2368 B7R0.15 COC(CO)C(O)=O Amb24482992 [1,0,1,0,0,0|1,0,0]=3 2369 B7R0.15 COC(CS)C(O)=O Amb25305649 [1,0,1,0,0,0|1,1,0]=4 2370 B7R0.15 CO[C@H](CO)C(N)=O Amb25755894 [1,0,1,0,0,0|2,0,0]=4 2371 B7R0.15 CSC(CCl)C(O)=O Amb24526774 [1,0,1,0,0,0|2,0,0]=4 2372 B7R0.15 CSC(CO)C(C)=O Amb25746293 [1,0,1,0,0,0|2,0,0]=4 2373 B7R0.15 CSC(CO)C(N)=O Amb25849170 [1,0,1,0,0,0|2,0,0]=4 2374 B7R0.15 C\C(\O)=C(\CO)/NC Amb25759923 [1,0,1,0,0,0|1,0,1]=4 2375 B7R0.15 C\C=C(\CO)/C(O)=O Amb25306747 [1,0,1,0,0,0|1,0,1]=4 2376 B7R0.15 NC[C@@H](CO)C(O)=O Amb22756739 [1,0,1,0,0,0|2,0,0]=4 2377 B7R0.15 NNC(CS)C(O)=O Amb24117863 [1,0,1,0,0,0|1,1,0]=4 2378 B7R0.15 NN[C@@H](CO)C(O)=O Amb24384871 [1,0,1,0,0,0|1,0,0]=3 2379 B7R0.15 OC(=O)C(CO)CO Amb18124271 [1,0,1,0,0,0|2,0,0]=4 2380 B7R0.15 OC(=O)C(CS)NS Amb25286626 [1,0,1,0,0,0|1,1,0]=4 2381 B7R0.15 OCC(NO)C(O)=O Amb24719766 [1,0,1,0,0,0|1,0,0]=3 2382 B7R0.15 [C-]#[N+]C(CC)C(O)=O Amb24432856 [1,0,1,0,0,0|0,0,2]=4 2383 B7R0.2 CC(C)CC(C)C=O Amb18641813 [1,0,1,0,0,0|2,0,0]=4 2384 B7R0.2 CC(C)CC(Cl)C=O Amb24482192 [1,0,1,0,0,0|2,0,0]=4 2385 B7R0.2 CC(C)CC(N)C=C Amb25743094 [1,0,1,0,0,0|2,0,0]=4 2386 B7R0.2 CC(C)CC(N)CO Amb18015118 [1,0,1,0,0,0|1,0,1]=4 2387 B7R0.2 CC(C)C[C@@H](N)C=O Amb25698367 [1,0,1,0,0,0|1,0,0]=3 2388 B7R0.2 CC(C)C[C@@H](N)CO Amb22746869 [1,0,1,0,0,0|1,0,1]=4 2389 B7R0.2 CC(C)C[C@@H](O)C=O Amb25104909 [1,0,1,0,0,0|2,0,0]=4 2390 B7R0.2 CC(C)C[C@H](Cl)C=O Amb24661911 [1,0,1,0,0,0|2,0,0]=4 2391 B7R0.2 CC(C)C[C@H](N)C=C Amb25745886 [1,0,1,0,0,0|2,0,0]=4 2392 B7R0.2 CC(C)C[C@H](N)CO Amb22504556 [1,0,1,0,0,0|1,0,1]=4 2393 B7R0.2 CC(O)CC(=O)C=O Amb24666713 [1,0,1,0,0,0|1,0,1]=4 2394 B7R0.2 CC(O)CC(C)CO Amb25262806 [1,0,1,0,0,0|1,0,1]=4 2395 B7R0.2 CC(O)CC(Cl)C=C Amb25731114 [1,0,1,0,0,0|2,0,0]=4 2396 B7R0.2 CC(O)CC(N)CI Amb25197705 [1,0,1,0,0,0|1,0,1]=4 2397 B7R0.2 CC(O)CC(N)CO Amb25828018 [1,0,1,0,0,0|0,0,1]=3 2398 B7R0.2 CC(O)CC(O)C=C Amb24397089 [1,0,1,0,0,0|2,0,0]=4 2399 B7R0.2 C[C@@H](C[C@H](C)O)C=C Amb25763927 [1,0,1,0,0,0|2,0,0]=4 2400 B7R0.2 C[C@@H](O)CC(O)C=C Amb25207943 [1,0,1,0,0,0|2,0,0]=4 2401 B7R0.2 C[C@@H](O)C[C@H](C)CO Amb24642405 [1,0,1,0,0,0|1,0,1]=4 2402 B7R0.2 C[C@@H](O)C[C@H](O)C=C Amb25381234 [1,0,1,0,0,0|2,0,0]=4 2403 B7R0.2 C[C@H](O)C[C@@H](C)CO Amb25845280 [1,0,1,0,0,0|1,0,1]=4 2404 B7R0.2 C[C@H](O)C[C@@H](N)CO Amb25105060 [1,0,1,0,0,0|0,0,1]=3 2405 B7R0.2 N[C@H](CC(O)=O)C=O Amb24643781 [1,0,1,0,0,0|1,0,1]=4 2406 B7R1.1 BrCC1CCCN1 Amb20618588 [2,0,0,0,0,0|1,0,1]=4 2407 B7R1.1 BrCC1CCCN1 Amb21962027 [2,0,0,0,0,0|1,0,1]=4 2408 B7R1.1 BrC[C@@H]1CCCN1 Amb22225950 [2,0,0,0,0,0|1,0,1]=4 2409 B7R1.1 BrC[C@@H]1CCCN1 Amb25809414 [2,0,0,0,0,0|1,0,1]=4 2410 B7R1.1 BrC[C@H]1CCCN1 Amb25355431 [2,0,0,0,0,0|1,0,1]=4 2411 B7R1.1 C#CC1CCCN1 Amb23598273 [2,0,0,0,0,0|1,0,1]=4 2412 B7R1.1 C#C[C@@H]1CCCN1 Amb24479840 [2,0,0,0,0,0|1,0,1]=4 2413 B7R1.1 C=CC1CCCC1 Amb17934190 [2,0,0,0,0,0|2,0,0]=4 2414 B7R1.1 C=CC1CCCN1 Amb23536605 [2,0,0,0,0,0|1,0,0]=3 2415 B7R1.1 C=CC1CCCN1 Amb24082686 [2,0,0,0,0,0|1,0,0]=3 2416 B7R1.1 C=CC1NCCO1 Amb25810198 [2,0,0,0,0,0|2,0,0]=4 2417 B7R1.1 C=C[C@H]1CCCN1 Amb24642810 [2,0,0,0,0,0|1,0,0]=3 2418 B7R1.1 CCC1CCCN1 Amb19515009 [2,0,0,0,0,0|1,0,1]=4 2419 B7R1.1 CC[C@@H]1CCCN1 Amb22225172 [2,0,0,0,0,0|1,0,1]=4 2420 B7R1.1 CC[C@@H]1CCCN1 Amb22747053 [2,0,0,0,0,0|1,0,1]=4 2421 B7R1.1 CC[C@H]1CCCN1 Amb25822206 [2,0,0,0,0,0|1,0,1]=4 2422 B7R1.1 COC1CCCN1 Amb22493883 [2,0,0,0,0,0|2,0,0]=4 2423 B7R1.1 ClCC1CCCN1 Amb1102532 [2,0,0,0,0,0|1,0,1]=4 2424 B7R1.1 ClCC1CCCN1 Amb22228750 [2,0,0,0,0,0|1,0,1]=4 2425 B7R1.1 ClC[C@@H]1CCCN1 Amb22226498 [2,0,0,0,0,0|1,0,1]=4 2426 B7R1.1 ClC[C@@H]1CCCN1 Amb22232498 [2,0,0,0,0,0|1,0,1]=4 2427 B7R1.1 FCC1CCCN1 Amb13953136 [2,0,0,0,0,0|1,0,1]=4 2428 B7R1.1 FC[C@@H]1CCCN1 Amb22405982 [2,0,0,0,0,0|1,0,1]=4 2429 B7R1.1 ICC1CCCN1 Amb21861199 [2,0,0,0,0,0|1,0,1]=4 2430 B7R1.1 ICC1CCCN1 Amb22228742 [2,0,0,0,0,0|1,0,1]=4 2431 B7R1.1 IC[C@@H]1CCCN1 Amb22226246 [2,0,0,0,0,0|1,0,1]=4 2432 B7R1.1 IC[C@@H]1CCCN1 Amb24612062 [2,0,0,0,0,0|1,0,1]=4 2433 B7R1.1 N#CC1CCCN1 Amb10069328 [2,0,0,0,0,0|1,0,1]=4 2434 B7R1.1 N#CC1CCCN1 Amb18198112 [2,0,0,0,0,0|1,0,1]=4 2435 B7R1.1 N#CC1CCCN1 Amb22405979 [2,0,0,0,0,0|1,0,1]=4 2436 B7R1.1 N#C[C@@H]1CCCN1 Amb17399785 [2,0,0,0,0,0|1,0,1]=4 2437 B7R1.1 N#C[C@H]1CCCN1 Amb22225409 [2,0,0,0,0,0|1,0,1]=4 2438 B7R1.1 NCC1CCCN1 Amb19516137 [2,0,0,0,0,0|1,0,1]=4 2439 B7R1.1 NCC1CCCN1 Amb22504269 [2,0,0,0,0,0|1,0,1]=4 2440 B7R1.1 NC[C@@H]1CCCN1 Amb10066983 [2,0,0,0,0,0|1,0,1]=4 2441 B7R1.1 NC[C@@H]1CCCN1 Amb22405933 [2,0,0,0,0,0|1,0,1]=4 2442 B7R1.1 NC[C@@H]1CCCN1 Amb22748399 [2,0,0,0,0,0|1,0,1]=4 2443 B7R1.1 NNC1CCCN1 Amb24525186 [2,0,0,0,0,0|2,0,0]=4 2444 B7R1.1 O=CC1=CCCC1 Amb17138358 [2,0,0,0,0,0|1,0,1]=4 2445 B7R1.1 O=CC1C=CCN1 Amb24617554 [2,0,0,0,0,0|0,0,2]=4 2446 B7R1.1 O=CC1CCCN1 Amb20618600 [2,0,0,0,0,0|0,0,0]=2 2447 B7R1.1 O=CC1CCCN1 Amb22231416 [2,0,0,0,0,0|0,0,0]=2 2448 B7R1.1 O=CC1CNCC1 Amb18197564 [2,0,0,0,0,0|2,0,0]=4 2449 B7R1.1 O=CC1CNCC1 Amb22231419 [2,0,0,0,0,0|2,0,0]=4 2450 B7R1.1 O=CC1COCO1 Amb25767896 [2,0,0,0,0,0|2,0,0]=4 2451 B7R1.1 O=CC1CSCC1 Amb18199140 [2,0,0,0,0,0|2,0,0]=4 2452 B7R1.1 O=CC1SCCS1 Amb25169582 [2,0,0,0,0,0|2,0,0]=4 2453 B7R1.1 O=CN1CCCO1 Amb24470900 [2,0,0,0,0,0|2,0,0]=4 2454 B7R1.1 O=C[C@@H]1CCCN1 Amb22226769 [2,0,0,0,0,0|0,0,0]=2 2455 B7R1.1 O=C[C@@H]1CCCO1 Amb25338193 [2,0,0,0,0,0|1,0,0]=3 2456 B7R1.1 O=C[C@@H]1COCC1 Amb25123223 [2,0,0,0,0,0|2,0,0]=4 2457 B7R1.1 O=C[C@H]1CCC=C1 Amb25116186 [2,0,0,0,0,0|1,0,1]=4 2458 B7R1.1 O=C[C@H]1CCCN1 Amb25684302 [2,0,0,0,0,0|0,0,0]=2 2459 B7R1.1 O=C[C@H]1CCCO1 Amb25216742 [2,0,0,0,0,0|1,0,0]=3 2460 B7R1.1 OCC1CCCN1 Amb2237182 [2,0,0,0,0,0|0,0,1]=3 2461 B7R1.1 OCC1CCCO1 Amb22731176 [2,0,0,0,0,0|1,0,1]=4 2462 B7R1.1 OCC1CCCS1 Amb19149313 [2,0,0,0,0,0|1,0,1]=4 2463 B7R1.1 OCC1NCCO1 Amb25230305 [2,0,0,0,0,0|1,0,1]=4 2464 B7R1.1 OCC1NCCS1 Amb25821150 [2,0,0,0,0,0|1,0,1]=4 2465 B7R1.1 OC[C@@H]1CCCN1 Amb22748614 [2,0,0,0,0,0|0,0,1]=3 2466 B7R1.1 OC[C@@H]1CCCO1 Amb10601543 [2,0,0,0,0,0|1,0,1]=4 2467 B7R1.1 OC[C@H]1CCCN1 Amb2235512 [2,0,0,0,0,0|0,0,1]=3 2468 B7R1.1 OC[C@H]1CCCO1 Amb16185506 [2,0,0,0,0,0|1,0,1]=4 2469 B7R1.1 O\C=C/1\CCCN1 Amb24515856 [2,0,0,0,0,0|0,0,1]=3 2470 B7R1.1 O\N=C\1/CCCN1 Amb19769769 [2,0,0,0,0,0|1,0,1]=4 2471 B7R1.1 SC[C@@H]1CCCN1 Amb24120350 [2,0,0,0,0,0|0,1,1]=4 2472 B7R1.2 C=C1CC(O)CC1 Amb25246529 [2,0,0,0,0,0|1,0,1]=4 2473 B7R1.2 CC1CC(=O)NC1 Amb10608004 [2,0,0,0,0,0|1,0,1]=4 2474 B7R1.2 CC1CC(O)CN1 Amb20668139 [2,0,0,0,0,0|0,0,1]=3 2475 B7R1.2 CC1CC(O)CS1 Amb24660406 [2,0,0,0,0,0|1,0,1]=4 2476 B7R1.2 CC1CNC(C)C1 Amb19335336 [2,0,0,0,0,0|1,0,1]=4 2477 B7R1.2 CC1NCC(C1)C Amb17593077 [2,0,0,0,0,0|1,0,1]=4 2478 B7R1.2 C[C@@H]1CC(O)OC1 Amb25795468 [2,0,0,0,0,0|2,0,0]=4 2479 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [2,0,0,0,0,0|1,0,1]=4 2480 B7R1.2 C[C@@H]1CN[C@@H](C)C1 Amb25026729 [2,0,0,0,0,0|1,0,1]=4 2481 B7R1.2 C[C@@H]1CN[C@H](C)C1 Amb18195964 [2,0,0,0,0,0|1,0,1]=4 2482 B7R1.2 C[C@@H]1C[C@@H](F)CN1 Amb22886338 [2,0,0,0,0,0|1,0,1]=4 2483 B7R1.2 C[C@@H]1C[C@@H](F)CN1 Amb24745852 [2,0,0,0,0,0|1,0,1]=4 2484 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22745222 [2,0,0,0,0,0|0,0,1]=3 2485 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22746400 [2,0,0,0,0,0|0,0,1]=3 2486 B7R1.2 C[C@@H]1C[C@H](F)CN1 Amb22886231 [2,0,0,0,0,0|1,0,1]=4 2487 B7R1.2 C[C@@H]1C[C@H](O)CC1 Amb25241408 [2,0,0,0,0,0|1,0,1]=4 2488 B7R1.2 C[C@@H]1C[C@H](O)CN1 Amb22886268 [2,0,0,0,0,0|0,0,1]=3 2489 B7R1.2 C[C@H]1C[C@@H](O)CN1 Amb24560197 [2,0,0,0,0,0|0,0,1]=3 2490 B7R1.2 C[C@H]1C[C@H](N)CN1 Amb24562233 [2,0,0,0,0,0|1,0,1]=4 2491 B7R1.2 C[C@H]1C[C@H](O)CC1 Amb25241604 [2,0,0,0,0,0|1,0,1]=4 2492 B7R1.2 C[C@H]1C[C@H](O)CN1 Amb24523959 [2,0,0,0,0,0|0,0,1]=3 2493 B7R1.2 C[C@H]1C[C@H](O)CO1 Amb25212245 [2,0,0,0,0,0|1,0,1]=4 2494 B7R1.2 NC1CC(O)CC1 Amb18561405 [2,0,0,0,0,0|2,0,0]=4 2495 B7R1.2 NC1CC(O)CC1 Amb19958405 [2,0,0,0,0,0|2,0,0]=4 2496 B7R1.2 NC1CNC(=O)C1 Amb17760661 [2,0,0,0,0,0|1,0,1]=4 2497 B7R1.2 N[C@@H]1CC[C@@H](C1)O Amb10066973 [2,0,0,0,0,0|2,0,0]=4 2498 B7R1.2 N[C@@H]1CC[C@H](C1)O Amb10066961 [2,0,0,0,0,0|2,0,0]=4 2499 B7R1.2 N[C@@H]1CC[C@H](C1)O Amb16233749 [2,0,0,0,0,0|2,0,0]=4 2500 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [2,0,0,0,0,0|1,0,1]=4 2501 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [2,0,0,0,0,0|1,0,1]=4 2502 B7R1.2 N[C@@H]1C[C@@H](O)CC1 Amb22386861 [2,0,0,0,0,0|2,0,0]=4 2503 B7R1.2 N[C@@H]1C[C@@H](O)CC1 Amb22746957 [2,0,0,0,0,0|2,0,0]=4 2504 B7R1.2 N[C@@H]1C[C@H](O)CC1 Amb22274622 [2,0,0,0,0,0|2,0,0]=4 2505 B7R1.2 N[C@H]1CC[C@@H](C1)O Amb10066972 [2,0,0,0,0,0|2,0,0]=4 2506 B7R1.2 N[C@H]1CC[C@H](C1)O Amb10066971 [2,0,0,0,0,0|2,0,0]=4 2507 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [2,0,0,0,0,0|1,0,1]=4 2508 B7R1.2 N[C@H]1C[C@@H](O)CC1 Amb22406236 [2,0,0,0,0,0|2,0,0]=4 2509 B7R1.2 O=C1CC(S)CN1 Amb25685875 [2,0,0,0,0,0|0,1,1]=4 2510 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [2,0,0,0,0,0|0,1,1]=4 2511 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [2,0,0,0,0,0|0,1,1]=4 2512 B7R1.2 OC1CC(=O)CC1 Amb22057378 [2,0,0,0,0,0|1,0,1]=4 2513 B7R1.2 OC1CC(Br)CC1 Amb25275238 [2,0,0,0,0,0|2,0,0]=4 2514 B7R1.2 OC1CC(S)CC1 Amb25051687 [2,0,0,0,0,0|1,1,0]=4 2515 B7R1.2 OC1CNC(=O)C1 Amb19958404 [2,0,0,0,0,0|0,0,1]=3 2516 B7R1.2 OC1CSS(=O)C1 Amb25169570 [2,0,0,0,0,0|2,0,0]=4 2517 B7R1.2 O[C@@H]1CC(=O)NC1 Amb15691722 [2,0,0,0,0,0|0,0,1]=3 2518 B7R1.2 O[C@@H]1CC(O)C=C1 Amb25136242 [2,0,0,0,0,0|1,0,1]=4 2519 B7R1.2 O[C@@H]1CN(O)CC1 Amb25025106 [2,0,0,0,0,0|2,0,0]=4 2520 B7R1.2 O[C@H]1CSS(=O)C1 Amb25317551 [2,0,0,0,0,0|2,0,0]=4 2521 B7R1.2 O[C@H]1C[C@H](O)CC1 Amb24519755 [2,0,0,0,0,0|1,0,0]=3 2522 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [2,0,0,0,0,0|1,0,1]=4 2523 B9R0.3 C[C@H](CCCO)P(O)(O)=O Amb24447856 [0,1,1,0,0,0|2,0,0]=4 2524 B9R0.6 CC(C(C)=O)N(C)CCO Amb24475705 [0,1,1,0,0,0|1,0,0]=3 2525 B9R0.6 CC(C(N)=O)N(C)CCN Amb19013777 [0,1,1,0,0,0|2,0,0]=4 2526 B9R0.6 CC(C(N)=S)N(C)CCO Amb18798155 [0,1,1,0,0,0|1,1,0]=4 2527 B9R0.6 CC(C(N)CCC)C(O)=O Amb24763852 [0,1,1,0,0,0|2,0,0]=4 2528 B9R0.6 CC(C(O)=O)N(C)CC#C Amb18993822 [0,1,1,0,0,0|1,0,1]=4 2529 B9R0.6 CC(C(O)=O)N(C)CC#N Amb18983872 [0,1,1,0,0,0|1,0,1]=4 2530 B9R0.6 CC(C(O)=O)N(C)CC=C Amb18313114 [0,1,1,0,0,0|1,0,1]=4 2531 B9R0.6 CC(C(O)=O)N(C)CCN Amb19028451 [0,1,1,0,0,0|1,0,0]=3 2532 B9R0.6 CC(C(O)=O)S(=O)CCF Amb24638591 [0,1,1,0,0,0|2,0,0]=4 2533 B9R0.6 CC(C(O)CCC)C(O)=O Amb18310700 [0,1,1,0,0,0|2,0,0]=4 2534 B9R0.6 CC(CCO)C(N)C(O)=O Amb25054791 [0,1,1,0,0,0|2,0,0]=4 2535 B9R0.6 CC(CCO)C(O)C(O)=O Amb24392760 [0,1,1,0,0,0|2,0,0]=4 2536 B9R0.6 CC(CCO)[C@H](N)C(O)=O Amb24744497 [0,1,1,0,0,0|2,0,0]=4 2537 B9R0.6 CC([C@H](N)CCC)C(O)=O Amb25238448 [0,1,1,0,0,0|2,0,0]=4 2538 B9R0.6 CCCN(C)C(C)C(N)=O Amb25663070 [0,1,1,0,0,0|2,0,0]=4 2539 B9R0.6 CCCN(C)[C@@H](C)C(O)=O Amb25834811 [0,1,1,0,0,0|1,0,0]=3 2540 B9R0.6 CCCN(C)[C@H](C)C(N)=O Amb25686765 [0,1,1,0,0,0|2,0,0]=4 2541 B9R0.6 CCCS(=O)C(C)C(O)=O Amb18304634 [0,1,1,0,0,0|2,0,0]=4 2542 B9R0.6 CN(C(C(=O)Cl)C)CCO Amb17142906 [0,1,1,0,0,0|1,0,0]=3 2543 B9R0.6 CN(C(C(=O)N)C)CCO Amb17142867 [0,1,1,0,0,0|1,0,0]=3 2544 B9R0.6 CN(CCO)C(=O)C(O)=O Amb18970475 [0,1,1,0,0,0|1,0,1]=4 2545 B9R0.6 C[C@@H](CCO)[C@H](N)C(O)=O Amb25709206 [0,1,1,0,0,0|2,0,0]=4 2546 B9R0.6 C[C@@H]([C@@H](O)CCC)C(O)=O Amb24445556 [0,1,1,0,0,0|2,0,0]=4 2547 B9R0.6 C[C@@H]([C@H](O)CCC)C(O)=O Amb24529277 [0,1,1,0,0,0|2,0,0]=4 2548 B9R0.6 C[C@H](C(O)CCC)C(O)=O Amb25096562 [0,1,1,0,0,0|2,0,0]=4 2549 B9R0.6 C[C@H](CCO)[C@H](N)C(O)=O Amb25111969 [0,1,1,0,0,0|2,0,0]=4 2550 B9R0.6 C[C@H](CCO)[C@H](O)C(O)=O Amb25122108 [0,1,1,0,0,0|2,0,0]=4 2551 B9R0.6 C[C@H]([C@@H](O)CCC)C(O)=O Amb25789993 [0,1,1,0,0,0|2,0,0]=4 2552 B9R0.6 NC(C(S)CCO)C(O)=O Amb24724703 [0,1,1,0,0,0|2,0,0]=4 2553 B9R0.6 N[C@@H](C(S)CCO)C(O)=O Amb25320812 [0,1,1,0,0,0|2,0,0]=4 2554 B9R0.6 OCCC(O)C(O)C(O)=O Amb24482452 [0,1,1,0,0,0|2,0,0]=4 2555 B9R0.7 CC(C)CCC(C)C(O)=O Amb19033547 [0,1,1,0,0,0|2,0,0]=4 2556 B9R0.7 CC(C)CNC(C)C(C)=O Amb24480697 [0,1,1,0,0,0|2,0,0]=4 2557 B9R0.7 CC(C)CN[C@H](C)C(N)=O Amb25052017 [0,1,1,0,0,0|2,0,0]=4 2558 B9R0.7 CC(C)CN[C@H](C)C(O)=O Amb25300819 [0,1,1,0,0,0|1,0,0]=3 2559 B9R0.7 CC(C)NNC(C)C(O)=O Amb24070154 [0,1,1,0,0,0|2,0,0]=4 2560 B9R0.7 CC(CCC(C)Br)C(O)=O Amb24452260 [0,1,1,0,0,0|2,0,0]=4 2561 B9R0.7 CC(NCC(=C)Br)C(O)=O Amb18303282 [0,1,1,0,0,0|1,0,1]=4 2562 B9R0.7 CC(NCC(C)N)C(O)=O Amb24599775 [0,1,1,0,0,0|1,0,0]=3 2563 B9R0.7 CC(NCC(F)F)C(N)=O Amb18791495 [0,1,1,0,0,0|2,0,0]=4 2564 B9R0.7 CC(NCC(F)F)C(O)=O Amb18789168 [0,1,1,0,0,0|1,0,0]=3 2565 B9R0.7 CC(NC[C@@H](C)O)C(N)=O Amb25702192 [0,1,1,0,0,0|1,0,0]=3 2566 B9R0.7 CC(O)CCC(C)C(O)=O Amb25848509 [0,1,1,0,0,0|1,0,0]=3 2567 B9R0.7 CC(O)CNC(C)C(O)=O Amb18523859 [0,1,1,0,0,0|0,0,0]=2 2568 B9R0.7 CC(O)CN[C@@H](C)C(O)=O Amb25129862 [0,1,1,0,0,0|0,0,0]=2 2569 B9R0.7 CC(O)COC(C)C(O)=O Amb25146942 [0,1,1,0,0,0|1,0,0]=3 2570 B9R0.7 CC(O)CSC(C)C(O)=O Amb18303285 [0,1,1,0,0,0|1,0,0]=3 2571 B9R0.7 CC(OCC(C)F)C(O)=O Amb25350495 [0,1,1,0,0,0|2,0,0]=4 2572 B9R0.7 CC(OCC(O)=O)C(O)=O Amb25292152 [0,1,1,0,0,0|1,0,1]=4 2573 B9R0.7 CC(SCC(C)N)C(O)=O Amb25224815 [0,1,1,0,0,0|2,0,0]=4 2574 B9R0.7 CC(SCC(F)F)C(O)=O Amb18793589 [0,1,1,0,0,0|2,0,0]=4 2575 B9R0.7 C[C@@H](CCC(O)=O)C(O)=O Amb22799543 [0,1,1,0,0,0|1,0,1]=4 2576 B9R0.7 C[C@@H](NCC(=C)Br)C(O)=O Amb24441867 [0,1,1,0,0,0|1,0,1]=4 2577 B9R0.7 C[C@@H](NCC(=C)Cl)C(O)=O Amb25085078 [0,1,1,0,0,0|1,0,1]=4 2578 B9R0.7 C[C@@H](NCC(N)=O)C(O)=O Amb25849548 [0,1,1,0,0,0|0,0,2]=4 2579 B9R0.7 C[C@@H](NCC(O)=O)C(O)=O Amb22748947 [0,1,1,0,0,0|0,0,1]=3 2580 B9R0.7 C[C@@H](OCC(F)F)C(O)=O Amb25060997 [0,1,1,0,0,0|2,0,0]=4 2581 B9R0.7 C[C@@H](SCC(O)=O)C(O)=O Amb24482305 [0,1,1,0,0,0|1,0,1]=4 2582 B9R0.7 C[C@H](CCC(O)=O)C(O)=O Amb22225175 [0,1,1,0,0,0|1,0,1]=4 2583 B9R0.7 C[C@H](NCC(=C)Cl)C(O)=O Amb25135747 [0,1,1,0,0,0|1,0,1]=4 2584 B9R0.7 C[C@H](NCC(F)F)C(O)=O Amb25234396 [0,1,1,0,0,0|1,0,0]=3 2585 B9R0.7 C[C@H](NCC(N)=O)C(O)=O Amb24753576 [0,1,1,0,0,0|0,0,2]=4 2586 B9R0.7 C[C@H](NCC(O)=O)C(O)=O Amb25133540 [0,1,1,0,0,0|0,0,1]=3 2587 B9R0.7 C[C@H](O)CC[C@@H](C)C(O)=O Amb25378744 [0,1,1,0,0,0|1,0,0]=3 2588 B9R0.7 C[C@H](O)CNC(=O)C(O)=O Amb25853206 [0,1,1,0,0,0|1,0,1]=4 2589 B9R0.7 C[C@H](OCC(F)F)C(O)=O Amb25355140 [0,1,1,0,0,0|2,0,0]=4 2590 B9R0.7 C[C@H](OCC(O)=O)C(O)=O Amb24393806 [0,1,1,0,0,0|1,0,1]=4 2591 B9R0.7 C\C(=C\CC(C)O)\C(O)=O Amb25368118 [0,1,1,0,0,0|1,0,1]=4 2592 B9R0.7 OC(=O)CSC(C(=O)O)C Amb2431034 [0,1,1,0,0,0|1,0,1]=4 2593 B9R0.8 CC(CCCN)C(=O)NO Amb25230525 [0,1,1,0,0,0|2,0,0]=4 2594 B9R0.8 CC(NCCF)C(N)=NO Amb24438164 [0,1,1,0,0,0|2,0,0]=4 2595 B9R0.8 CC(NCCO)C(C)CO Amb25147744 [0,1,1,0,0,0|1,0,1]=4 2596 B9R0.8 CC(OCCO)C(N)=NO Amb25736409 [0,1,1,0,0,0|2,0,0]=4 2597 B9R0.8 CC(SCCO)C(N)=NO Amb18798354 [0,1,1,0,0,0|2,0,0]=4 2598 B9R0.8 CCC(=O)C(C)SCCO Amb25052539 [0,1,1,0,0,0|2,0,0]=4 2599 B9R0.8 CCCNC(C)C(=O)OC Amb25350065 [0,1,1,0,0,0|1,0,0]=3 2600 B9R0.8 CCCSC(C)C(=O)OC Amb18798146 [0,1,1,0,0,0|2,0,0]=4 2601 B9R0.8 CNC(=O)C(C)NCCN Amb24478040 [0,1,1,0,0,0|2,0,0]=4 2602 B9R0.8 CNC(=O)C(C)NCCS Amb24532094 [0,1,1,0,0,0|1,1,0]=4 2603 B9R0.8 COC(=O)C(=O)NCCO Amb10601810 [0,1,1,0,0,0|1,0,1]=4 2604 B9R0.8 COC(=O)C(C)CCCBr Amb25249687 [0,1,1,0,0,0|2,0,0]=4 2605 B9R0.8 COC(=O)C(C)CCCO Amb24413656 [0,1,1,0,0,0|1,0,0]=3 2606 B9R0.8 COC(=O)C(C)NCC#C Amb18315370 [0,1,1,0,0,0|1,0,1]=4 2607 B9R0.8 COC(=O)C(C)NCC#N Amb18307572 [0,1,1,0,0,0|1,0,1]=4 2608 B9R0.8 COC(=O)C(C)NCC=C Amb24411113 [0,1,1,0,0,0|1,0,1]=4 2609 B9R0.8 COC(=O)C(C)NCCBr Amb25802430 [0,1,1,0,0,0|1,0,0]=3 2610 B9R0.8 COC(=O)C(C)NCCF Amb25032140 [0,1,1,0,0,0|1,0,0]=3 2611 B9R0.8 COC(=O)C(C)OCCN Amb25135790 [0,1,1,0,0,0|2,0,0]=4 2612 B9R0.8 COC(=O)C(C)SCCF Amb25711934 [0,1,1,0,0,0|2,0,0]=4 2613 B9R0.8 COC(=O)C(C)SCCN Amb18798233 [0,1,1,0,0,0|2,0,0]=4 2614 B9R0.8 COC(=O)C(C)SCCO Amb18183513 [0,1,1,0,0,0|1,0,0]=3 2615 B9R0.8 COC(=O)C(N)CCCO Amb18644325 [0,1,1,0,0,0|2,0,0]=4 2616 B9R0.8 COC(=O)C(O)CCCO Amb24404795 [0,1,1,0,0,0|2,0,0]=4 2617 B9R0.8 COC(=O)N(C)CCCO Amb25261910 [0,1,1,0,0,0|2,0,0]=4 2618 B9R0.8 COC(=O)[C@@H](C)CCCBr Amb24477377 [0,1,1,0,0,0|2,0,0]=4 2619 B9R0.8 COC(=O)[C@@H](C)NCOC Amb25333636 [0,1,1,0,0,0|2,0,0]=4 2620 B9R0.8 COC(=O)[C@H](C)NCC#C Amb25700538 [0,1,1,0,0,0|1,0,1]=4 2621 B9R0.8 COC(=O)[C@H](C)NCC=C Amb24432295 [0,1,1,0,0,0|1,0,1]=4 2622 B9R0.8 COC(=O)[C@H](C)NCCCl Amb24505287 [0,1,1,0,0,0|1,0,0]=3 2623 B9R0.8 COC(=O)[C@H](C)NCOC Amb24721830 [0,1,1,0,0,0|2,0,0]=4 2624 B9R0.8 COC(=O)[C@H](C)OCCC Amb25713201 [0,1,1,0,0,0|2,0,0]=4 2625 B9R0.8 OCCCC(O)C(=O)CO Amb24685446 [0,1,1,0,0,0|2,0,0]=4 2626 B9R0.8 OCCC[C@H](O)C(=O)CO Amb25687237 [0,1,1,0,0,0|2,0,0]=4 2627 B9R0.13 C#CCNC(CN)C(O)=O Amb25770370 [0,1,1,0,0,0|1,0,1]=4 2628 B9R0.13 C=CC(NCCO)C(O)=O Amb25796601 [0,1,1,0,0,0|0,0,1]=3 2629 B9R0.13 C=CC(SCCO)C(O)=O Amb24407705 [0,1,1,0,0,0|1,0,1]=4 2630 B9R0.13 C=CCNC(CN)C(O)=O Amb24482116 [0,1,1,0,0,0|1,0,1]=4 2631 B9R0.13 C=CCNC(CO)C(O)=O Amb25702701 [0,1,1,0,0,0|1,0,1]=4 2632 B9R0.13 C=CCN[C@H](CS)C(O)=O Amb24710832 [0,1,1,0,0,0|1,0,1]=4 2633 B9R0.13 CCC(CCCBr)C(O)=O Amb18131058 [0,1,1,0,0,0|2,0,0]=4 2634 B9R0.13 CCC(CCCCl)C(O)=O Amb24480523 [0,1,1,0,0,0|2,0,0]=4 2635 B9R0.13 CCC(CCCF)C(O)=O Amb25104466 [0,1,1,0,0,0|2,0,0]=4 2636 B9R0.13 CCC(CCCN)C(O)=O Amb25703115 [0,1,1,0,0,0|2,0,0]=4 2637 B9R0.13 CCC(NCC#C)C(O)=O Amb19022035 [0,1,1,0,0,0|1,0,1]=4 2638 B9R0.13 CCC(NCC=C)C(O)=O Amb24122853 [0,1,1,0,0,0|1,0,1]=4 2639 B9R0.13 CCC(NCCF)C(N)=O Amb25772480 [0,1,1,0,0,0|2,0,0]=4 2640 B9R0.13 CCC(NCCN)C(N)=O Amb24430008 [0,1,1,0,0,0|2,0,0]=4 2641 B9R0.13 CCC(NCCO)C(N)=O Amb24688074 [0,1,1,0,0,0|1,0,0]=3 2642 B9R0.13 CCC(NCCO)C(O)=O Amb18115226 [0,1,1,0,0,0|0,0,0]=2 2643 B9R0.13 CCC(OCCN)C(O)=O Amb18111197 [0,1,1,0,0,0|2,0,0]=4 2644 B9R0.13 CCC(OCCO)C(O)=O Amb23580631 [0,1,1,0,0,0|1,0,0]=3 2645 B9R0.13 CCC(SCCN)C(O)=O Amb18788222 [0,1,1,0,0,0|2,0,0]=4 2646 B9R0.13 CCC(SCCO)C(N)=O Amb18788232 [0,1,1,0,0,0|2,0,0]=4 2647 B9R0.13 CCCCC(CC)C(O)=O Amb22232366 [0,1,1,0,0,0|2,0,0]=4 2648 B9R0.13 CCCCC(CC)C(O)=O Amb22334224 [0,1,1,0,0,0|2,0,0]=4 2649 B9R0.13 CCCCC(CC)C(O)=O Amb22337839 [0,1,1,0,0,0|2,0,0]=4 2650 B9R0.13 CCCCC(CC)C(O)=O Amb22351159 [0,1,1,0,0,0|2,0,0]=4 2651 B9R0.13 CCCCC(CC)C(O)=O Amb22351729 [0,1,1,0,0,0|2,0,0]=4 2652 B9R0.13 CCCCC(CC)C(O)=O Amb22351933 [0,1,1,0,0,0|2,0,0]=4 2653 B9R0.13 CCCCC(CC)C(O)=O Amb22363218 [0,1,1,0,0,0|2,0,0]=4 2654 B9R0.13 CCCCC(NC)C(O)=O Amb24116642 [0,1,1,0,0,0|2,0,0]=4 2655 B9R0.13 CCCCC(SC)C(O)=O Amb24478447 [0,1,1,0,0,0|2,0,0]=4 2656 B9R0.13 CCCC[C@@H](C(=O)O)CO Amb16232529 [0,1,1,0,0,0|2,0,0]=4 2657 B9R0.13 CCCC[C@@H](CO)C(O)=O Amb22745320 [0,1,1,0,0,0|2,0,0]=4 2658 B9R0.13 CCCC[C@@H](NC)C(O)=O Amb22799980 [0,1,1,0,0,0|2,0,0]=4 2659 B9R0.13 CCCC[C@H](CC)C(O)=O Amb24671282 [0,1,1,0,0,0|2,0,0]=4 2660 B9R0.13 CCCC[C@H](CN)C(O)=O Amb25307811 [0,1,1,0,0,0|2,0,0]=4 2661 B9R0.13 CCCNC(CO)C(O)=O Amb18637569 [0,1,1,0,0,0|1,0,0]=3 2662 B9R0.13 CCCN[C@@H](CO)C(O)=O Amb24351588 [0,1,1,0,0,0|1,0,0]=3 2663 B9R0.13 CCCOC(CN)C(O)=O Amb25827128 [0,1,1,0,0,0|2,0,0]=4 2664 B9R0.13 CCONC(CN)C(O)=O Amb24481161 [0,1,1,0,0,0|2,0,0]=4 2665 B9R0.13 CCSNC(CS)C(O)=O Amb24740319 [0,1,1,0,0,0|2,0,0]=4 2666 B9R0.13 CNC(CCCN)C(O)=O Amb18644280 [0,1,1,0,0,0|2,0,0]=4 2667 B9R0.13 CN[C@@H](CCCN)C(O)=O Amb24584680 [0,1,1,0,0,0|2,0,0]=4 2668 B9R0.13 COC(CCCO)C(C)=O Amb25059738 [0,1,1,0,0,0|2,0,0]=4 2669 B9R0.13 CSC(CCNO)C(O)=O Amb24390302 [0,1,1,0,0,0|2,0,0]=4 2670 B9R0.13 N#CCNC(CS)C(O)=O Amb24477457 [0,1,1,0,0,0|1,0,1]=4 2671 B9R0.13 NCCCC(CN)C(O)=O Amb25072736 [0,1,1,0,0,0|2,0,0]=4 2672 B9R0.13 NCCNC(CS)C(O)=O Amb24482466 [0,1,1,0,0,0|1,0,0]=3 2673 B9R0.13 NCCN[C@H](CS)C(O)=O Amb24334738 [0,1,1,0,0,0|1,0,0]=3 2674 B9R0.13 OC(=O)C(CS)NCCCl Amb25695120 [0,1,1,0,0,0|1,0,0]=3 2675 B9R0.42 CC(C(=O)O)NC(=O)CC Amb1116933 [0,1,1,0,0,0|1,0,1]=4 2676 B9R0.42 CC(CC(N)C(O)=O)CO Amb25147300 [0,1,1,0,0,0|2,0,0]=4 2677 B9R0.42 CC(CC(O)CN)C(O)=O Amb25375725 [0,1,1,0,0,0|2,0,0]=4 2678 B9R0.42 CC(CN)CC(C)C(O)=O Amb24717285 [0,1,1,0,0,0|2,0,0]=4 2679 B9R0.42 CC(CO)NC(=O)C(O)=O Amb25106609 [0,1,1,0,0,0|1,0,1]=4 2680 B9R0.42 CC(NC(C)C#C)C(O)=O Amb25088637 [0,1,1,0,0,0|1,0,1]=4 2681 B9R0.42 CC(NC(C)C=C)C(O)=O Amb18310595 [0,1,1,0,0,0|1,0,1]=4 2682 B9R0.42 CC(NC(C)CF)C(N)=O Amb25333137 [0,1,1,0,0,0|2,0,0]=4 2683 B9R0.42 CC(NC(C)CO)C(O)=O Amb18315378 [0,1,1,0,0,0|0,0,0]=2 2684 B9R0.42 CC(O)C(C)NC(C)CO Amb24400821 [0,1,1,0,0,0|1,0,1]=4 2685 B9R0.42 CC(OC(=O)CO)C(O)=O Amb24480687 [0,1,1,0,0,0|1,0,1]=4 2686 B9R0.42 CC(OC(C)CN)C(O)=O Amb18110542 [0,1,1,0,0,0|2,0,0]=4 2687 B9R0.42 CC(SC(C)CN)C(O)=O Amb25096975 [0,1,1,0,0,0|2,0,0]=4 2688 B9R0.42 CC(SC(C)CO)C(O)=O Amb24687156 [0,1,1,0,0,0|1,0,0]=3 2689 B9R0.42 CCC(=O)N[C@@H](C)C(O)=O Amb22901053 [0,1,1,0,0,0|1,0,1]=4 2690 B9R0.42 CCC(C)CC(C)C(O)=O Amb22228338 [0,1,1,0,0,0|2,0,0]=4 2691 B9R0.42 CCC(C)N[C@@H](C)C(O)=O Amb25691180 [0,1,1,0,0,0|1,0,0]=3 2692 B9R0.42 CCC(C)N[C@H](C)C(O)=O Amb24375136 [0,1,1,0,0,0|1,0,0]=3 2693 B9R0.42 CCC(C)OC(C)C(O)=O Amb25357779 [0,1,1,0,0,0|2,0,0]=4 2694 B9R0.42 CCS(=O)N[C@H](C)C(O)=O Amb24572538 [0,1,1,0,0,0|2,0,0]=4 2695 B9R0.42 CC[C@@H](C)C[C@H](C)C(O)=O Amb24426532 [0,1,1,0,0,0|2,0,0]=4 2696 B9R0.42 CC[C@H](C)C[C@@H](C)C(O)=O Amb24480420 [0,1,1,0,0,0|2,0,0]=4 2697 B9R0.42 C[C@@H](C[C@H](O)CN)C(O)=O Amb24447195 [0,1,1,0,0,0|2,0,0]=4 2698 B9R0.42 C[C@@H](NC(=O)CN)C(O)=O Amb22746707 [0,1,1,0,0,0|1,0,1]=4 2699 B9R0.42 C[C@@H](NC(C)CN)C(O)=O Amb25291159 [0,1,1,0,0,0|1,0,0]=3 2700 B9R0.42 C[C@@H](N[C@@H](C)C#N)C(O)=O Amb24479136 [0,1,1,0,0,0|1,0,1]=4 2701 B9R0.42 C[C@H](C(=O)O)NC(=O)CCl Amb10842258 [0,1,1,0,0,0|1,0,1]=4 2702 B9R0.42 C[C@H](C[C@H](C)CO)C(O)=O Amb24480419 [0,1,1,0,0,0|1,0,0]=3 2703 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CO Amb25378739 [0,1,1,0,0,0|2,0,0]=4 2704 B9R0.42 C[C@H](NC(=O)CBr)C(O)=O Amb25804070 [0,1,1,0,0,0|1,0,1]=4 2705 B9R0.42 C[C@H](OC(=O)CO)C(O)=O Amb24469338 [0,1,1,0,0,0|1,0,1]=4 2706 B9R0.42 NC(CC(O)CO)C(O)=O Amb18644388 [0,1,1,0,0,0|2,0,0]=4 2707 B9R0.42 NC(CC(O)CO)C(O)=O Amb24117285 [0,1,1,0,0,0|2,0,0]=4 2708 B9R0.42 N[C@@H](CC(F)CO)C(O)=O Amb24079182 [0,1,1,0,0,0|2,0,0]=4 2709 B9R0.42 N[C@@H](C[C@@H](O)CO)C(O)=O Amb24680903 [0,1,1,0,0,0|2,0,0]=4 2710 B9R0.42 OCC(O)CC(O)C(O)=O Amb18644410 [0,1,1,0,0,0|2,0,0]=4 2711 B9R0.42 OC[C@@H](O)C[C@@H](O)C(O)=O Amb25227512 [0,1,1,0,0,0|2,0,0]=4 2712 B9R0.42 OC[C@@H](O)C[C@H](O)C(O)=O Amb25336564 [0,1,1,0,0,0|2,0,0]=4 2713 B9R0.42 OC[C@H](O)C[C@@H](O)C(O)=O Amb25774509 [0,1,1,0,0,0|2,0,0]=4 2714 B9R0.47 C=C(CNCCO)C(O)=O Amb25091316 [0,1,1,0,0,0|0,0,2]=4 2715 B9R0.47 CC(C(=O)O)SCCC#N Amb17502364 [0,1,1,0,0,0|2,0,0]=4 2716 B9R0.47 CC(C(=O)O)SCCCN Amb17500677 [0,1,1,0,0,0|2,0,0]=4 2717 B9R0.47 CC(CCCC#C)C(O)=O Amb25824201 [0,1,1,0,0,0|2,0,0]=4 2718 B9R0.47 CC(CCCC=C)C(O)=O Amb18643893 [0,1,1,0,0,0|2,0,0]=4 2719 B9R0.47 CC(CCCCF)C(O)=O Amb24370978 [0,1,1,0,0,0|2,0,0]=4 2720 B9R0.47 CC(CCCCN)C(O)=O Amb18644200 [0,1,1,0,0,0|2,0,0]=4 2721 B9R0.47 CC(CNCCF)C(N)=O Amb24365709 [0,1,1,0,0,0|2,0,0]=4 2722 B9R0.47 CC(CNCCF)C(O)=O Amb25061129 [0,1,1,0,0,0|1,0,0]=3 2723 B9R0.47 CC(CSCCF)C(O)=O Amb25696347 [0,1,1,0,0,0|2,0,0]=4 2724 B9R0.47 CC(CSCCN)C(O)=O Amb18788221 [0,1,1,0,0,0|2,0,0]=4 2725 B9R0.47 CC(NCCC#C)C(N)=O Amb25739912 [0,1,1,0,0,0|2,0,0]=4 2726 B9R0.47 CC(NCCC=C)C(N)=O Amb25805020 [0,1,1,0,0,0|2,0,0]=4 2727 B9R0.47 CC(NCCC=C)C(O)=O Amb25309133 [0,1,1,0,0,0|1,0,0]=3 2728 B9R0.47 CC(NCCCF)C(O)=O Amb24407596 [0,1,1,0,0,0|1,0,0]=3 2729 B9R0.47 CC(NCCCN)C(N)=O Amb24761337 [0,1,1,0,0,0|2,0,0]=4 2730 B9R0.47 CC(O)C(C)NCCCO Amb25207107 [0,1,1,0,0,0|1,0,1]=4 2731 B9R0.47 CC(OCCC#C)C(O)=O Amb25685097 [0,1,1,0,0,0|2,0,0]=4 2732 B9R0.47 CC(OCCC#N)C(O)=O Amb25777717 [0,1,1,0,0,0|2,0,0]=4 2733 B9R0.47 CC(OCCCF)C(O)=O Amb24602795 [0,1,1,0,0,0|2,0,0]=4 2734 B9R0.47 CC(OCCCN)C(O)=O Amb18111477 [0,1,1,0,0,0|2,0,0]=4 2735 B9R0.47 CC(OCCCO)C(O)=O Amb25132795 [0,1,1,0,0,0|1,0,0]=3 2736 B9R0.47 CC(SCCCO)C(C)=O Amb24724359 [0,1,1,0,0,0|2,0,0]=4 2737 B9R0.47 CC(SCCCS)C(O)=O Amb18648366 [0,1,1,0,0,0|1,1,0]=4 2738 B9R0.47 CCCCC[C@@H](C(=O)O)C Amb10844510 [0,1,1,0,0,0|2,0,0]=4 2739 B9R0.47 CCCCC[C@H](C(=O)O)C Amb10844515 [0,1,1,0,0,0|2,0,0]=4 2740 B9R0.47 CCCCNC(C)C(C)=O Amb25294138 [0,1,1,0,0,0|2,0,0]=4 2741 B9R0.47 CCCCO[C@H](C)C(O)=O Amb24480807 [0,1,1,0,0,0|2,0,0]=4 2742 B9R0.47 CCCCS[C@H](C)C(O)=O Amb24725214 [0,1,1,0,0,0|2,0,0]=4 2743 B9R0.47 CCCNCC(O)C(O)=O Amb24734975 [0,1,1,0,0,0|2,0,0]=4 2744 B9R0.47 CCCONC(C)C(N)=O Amb25803680 [0,1,1,0,0,0|2,0,0]=4 2745 B9R0.47 CCCONC(C)C(O)=O Amb25664130 [0,1,1,0,0,0|1,0,0]=3 2746 B9R0.47 CCC\C=C\C(C)C(O)=O Amb25687429 [0,1,1,0,0,0|2,0,0]=4 2747 B9R0.47 CCC\C=N\[C@@H](C)C(O)=O Amb24401135 [0,1,1,0,0,0|1,0,1]=4 2748 B9R0.47 CCOCC[C@H](C)C(O)=O Amb25791629 [0,1,1,0,0,0|2,0,0]=4 2749 B9R0.47 CCOCSC(C)C(O)=O Amb24456124 [0,1,1,0,0,0|2,0,0]=4 2750 B9R0.47 CCSCCC(C(=O)O)C Amb10844082 [0,1,1,0,0,0|2,0,0]=4 2751 B9R0.47 CNCCCC(C)C(O)=O Amb25313872 [0,1,1,0,0,0|2,0,0]=4 2752 B9R0.47 CNCCOC(C)C(O)=O Amb18630742 [0,1,1,0,0,0|2,0,0]=4 2753 B9R0.47 COCCCC(N)C(O)=O Amb20628315 [0,1,1,0,0,0|2,0,0]=4 2754 B9R0.47 COCCCC(N)C(O)=O Amb22058809 [0,1,1,0,0,0|2,0,0]=4 2755 B9R0.47 COCCC[C@@H](N)C(O)=O Amb25081508 [0,1,1,0,0,0|2,0,0]=4 2756 B9R0.47 COCCC[C@H](N)C(O)=O Amb25378737 [0,1,1,0,0,0|2,0,0]=4 2757 B9R0.47 COCCNC(C)C(N)=O Amb19222868 [0,1,1,0,0,0|1,0,0]=3 2758 B9R0.47 COCCOC(C)C(N)=O Amb24471883 [0,1,1,0,0,0|2,0,0]=4 2759 B9R0.47 COCCSC(C)C(N)=O Amb18792461 [0,1,1,0,0,0|2,0,0]=4 2760 B9R0.47 COCCSC(F)C(O)=O Amb25342930 [0,1,1,0,0,0|2,0,0]=4 2761 B9R0.47 COCOC[C@@H](C)C(O)=O Amb24505310 [0,1,1,0,0,0|2,0,0]=4 2762 B9R0.47 CSCCNC(C)C(O)=O Amb25805024 [0,1,1,0,0,0|0,1,0]=3 2763 B9R0.47 CSCCN[C@@H](C)C(O)=O Amb24554487 [0,1,1,0,0,0|0,1,0]=3 2764 B9R0.47 CSCCN[C@H](C)C(O)=O Amb25027967 [0,1,1,0,0,0|0,1,0]=3 2765 B9R0.47 CSCCOC(C)C(O)=O Amb24482366 [0,1,1,0,0,0|1,1,0]=4 2766 B9R0.47 CSCCO[C@@H](C)C(O)=O Amb25146944 [0,1,1,0,0,0|1,1,0]=4 2767 B9R0.47 C[C@@H](NCCC=C)C(O)=O Amb25702627 [0,1,1,0,0,0|1,0,0]=3 2768 B9R0.47 C[C@@H](NCCCF)C(O)=O Amb25049576 [0,1,1,0,0,0|1,0,0]=3 2769 B9R0.47 C[C@@H](NCCCN)C(O)=O Amb25710680 [0,1,1,0,0,0|1,0,0]=3 2770 B9R0.47 C[C@@H](NC\C=C\Cl)C(O)=O Amb25375417 [0,1,1,0,0,0|1,0,1]=4 2771 B9R0.47 C[C@@H](OCCCF)C(O)=O Amb25146943 [0,1,1,0,0,0|2,0,0]=4 2772 B9R0.47 C[C@@H](OCCCO)C(O)=O Amb24692362 [0,1,1,0,0,0|1,0,0]=3 2773 B9R0.47 C[C@H](NCCC#N)C(O)=O Amb25090098 [0,1,1,0,0,0|1,0,0]=3 2774 B9R0.47 C[C@H](NCCCF)C(O)=O Amb25300818 [0,1,1,0,0,0|1,0,0]=3 2775 B9R0.47 C[C@H](NCCCN)C(O)=O Amb24653332 [0,1,1,0,0,0|1,0,0]=3 2776 B9R0.47 C[C@H](NC\C=C\Cl)C(O)=O Amb25102851 [0,1,1,0,0,0|1,0,1]=4 2777 B9R0.47 C[C@H](OCCC#C)C(O)=O Amb25265806 [0,1,1,0,0,0|2,0,0]=4 2778 B9R0.47 C[C@H](OCCCN)C(O)=O Amb25146951 [0,1,1,0,0,0|2,0,0]=4 2779 B9R0.47 C[C@H](OCCCO)C(O)=O Amb25720488 [0,1,1,0,0,0|1,0,0]=3 2780 B9R0.47 NC(CCCNO)C(O)=O Amb24722710 [0,1,1,0,0,0|2,0,0]=4 2781 B9R0.47 NC(CCNCO)C(O)=O Amb25701616 [0,1,1,0,0,0|2,0,0]=4 2782 B9R0.47 NC(CNCCO)C(O)=O Amb25073329 [0,1,1,0,0,0|1,0,0]=3 2783 B9R0.47 NC(\C=C\CCO)C(O)=O Amb25228356 [0,1,1,0,0,0|2,0,0]=4 2784 B9R0.47 NCCCC[C@@H](C(=O)O)C Amb10844513 [0,1,1,0,0,0|2,0,0]=4 2785 B9R0.47 NCCNCC(N)C(O)=O Amb25032175 [0,1,1,0,0,0|2,0,0]=4 2786 B9R0.47 NCCNCC(O)C(O)=O Amb25135297 [0,1,1,0,0,0|2,0,0]=4 2787 B9R0.47 NCCNC[C@@H](N)C(O)=O Amb25147420 [0,1,1,0,0,0|2,0,0]=4 2788 B9R0.47 NCCNC[C@H](N)C(O)=O Amb24580529 [0,1,1,0,0,0|2,0,0]=4 2789 B9R0.47 NOCCCC(N)C(O)=O Amb24117962 [0,1,1,0,0,0|2,0,0]=4 2790 B9R0.47 N[C@@H](CCCCO)C(O)=O Amb22900800 [0,1,1,0,0,0|2,0,0]=4 2791 B9R0.47 N[C@@H](CCCNO)C(O)=O Amb25075377 [0,1,1,0,0,0|2,0,0]=4 2792 B9R0.47 N[C@@H](CCNCO)C(O)=O Amb24760325 [0,1,1,0,0,0|2,0,0]=4 2793 B9R0.47 N[C@@H](CNCCO)C(O)=O Amb25146307 [0,1,1,0,0,0|1,0,0]=3 2794 B9R0.47 N[C@@H](COCCO)C(O)=O Amb24479093 [0,1,1,0,0,0|2,0,0]=4 2795 B9R0.47 N[C@H](CNCCO)C(O)=O Amb24617539 [0,1,1,0,0,0|1,0,0]=3 2796 B9R0.47 N[C@H](\C=C\CCO)C(O)=O Amb24603441 [0,1,1,0,0,0|2,0,0]=4 2797 B9R0.47 OC(=O)C(=O)NCCCO Amb24371547 [0,1,1,0,0,0|1,0,1]=4 2798 B9R0.47 OCCCCC(O)C(O)=O Amb18644356 [0,1,1,0,0,0|2,0,0]=4 2799 B9R0.47 OCCCC[C@H](O)C(O)=O Amb24480682 [0,1,1,0,0,0|2,0,0]=4 2800 B9R0.47 OCCCSC(F)C(O)=O Amb24659088 [0,1,1,0,0,0|2,0,0]=4 2801 B9R0.47 OCCNC[C@H](O)C(O)=O Amb25316160 [0,1,1,0,0,0|1,0,0]=3 2802 B9R0.47 OCCSCC(O)C(O)=O Amb25211640 [0,1,1,0,0,0|2,0,0]=4 2803 B9R0.51 C=CCNC(C(=O)O)(C)C Amb17399883 [0,1,1,0,0,0|1,0,1]=4 2804 B9R0.51 CC(=O)C(C)(O)CCCO Amb24520546 [0,1,1,0,0,0|2,0,0]=4 2805 B9R0.51 CC(C(=O)O)(CCCC)O Amb17593657 [0,1,1,0,0,0|2,0,0]=4 2806 B9R0.51 CC(C)(C#CCO)C(O)=O Amb24479219 [0,1,1,0,0,0|1,0,1]=4 2807 B9R0.51 CC(C)(CCCBr)C(O)=O Amb18131057 [0,1,1,0,0,0|2,0,0]=4 2808 B9R0.51 CC(C)(CCCS)C(O)=O Amb25699465 [0,1,1,0,0,0|1,1,0]=4 2809 B9R0.51 CC(C)(NCC#C)C(O)=O Amb18999300 [0,1,1,0,0,0|1,0,1]=4 2810 B9R0.51 CC(C)(NCC#N)C(O)=O Amb24714197 [0,1,1,0,0,0|1,0,1]=4 2811 B9R0.51 CC(C)(NCCN)C(O)=O Amb19015473 [0,1,1,0,0,0|1,0,0]=3 2812 B9R0.51 CC(C)(NCCO)C(N)=O Amb25110511 [0,1,1,0,0,0|1,0,0]=3 2813 B9R0.51 CC(C)(OCCN)C(O)=O Amb18110232 [0,1,1,0,0,0|2,0,0]=4 2814 B9R0.51 CC(C)(OCCO)C(O)=O Amb24454935 [0,1,1,0,0,0|1,0,0]=3 2815 B9R0.51 CC(N)(CCCN)C(O)=O Amb18644277 [0,1,1,0,0,0|2,0,0]=4 2816 B9R0.51 CC(N)(CCCO)C(N)=O Amb24353259 [0,1,1,0,0,0|2,0,0]=4 2817 B9R0.51 CC(N)(CCCO)C(O)=O Amb24061058 [0,1,1,0,0,0|1,0,0]=3 2818 B9R0.51 CC(O)(CCCN)C(O)=O Amb25380779 [0,1,1,0,0,0|2,0,0]=4 2819 B9R0.51 CCCCC(C)(Cl)C(O)=O Amb24373145 [0,1,1,0,0,0|2,0,0]=4 2820 B9R0.51 CCCCC(C)(F)C(O)=O Amb24444856 [0,1,1,0,0,0|2,0,0]=4 2821 B9R0.51 CCCC[C@@](C)(F)C(O)=O Amb24622375 [0,1,1,0,0,0|2,0,0]=4 2822 B9R0.51 CCCC[C@@](C)(N)C(O)=O Amb19929613 [0,1,1,0,0,0|2,0,0]=4 2823 B9R0.51 CCCNC(C)(C)C(N)=O Amb18304449 [0,1,1,0,0,0|2,0,0]=4 2824 B9R0.51 CCCOC(C)(C)C(O)=O Amb18305285 [0,1,1,0,0,0|2,0,0]=4 2825 B9R0.51 CCCOC(C)(O)C(O)=O Amb25341784 [0,1,1,0,0,0|2,0,0]=4 2826 B9R0.51 CCCSC(C(=O)O)(C)C Amb17501481 [0,1,1,0,0,0|2,0,0]=4 2827 B9R0.51 C[C@](N)(CCCN)C(O)=O Amb24480786 [0,1,1,0,0,0|2,0,0]=4 2828 B9R0.51 NC(N)(CCCO)C(O)=O Amb25300624 [0,1,1,0,0,0|2,0,0]=4 2829 B9R0.51 NCCSC(C(=O)O)(C)C Amb17500467 [0,1,1,0,0,0|2,0,0]=4 2830 B9R0.51 OCCCC(F)(F)C(O)=O Amb24652882 [0,1,1,0,0,0|2,0,0]=4 2831 B9R0.51 OCCSC(C(=O)O)(C)C Amb17502590 [0,1,1,0,0,0|1,0,0]=3 2832 B9R0.21 CS(=O)(=O)CCC(O)CN Amb25803143 [0,1,1,0,0,0|1,0,1]=4 2833 B9R0.21 NCC(O)CSP(O)(O)=O Amb25124042 [0,1,1,0,0,0|2,0,0]=4 2834 B9R0.21 OC[C@@H](O)CCP(O)(O)=O Amb25047616 [0,1,1,0,0,0|2,0,0]=4 2835 B9R0.23 CC(=O)CC(O)C(O)CO Amb24737444 [0,1,1,0,0,0|2,0,0]=4 2836 B9R0.23 CC(=O)C[C@@H](O)[C@@H](O)CO Amb25767917 [0,1,1,0,0,0|2,0,0]=4 2837 B9R0.23 CC(C(CC(=O)O)N)CC Amb2438880 [0,1,1,0,0,0|2,0,0]=4 2838 B9R0.23 CC(CC(O)=O)C(=O)CN Amb25072734 [0,1,1,0,0,0|0,0,2]=4 2839 B9R0.23 CC(CC(O)=O)C(N)CC Amb25820735 [0,1,1,0,0,0|2,0,0]=4 2840 B9R0.23 CC(CC)C(O)CC(O)=O Amb18310690 [0,1,1,0,0,0|2,0,0]=4 2841 B9R0.23 CC(CC)[C@H](N)CC(O)=O Amb25117039 [0,1,1,0,0,0|2,0,0]=4 2842 B9R0.23 CCC(C)C(C)CC(O)=O Amb18304200 [0,1,1,0,0,0|2,0,0]=4 2843 B9R0.23 CCC(Cl)C(O)CC(O)=O Amb25111208 [0,1,1,0,0,0|2,0,0]=4 2844 B9R0.23 CCC(O)C(O)CC(O)=O Amb25132101 [0,1,1,0,0,0|1,0,0]=3 2845 B9R0.23 CCN(O)C(C)CC(O)=O Amb25379050 [0,1,1,0,0,0|2,0,0]=4 2846 B9R0.23 CC[C@@H](C)[C@H](C)CC(O)=O Amb24715562 [0,1,1,0,0,0|2,0,0]=4 2847 B9R0.23 CC[C@H](O)[C@H](N)CC(O)=O Amb25204323 [0,1,1,0,0,0|1,0,0]=3 2848 B9R0.23 COC(O)C(O)CC(O)=O Amb24650997 [0,1,1,0,0,0|2,0,0]=4 2849 B9R0.23 C[C@@H](CC([O-])=O)C(O)CO Amb24334935 [0,1,1,0,0,0|1,0,1]=4 2850 B9R0.23 C[C@@H](CC)[C@@H](O)CC(O)=O Amb25068472 [0,1,1,0,0,0|2,0,0]=4 2851 B9R0.23 C[C@@H](CC)[C@H](N)CC(O)=O Amb19944304 [0,1,1,0,0,0|2,0,0]=4 2852 B9R0.23 C[C@@H](CC)[C@H](N)CC(O)=O Amb25068405 [0,1,1,0,0,0|2,0,0]=4 2853 B9R0.23 C[C@@H](CC)[C@H](O)CC(O)=O Amb24409363 [0,1,1,0,0,0|2,0,0]=4 2854 B9R0.23 C[C@@H]([C@@H](CC(=O)O)N)CC Amb16184028 [0,1,1,0,0,0|2,0,0]=4 2855 B9R0.23 C[C@H](CC(O)=O)[C@H](O)CN Amb25131743 [0,1,1,0,0,0|0,0,0]=2 2856 B9R0.23 C[C@H](CC)[C@@H](N)CC(O)=O Amb25689818 [0,1,1,0,0,0|2,0,0]=4 2857 B9R0.23 C[C@H]([C@H](CC(=O)O)N)CC Amb16184016 [0,1,1,0,0,0|2,0,0]=4 2858 B9R0.23 NC(=O)CC(O)C(O)CO Amb25139467 [0,1,1,0,0,0|2,0,0]=4 2859 B9R0.23 NC(CC(N)=O)C(O)CO Amb24460353 [0,1,1,0,0,0|2,0,0]=4 2860 B9R0.23 NCC(=O)C(N)CC(O)=O Amb24745663 [0,1,1,0,0,0|0,0,2]=4 2861 B9R0.23 N[C@@H](CC(O)=O)[C@@H](N)CO Amb25788533 [0,1,1,0,0,0|2,0,0]=4 2862 B9R0.23 OC[C@@H](O)[C@@H](O)CC(O)=O Amb24509722 [0,1,1,0,0,0|1,0,0]=3 2863 B9R0.23 OC[C@@H](O)[C@H](O)CC(O)=O Amb25258026 [0,1,1,0,0,0|1,0,0]=3 2864 B9R0.23 OC[C@H](O)[C@H](O)CC(O)=O Amb24726353 [0,1,1,0,0,0|1,0,0]=3 2865 B9R0.24 CC(CCC(=O)NN)CN Amb25287777 [0,1,1,0,0,0|2,0,0]=4 2866 B9R0.24 CC(CN)CCC(=O)C#C Amb25138223 [0,1,1,0,0,0|2,0,0]=4 2867 B9R0.24 CC(CN)CCC(=O)C=C Amb24601148 [0,1,1,0,0,0|2,0,0]=4 2868 B9R0.24 CC(CN)CCC(=O)NO Amb25145597 [0,1,1,0,0,0|1,0,0]=3 2869 B9R0.24 CCC(=O)NCC(O)CN Amb25272632 [0,1,1,0,0,0|2,0,0]=4 2870 B9R0.24 CCC(C)CCC(=O)OC Amb25690993 [0,1,1,0,0,0|2,0,0]=4 2871 B9R0.24 CCC(O)CCC(=O)OC Amb25850223 [0,1,1,0,0,0|1,0,0]=3 2872 B9R0.24 CCN(O)CCC(=O)OC Amb24763933 [0,1,1,0,0,0|2,0,0]=4 2873 B9R0.24 CCS(=O)CCC(O)CN Amb24738164 [0,1,1,0,0,0|2,0,0]=4 2874 B9R0.24 CC[C@@H](O)CCC(=O)OC Amb24561650 [0,1,1,0,0,0|1,0,0]=3 2875 B9R0.24 CC[C@H](O)CCC(=O)OC Amb24377641 [0,1,1,0,0,0|1,0,0]=3 2876 B9R0.24 COC(=O)CCC(=O)CN Amb18202127 [0,1,1,0,0,0|0,0,2]=4 2877 B9R0.24 COC(=O)CCC(Br)CBr Amb25343381 [0,1,1,0,0,0|2,0,0]=4 2878 B9R0.24 COC(=O)CCC(C)CBr Amb25032347 [0,1,1,0,0,0|2,0,0]=4 2879 B9R0.24 COC(=O)CCC(Cl)CCl Amb25241534 [0,1,1,0,0,0|2,0,0]=4 2880 B9R0.24 COC(=O)CCC(N)CF Amb24517084 [0,1,1,0,0,0|2,0,0]=4 2881 B9R0.24 COC(=O)CCC(O)C=C Amb25127861 [0,1,1,0,0,0|1,0,1]=4 2882 B9R0.24 COC(=O)CCC(O)CBr Amb25044783 [0,1,1,0,0,0|1,0,0]=3 2883 B9R0.24 COC(=O)CCC(O)CN Amb25857935 [0,1,1,0,0,0|0,0,0]=2 2884 B9R0.24 COC(=O)CCC(O)CO Amb25204294 [0,1,1,0,0,0|1,0,0]=3 2885 B9R0.24 COC(=O)CC[C@@H](O)C#C Amb25343842 [0,1,1,0,0,0|1,0,1]=4 2886 B9R0.24 COC(=O)CC[C@@H](O)CN Amb24744697 [0,1,1,0,0,0|0,0,0]=2 2887 B9R0.24 COC(=O)CC[C@H](O)C=C Amb24481290 [0,1,1,0,0,0|1,0,1]=4 2888 B9R0.24 COC(=O)CNC(C)CN Amb25299776 [0,1,1,0,0,0|2,0,0]=4 2889 B9R0.24 COC(=O)COC(C)CN Amb24480966 [0,1,1,0,0,0|2,0,0]=4 2890 B9R0.24 COC(=O)NCC(C)CN Amb18313166 [0,1,1,0,0,0|2,0,0]=4 2891 B9R0.24 COC(=O)NCC(O)CN Amb24589991 [0,1,1,0,0,0|1,0,0]=3 2892 B9R0.24 OC(COC(=O)CO)CO Amb25854328 [0,1,1,0,0,0|2,0,0]=4 2893 B9R0.24 OCC(O)CCC(O)C=O Amb25713052 [0,1,1,0,0,0|1,0,1]=4 2894 B9R0.24 OC[C@H](O)CC[C@@H](O)C=O Amb25059567 [0,1,1,0,0,0|1,0,1]=4 2895 B9R0.24 OC[C@H](O)CC[C@H](O)C=O Amb24456857 [0,1,1,0,0,0|1,0,1]=4 2896 B9R0.43 CCC(CCC(O)=O)C#N Amb18643712 [0,1,1,0,0,0|2,0,0]=4 2897 B9R0.43 CCC(CCC(O)=O)C=O Amb25378745 [0,1,1,0,0,0|1,0,1]=4 2898 B9R0.43 CCC(CCC(O)=O)NN Amb24478238 [0,1,1,0,0,0|2,0,0]=4 2899 B9R0.43 CC[C@@H](CCC(O)=O)NN Amb24640349 [0,1,1,0,0,0|2,0,0]=4 2900 B9R0.43 CN[C@H](CS)CCC(O)=O Amb24482183 [0,1,1,0,0,0|2,0,0]=4 2901 B9R0.43 COC(CCC(O)=O)OC Amb24657204 [0,1,1,0,0,0|2,0,0]=4 2902 B9R0.43 CO[C@H](CN)CCC(O)=O Amb24544386 [0,1,1,0,0,0|0,0,0]=2 2903 B9R0.43 NCC(CCC(O)=O)=NO Amb24591142 [0,1,1,0,0,0|0,0,1]=3 2904 B9R0.43 NCC(CCC(O)=O)CN Amb25062561 [0,1,1,0,0,0|1,0,0]=3 2905 B9R0.48 C#CCC(O)CCC(O)=O Amb25077171 [0,1,1,0,0,0|1,0,0]=3 2906 B9R0.48 C=CCC(N)CCC(O)=O Amb25132628 [0,1,1,0,0,0|2,0,0]=4 2907 B9R0.48 C=CC[C@@H](N)CCC(O)=O Amb25308063 [0,1,1,0,0,0|2,0,0]=4 2908 B9R0.48 CC(=O)CCC(O)CC#N Amb18643714 [0,1,1,0,0,0|1,0,1]=4 2909 B9R0.48 CC(CC#C)CCC(O)=O Amb25331115 [0,1,1,0,0,0|2,0,0]=4 2910 B9R0.48 CC(CC#N)CCC(O)=O Amb25826195 [0,1,1,0,0,0|1,0,1]=4 2911 B9R0.48 CC(CCN)CCC(N)=O Amb19515543 [0,1,1,0,0,0|2,0,0]=4 2912 B9R0.48 CC(CCN)CCC(O)=O Amb18124749 [0,1,1,0,0,0|1,0,0]=3 2913 B9R0.48 CCCC(Br)CCC(O)=O Amb24469305 [0,1,1,0,0,0|2,0,0]=4 2914 B9R0.48 CCCC(CCC(=O)N)O Amb17593642 [0,1,1,0,0,0|2,0,0]=4 2915 B9R0.48 CCCC(CCC(=O)O)N Amb1014101 [0,1,1,0,0,0|2,0,0]=4 2916 B9R0.48 CCCC(CCC(=O)[O-])O Amb2386295 [0,1,1,0,0,0|1,0,1]=4 2917 B9R0.48 CCCC(Cl)CCC(O)=O Amb23590328 [0,1,1,0,0,0|2,0,0]=4 2918 B9R0.48 CCCC(O)CCC(O)=O Amb17689110 [0,1,1,0,0,0|1,0,0]=3 2919 B9R0.48 CCCC(O)CCC([O-])=O Amb17778117 [0,1,1,0,0,0|1,0,1]=4 2920 B9R0.48 CCC[C@@H](C)CCC(O)=O Amb24548514 [0,1,1,0,0,0|2,0,0]=4 2921 B9R0.48 CCC[C@H](C)CCC(O)=O Amb24446759 [0,1,1,0,0,0|2,0,0]=4 2922 B9R0.48 CCC[C@H](N)CCC(O)=O Amb25211817 [0,1,1,0,0,0|2,0,0]=4 2923 B9R0.48 CCNC(C)CCC(O)=O Amb24394614 [0,1,1,0,0,0|2,0,0]=4 2924 B9R0.48 CCOC(C)CCC(O)=O Amb24690847 [0,1,1,0,0,0|2,0,0]=4 2925 B9R0.48 CCSC(C)CCC(O)=O Amb18800669 [0,1,1,0,0,0|2,0,0]=4 2926 B9R0.48 CNCC(O)CCC(O)=O Amb24745159 [0,1,1,0,0,0|0,0,0]=2 2927 B9R0.48 CNCC(O)CNC(C)=O Amb24577191 [0,1,1,0,0,0|2,0,0]=4 2928 B9R0.48 COCC(C)CCC(O)=O Amb25340432 [0,1,1,0,0,0|2,0,0]=4 2929 B9R0.48 COCC(O)CCC(C)=O Amb24438108 [0,1,1,0,0,0|2,0,0]=4 2930 B9R0.48 C[C@@H](CC=O)CCC(O)=O Amb24505022 [0,1,1,0,0,0|2,0,0]=4 2931 B9R0.48 C[C@@H](CCS)CCC(O)=O Amb24693959 [0,1,1,0,0,0|2,0,0]=4 2932 B9R0.48 C[C@H](CCBr)CCC(O)=O Amb24585993 [0,1,1,0,0,0|2,0,0]=4 2933 B9R0.48 C\C=C\C(O)CCC(O)=O Amb25275755 [0,1,1,0,0,0|1,0,1]=4 2934 B9R0.48 C\C=C\[C@H](O)CCC(O)=O Amb24538051 [0,1,1,0,0,0|1,0,1]=4 2935 B9R0.48 NC(CC#N)CCC(O)=O Amb24595715 [0,1,1,0,0,0|1,0,1]=4 2936 B9R0.48 NC(CCS)CCC(O)=O Amb24453471 [0,1,1,0,0,0|2,0,0]=4 2937 B9R0.48 NCCC(=O)CCC(O)=O Amb25790735 [0,1,1,0,0,0|0,0,2]=4 2938 B9R0.48 N[C@@H](CCO)CCC(O)=O Amb25756968 [0,1,1,0,0,0|2,0,0]=4 2939 B9R0.48 N[C@H](CC#N)CCC(O)=O Amb24541852 [0,1,1,0,0,0|1,0,1]=4 2940 B9R0.48 OC(CCS)CCC(O)=O Amb25320980 [0,1,1,0,0,0|1,0,0]=3 2941 B9R0.48 OCC[C@H](O)CCC(O)=O Amb25843738 [0,1,1,0,0,0|1,0,0]=3 2942 B9R0.64 CC(=O)CCC(C)(O)CO Amb25713212 [0,1,1,0,0,0|2,0,0]=4 2943 B9R0.64 CC(O)(CCC(O)=O)CO Amb25108439 [0,1,1,0,0,0|1,0,0]=3 2944 B9R0.64 CCC(C)(C)CCC(O)=O Amb18644164 [0,1,1,0,0,0|2,0,0]=4 2945 B9R0.64 CCC(C)(O)CCC(N)=O Amb25723101 [0,1,1,0,0,0|2,0,0]=4 2946 B9R0.64 CCC(C)(O)CCC(O)=O Amb25317242 [0,1,1,0,0,0|1,0,0]=3 2947 B9R0.64 CC[C@@](C)(O)CCC(O)=O Amb24461550 [0,1,1,0,0,0|1,0,0]=3 2948 B9R0.64 NCC(O)(O)CCC(O)=O Amb24401314 [0,1,1,0,0,0|0,0,0]=2 2949 B9R0.64 NCP(=O)(CCC(=O)O)O Amb1807904 [0,1,1,0,0,0|1,0,0]=3 2950 B9R0.64 OC(=O)CCC(F)(F)CBr Amb25766479 [0,1,1,0,0,0|2,0,0]=4 2951 B9R0.64 OCP(O)(=O)CCC(O)=O Amb24482433 [0,1,1,0,0,0|2,0,0]=4 2952 B9R0.12 CC(OC)C(CCO)NC Amb24562265 [0,1,1,0,0,0|1,0,1]=4 2953 B9R0.12 CCCC(NC)C(=O)OC Amb24116637 [0,1,1,0,0,0|1,0,0]=3 2954 B9R0.12 CCC[C@@H](NC)C(=O)OC Amb25253764 [0,1,1,0,0,0|1,0,0]=3 2955 B9R0.12 CCN(CCO)C(=O)OC Amb24469191 [0,1,1,0,0,0|2,0,0]=4 2956 B9R0.12 CNC(C(=O)NC)CCO Amb10809383 [0,1,1,0,0,0|1,0,0]=3 2957 B9R0.12 CNC(CC=C)C(=O)OC Amb25198840 [0,1,1,0,0,0|1,0,1]=4 2958 B9R0.12 CNC(CSC)C(=O)OC Amb18788231 [0,1,1,0,0,0|2,0,0]=4 2959 B9R0.12 CN[C@@H](CC=C)C(=O)OC Amb24740078 [0,1,1,0,0,0|1,0,1]=4 2960 B9R0.12 CN[C@@H](CSC)C(=O)OC Amb25039328 [0,1,1,0,0,0|2,0,0]=4 2961 B9R0.12 COC(=O)C(CCBr)OC Amb24524133 [0,1,1,0,0,0|2,0,0]=4 2962 B9R0.12 COC(=O)C(CCO)OC Amb25676612 [0,1,1,0,0,0|1,0,0]=3 2963 B9R0.12 COC(=O)C(COC)NC Amb20630218 [0,1,1,0,0,0|2,0,0]=4 2964 B9R0.12 COC(CCN)C(=O)NO Amb25219689 [0,1,1,0,0,0|2,0,0]=4 2965 B9R0.12 CON(CCO)C(=O)OC Amb24703889 [0,1,1,0,0,0|2,0,0]=4 2966 B9R0.12 NNC(=O)C(CCO)NO Amb24520800 [0,1,1,0,0,0|2,0,0]=4 2967 B9R0.12 OCCC(C(=O)OC)CC Amb17593656 [0,1,1,0,0,0|1,0,0]=3 2968 B9R0.15 CC(=O)C(CCO)CCO Amb24661854 [0,1,1,0,0,0|2,0,0]=4 2969 B9R0.15 CC(O)C(CCO)NCC Amb24435783 [0,1,1,0,0,0|1,0,1]=4 2970 B9R0.15 CCCC(CCN)C(O)=O Amb24566993 [0,1,1,0,0,0|2,0,0]=4 2971 B9R0.15 CCCC(CCO)C(O)=O Amb25260506 [0,1,1,0,0,0|1,0,0]=3 2972 B9R0.15 CCCC(COC)C(O)=O Amb24586210 [0,1,1,0,0,0|2,0,0]=4 2973 B9R0.15 CCC[C@H](NC=O)C(O)=O Amb24478840 [0,1,1,0,0,0|1,0,1]=4 2974 B9R0.15 CCNC(CCC)C(N)=O Amb24419625 [0,1,1,0,0,0|2,0,0]=4 2975 B9R0.15 CCNC(CSC)C(O)=O Amb18788229 [0,1,1,0,0,0|2,0,0]=4 2976 B9R0.15 CCOC(CCO)C(O)=O Amb24476865 [0,1,1,0,0,0|1,0,0]=3 2977 B9R0.15 CCOC(CCS)C(O)=O Amb18788311 [0,1,1,0,0,0|1,1,0]=4 2978 B9R0.15 CCSC(CCC)C(O)=O Amb24482477 [0,1,1,0,0,0|2,0,0]=4 2979 B9R0.15 CCSC(CCN)C(O)=O Amb25109760 [0,1,1,0,0,0|2,0,0]=4 2980 B9R0.15 CC\C=C(\CCO)/C(O)=O Amb24550606 [0,1,1,0,0,0|1,0,1]=4 2981 B9R0.15 COCC(CCN)C(O)=O Amb24536085 [0,1,1,0,0,0|2,0,0]=4 2982 B9R0.15 CSNC(CCS)C(O)=O Amb24477034 [0,1,1,0,0,0|0,1,0]=3 2983 B9R0.15 CSN[C@@H](CCS)C(O)=O Amb24482159 [0,1,1,0,0,0|0,1,0]=3 2984 B9R0.15 C\C=C\C(CCC)C(O)=O Amb18643916 [0,1,1,0,0,0|2,0,0]=4 2985 B9R0.15 NCCC(CCN)C(O)=O Amb20622689 [0,1,1,0,0,0|2,0,0]=4 2986 B9R0.15 NCCC(CCN)C(O)=O Amb24120603 [0,1,1,0,0,0|2,0,0]=4 2987 B9R0.15 NCCC(CCO)C(O)=O Amb24392642 [0,1,1,0,0,0|1,0,0]=3 2988 B9R0.15 NCCN(CCO)C(O)=O Amb24100350 [0,1,1,0,0,0|2,0,0]=4 2989 B9R0.15 OC(=O)C(CCBr)NC=O Amb25338200 [0,1,1,0,0,0|1,0,1]=4 2990 B9R0.15 OC(=O)C(CCCl)CCCl Amb25088433 [0,1,1,0,0,0|2,0,0]=4 2991 B9R0.15 OC(=O)C(CCS)NC=O Amb24471731 [0,1,1,0,0,0|0,1,1]=4 2992 B9R0.15 OCCC(CCBr)C(O)=O Amb24616904 [0,1,1,0,0,0|1,0,0]=3 2993 B9R0.15 OCCC(NC=O)C(O)=O Amb18305692 [0,1,1,0,0,0|0,0,1]=3 2994 B9R0.15 OCC[C@H](NC=O)C(O)=O Amb25056777 [0,1,1,0,0,0|0,0,1]=3 2995 B9R0.15 [N-]=[N+]=NC(CCO)C(O)=O Amb24524339 [0,1,1,0,0,0|1,0,1]=4 2996 B9R0.15 [N-]=[N+]=N[C@@H](CCO)C(O)=O Amb25695440 [0,1,1,0,0,0|1,0,1]=4 2997 B9R0.29 CC(CC)C(NBr)C(O)=O Amb25125862 [0,1,1,0,0,0|2,0,0]=4 2998 B9R0.29 CC(CC)C(NC)C(N)=O Amb18304752 [0,1,1,0,0,0|2,0,0]=4 2999 B9R0.29 CC(CC)C(NCl)C(O)=O Amb25279236 [0,1,1,0,0,0|2,0,0]=4 3000 B9R0.29 CC(CC)C(NN)C(O)=O Amb24398974 [0,1,1,0,0,0|2,0,0]=4 3001 B9R0.29 CC(CC)C(NO)C(O)=O Amb25378713 [0,1,1,0,0,0|2,0,0]=4 3002 B9R0.29 CC(CC)C(OC)C(O)=O Amb24563898 [0,1,1,0,0,0|2,0,0]=4 3003 B9R0.29 CC(CC)C(SC)C(O)=O Amb25076827 [0,1,1,0,0,0|2,0,0]=4 3004 B9R0.29 CC(CO)C(NC)C(O)=O Amb18644323 [0,1,1,0,0,0|0,0,0]=2 3005 B9R0.29 CC(OC)C(NC)C(O)=O Amb24117895 [0,1,1,0,0,0|2,0,0]=4 3006 B9R0.29 CC(OC)C(NC)C(O)=O Amb24596308 [0,1,1,0,0,0|2,0,0]=4 3007 B9R0.29 CCC(O)C(NC)C(O)=O Amb25046706 [0,1,1,0,0,0|1,0,0]=3 3008 B9R0.29 CCC(O)C(OC)C(O)=O Amb18644355 [0,1,1,0,0,0|2,0,0]=4 3009 B9R0.29 CC[C@@H]([C@@H](C(=O)O)NC)C Amb16183967 [0,1,1,0,0,0|1,0,0]=3 3010 B9R0.29 CC[C@H](N)[C@H](CC)C(O)=O Amb24505157 [0,1,1,0,0,0|2,0,0]=4 3011 B9R0.29 CC[C@H](O)[C@H](NC)C(O)=O Amb24446992 [0,1,1,0,0,0|1,0,0]=3 3012 B9R0.29 CO[C@@H]([C@H](O)CO)C(N)=O Amb24427631 [0,1,1,0,0,0|2,0,0]=4 3013 B9R0.29 CO[C@H]([C@@H](O)CO)C(O)=O Amb25065328 [0,1,1,0,0,0|1,0,0]=3 3014 B9R0.29 CO[C@H]([C@H](O)CO)C(O)=O Amb25053877 [0,1,1,0,0,0|1,0,0]=3 3015 B9R0.29 C[C@@H](CC)[C@@H](CC)C(O)=O Amb24713592 [0,1,1,0,0,0|2,0,0]=4 3016 B9R0.29 C[C@@H](CC)[C@@H](NC)C(O)=O Amb25132156 [0,1,1,0,0,0|1,0,0]=3 3017 B9R0.29 C[C@@H](CC)[C@H](NBr)C(O)=O Amb24640231 [0,1,1,0,0,0|2,0,0]=4 3018 B9R0.29 C[C@@H](CC)[C@H](NC)C(O)=O Amb22747123 [0,1,1,0,0,0|1,0,0]=3 3019 B9R0.29 C[C@@H](CC)[C@H](NN)C(O)=O Amb25102747 [0,1,1,0,0,0|2,0,0]=4 3020 B9R0.29 C[C@@H](OC)[C@H](NC)C(O)=O Amb25340790 [0,1,1,0,0,0|2,0,0]=4 3021 B9R0.29 C[C@H](CC)[C@H](NC)C(O)=O Amb24544666 [0,1,1,0,0,0|1,0,0]=3 3022 B9R0.29 C[C@H](OC)[C@H](NC)C(O)=O Amb24478844 [0,1,1,0,0,0|2,0,0]=4 3023 B9R0.33 CC(=O)C(CCO)C(C)=O Amb25706995 [0,1,1,0,0,0|2,0,0]=4 3024 B9R0.33 CC(=O)C(CCO)C(N)=O Amb24447028 [0,1,1,0,0,0|2,0,0]=4 3025 B9R0.33 CC(C)C(CCN)C(O)=O Amb22371125 [0,1,1,0,0,0|2,0,0]=4 3026 B9R0.33 CC(C)C(CCN)C(O)=O Amb24426418 [0,1,1,0,0,0|2,0,0]=4 3027 B9R0.33 CC(C)[C@@H](CCC)C(O)=O Amb24376843 [0,1,1,0,0,0|2,0,0]=4 3028 B9R0.33 CC(C)[C@H](CCO)C([O-])=O Amb25730649 [0,1,1,0,0,0|1,0,1]=4 3029 B9R0.33 CCCC(C(=O)O)C(C)C Amb17616275 [0,1,1,0,0,0|2,0,0]=4 3030 B9R0.33 CCCC(C(N)=O)N(C)C Amb24116638 [0,1,1,0,0,0|2,0,0]=4 3031 B9R0.33 CCC[C@@H](C(N)=O)N(C)C Amb25727209 [0,1,1,0,0,0|2,0,0]=4 3032 B9R0.33 CN(C)C(CC#C)C(O)=O Amb24451303 [0,1,1,0,0,0|1,0,1]=4 3033 B9R0.33 CN(C)C(CCO)C(O)=O Amb24116966 [0,1,1,0,0,0|0,0,0]=2 3034 B9R0.33 CN(C)[C@@H](CCN)C(O)=O Amb25147640 [0,1,1,0,0,0|1,0,0]=3 3035 B9R0.33 COC[C@@H](C(O)=O)N(C)C Amb24568550 [0,1,1,0,0,0|2,0,0]=4 3036 B9R0.33 CSCC(C(O)=O)N(C)C Amb24373867 [0,1,1,0,0,0|2,0,0]=4 3037 B9R0.33 CSC[C@H](C(O)=O)N(C)C Amb25692205 [0,1,1,0,0,0|2,0,0]=4 3038 B9R0.39 CC(=O)C(CC(O)=O)NC Amb18611382 [0,1,1,0,0,0|1,0,1]=4 3039 B9R0.39 CC(=O)CC(NC)C(O)=O Amb25690263 [0,1,1,0,0,0|0,0,2]=4 3040 B9R0.39 CC(C)CC(CC)C(O)=O Amb19014184 [0,1,1,0,0,0|2,0,0]=4 3041 B9R0.39 CC(C)CC(NC)C(N)=O Amb19006600 [0,1,1,0,0,0|2,0,0]=4 3042 B9R0.39 CC(C)CC(NC)C(O)=O Amb22274694 [0,1,1,0,0,0|1,0,0]=3 3043 B9R0.39 CC(C)CC(NN)C(O)=O Amb18644273 [0,1,1,0,0,0|2,0,0]=4 3044 B9R0.39 CC(C)C[C@@H](NC)C(O)=O Amb22745995 [0,1,1,0,0,0|1,0,0]=3 3045 B9R0.39 CC(C)C[C@H](NC)C(N)=O Amb24550819 [0,1,1,0,0,0|2,0,0]=4 3046 B9R0.39 CC(C)C[C@H](NCl)C(O)=O Amb24563420 [0,1,1,0,0,0|2,0,0]=4 3047 B9R0.39 CCC(C(=O)O)CC(=O)O Amb10071696 [0,1,1,0,0,0|1,0,1]=4 3048 B9R0.39 CCC(CC(F)F)C(O)=O Amb25709926 [0,1,1,0,0,0|2,0,0]=4 3049 B9R0.39 CCC(CP(O)=O)C(O)=O Amb24482481 [0,1,1,0,0,0|2,0,0]=4 3050 B9R0.39 CC[C@H](CC(O)=O)C(O)=O Amb24643194 [0,1,1,0,0,0|1,0,1]=4 3051 B9R0.39 CNC(C(=O)O)CC(=O)O Amb1905634 [0,1,1,0,0,0|0,0,1]=3 3052 B9R0.39 CNC(CC(N)=O)C(O)=O Amb18644255 [0,1,1,0,0,0|0,0,2]=4 3053 B9R0.39 CNC(CS(O)=O)C(O)=O Amb25765774 [0,1,1,0,0,0|1,0,0]=3 3054 B9R0.39 CN[C@@H](C(=O)O)CC(C)C Amb10842218 [0,1,1,0,0,0|1,0,0]=3 3055 B9R0.39 CN[C@@H](CC(O)=O)C(O)=O Amb22748003 [0,1,1,0,0,0|0,0,1]=3 3056 B9R0.39 CN[C@@H](CS(O)=O)C(O)=O Amb24482415 [0,1,1,0,0,0|1,0,0]=3 3057 B9R0.39 CN[C@H](C(=O)O)CC(C)C Amb16183858 [0,1,1,0,0,0|1,0,0]=3 3058 B9R0.39 COC(CC(O)=O)C(O)=O Amb18124863 [0,1,1,0,0,0|1,0,1]=4 3059 B9R0.39 CO[C@@H](CC(O)=O)C(O)=O Amb25122107 [0,1,1,0,0,0|1,0,1]=4 3060 B9R0.39 CSC(CC(O)=O)C(O)=O Amb18646024 [0,1,1,0,0,0|1,0,1]=4 3061 B9R0.39 CS[C@@H](CC(O)=O)C(O)=O Amb25191487 [0,1,1,0,0,0|1,0,1]=4 3062 B9R0.39 CS[C@H](CC(O)=O)C(O)=O Amb24423669 [0,1,1,0,0,0|1,0,1]=4 3063 B9R0.39 NN[C@@H](CC(O)=O)C(O)=O Amb24117193 [0,1,1,0,0,0|1,0,1]=4 3064 B9R0.39 OC(=O)C(CC(O)=O)NO Amb24685872 [0,1,1,0,0,0|1,0,1]=4 3065 B9R0.39 OC(=O)C(CC(O)=O)NS Amb25808901 [0,1,1,0,0,0|1,0,1]=4 3066 B9R0.39 OC(=O)[C@H](CC(O)=O)NO Amb24117497 [0,1,1,0,0,0|1,0,1]=4 3067 B9R0.39 OC(=O)[C@H](CC(O)=O)NO Amb24630025 [0,1,1,0,0,0|1,0,1]=4 3068 B9R0.74 C=CC(N)(CCO)C(O)=O Amb24505246 [0,1,1,0,0,0|1,0,1]=4 3069 B9R0.74 CC(CCO)(C=C)C(O)=O Amb24633757 [0,1,1,0,0,0|1,0,1]=4 3070 B9R0.74 CCC(C)(CCC)C(O)=O Amb18311361 [0,1,1,0,0,0|2,0,0]=4 3071 B9R0.74 CCC(C)(CCCl)C(O)=O Amb24468418 [0,1,1,0,0,0|2,0,0]=4 3072 B9R0.74 CCC(C)(CCN)C(O)=O Amb24562793 [0,1,1,0,0,0|2,0,0]=4 3073 B9R0.74 CCC(C)(CCO)C(O)=O Amb25698302 [0,1,1,0,0,0|1,0,0]=3 3074 B9R0.74 CCC(O)(CCC)C(O)=O Amb18124781 [0,1,1,0,0,0|2,0,0]=4 3075 B9R0.74 CCCC(C)(NC)C(N)=O Amb19006593 [0,1,1,0,0,0|2,0,0]=4 3076 B9R0.74 CCCC(C)(OC)C(O)=O Amb18523824 [0,1,1,0,0,0|2,0,0]=4 3077 B9R0.74 CC[C@@](N)(CCC)C(O)=O Amb25368394 [0,1,1,0,0,0|2,0,0]=4 3078 B9R0.74 CC[C@](N)(CCC)C(O)=O Amb25842897 [0,1,1,0,0,0|2,0,0]=4 3079 B9R0.74 CC[C@](O)(CCC)C(O)=O Amb24685910 [0,1,1,0,0,0|2,0,0]=4 3080 B9R0.74 CNC(C)(COC)C(O)=O Amb19025782 [0,1,1,0,0,0|2,0,0]=4 3081 B9R0.74 CNC(C)(CSC)C(O)=O Amb18788227 [0,1,1,0,0,0|2,0,0]=4 3082 B9R0.74 OCC(O)(CCO)C(O)=O Amb25749062 [0,1,1,0,0,0|2,0,0]=4 3083 B9R0.10 CC(C)CC(N)S(O)(=O)=O Amb24390196 [0,1,1,0,0,0|2,0,0]=4 3084 B9R0.10 CC(O)CC(C)S(O)(=O)=O Amb24509369 [0,1,1,0,0,0|2,0,0]=4 3085 B9R0.10 CC(O)CC(N)P(O)(O)=O Amb25844516 [0,1,1,0,0,0|1,0,0]=3 3086 B9R0.11 CC(C)CC(C)(N)C(N)=O Amb18288986 [0,1,1,0,0,0|2,0,0]=4 3087 B9R0.11 CC(C)CC(C)(O)C(O)=O Amb18523766 [0,1,1,0,0,0|2,0,0]=4 3088 B9R0.11 CC(C)CC(F)(F)C(O)=O Amb25773701 [0,1,1,0,0,0|2,0,0]=4 3089 B9R0.11 CC(C)C[C@@](C)(O)C(O)=O Amb25744207 [0,1,1,0,0,0|2,0,0]=4 3090 B9R0.11 CC(C)C[C@](C)(O)C(O)=O Amb24763710 [0,1,1,0,0,0|2,0,0]=4 3091 B9R0.11 CC(CC(C(=O)O)(C)C)C Amb10843993 [0,1,1,0,0,0|2,0,0]=4 3092 B9R0.11 CC(C[C@@](C(=O)O)(N)C)C Amb10066904 [0,1,1,0,0,0|1,0,0]=3 3093 B9R0.11 CC(N)(CC(O)=O)C(O)=O Amb22800383 [0,1,1,0,0,0|1,0,1]=4 3094 B9R0.11 CC(O)CC(C)(C)C(O)=O Amb25230577 [0,1,1,0,0,0|1,0,0]=3 3095 B9R0.11 CC(O)CC(C)(O)C(O)=O Amb25265252 [0,1,1,0,0,0|1,0,0]=3 3096 B9R0.11 CN(C)CC(C)(N)C(O)=O Amb18294465 [0,1,1,0,0,0|2,0,0]=4 3097 B9R0.11 NC(N)(CC(O)=O)C(O)=O Amb24460545 [0,1,1,0,0,0|1,0,1]=4 3098 B9R0.11 OC(=O)CC(C(=O)O)(N)C Amb10807406 [0,1,1,0,0,0|1,0,1]=4 3099 B9R0.11 OC(=O)C[C@@](C(=O)O)(N)C Amb10601663 [0,1,1,0,0,0|1,0,1]=4 3100 B9R0.11 OC(=O)C[C@](C(=O)O)(N)C Amb10601664 [0,1,1,0,0,0|1,0,1]=4 3101 B9R0.11 OC(=O)C[C@](C(=O)O)(N)C Amb17608152 [0,1,1,0,0,0|1,0,1]=4 3102 B9R0.57 C([2H])(CC(C(=O)O)N)([2H])[2H] Amb17607913 [0,1,1,0,0,0|2,0,0]=4 3103 B9R0.57 CC(C)(C)CC(Br)C(O)=O Amb25324184 [0,1,1,0,0,0|2,0,0]=4 3104 B9R0.57 CC(C)(C)CC(Cl)C(O)=O Amb25281140 [0,1,1,0,0,0|2,0,0]=4 3105 B9R0.57 CC(C)(C)CC(F)C(O)=O Amb25107249 [0,1,1,0,0,0|2,0,0]=4 3106 B9R0.57 CC(C)(C)CC(N)C(N)=O Amb19000296 [0,1,1,0,0,0|2,0,0]=4 3107 B9R0.57 CC(C)(C)CC(N)P(O)=O Amb24695250 [0,1,1,0,0,0|2,0,0]=4 3108 B9R0.57 CC(C)(C)CC(O)C(O)=O Amb18302187 [0,1,1,0,0,0|2,0,0]=4 3109 B9R0.57 CC(C)(C)C[C@@H](N)C(N)=O Amb24457334 [0,1,1,0,0,0|2,0,0]=4 3110 B9R0.57 CC(C)(C)C[C@@H](O)C(O)=O Amb22057813 [0,1,1,0,0,0|2,0,0]=4 3111 B9R0.57 CC(C)(C)C[C@H](O)C(O)=O Amb25727583 [0,1,1,0,0,0|2,0,0]=4 3112 B9R0.57 CC(C)(Cl)C[C@H](N)C(O)=O Amb24711368 [0,1,1,0,0,0|1,0,0]=3 3113 B9R0.57 CC(C)(F)C[C@@H](N)C(O)=O Amb24055873 [0,1,1,0,0,0|1,0,0]=3 3114 B9R0.57 CC(C)(N)CC(N)C(O)=O Amb25195464 [0,1,1,0,0,0|1,0,0]=3 3115 B9R0.57 CC(C)(O)CC(N)C(O)=O Amb18644326 [0,1,1,0,0,0|0,0,0]=2 3116 B9R0.57 CC(C)(O)C[C@@H](N)C(O)=O Amb24479570 [0,1,1,0,0,0|0,0,0]=2 3117 B9R0.57 CC(CC(C)(C)C)C(O)=O Amb18124693 [0,1,1,0,0,0|2,0,0]=4 3118 B9R0.57 CC(CC(C)(C)N)C(O)=O Amb22364426 [0,1,1,0,0,0|2,0,0]=4 3119 B9R0.57 CC(CC(C)(C)O)C(C)=O Amb25141586 [0,1,1,0,0,0|2,0,0]=4 3120 B9R0.57 CC(CC(C)(C)O)C(O)=O Amb24529313 [0,1,1,0,0,0|1,0,0]=3 3121 B9R0.57 CC(F)(F)CC(S)C(O)=O Amb24677777 [0,1,1,0,0,0|2,0,0]=4 3122 B9R0.57 CS(=N)(=O)CC(N)C(O)=O Amb24732321 [0,1,1,0,0,0|1,0,1]=4 3123 B9R0.57 C[S@](=N)(=O)C[C@H](N)C(O)=O Amb25749061 [0,1,1,0,0,0|1,0,1]=4 3124 B9R0.57 C[Si](C)(C)C[C@H](N)C(O)=O Amb24482244 [0,1,1,0,0,0|1,1,0]=4 3125 B9R0.57 C[Si](C)(O)CC(N)C(O)=O Amb25060652 [0,1,1,0,0,0|0,1,0]=3 3126 B9R0.57 NC(C(=O)O)CC(F)(F)F Amb10603542 [0,1,1,0,0,0|2,0,0]=4 3127 B9R0.57 NC(CC(Cl)(Cl)Cl)C(O)=O Amb24399501 [0,1,1,0,0,0|2,0,0]=4 3128 B9R0.57 NC(CS(O)(=O)=O)C(O)=O Amb21929317 [0,1,1,0,0,0|2,0,0]=4 3129 B9R0.57 N[C@@H](C(=O)O)CC(C)(C)C Amb16184025 [0,1,1,0,0,0|1,0,0]=3 3130 B9R0.57 N[C@@H](CC(F)(F)F)C(O)=O Amb19889287 [0,1,1,0,0,0|2,0,0]=4 3131 B9R0.57 N[C@@H](CS(O)(=O)=O)C(O)=O Amb17942867 [0,1,1,0,0,0|2,0,0]=4 3132 B9R0.57 N[C@H](CC(F)(F)F)C(O)=O Amb19889286 [0,1,1,0,0,0|2,0,0]=4 3133 B9R0.57 OC(=O)[C@H](C[C](=O)(O)C)N Amb10604178 [0,1,1,0,0,0|0,0,1]=3 3134 B9R0.57 [2H]C([2H])([2H])C[C@@H](N)C(O)=O Amb19130400 [0,1,1,0,0,0|2,0,0]=4 3135 B9R0.79 CC(=O)C(C)C(N)C(O)=O Amb18202116 [0,1,1,0,0,0|0,0,2]=4 3136 B9R0.79 CC(=O)[C@@H](C)[C@H](N)C(O)=O Amb25703453 [0,1,1,0,0,0|0,0,2]=4 3137 B9R0.79 CC(C(C)O)C(=O)C(O)=O Amb24454984 [0,1,1,0,0,0|1,0,1]=4 3138 B9R0.79 CC(C(N)C(O)=O)C(Cl)Cl Amb24412209 [0,1,1,0,0,0|2,0,0]=4 3139 B9R0.79 CC(C)C(C)C(C)C(O)=O Amb18124692 [0,1,1,0,0,0|2,0,0]=4 3140 B9R0.79 CC(C)C(C)C(F)C(O)=O Amb25853148 [0,1,1,0,0,0|2,0,0]=4 3141 B9R0.79 CC(C)C(Cl)C(N)C(O)=O Amb25779528 [0,1,1,0,0,0|1,0,0]=3 3142 B9R0.79 CC(C)C(O)C(Br)C(O)=O Amb25313138 [0,1,1,0,0,0|2,0,0]=4 3143 B9R0.79 CC(C)C(O)C(C)C(O)=O Amb18990636 [0,1,1,0,0,0|2,0,0]=4 3144 B9R0.79 CC(C)C(O)C(Cl)C(O)=O Amb25275308 [0,1,1,0,0,0|2,0,0]=4 3145 B9R0.79 CC(C)C(O)C(N)C(O)=O Amb23399656 [0,1,1,0,0,0|1,0,0]=3 3146 B9R0.79 CC(C)C(O)[C@@H](N)C(O)=O Amb19130451 [0,1,1,0,0,0|1,0,0]=3 3147 B9R0.79 CC(C)C(O)[C@H](N)C(O)=O Amb24509492 [0,1,1,0,0,0|1,0,0]=3 3148 B9R0.79 CC(C)[C@@H](C)[C@@H](N)C(O)=O Amb24670804 [0,1,1,0,0,0|1,0,0]=3 3149 B9R0.79 CC(C)[C@@H](C)[C@H](N)C(O)=O Amb25061907 [0,1,1,0,0,0|1,0,0]=3 3150 B9R0.79 CC(C)[C@@H](C)[C@H](O)C(O)=O Amb24447350 [0,1,1,0,0,0|2,0,0]=4 3151 B9R0.79 CC(C)[C@@H](F)[C@@H](N)C(O)=O Amb22802115 [0,1,1,0,0,0|1,0,0]=3 3152 B9R0.79 CC(C)[C@@H](N)C(O)C(O)=O Amb25258947 [0,1,1,0,0,0|2,0,0]=4 3153 B9R0.79 CC(C)[C@@H](O)[C@@H](N)C(O)=O Amb22224932 [0,1,1,0,0,0|1,0,0]=3 3154 B9R0.79 CC(C)[C@@H](O)[C@@H](O)C(O)=O Amb25222321 [0,1,1,0,0,0|2,0,0]=4 3155 B9R0.79 CC(C)[C@@H](O)[C@H](O)C(O)=O Amb24550312 [0,1,1,0,0,0|2,0,0]=4 3156 B9R0.79 CC(C)[C@@H](S)[C@H](N)C(O)=O Amb25302326 [0,1,1,0,0,0|1,0,0]=3 3157 B9R0.79 CC(C)[C@H](C)[C@@H](N)C(O)=O Amb25147401 [0,1,1,0,0,0|1,0,0]=3 3158 B9R0.79 CC(C)[C@H](C)[C@H](O)C(O)=O Amb24548143 [0,1,1,0,0,0|2,0,0]=4 3159 B9R0.79 CC(C)[C@H](N)C(O)C(O)=O Amb24744520 [0,1,1,0,0,0|2,0,0]=4 3160 B9R0.79 CC(C)[C@H](N)[C@@H](F)C(O)=O Amb24629885 [0,1,1,0,0,0|2,0,0]=4 3161 B9R0.79 CC(C)[C@H](N)[C@@H](O)C(O)=O Amb24428177 [0,1,1,0,0,0|2,0,0]=4 3162 B9R0.79 CC(C)[C@H](N)[C@H](O)C(O)=O Amb25147282 [0,1,1,0,0,0|2,0,0]=4 3163 B9R0.79 CC(C)[C@H](O)[C@@H](Br)C(O)=O Amb24598278 [0,1,1,0,0,0|2,0,0]=4 3164 B9R0.79 CC(N)C(C)C(C)C(O)=O Amb25828384 [0,1,1,0,0,0|2,0,0]=4 3165 B9R0.79 CC(O)C(C)C(N)C(O)=O Amb21953714 [0,1,1,0,0,0|0,0,0]=2 3166 B9R0.79 CC(O)C(C)[C@@H](N)C(O)=O Amb22800202 [0,1,1,0,0,0|0,0,0]=2 3167 B9R0.79 CC(O)C(O)C(O)C(C)=O Amb25145498 [0,1,1,0,0,0|2,0,0]=4 3168 B9R0.79 CC(O)[C@@H](C)[C@@H](N)C(O)=O Amb24052812 [0,1,1,0,0,0|0,0,0]=2 3169 B9R0.79 CC([C@@H](N)C(O)=O)C(O)=O Amb22745450 [0,1,1,0,0,0|1,0,1]=4 3170 B9R0.79 CC([C@@H]([C@@H](C(=O)O)N)C)O Amb10603785 [0,1,1,0,0,0|0,0,0]=2 3171 B9R0.79 CC([C@@H]([C@H](C(=O)O)C)O)C Amb10844253 [0,1,1,0,0,0|2,0,0]=4 3172 B9R0.79 CC([C@@H]([C@H](C(=O)O)N)O)C Amb10807407 [0,1,1,0,0,0|1,0,0]=3 3173 B9R0.79 CN(O)C(C)C(C)C(O)=O Amb24540667 [0,1,1,0,0,0|2,0,0]=4 3174 B9R0.79 C[C@@H](O)C(O)[C@H](N)C(O)=O Amb24435507 [0,1,1,0,0,0|0,0,0]=2 3175 B9R0.79 C[C@@H](O)[C@@H](C)[C@@H](N)C(O)=O Amb25693814 [0,1,1,0,0,0|0,0,0]=2 3176 B9R0.79 C[C@@H](O)[C@@H](C)[C@H](N)C(O)=O Amb24340188 [0,1,1,0,0,0|0,0,0]=2 3177 B9R0.79 C[C@@H](O)[C@@H](O)[C@@H](O)C(C)=O Amb24661092 [0,1,1,0,0,0|2,0,0]=4 3178 B9R0.79 C[C@@H](O)[C@H](O)[C@@H](O)C(O)=O Amb24482345 [0,1,1,0,0,0|1,0,0]=3 3179 B9R0.79 C[C@@H](O)[C@H](O)[C@H](O)C(O)=O Amb24711187 [0,1,1,0,0,0|1,0,0]=3 3180 B9R0.79 C[C@@H]([C@H](N)C(O)=O)C(O)=O Amb22756698 [0,1,1,0,0,0|1,0,1]=4 3181 B9R0.79 C[C@@H]([C@H](O)[C@H](C)N)C(O)=O Amb24563136 [0,1,1,0,0,0|2,0,0]=4 3182 B9R0.79 C[C@H](O)C(C)[C@H](N)C(O)=O Amb22735316 [0,1,1,0,0,0|0,0,0]=2 3183 B9R0.79 C[C@H](O)[C@@H](O)[C@@H](O)C(N)=O Amb24712923 [0,1,1,0,0,0|2,0,0]=4 3184 B9R0.79 C[C@H](O)[C@@H](O)[C@@H](O)C(O)=O Amb25374422 [0,1,1,0,0,0|1,0,0]=3 3185 B9R0.79 C[C@H]([C@@H]([C@@H](C(=O)O)N)C)O Amb17615448 [0,1,1,0,0,0|0,0,0]=2 3186 B9R0.79 C[C@H]([C@H](N)C(O)=O)C(C)Cl Amb25363328 [0,1,1,0,0,0|1,0,0]=3 3187 B9R0.79 C[C@H]([C@H](N)C(O)=O)C(O)=O Amb25324829 [0,1,1,0,0,0|1,0,1]=4 3188 B9R0.79 NC(C(Br)C(O)=O)C(O)=O Amb18657078 [0,1,1,0,0,0|1,0,1]=4 3189 B9R0.79 NC(C(Cl)C(Cl)Cl)C(O)=O Amb24375729 [0,1,1,0,0,0|2,0,0]=4 3190 B9R0.79 NC(C(Cl)C(O)=O)C(O)=O Amb18126453 [0,1,1,0,0,0|1,0,1]=4 3191 B9R0.79 NC(C(F)C(O)=O)C(O)=O Amb24061061 [0,1,1,0,0,0|1,0,1]=4 3192 B9R0.79 NC(C(N)C(O)=O)C(O)=O Amb18124865 [0,1,1,0,0,0|1,0,1]=4 3193 B9R0.79 NC(C(N)C(O)=O)C(O)=O Amb24117894 [0,1,1,0,0,0|1,0,1]=4 3194 B9R0.79 NC(C(O)C(F)F)C(O)=O Amb19148422 [0,1,1,0,0,0|2,0,0]=4 3195 B9R0.79 NC([C@H](O)C(O)=O)C(O)=O Amb24513602 [0,1,1,0,0,0|1,0,1]=4 3196 B9R0.79 N[C@@H](C(O)C(O)=O)C(O)=O Amb22229324 [0,1,1,0,0,0|1,0,1]=4 3197 B9R0.79 N[C@@H]([C@@H](O)C(O)=O)C(O)=O Amb24087715 [0,1,1,0,0,0|1,0,1]=4 3198 B9R0.79 N[C@@H]([C@@H](O)C(O)=O)C(O)=O Amb24117974 [0,1,1,0,0,0|1,0,1]=4 3199 B9R0.79 N[C@H]([C@@H](C(=O)O)N)C(=O)O Amb10072362 [0,1,1,0,0,0|1,0,1]=4 3200 B9R0.79 N[C@H]([C@@H](F)C(O)=O)C(O)=O Amb22229006 [0,1,1,0,0,0|1,0,1]=4 3201 B9R0.79 N[C@H]([C@@H](N)C(O)=O)C(O)=O Amb22802394 [0,1,1,0,0,0|1,0,1]=4 3202 B9R0.79 N[C@H]([C@@H](O)C(O)=O)C(O)=O Amb17942870 [0,1,1,0,0,0|1,0,1]=4 3203 B9R0.79 N[C@H]([C@H](F)C(O)=O)C(O)=O Amb24634454 [0,1,1,0,0,0|1,0,1]=4 3204 B9R0.79 OC(=O)C(C(C(=O)O)C)N Amb2099482 [0,1,1,0,0,0|1,0,1]=4 3205 B9R0.79 OC(=O)[C@H](C(C(=O)O)C)N Amb16232531 [0,1,1,0,0,0|1,0,1]=4 3206 B9R0.79 OC(=O)[C@H]([C@@H](C(=O)O)N)O Amb17615140 [0,1,1,0,0,0|1,0,1]=4 3207 B9R0.1 C=C(Br)CNCC(O)CF Amb24738331 [0,1,1,0,0,0|2,0,0]=4 3208 B9R0.1 C=CC(O)CCCC(O)=O Amb25137244 [0,1,1,0,0,0|1,0,1]=4 3209 B9R0.1 C=CC(O)CSCC(O)=O Amb25092349 [0,1,1,0,0,0|1,0,1]=4 3210 B9R0.1 C=C[C@@H](O)CCCC(O)=O Amb24352126 [0,1,1,0,0,0|1,0,1]=4 3211 B9R0.1 C=C[C@H](O)CSCC(O)=O Amb24482220 [0,1,1,0,0,0|1,0,1]=4 3212 B9R0.1 CC(=C)CNCC(=O)OC Amb25139895 [0,1,1,0,0,0|1,0,1]=4 3213 B9R0.1 CC(=C)CNCC(O)CF Amb25263943 [0,1,1,0,0,0|2,0,0]=4 3214 B9R0.1 CC(=C)CNCC(O)CO Amb25100715 [0,1,1,0,0,0|2,0,0]=4 3215 B9R0.1 CC(=C)CNC[C@H](O)CO Amb25363682 [0,1,1,0,0,0|2,0,0]=4 3216 B9R0.1 CC(C)CSCC(=O)NO Amb24380503 [0,1,1,0,0,0|2,0,0]=4 3217 B9R0.1 CC(C=C)ONCC(O)=O Amb24658665 [0,1,1,0,0,0|2,0,0]=4 3218 B9R0.1 CC(CCCC(O)=O)C#N Amb18643710 [0,1,1,0,0,0|2,0,0]=4 3219 B9R0.1 CC(CCCC(O)=O)C=C Amb24716210 [0,1,1,0,0,0|2,0,0]=4 3220 B9R0.1 CC(CCCC(O)=O)CO Amb25068017 [0,1,1,0,0,0|1,0,0]=3 3221 B9R0.1 CC(CCl)CCCC(O)=O Amb18646189 [0,1,1,0,0,0|2,0,0]=4 3222 B9R0.1 CC(CN)CNCC(O)=O Amb25773527 [0,1,1,0,0,0|1,0,0]=3 3223 B9R0.1 CC(CNCC(C)O)OC Amb25859050 [0,1,1,0,0,0|1,0,1]=4 3224 B9R0.1 CC(CNCC(N)=O)CN Amb25185175 [0,1,1,0,0,0|2,0,0]=4 3225 B9R0.1 CC(CNCC(O)=O)=CCl Amb24482539 [0,1,1,0,0,0|1,0,1]=4 3226 B9R0.1 CC(CNCC(O)=O)C#N Amb25027854 [0,1,1,0,0,0|1,0,0]=3 3227 B9R0.1 CC(CNC[C@H](C)O)OC Amb24360707 [0,1,1,0,0,0|1,0,1]=4 3228 B9R0.1 CC(CO)CNCC(=C)Br Amb24637572 [0,1,1,0,0,0|2,0,0]=4 3229 B9R0.1 CC(CO)CNCC(=C)Cl Amb24466435 [0,1,1,0,0,0|2,0,0]=4 3230 B9R0.1 CC(CO)CNCC(C)=C Amb24529752 [0,1,1,0,0,0|2,0,0]=4 3231 B9R0.1 CC(CO)CSCC(C)=O Amb24702606 [0,1,1,0,0,0|2,0,0]=4 3232 B9R0.1 CC(CO)NCCC(O)=O Amb17719769 [0,1,1,0,0,0|2,0,0]=4 3233 B9R0.1 CC(O)CCCC(=O)C=C Amb24478307 [0,1,1,0,0,0|2,0,0]=4 3234 B9R0.1 CC(O)CCCC(=O)NN Amb24352284 [0,1,1,0,0,0|2,0,0]=4 3235 B9R0.1 CC(O)CCNC(=O)CO Amb24482704 [0,1,1,0,0,0|2,0,0]=4 3236 B9R0.1 CC(O)CNCC(C)CO Amb25742842 [0,1,1,0,0,0|1,0,1]=4 3237 B9R0.1 CC(O)CNCC(Cl)=CCl Amb24367611 [0,1,1,0,0,0|2,0,0]=4 3238 B9R0.1 CC(O)CNCC(O)CF Amb25347347 [0,1,1,0,0,0|1,0,1]=4 3239 B9R0.1 CC(O)CNC[C@@H](O)CC Amb25839101 [0,1,1,0,0,0|1,0,1]=4 3240 B9R0.1 CC(O)COCC(=O)CO Amb24371356 [0,1,1,0,0,0|1,0,0]=3 3241 B9R0.1 CCC(=C)CNCC(C)O Amb24474489 [0,1,1,0,0,0|2,0,0]=4 3242 B9R0.1 CCC(=C)CNC[C@@H](C)O Amb25707181 [0,1,1,0,0,0|2,0,0]=4 3243 B9R0.1 CCC(=C)CNC[C@H](C)O Amb24678199 [0,1,1,0,0,0|2,0,0]=4 3244 B9R0.1 CCC(=O)CCC[C@H](C)O Amb25723337 [0,1,1,0,0,0|2,0,0]=4 3245 B9R0.1 CCC(C)CCCC(O)=O Amb18124682 [0,1,1,0,0,0|2,0,0]=4 3246 B9R0.1 CCC(C)CSCC(O)=O Amb18800668 [0,1,1,0,0,0|2,0,0]=4 3247 B9R0.1 CCC(N)COCC(O)=O Amb18630610 [0,1,1,0,0,0|2,0,0]=4 3248 B9R0.1 CCC(O)CCCC(C)=O Amb25146602 [0,1,1,0,0,0|2,0,0]=4 3249 B9R0.1 CCC(O)CCCC(O)=O Amb18644263 [0,1,1,0,0,0|1,0,0]=3 3250 B9R0.1 CCC(O)CNCC(=C)Br Amb25804653 [0,1,1,0,0,0|2,0,0]=4 3251 B9R0.1 CCC(O)CNCC(=C)Cl Amb25147732 [0,1,1,0,0,0|2,0,0]=4 3252 B9R0.1 CCC(O)COCC(O)=O Amb25805810 [0,1,1,0,0,0|1,0,0]=3 3253 B9R0.1 CCC(O)CSCC(O)=O Amb18792573 [0,1,1,0,0,0|1,0,0]=3 3254 B9R0.1 CC[C@@H](O)CNCC(=C)Br Amb24633666 [0,1,1,0,0,0|2,0,0]=4 3255 B9R0.1 CC[C@@H](O)CNCC(=C)Cl Amb24735703 [0,1,1,0,0,0|2,0,0]=4 3256 B9R0.1 CC[C@@H](O)CNCC(C)=C Amb24504852 [0,1,1,0,0,0|2,0,0]=4 3257 B9R0.1 CC[C@H](O)CNCC(C)=C Amb25134861 [0,1,1,0,0,0|2,0,0]=4 3258 B9R0.1 CC[C@H](O)CNCC(N)=O Amb24658160 [0,1,1,0,0,0|1,0,0]=3 3259 B9R0.1 CNC(=O)CSCC(C)O Amb24402730 [0,1,1,0,0,0|2,0,0]=4 3260 B9R0.1 CNC(=O)CSC[C@H](C)O Amb25169392 [0,1,1,0,0,0|2,0,0]=4 3261 B9R0.1 COC(=O)CCCC(C)Br Amb24346809 [0,1,1,0,0,0|2,0,0]=4 3262 B9R0.1 COC(=O)CCCC(C)C Amb22586581 [0,1,1,0,0,0|2,0,0]=4 3263 B9R0.1 COC(=O)CCCC(C)Cl Amb24626627 [0,1,1,0,0,0|2,0,0]=4 3264 B9R0.1 COC(=O)CCCC(C)O Amb24414468 [0,1,1,0,0,0|1,0,0]=3 3265 B9R0.1 COC(=O)CNCC(F)F Amb18179465 [0,1,1,0,0,0|2,0,0]=4 3266 B9R0.1 COC(=O)CNC[C@H](C)O Amb25773564 [0,1,1,0,0,0|0,0,0]=2 3267 B9R0.1 COC(=O)CNOC(C)C Amb25707401 [0,1,1,0,0,0|2,0,0]=4 3268 B9R0.1 COC(=O)COCC(C)Cl Amb25257984 [0,1,1,0,0,0|2,0,0]=4 3269 B9R0.1 COC(=O)CSCC(C)O Amb18792574 [0,1,1,0,0,0|1,0,0]=3 3270 B9R0.1 COC(=O)CSC[C@@H](C)O Amb24375131 [0,1,1,0,0,0|1,0,0]=3 3271 B9R0.1 COC(=O)CSC[C@H](C)N Amb24396440 [0,1,1,0,0,0|2,0,0]=4 3272 B9R0.1 COC(=O)CSC[C@H](C)O Amb24375132 [0,1,1,0,0,0|1,0,0]=3 3273 B9R0.1 COC(=O)NCCC(C)O Amb24747341 [0,1,1,0,0,0|2,0,0]=4 3274 B9R0.1 COC(=O)NCC[C@@H](C)O Amb24353280 [0,1,1,0,0,0|2,0,0]=4 3275 B9R0.1 COC(=O)\C=C\CC(C)O Amb24396746 [0,1,1,0,0,0|1,0,1]=4 3276 B9R0.1 COC(C)CCCC(C)=O Amb25146522 [0,1,1,0,0,0|2,0,0]=4 3277 B9R0.1 COC(C)CCCC(O)=O Amb25728362 [0,1,1,0,0,0|1,0,0]=3 3278 B9R0.1 COC(C)CNCC(O)=O Amb25695493 [0,1,1,0,0,0|0,0,0]=2 3279 B9R0.1 CSC(C)CCCC(O)=O Amb25265803 [0,1,1,0,0,0|1,1,0]=4 3280 B9R0.1 CSC(C)CNCC(N)=O Amb25766612 [0,1,1,0,0,0|1,1,0]=4 3281 B9R0.1 CSC(C)CNCC(O)=O Amb25137618 [0,1,1,0,0,0|0,1,0]=3 3282 B9R0.1 C[C@@H](CCCC(O)=O)C=C Amb24447465 [0,1,1,0,0,0|2,0,0]=4 3283 B9R0.1 C[C@@H](O)CCNC(=O)CO Amb24570702 [0,1,1,0,0,0|2,0,0]=4 3284 B9R0.1 C[C@@H](O)CNCC(O)CO Amb25140331 [0,1,1,0,0,0|0,0,2]=4 3285 B9R0.1 C[C@H](CCCC(O)=O)C=C Amb25367325 [0,1,1,0,0,0|2,0,0]=4 3286 B9R0.1 C[C@H](CO)CCCC(C)=O Amb25335279 [0,1,1,0,0,0|2,0,0]=4 3287 B9R0.1 C[C@H](O)CCNC(=O)CO Amb25358407 [0,1,1,0,0,0|2,0,0]=4 3288 B9R0.1 C[C@H](O)CNCC(C)CO Amb25303273 [0,1,1,0,0,0|1,0,1]=4 3289 B9R0.1 C\C(\CNCC(O)=O)=C/C Amb24351586 [0,1,1,0,0,0|1,0,1]=4 3290 B9R0.1 C\C(\CNCC(O)=O)=C\C Amb25175094 [0,1,1,0,0,0|1,0,1]=4 3291 B9R0.1 NC(=O)CNCC(O)CO Amb25096977 [0,1,1,0,0,0|1,0,0]=3 3292 B9R0.1 NC(=O)COCC(O)CCl Amb24675285 [0,1,1,0,0,0|2,0,0]=4 3293 B9R0.1 NC(=O)CSCC(O)CBr Amb25169390 [0,1,1,0,0,0|2,0,0]=4 3294 B9R0.1 NC(=O)CSCC(O)CCl Amb25169389 [0,1,1,0,0,0|2,0,0]=4 3295 B9R0.1 NC(CS)CCCC(O)=O Amb25706315 [0,1,1,0,0,0|2,0,0]=4 3296 B9R0.1 NCC(N)CCCC(O)=O Amb24375177 [0,1,1,0,0,0|2,0,0]=4 3297 B9R0.1 NCC(N)COCC(O)=O Amb24677956 [0,1,1,0,0,0|2,0,0]=4 3298 B9R0.1 NC[C@@H](N)CCCC(O)=O Amb25147297 [0,1,1,0,0,0|2,0,0]=4 3299 B9R0.1 N[C@@H](CS)CCCC(O)=O Amb25288626 [0,1,1,0,0,0|2,0,0]=4 3300 B9R0.1 N[C@H](CS)CCCC(O)=O Amb24482180 [0,1,1,0,0,0|2,0,0]=4 3301 B9R0.1 OC(=O)CCCC(Cl)CCl Amb18649051 [0,1,1,0,0,0|2,0,0]=4 3302 B9R0.1 OC(=O)CNCC(S)C=O Amb24482295 [0,1,1,0,0,0|0,1,1]=4 3303 B9R0.1 OC(=O)COCC(S)CS Amb18129098 [0,1,1,0,0,0|1,1,0]=4 3304 B9R0.1 OCC(CNCC(O)C)O Amb17308666 [0,1,1,0,0,0|0,0,2]=4 3305 B9R0.1 OCC(O)C=NCC(O)=O Amb25113464 [0,1,1,0,0,0|0,0,2]=4 3306 B9R0.1 OCC(O)CNCC(O)=O Amb24360971 [0,1,1,0,0,0|0,0,0]=2 3307 B9R0.1 OCC(O)COCC(O)=O Amb24534716 [0,1,1,0,0,0|1,0,0]=3 3308 B9R0.53 CC(C)CC(=C)CC(O)=O Amb18643897 [0,1,1,0,0,0|2,0,0]=4 3309 B9R0.53 CC(C)CS(=O)CC(O)=O Amb18792576 [0,1,1,0,0,0|2,0,0]=4 3310 B9R0.53 CC(C)C[C@@H](C)CC(O)=O Amb24455134 [0,1,1,0,0,0|2,0,0]=4 3311 B9R0.53 CC(C)C[C@H](N)CC(O)=O Amb19944305 [0,1,1,0,0,0|2,0,0]=4 3312 B9R0.53 CC(C)C[C@H](O)CC(O)=O Amb24505145 [0,1,1,0,0,0|2,0,0]=4 3313 B9R0.53 CC(CC(CC(=O)O)N)C Amb2438867 [0,1,1,0,0,0|2,0,0]=4 3314 B9R0.53 CC(CC(CC(=O)O)O)C Amb17232005 [0,1,1,0,0,0|2,0,0]=4 3315 B9R0.53 CC(CN(CC(O)C)C)O Amb17334272 [0,1,1,0,0,0|1,0,1]=4 3316 B9R0.53 CC(C[C@@H](CC(=O)O)C)C Amb10844383 [0,1,1,0,0,0|2,0,0]=4 3317 B9R0.53 CC(C[C@@H](CC(=O)O)N)C Amb16184017 [0,1,1,0,0,0|2,0,0]=4 3318 B9R0.53 CC(N)CN(C)CC(N)=O Amb25060268 [0,1,1,0,0,0|2,0,0]=4 3319 B9R0.53 CC(N)CN(C)CC(O)=O Amb25140627 [0,1,1,0,0,0|1,0,0]=3 3320 B9R0.53 CC(O)CN(C)CC(=C)Cl Amb18798255 [0,1,1,0,0,0|2,0,0]=4 3321 B9R0.53 CC(O)CN(C)CC(C)=O Amb24441836 [0,1,1,0,0,0|1,0,0]=3 3322 B9R0.53 CC(O)CN(C)CC(N)=S Amb18798162 [0,1,1,0,0,0|1,1,0]=4 3323 B9R0.53 CC(O)CN(C)CC(O)=O Amb18312778 [0,1,1,0,0,0|0,0,0]=2 3324 B9R0.53 CN(CC(=O)O)CC(=O)O Amb1156001 [0,1,1,0,0,0|1,0,1]=4 3325 B9R0.53 CN(CC(F)F)CC(O)=O Amb18177927 [0,1,1,0,0,0|2,0,0]=4 3326 B9R0.53 CN(C[C@H](C)O)CC(C)O Amb25212185 [0,1,1,0,0,0|1,0,1]=4 3327 B9R0.53 CN(O)CC(O)CC(O)=O Amb24611959 [0,1,1,0,0,0|2,0,0]=4 3328 B9R0.53 C[C@H](N)C[C@H](N)CC(O)=O Amb24418565 [0,1,1,0,0,0|2,0,0]=4 3329 B9R0.53 OC(=O)CN(Br)CC(O)=O Amb25277216 [0,1,1,0,0,0|1,0,1]=4 3330 B9R0.53 OC(=O)CN(Cl)CC(O)=O Amb24482142 [0,1,1,0,0,0|1,0,1]=4 3331 B9R0.53 ON(CC(O)=O)CC(O)=O Amb25062474 [0,1,1,0,0,0|1,0,1]=4 3332 B9R0.53 [NH3+]N(CC(O)=O)CC(O)=O Amb23453377 [0,1,1,0,0,0|1,0,1]=4 3333 B9R0.53 [NH3+]N(CC(O)=O)CC(O)=O Amb24121533 [0,1,1,0,0,0|1,0,1]=4 3334 B9R0.56 CC(=C)CNCC(C)(C)O Amb24662791 [0,1,1,0,0,0|2,0,0]=4 3335 B9R0.56 CC(=O)CCCC(O)(C)C Amb17593627 [0,1,1,0,0,0|2,0,0]=4 3336 B9R0.56 CC(=O)NNCC(C)(C)O Amb25741973 [0,1,1,0,0,0|2,0,0]=4 3337 B9R0.56 CC(C)(C)CCCC(O)=O Amb18307485 [0,1,1,0,0,0|2,0,0]=4 3338 B9R0.56 CC(C)(C)CNCC(N)=O Amb18315719 [0,1,1,0,0,0|2,0,0]=4 3339 B9R0.56 CC(C)(C)CNCC(O)=O Amb19012829 [0,1,1,0,0,0|1,0,0]=3 3340 B9R0.56 CC(C)(C)COCC(O)=O Amb25079059 [0,1,1,0,0,0|2,0,0]=4 3341 B9R0.56 CC(C)(C)ONCC(O)=O Amb25767797 [0,1,1,0,0,0|2,0,0]=4 3342 B9R0.56 CC(C)(F)CCCC(O)=O Amb25270576 [0,1,1,0,0,0|2,0,0]=4 3343 B9R0.56 CC(C)(F)COCC(O)=O Amb25234238 [0,1,1,0,0,0|2,0,0]=4 3344 B9R0.56 CC(C)(F)CSCC(O)=O Amb24596449 [0,1,1,0,0,0|2,0,0]=4 3345 B9R0.56 CC(C)(N)CCCC(O)=O Amb25839402 [0,1,1,0,0,0|2,0,0]=4 3346 B9R0.56 CC(C)(N)CNCC(O)=O Amb24415937 [0,1,1,0,0,0|1,0,0]=3 3347 B9R0.56 CC(C)(N)COCC(O)=O Amb18630788 [0,1,1,0,0,0|2,0,0]=4 3348 B9R0.56 CC(C)(N)CSCC(O)=O Amb25831613 [0,1,1,0,0,0|2,0,0]=4 3349 B9R0.56 CC(C)(O)CCCC(O)=O Amb24340189 [0,1,1,0,0,0|1,0,0]=3 3350 B9R0.56 CC(C)(O)CNCC(=C)Br Amb25336430 [0,1,1,0,0,0|2,0,0]=4 3351 B9R0.56 CC(C)(O)CNCC(=C)Cl Amb25741693 [0,1,1,0,0,0|2,0,0]=4 3352 B9R0.56 CC(C)(O)CNCC(N)=O Amb18304038 [0,1,1,0,0,0|1,0,0]=3 3353 B9R0.56 CC(C)(O)CNCC(O)=O Amb18304065 [0,1,1,0,0,0|0,0,0]=2 3354 B9R0.56 CC(C)(O)CSCC(O)=O Amb18307056 [0,1,1,0,0,0|1,0,0]=3 3355 B9R0.56 CC(C)(O)C\C=C\C(O)=O Amb18644104 [0,1,1,0,0,0|1,0,1]=4 3356 B9R0.56 CC(C)CNCP(O)(O)=O Amb25685379 [0,1,1,0,0,0|2,0,0]=4 3357 B9R0.56 CC(O)CNCC(C)(C)O Amb18304051 [0,1,1,0,0,0|1,0,1]=4 3358 B9R0.56 CP(C)(=O)CNCC(O)=O Amb25339632 [0,1,1,0,0,0|1,0,1]=4 3359 B9R0.56 CP(O)(=O)CCCC(O)=O Amb24524573 [0,1,1,0,0,0|2,0,0]=4 3360 B9R0.56 CP(O)(=O)CNCC(O)=O Amb25772534 [0,1,1,0,0,0|1,0,0]=3 3361 B9R0.56 C[C@H](O)CNCC(C)(C)O Amb24555845 [0,1,1,0,0,0|1,0,1]=4 3362 B9R0.56 C[Si](C)(C)CNCC(O)=O Amb24711223 [0,1,1,0,0,0|1,1,0]=4 3363 B9R0.56 OC(=O)CCCC(F)(F)C Amb17593778 [0,1,1,0,0,0|2,0,0]=4 3364 B9R0.56 OC(=O)CNCC(F)(F)F Amb19372984 [0,1,1,0,0,0|2,0,0]=4 3365 B9R0.56 OC(=O)CNCC(O)(O)O Amb24482160 [0,1,1,0,0,0|1,0,0]=3 3366 B9R0.56 OC(=O)CNCP(O)(=O)=O Amb25282213 [0,1,1,0,0,0|2,0,0]=4 3367 B9R0.56 OC(=O)CNCP(O)(O)=O Amb21618824 [0,1,1,0,0,0|2,0,0]=4 3368 B9R0.56 OC(=O)CN[13CH2]P(O)(O)=O Amb22367405 [0,1,1,0,0,0|2,0,0]=4 3369 B9R0.56 O[13C](=O)[13CH2][15NH]CP(=O)(O)O Amb17614840 [0,1,1,0,0,0|2,0,0]=4 3370 B9R1.7 C=CCC1CC(O)CN1 Amb18642526 [1,1,0,0,0,0|1,0,0]=3 3371 B9R1.7 C=CCC1CCC(O)C1 Amb25187233 [1,1,0,0,0,0|2,0,0]=4 3372 B9R1.7 C=CC[C@@H]1CC(O)CN1 Amb24713577 [1,1,0,0,0,0|1,0,0]=3 3373 B9R1.7 C=CC[C@@H]1CC[C@@H](O)C1 Amb25746173 [1,1,0,0,0,0|2,0,0]=4 3374 B9R1.7 C=CC[C@H]1C[C@@H](O)CN1 Amb24549566 [1,1,0,0,0,0|1,0,0]=3 3375 B9R1.7 C=CC[C@H]1C[C@H](O)CO1 Amb25271510 [1,1,0,0,0,0|2,0,0]=4 3376 B9R1.7 CC1CC(CC1)CC=O Amb18642465 [1,1,0,0,0,0|2,0,0]=4 3377 B9R1.7 CCCC1CC(O)CN1 Amb24428583 [1,1,0,0,0,0|1,0,1]=4 3378 B9R1.7 COCC1CC(F)CN1 Amb25245289 [1,1,0,0,0,0|1,0,1]=4 3379 B9R1.7 COCC1CC(O)CN1 Amb25102542 [1,1,0,0,0,0|0,0,1]=3 3380 B9R1.7 COCC1CCC(O)C1 Amb25692823 [1,1,0,0,0,0|1,0,1]=4 3381 B9R1.7 COC[C@@H]1C[C@H](O)CN1 Amb25841067 [1,1,0,0,0,0|0,0,1]=3 3382 B9R1.7 OC1CC(CC1)CC=O Amb24646684 [1,1,0,0,0,0|1,0,0]=3 3383 B9R1.7 OC1CN(CC=O)CC1 Amb24400602 [1,1,0,0,0,0|2,0,0]=4 3384 B9R1.7 OC1CNC(C1)CCO Amb25312112 [1,1,0,0,0,0|0,0,1]=3 3385 B9R1.7 OC1COC(C1)=CC=O Amb25298550 [1,1,0,0,0,0|1,0,1]=4 3386 B9R1.7 O[C@@H]1CC[C@H](C1)CCO Amb24719687 [1,1,0,0,0,0|1,0,1]=4 3387 B9R1.21 CCC1CC(CC1)C=O Amb25312233 [1,1,0,0,0,0|2,0,0]=4 3388 B9R1.21 CCC1CC(CN1)OC Amb23453856 [1,1,0,0,0,0|1,0,1]=4 3389 B9R1.21 CC[C@H]1C[C@@H](CO)NC1 Amb24547528 [1,1,0,0,0,0|1,0,1]=4 3390 B9R1.21 CNC1CC(CC1)C=O Amb24374756 [1,1,0,0,0,0|2,0,0]=4 3391 B9R1.21 CNC1CNC(C1)CO Amb24433815 [1,1,0,0,0,0|1,0,1]=4 3392 B9R1.21 CN[C@@H]1CN[C@@H](C1)CO Amb24551897 [1,1,0,0,0,0|1,0,1]=4 3393 B9R1.21 COC1CC(CO1)C=O Amb25269556 [1,1,0,0,0,0|2,0,0]=4 3394 B9R1.21 COC1CNC(CCl)C1 Amb24738353 [1,1,0,0,0,0|1,0,1]=4 3395 B9R1.21 COC1CNC(CN)C1 Amb18281953 [1,1,0,0,0,0|1,0,1]=4 3396 B9R1.21 CSC1CNC(CO)C1 Amb25172160 [1,1,0,0,0,0|0,1,1]=4 3397 B9R1.21 N#CC1CC(CC1)C=O Amb25147099 [1,1,0,0,0,0|2,0,0]=4 3398 B9R1.21 N#C[C@@H]1C[C@@H](CC1)C=O Amb25264820 [1,1,0,0,0,0|2,0,0]=4 3399 B9R1.21 O=CC1CC(CC1)C=O Amb18642420 [1,1,0,0,0,0|1,0,1]=4 3400 B9R1.21 O=C[C@@H]1C[C@H](CC1)C=O Amb24715887 [1,1,0,0,0,0|1,0,1]=4 3401 B9R1.21 O=C[C@H]1C[C@H](CC1)C=O Amb24392142 [1,1,0,0,0,0|1,0,1]=4 3402 B9R1.21 OCC1CCC(C=O)O1 Amb18642773 [1,1,0,0,0,0|2,0,0]=4 3403 B9R1.21 OCC1CN(CC1)C=O Amb24737938 [1,1,0,0,0,0|2,0,0]=4 3404 B9R1.21 OC[C@@H]1CCC(C=O)O1 Amb25773392 [1,1,0,0,0,0|2,0,0]=4 3405 B9R1.21 OC[C@@H]1CC[C@@H](C=O)O1 Amb24628915 [1,1,0,0,0,0|2,0,0]=4 3406 B9R1.21 OC[C@H]1C[C@H](CC1)CO Amb25847797 [1,1,0,0,0,0|1,0,1]=4 3407 B9R1.22 CCC1CC(O)CN1C Amb23453955 [1,1,0,0,0,0|1,0,1]=4 3408 B9R1.22 CN1CC(F)CC1CO Amb24753799 [1,1,0,0,0,0|1,0,1]=4 3409 B9R1.22 CN1CC(S)CC1CO Amb24745804 [1,1,0,0,0,0|0,1,1]=4 3410 B9R1.22 CN1C[C@@H](C[C@H]1CO)N Amb15701329 [1,1,0,0,0,0|1,0,1]=4 3411 B9R1.22 CN1C[C@@H](N)C[C@H]1CO Amb22587281 [1,1,0,0,0,0|1,0,1]=4 3412 B9R1.22 CN1C[C@@H](N)C[C@H]1CO Amb23385232 [1,1,0,0,0,0|1,0,1]=4 3413 B9R1.22 CN1C[C@@H](O)C[C@@H]1CO Amb22746005 [1,1,0,0,0,0|0,0,1]=3 3414 B9R1.22 CN1C[C@H](O)C[C@H]1CN Amb24539864 [1,1,0,0,0,0|1,0,1]=4 3415 B9R1.22 CN1C[C@H](O)C[C@H]1CO Amb19888613 [1,1,0,0,0,0|0,0,1]=3 3416 B9R1.22 CN1OC(O)CC1CO Amb25357380 [1,1,0,0,0,0|1,0,1]=4 3417 B9R1.22 OC[C@@H]1C[C@H](CN1C)O Amb13883425 [1,1,0,0,0,0|0,0,1]=3 3418 B9R1.23 C=CC1CC(O)C(O)O1 Amb25680515 [1,1,0,0,0,0|2,0,0]=4 3419 B9R1.23 C=C[C@@H]1C[C@H](O)[C@H](O)C1 Amb25106818 [1,1,0,0,0,0|2,0,0]=4 3420 B9R1.23 CC1CN(CC1O)C=O Amb25183690 [1,1,0,0,0,0|2,0,0]=4 3421 B9R1.23 CC1NC(CC1O)CC Amb23453816 [1,1,0,0,0,0|1,0,1]=4 3422 B9R1.23 C[C@@H]1O[C@@H](C[C@H]1O)CO Amb25175404 [1,1,0,0,0,0|1,0,1]=4 3423 B9R1.23 C[C@@H]1O[C@H](C[C@@H]1O)CO Amb25177058 [1,1,0,0,0,0|1,0,1]=4 3424 B9R1.23 C[C@H]1O[C@@H](C[C@H]1O)CO Amb24630775 [1,1,0,0,0,0|1,0,1]=4 3425 B9R1.23 N[C@@H]1C[C@@H](C[C@@H]1O)CO Amb25377841 [1,1,0,0,0,0|1,0,1]=4 3426 B9R1.23 N[C@H]1C[C@H](C[C@@H]1O)CO Amb24531745 [1,1,0,0,0,0|1,0,1]=4 3427 B9R1.23 N[C@H]1C[C@H](C[C@H]1O)CO Amb24567086 [1,1,0,0,0,0|1,0,1]=4 3428 B9R1.23 OC1CN(CC1O)C=O Amb25725270 [1,1,0,0,0,0|2,0,0]=4 3429 B9R1.23 OCC1CC(O)C(O)O1 Amb25124764 [1,1,0,0,0,0|1,0,1]=4 3430 B9R1.23 OC[C@H]1C[C@@H](O)C(O)O1 Amb25235052 [1,1,0,0,0,0|1,0,1]=4 3431 B9R1.125 CC1CC(C)(CC1)C=O Amb23454036 [1,1,0,0,0,0|2,0,0]=4 3432 B9R1.125 C[C@@]1(C[C@H](O)CC1)C=C Amb25284211 [1,1,0,0,0,0|2,0,0]=4 3433 B9R1.125 OCC1(O)C[C@H](O)CO1 Amb24431019 [1,1,0,0,0,0|1,0,1]=4 3434 B9R1.132 CC1CNC(CO)C1O Amb24524190 [1,1,0,0,0,0|1,0,1]=4 3435 B9R1.132 CCC1NCC(O)C1O Amb25269346 [1,1,0,0,0,0|1,0,1]=4 3436 B9R1.132 CC[C@@H]1NC[C@@H](O)[C@@H]1O Amb25203762 [1,1,0,0,0,0|1,0,1]=4 3437 B9R1.132 CC[C@H]1NC[C@H](O)[C@H]1O Amb24617458 [1,1,0,0,0,0|1,0,1]=4 3438 B9R1.132 C[C@H]1CN[C@H](CO)[C@H]1O Amb24617977 [1,1,0,0,0,0|1,0,1]=4 3439 B9R1.132 C[C@H]1[C@@H](CCC1O)CO Amb25176819 [1,1,0,0,0,0|1,0,1]=4 3440 B9R1.132 NC1C(CO)NCC1O Amb25258864 [1,1,0,0,0,0|0,0,1]=3 3441 B9R1.132 NCC1NCC(O)C1O Amb25082729 [1,1,0,0,0,0|1,0,1]=4 3442 B9R1.132 NC[C@@H]1NC[C@@H](O)[C@H]1O Amb24617835 [1,1,0,0,0,0|1,0,1]=4 3443 B9R1.132 N[C@@H]1CN[C@H](CO)[C@H]1O Amb24515541 [1,1,0,0,0,0|1,0,1]=4 3444 B9R1.132 N[C@@H]1[C@@H](CO)NC[C@H]1O Amb24671216 [1,1,0,0,0,0|0,0,1]=3 3445 B9R1.132 N[C@H]1[C@@H](CO)NC[C@@H]1O Amb25745255 [1,1,0,0,0,0|0,0,1]=3 3446 B9R1.132 OC1C(F)CNC1CO Amb24753826 [1,1,0,0,0,0|1,0,1]=4 3447 B9R1.132 OC1CC=C(C=O)C1O Amb24647863 [1,1,0,0,0,0|1,0,1]=4 3448 B9R1.132 OCC1NCC(O)C1O Amb25348005 [1,1,0,0,0,0|0,0,1]=3 3449 B9R1.132 OCC1NCC(O)[C@H]1O Amb24694168 [1,1,0,0,0,0|0,0,1]=3 3450 B9R1.132 OCC1OC[C@@H](O)[C@H]1O Amb24688231 [1,1,0,0,0,0|1,0,1]=4 3451 B9R1.132 OC[C@@H]1NC[C@@H](O)[C@H]1O Amb23541061 [1,1,0,0,0,0|0,0,1]=3 3452 B9R1.132 OC[C@@H]1NC[C@H](O)[C@@H]1O Amb24118007 [1,1,0,0,0,0|0,0,1]=3 3453 B9R1.132 OC[C@@H]1NC[C@H](O)[C@H]1O Amb22799417 [1,1,0,0,0,0|0,0,1]=3 3454 B9R1.132 OC[C@@H]1OC[C@@H](O)[C@@H]1O Amb22747091 [1,1,0,0,0,0|1,0,1]=4 3455 B9R1.132 OC[C@@H]1OC[C@H](O)[C@H]1O Amb24587006 [1,1,0,0,0,0|1,0,1]=4 3456 B9R1.132 OC[C@H]1NCC(O)C1O Amb25294362 [1,1,0,0,0,0|0,0,1]=3 3457 B9R1.132 OC[C@H]1NCC(O)[C@H]1O Amb25294352 [1,1,0,0,0,0|0,0,1]=3 3458 B9R1.132 OC[C@H]1NC[C@@H](O)[C@@H]1O Amb25231751 [1,1,0,0,0,0|0,0,1]=3 3459 B9R1.132 OC[C@H]1OC[C@H](O)[C@@H]1O Amb22233163 [1,1,0,0,0,0|1,0,1]=4 3460 B9R1.132 OC[C@H]1OC[C@H](O)[C@H]1O Amb24572863 [1,1,0,0,0,0|1,0,1]=4 3461 B9R1.132 OC[C@H]1SCC(O)C1O Amb25346221 [1,1,0,0,0,0|1,0,1]=4 3462 B9R1.132 OC[C@H]1SC[C@@H](O)[C@@H]1O Amb24563495 [1,1,0,0,0,0|1,0,1]=4 3463 B9R1.132 OC[C@H]1SC[C@@H](O)[C@H]1O Amb24576957 [1,1,0,0,0,0|1,0,1]=4 3464 B9R1.132 O[C@@H]1[C@@H](C=O)OC[C@H]1O Amb24629264 [1,1,0,0,0,0|1,0,0]=3 3465 B9R1.132 O[C@@H]1[C@H](C=O)OC[C@H]1O Amb24611196 [1,1,0,0,0,0|1,0,0]=3 3466 B9R1.132 O[C@H]1[C@H](CBr)NC[C@H]1O Amb24563539 [1,1,0,0,0,0|1,0,1]=4 3467 B9R1.132 O[C@H]1[C@H](F)CN[C@@H]1CO Amb25292264 [1,1,0,0,0,0|1,0,1]=4 3468 B9R1.133 CC1(C)CC(CC1)C=O Amb24418196 [1,1,0,0,0,0|2,0,0]=4 3469 B9R1.133 O=CC1CC(F)(F)CC1 Amb24620428 [1,1,0,0,0,0|2,0,0]=4 3470 B9R1.133 O=CC1CC(F)(F)CN1 Amb25846114 [1,1,0,0,0,0|1,0,0]=3 3471 B9R1.133 OCC1CC(F)(F)CN1 Amb23536873 [1,1,0,0,0,0|1,0,1]=4 3472 B9R1.133 OC[C@@H]1CC(F)(F)CN1 Amb22886267 [1,1,0,0,0,0|1,0,1]=4 3473 B9R1.11 C#CC(=O)C1CCCC1 Amb22498876 [1,1,0,0,0,0|2,0,0]=4 3474 B9R1.11 C#CC(=O)C1CCCO1 Amb24703684 [1,1,0,0,0,0|2,0,0]=4 3475 B9R1.11 C#CC(=O)[C@H]1CCCO1 Amb25092915 [1,1,0,0,0,0|2,0,0]=4 3476 B9R1.11 C=C(CO)C1CCCN1 Amb25211073 [1,1,0,0,0,0|1,0,0]=3 3477 B9R1.11 C=CC(=O)C1CCCC1 Amb25180831 [1,1,0,0,0,0|2,0,0]=4 3478 B9R1.11 C=CC(=O)C1CCCN1 Amb24376988 [1,1,0,0,0,0|1,0,0]=3 3479 B9R1.11 C=CC(=O)C1CCCO1 Amb25139821 [1,1,0,0,0,0|2,0,0]=4 3480 B9R1.11 C=CC(=O)C1CCCS1 Amb24462018 [1,1,0,0,0,0|2,0,0]=4 3481 B9R1.11 C=CC(O)C1CCCN1 Amb18642529 [1,1,0,0,0,0|1,0,1]=4 3482 B9R1.11 C=C[C@@H](O)[C@@H]1CCCN1 Amb24584983 [1,1,0,0,0,0|1,0,1]=4 3483 B9R1.11 CC(=NO)C1CCCO1 Amb25222498 [1,1,0,0,0,0|2,0,0]=4 3484 B9R1.11 CCC(=C)C1CCCN1 Amb23536671 [1,1,0,0,0,0|2,0,0]=4 3485 B9R1.11 CCC(=O)C1CCCC1 Amb10607936 [1,1,0,0,0,0|2,0,0]=4 3486 B9R1.11 CCC(=O)C1CCCN1 Amb17231849 [1,1,0,0,0,0|1,0,0]=3 3487 B9R1.11 CCC(=O)C1CCCO1 Amb23590157 [1,1,0,0,0,0|2,0,0]=4 3488 B9R1.11 CCC(=O)C1CCCS1 Amb25756050 [1,1,0,0,0,0|2,0,0]=4 3489 B9R1.11 CCC(C1CCCN1)O Amb17231861 [1,1,0,0,0,0|1,0,1]=4 3490 B9R1.11 CC[C@H](O)[C@@H]1CCCN1 Amb24514813 [1,1,0,0,0,0|1,0,1]=4 3491 B9R1.11 CC[C@H](O)[C@H]1CCCN1 Amb24558620 [1,1,0,0,0,0|1,0,1]=4 3492 B9R1.11 CNC(=O)C1CCCN1 Amb10609065 [1,1,0,0,0,0|1,0,0]=3 3493 B9R1.11 CNC(=O)C1CCCS1 Amb24629729 [1,1,0,0,0,0|2,0,0]=4 3494 B9R1.11 CNC(=O)[C@@H]1CCCN1 Amb10874670 [1,1,0,0,0,0|1,0,0]=3 3495 B9R1.11 CNC(=O)[C@@H]1CCCN1 Amb15740702 [1,1,0,0,0,0|1,0,0]=3 3496 B9R1.11 CNC(=O)[C@@H]1CCCN1 Amb22587500 [1,1,0,0,0,0|1,0,0]=3 3497 B9R1.11 CNC(=O)[C@H]1CCCN1 Amb22232105 [1,1,0,0,0,0|1,0,0]=3 3498 B9R1.11 CNC(=O)[C@H]1CCCN1 Amb22587598 [1,1,0,0,0,0|1,0,0]=3 3499 B9R1.11 COC(=C)C1NCCO1 Amb25146162 [1,1,0,0,0,0|2,0,0]=4 3500 B9R1.11 COC(=N)C1CCCC1 Amb25713898 [1,1,0,0,0,0|2,0,0]=4 3501 B9R1.11 COC(=N)C1CCCS1 Amb25708928 [1,1,0,0,0,0|2,0,0]=4 3502 B9R1.11 COC(=O)C1CC=CN1 Amb24406652 [1,1,0,0,0,0|0,0,2]=4 3503 B9R1.11 COC(=O)C1CC=NN1 Amb23400981 [1,1,0,0,0,0|1,0,1]=4 3504 B9R1.11 COC(=O)C1CCC=C1 Amb23456135 [1,1,0,0,0,0|1,0,1]=4 3505 B9R1.11 COC(=O)C1CCC=N1 Amb25106874 [1,1,0,0,0,0|0,0,2]=4 3506 B9R1.11 COC(=O)C1CCCS1 Amb23590656 [1,1,0,0,0,0|1,0,0]=3 3507 B9R1.11 COC(=O)C1CCC[NH2+]1 Amb22045239 [1,1,0,0,0,0|0,0,1]=3 3508 B9R1.11 COC(=O)C1CCN=N1 Amb24062008 [1,1,0,0,0,0|1,0,1]=4 3509 B9R1.11 COC(=O)C1CCNO1 Amb24607719 [1,1,0,0,0,0|2,0,0]=4 3510 B9R1.11 COC(=O)C1COCC1 Amb10610344 [1,1,0,0,0,0|2,0,0]=4 3511 B9R1.11 COC(=O)C1CSCC1 Amb24598032 [1,1,0,0,0,0|2,0,0]=4 3512 B9R1.11 COC(=O)C1CSCN1 Amb1154599 [1,1,0,0,0,0|1,0,0]=3 3513 B9R1.11 COC(=O)C1NCC=C1 Amb17621965 [1,1,0,0,0,0|0,0,2]=4 3514 B9R1.11 COC(=O)C1[NH2+]CCS1 Amb24113751 [1,1,0,0,0,0|1,0,1]=4 3515 B9R1.11 COC(=O)C=1CCCN1 Amb21964254 [1,1,0,0,0,0|0,0,2]=4 3516 B9R1.11 COC(=O)N1CCCC1 Amb15693435 [1,1,0,0,0,0|2,0,0]=4 3517 B9R1.11 COC(=O)N1CCCN1 Amb25231262 [1,1,0,0,0,0|1,0,0]=3 3518 B9R1.11 COC(=O)[C@@H]1C=CCN1 Amb22800018 [1,1,0,0,0,0|0,0,2]=4 3519 B9R1.11 COC(=O)[C@@H]1CC=NN1 Amb24340266 [1,1,0,0,0,0|1,0,1]=4 3520 B9R1.11 COC(=O)[C@@H]1CCCO1 Amb25113406 [1,1,0,0,0,0|1,0,0]=3 3521 B9R1.11 COC(=O)[C@@H]1CNCC1 Amb22405890 [1,1,0,0,0,0|2,0,0]=4 3522 B9R1.11 COC(=O)[C@@H]1CNCC1 Amb22744897 [1,1,0,0,0,0|2,0,0]=4 3523 B9R1.11 COC(=O)[C@@H]1COCC1 Amb23439173 [1,1,0,0,0,0|2,0,0]=4 3524 B9R1.11 COC(=O)[C@@H]1COCN1 Amb24680147 [1,1,0,0,0,0|1,0,0]=3 3525 B9R1.11 COC(=O)[C@@H]1NCCS1 Amb25368917 [1,1,0,0,0,0|1,0,0]=3 3526 B9R1.11 COC(=O)[C@H]1CCCN1 Amb10844896 [1,1,0,0,0,0|0,0,0]=2 3527 B9R1.11 COC(=O)[C@H]1CCCS1 Amb24061418 [1,1,0,0,0,0|1,0,0]=3 3528 B9R1.11 COC(=O)[C@H]1CNCC1 Amb20241764 [1,1,0,0,0,0|2,0,0]=4 3529 B9R1.11 COC(=O)[C@H]1CNCC1 Amb22225397 [1,1,0,0,0,0|2,0,0]=4 3530 B9R1.11 COC(=O)[C@H]1CNCC1 Amb22405891 [1,1,0,0,0,0|2,0,0]=4 3531 B9R1.11 COC(=O)[C@H]1NCC=C1 Amb16183938 [1,1,0,0,0,0|0,0,2]=4 3532 B9R1.11 C[C@H](CO)[C@@H]1CCCN1 Amb24713470 [1,1,0,0,0,0|1,0,1]=4 3533 B9R1.11 N=C(NO)C1CCCC1 Amb22733339 [1,1,0,0,0,0|2,0,0]=4 3534 B9R1.11 NC(=NO)C1CCCN1 Amb24749080 [1,1,0,0,0,0|1,0,0]=3 3535 B9R1.11 NC(=NO)C1CCCO1 Amb24340285 [1,1,0,0,0,0|2,0,0]=4 3536 B9R1.11 NCC(=O)C1CCCC1 Amb18832687 [1,1,0,0,0,0|2,0,0]=4 3537 B9R1.11 NCC(=O)C1CCCO1 Amb24398393 [1,1,0,0,0,0|2,0,0]=4 3538 B9R1.11 NCC(=O)N1CCCN1 Amb24105998 [1,1,0,0,0,0|2,0,0]=4 3539 B9R1.11 NCC(=O)N1CCCN1 Amb25821250 [1,1,0,0,0,0|2,0,0]=4 3540 B9R1.11 NCC(O)C1CCCN1 Amb25674944 [1,1,0,0,0,0|1,0,1]=4 3541 B9R1.11 NNC(=O)C1CCCC1 Amb22757358 [1,1,0,0,0,0|2,0,0]=4 3542 B9R1.11 NNC(=O)C1CCCN1 Amb18061830 [1,1,0,0,0,0|1,0,0]=3 3543 B9R1.11 NNC(=O)C1CCCO1 Amb1125370 [1,1,0,0,0,0|2,0,0]=4 3544 B9R1.11 NNC(=O)C1CSCN1 Amb24730884 [1,1,0,0,0,0|2,0,0]=4 3545 B9R1.11 NNC(=O)[C@@H]1CCCN1 Amb25304547 [1,1,0,0,0,0|1,0,0]=3 3546 B9R1.11 NNC(=O)[C@@H]1CCCO1 Amb25796517 [1,1,0,0,0,0|2,0,0]=4 3547 B9R1.11 NNC(=O)[C@H]1CCCN1 Amb24481597 [1,1,0,0,0,0|1,0,0]=3 3548 B9R1.11 NNC(=O)[C@H]1CCCO1 Amb25221584 [1,1,0,0,0,0|2,0,0]=4 3549 B9R1.11 NOC(=O)C1COCC1 Amb22170066 [1,1,0,0,0,0|2,0,0]=4 3550 B9R1.11 O=C(CBr)C1CCCC1 Amb19375225 [1,1,0,0,0,0|2,0,0]=4 3551 B9R1.11 O=C(CBr)C1CCCO1 Amb24104046 [1,1,0,0,0,0|2,0,0]=4 3552 B9R1.11 O=C(CCl)C1CCCN1 Amb24120424 [1,1,0,0,0,0|1,0,0]=3 3553 B9R1.11 O=C(CCl)C1CCCO1 Amb24751558 [1,1,0,0,0,0|2,0,0]=4 3554 B9R1.11 O=C(CCl)C1CCCS1 Amb25328071 [1,1,0,0,0,0|2,0,0]=4 3555 B9R1.11 O=C(CCl)[C@@H]1CCCN1 Amb25086239 [1,1,0,0,0,0|1,0,0]=3 3556 B9R1.11 O=C(CCl)[C@@H]1CCCO1 Amb25251070 [1,1,0,0,0,0|2,0,0]=4 3557 B9R1.11 O=C(CF)C1CCCC1 Amb23571962 [1,1,0,0,0,0|2,0,0]=4 3558 B9R1.11 O=C(CF)C1CCCN1 Amb24084125 [1,1,0,0,0,0|1,0,0]=3 3559 B9R1.11 O=C(CF)C1CCCO1 Amb25830880 [1,1,0,0,0,0|2,0,0]=4 3560 B9R1.11 O=C(CF)[C@@H]1CCCO1 Amb24084144 [1,1,0,0,0,0|2,0,0]=4 3561 B9R1.11 O=CC(=O)C1CCCC1 Amb25290062 [1,1,0,0,0,0|1,0,1]=4 3562 B9R1.11 OC(C=O)C1CCCC1 Amb25731162 [1,1,0,0,0,0|1,0,1]=4 3563 B9R1.11 OC(C=O)C1CCCN1 Amb25682582 [1,1,0,0,0,0|0,0,1]=3 3564 B9R1.11 OC(CO)C1CCCN1 Amb24652702 [1,1,0,0,0,0|0,0,2]=4 3565 B9R1.11 OCC(=O)N1CCCO1 Amb24615306 [1,1,0,0,0,0|2,0,0]=4 3566 B9R1.11 ONC(=O)C1CCCN1 Amb25127054 [1,1,0,0,0,0|0,0,0]=2 3567 B9R1.11 ONC(=O)C1COCC1 Amb24668940 [1,1,0,0,0,0|2,0,0]=4 3568 B9R1.11 ONC(=O)C1CSCC1 Amb24529110 [1,1,0,0,0,0|2,0,0]=4 3569 B9R1.11 ONC(=O)C=1CCCC1 Amb25178133 [1,1,0,0,0,0|1,0,1]=4 3570 B9R1.11 ONC(=O)[C@@H]1CCCO1 Amb25225821 [1,1,0,0,0,0|1,0,0]=3 3571 B9R1.11 ONC(=O)[C@H]1CCCN1 Amb24550780 [1,1,0,0,0,0|0,0,0]=2 3572 B9R1.11 O[C@@H](CCl)[C@@H]1CCCN1 Amb24587025 [1,1,0,0,0,0|1,0,1]=4 3573 B9R1.11 O[C@H](CCl)[C@@H]1CCCN1 Amb24580437 [1,1,0,0,0,0|1,0,1]=4 3574 B9R1.19 CC(C)(O)C1CCCN1 Amb18061666 [1,1,0,0,0,0|1,0,1]=4 3575 B9R1.19 CC(C)(O)[C@@H]1CCCN1 Amb23439134 [1,1,0,0,0,0|1,0,1]=4 3576 B9R1.19 CC(C)(O)[C@H]1CCCN1 Amb24077127 [1,1,0,0,0,0|1,0,1]=4 3577 B9R1.19 OP(O)(=O)C1CCCC1 Amb24617217 [1,1,0,0,0,0|2,0,0]=4 3578 B9R1.19 OP(O)(=O)C1CCCN1 Amb24479952 [1,1,0,0,0,0|1,0,0]=3 3579 B9R1.19 OP(O)(=O)C1CCCO1 Amb25201820 [1,1,0,0,0,0|2,0,0]=4 3580 B9R1.19 OS(=O)(=O)C1CCCC1 Amb24615046 [1,1,0,0,0,0|2,0,0]=4 3581 B9R1.41 C=C1CCCC1C(O)=O Amb18642417 [1,1,0,0,0,0|1,0,0]=3 3582 B9R1.41 CC(=O)C1CCCC1=S Amb24646456 [1,1,0,0,0,0|2,0,0]=4 3583 B9R1.41 CC(=O)C1CCCC1Br Amb24710867 [1,1,0,0,0,0|2,0,0]=4 3584 B9R1.41 CC(=O)C1CCCC1Cl Amb24063968 [1,1,0,0,0,0|2,0,0]=4 3585 B9R1.41 CC(=O)C1CCCC1O Amb25086736 [1,1,0,0,0,0|2,0,0]=4 3586 B9R1.41 CC(=O)C1CCCN1C Amb25295317 [1,1,0,0,0,0|1,0,0]=3 3587 B9R1.41 CC(=O)[C@H]1CCC[C@@H]1O Amb24512739 [1,1,0,0,0,0|2,0,0]=4 3588 B9R1.41 CC(=O)[C@H]1OCC[C@@H]1Cl Amb25232993 [1,1,0,0,0,0|2,0,0]=4 3589 B9R1.41 CC(O)[C@@H]1CCCN1C Amb24534366 [1,1,0,0,0,0|1,0,1]=4 3590 B9R1.41 CC1CCCC1C(=O)C Amb17593321 [1,1,0,0,0,0|2,0,0]=4 3591 B9R1.41 CC1CCCC1C(N)=O Amb24680775 [1,1,0,0,0,0|2,0,0]=4 3592 B9R1.41 CC1CCNC1C(O)=O Amb22496299 [1,1,0,0,0,0|0,0,0]=2 3593 B9R1.41 CC1CCN[C@@H]1C(O)=O Amb25786199 [1,1,0,0,0,0|0,0,0]=2 3594 B9R1.41 CC1CCOC1C(N)=O Amb25107757 [1,1,0,0,0,0|2,0,0]=4 3595 B9R1.41 CC1CCOC1C(O)=O Amb20668280 [1,1,0,0,0,0|1,0,0]=3 3596 B9R1.41 CC1COCC1C(O)=O Amb25326733 [1,1,0,0,0,0|2,0,0]=4 3597 B9R1.41 CC1NCCC1C(O)=O Amb18118138 [1,1,0,0,0,0|2,0,0]=4 3598 B9R1.41 CC1OCCC1C(O)=O Amb22059743 [1,1,0,0,0,0|2,0,0]=4 3599 B9R1.41 CC1OCNC1C(O)=O Amb24564435 [1,1,0,0,0,0|1,0,0]=3 3600 B9R1.41 CN1CC=CC1C(=O)O Amb15701264 [1,1,0,0,0,0|0,0,2]=4 3601 B9R1.41 CN1CC=CC1C(O)=O Amb22587153 [1,1,0,0,0,0|0,0,2]=4 3602 B9R1.41 CN1CCCC1C(=O)Cl Amb25250467 [1,1,0,0,0,0|1,0,0]=3 3603 B9R1.41 CN1CCCC1C(N)=O Amb22371060 [1,1,0,0,0,0|1,0,0]=3 3604 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb17935722 [1,1,0,0,0,0|0,0,0]=2 3605 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb18559228 [1,1,0,0,0,0|0,0,0]=2 3606 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb22748316 [1,1,0,0,0,0|0,0,0]=2 3607 B9R1.41 CN1CCC[C@H]1C(=O)O Amb10604041 [1,1,0,0,0,0|0,0,0]=2 3608 B9R1.41 CN1CCC[C@H]1C(O)=O Amb22587172 [1,1,0,0,0,0|0,0,0]=2 3609 B9R1.41 CN1CCN=C1C(O)=O Amb25352083 [1,1,0,0,0,0|1,0,1]=4 3610 B9R1.41 CN1CSCC1C(O)=O Amb19650934 [1,1,0,0,0,0|1,0,0]=3 3611 B9R1.41 CN1CSCC1C(O)=O Amb21959971 [1,1,0,0,0,0|1,0,0]=3 3612 B9R1.41 CN1CSC[C@H]1C(=O)O Amb10608462 [1,1,0,0,0,0|1,0,0]=3 3613 B9R1.41 CN1CSC[C@H]1C(O)=O Amb22587250 [1,1,0,0,0,0|1,0,0]=3 3614 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [1,1,0,0,0,0|1,0,0]=3 3615 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [1,1,0,0,0,0|1,0,0]=3 3616 B9R1.41 C[C@@H]1CCC[C@H]1C(C)=O Amb24692616 [1,1,0,0,0,0|2,0,0]=4 3617 B9R1.41 C[C@@H]1CCC[C@H]1C(N)=O Amb24598612 [1,1,0,0,0,0|2,0,0]=4 3618 B9R1.41 C[C@@H]1CCN[C@H]1C(O)=O Amb22747259 [1,1,0,0,0,0|0,0,0]=2 3619 B9R1.41 C[C@@H]1CCO[C@@H]1C(O)=O Amb25251332 [1,1,0,0,0,0|1,0,0]=3 3620 B9R1.41 C[C@@H]1COC[C@@H]1C(O)=O Amb24649146 [1,1,0,0,0,0|2,0,0]=4 3621 B9R1.41 C[C@@H]1NCC[C@H]1C(O)=O Amb18832568 [1,1,0,0,0,0|2,0,0]=4 3622 B9R1.41 C[C@@H]1OCC[C@@H]1C(O)=O Amb22886528 [1,1,0,0,0,0|2,0,0]=4 3623 B9R1.41 C[C@@H]1SCN[C@@H]1C(O)=O Amb24514827 [1,1,0,0,0,0|1,0,0]=3 3624 B9R1.41 C[C@@H]1SCN[C@H]1C(O)=O Amb24670517 [1,1,0,0,0,0|1,0,0]=3 3625 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [1,1,0,0,0,0|1,0,0]=3 3626 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [1,1,0,0,0,0|1,0,0]=3 3627 B9R1.41 C[C@H]1CCN[C@@H]1C(N)=O Amb25174509 [1,1,0,0,0,0|1,0,0]=3 3628 B9R1.41 C[C@H]1CCN[C@H]1C(O)=O Amb24715733 [1,1,0,0,0,0|0,0,0]=2 3629 B9R1.41 C[C@H]1CNCC1C(O)=O Amb24546979 [1,1,0,0,0,0|2,0,0]=4 3630 B9R1.41 C[C@H]1NCC[C@@H]1C(O)=O Amb24539923 [1,1,0,0,0,0|2,0,0]=4 3631 B9R1.41 C[C@H]1OCC[C@H]1C(O)=O Amb25253338 [1,1,0,0,0,0|2,0,0]=4 3632 B9R1.41 C[C@H]1SCN[C@@H]1C(O)=O Amb24539832 [1,1,0,0,0,0|1,0,0]=3 3633 B9R1.41 C[S+]1CCCC1C(O)=O Amb24634112 [1,1,0,0,0,0|1,0,0]=3 3634 B9R1.41 NC(=O)C1CCCC1=O Amb16233729 [1,1,0,0,0,0|2,0,0]=4 3635 B9R1.41 NC(=O)C1CCCC1O Amb25310986 [1,1,0,0,0,0|2,0,0]=4 3636 B9R1.41 NC(=O)C1CCCN1N Amb25703126 [1,1,0,0,0,0|1,0,0]=3 3637 B9R1.41 NC(=O)C1NCCC1O Amb24709283 [1,1,0,0,0,0|1,0,0]=3 3638 B9R1.41 NC(=O)[C@@H]1CCCC1=O Amb24182045 [1,1,0,0,0,0|2,0,0]=4 3639 B9R1.41 NC(=O)[C@@H]1CCCN1O Amb24476639 [1,1,0,0,0,0|1,0,0]=3 3640 B9R1.41 NC(=O)[C@@H]1CCC[C@H]1O Amb24120348 [1,1,0,0,0,0|2,0,0]=4 3641 B9R1.41 NC(=O)[C@@H]1NCC[C@H]1O Amb22744802 [1,1,0,0,0,0|1,0,0]=3 3642 B9R1.41 NC(=O)[C@H]1CCC[C@@H]1O Amb24514485 [1,1,0,0,0,0|2,0,0]=4 3643 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O Amb25194866 [1,1,0,0,0,0|1,0,0]=3 3644 B9R1.41 NC1CCCC1C(N)=O Amb19148786 [1,1,0,0,0,0|2,0,0]=4 3645 B9R1.41 NC1CCN[C@@H]1C(O)=O Amb25032243 [1,1,0,0,0,0|0,0,0]=2 3646 B9R1.41 NC1CCSC1C(O)=O Amb25314364 [1,1,0,0,0,0|1,0,0]=3 3647 B9R1.41 NC1COCC1C(O)=O Amb24709230 [1,1,0,0,0,0|2,0,0]=4 3648 B9R1.41 NC1CSCC1C(O)=O Amb24457278 [1,1,0,0,0,0|2,0,0]=4 3649 B9R1.41 NC1OCCC1C(O)=O Amb24441640 [1,1,0,0,0,0|2,0,0]=4 3650 B9R1.41 NC=1CCCC1C(O)=O Amb20240586 [1,1,0,0,0,0|1,0,1]=4 3651 B9R1.41 NN1CCCC1C(O)=O Amb18642792 [1,1,0,0,0,0|0,0,0]=2 3652 B9R1.41 NN1CCC[C@@H]1C(=O)O Amb10069459 [1,1,0,0,0,0|0,0,0]=2 3653 B9R1.41 N[C@@H]1CCC[C@H]1C(N)=O Amb25269871 [1,1,0,0,0,0|2,0,0]=4 3654 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=O Amb20241297 [1,1,0,0,0,0|1,0,0]=3 3655 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=O Amb22224830 [1,1,0,0,0,0|1,0,0]=3 3656 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=[ClH] Amb24627931 [1,1,0,0,0,0|2,0,0]=4 3657 B9R1.41 N[C@@H]1CCN[C@@H]1C(O)=O Amb19929517 [1,1,0,0,0,0|0,0,0]=2 3658 B9R1.41 N[C@@H]1CCS[C@H]1C(O)=O Amb24061395 [1,1,0,0,0,0|1,0,0]=3 3659 B9R1.41 N[C@@H]1CNC[C@@H]1C(O)=O Amb25685466 [1,1,0,0,0,0|2,0,0]=4 3660 B9R1.41 N[C@@H]1COC[C@@H]1C(O)=O Amb24078777 [1,1,0,0,0,0|2,0,0]=4 3661 B9R1.41 N[C@@H]1CSC[C@@H]1C(O)=O Amb25685470 [1,1,0,0,0,0|2,0,0]=4 3662 B9R1.41 N[C@@H]1OCC[C@@H]1C(O)=O Amb24581227 [1,1,0,0,0,0|2,0,0]=4 3663 B9R1.41 N[C@H]1CCC[C@@H]1C(O)=O Amb20241298 [1,1,0,0,0,0|1,0,0]=3 3664 B9R1.41 N[C@H]1CCC[C@@H]1C(O)=O Amb22224860 [1,1,0,0,0,0|1,0,0]=3 3665 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993719 [1,1,0,0,0,0|1,0,0]=3 3666 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993764 [1,1,0,0,0,0|1,0,0]=3 3667 B9R1.41 N[C@H]1CCS[C@H]1C(O)=O Amb24061394 [1,1,0,0,0,0|1,0,0]=3 3668 B9R1.41 N[C@H]1CNC[C@H]1C(O)=O Amb24628081 [1,1,0,0,0,0|2,0,0]=4 3669 B9R1.41 N[C@H]1COC[C@@H]1C(O)=O Amb24605467 [1,1,0,0,0,0|2,0,0]=4 3670 B9R1.41 N[C@H]1COC[C@H]1C(O)=O Amb24763623 [1,1,0,0,0,0|2,0,0]=4 3671 B9R1.41 O=C1CCCC1C(=O)Cl Amb21961757 [1,1,0,0,0,0|2,0,0]=4 3672 B9R1.41 OC(=O)C1=CCC[C@H]1O Amb25795408 [1,1,0,0,0,0|1,0,1]=4 3673 B9R1.41 OC(=O)C1CCCC1=O Amb18642571 [1,1,0,0,0,0|1,0,0]=3 3674 B9R1.41 OC(=O)C1CCCC1=S Amb25273371 [1,1,0,0,0,0|1,0,0]=3 3675 B9R1.41 OC(=O)C1CCCC1Br Amb24480063 [1,1,0,0,0,0|1,0,0]=3 3676 B9R1.41 OC(=O)C1CCCC1S Amb18280971 [1,1,0,0,0,0|1,0,0]=3 3677 B9R1.41 OC(=O)C1CCCN1Cl Amb25291925 [1,1,0,0,0,0|0,0,0]=2 3678 B9R1.41 OC(=O)C1CCNC1=O Amb18642691 [1,1,0,0,0,0|2,0,0]=4 3679 B9R1.41 OC(=O)C1CCOC1=O Amb17593365 [1,1,0,0,0,0|2,0,0]=4 3680 B9R1.41 OC(=O)C1CSCC1=O Amb16230660 [1,1,0,0,0,0|2,0,0]=4 3681 B9R1.41 OC(=O)C1NCCC1=S Amb25147125 [1,1,0,0,0,0|0,0,1]=3 3682 B9R1.41 OC(=O)C1NCCC1Br Amb24694082 [1,1,0,0,0,0|0,0,0]=2 3683 B9R1.41 OC(=O)C1NCCC1Cl Amb25080543 [1,1,0,0,0,0|0,0,0]=2 3684 B9R1.41 OC(=O)C1NCCC1F Amb25772909 [1,1,0,0,0,0|0,0,0]=2 3685 B9R1.41 OC(=O)C1NCCC1S Amb24556940 [1,1,0,0,0,0|0,0,0]=2 3686 B9R1.41 OC(=O)C1OCCC1Cl Amb25124121 [1,1,0,0,0,0|1,0,0]=3 3687 B9R1.41 OC(=O)C=1CCCC1Br Amb24424181 [1,1,0,0,0,0|1,0,1]=4 3688 B9R1.41 OC(=O)[C@@H]1CCCN1Br Amb24480123 [1,1,0,0,0,0|0,0,0]=2 3689 B9R1.41 OC(=O)[C@@H]1CSCC1=O Amb24182054 [1,1,0,0,0,0|2,0,0]=4 3690 B9R1.41 OC(=O)[C@H]1CCCN1F Amb24534439 [1,1,0,0,0,0|0,0,0]=2 3691 B9R1.41 OC(=O)[C@H]1CCC[C@@H]1Br Amb25251282 [1,1,0,0,0,0|1,0,0]=3 3692 B9R1.41 OC(=O)[C@H]1CCC[C@H]1Br Amb24693868 [1,1,0,0,0,0|1,0,0]=3 3693 B9R1.41 OC(=O)[C@H]1NCCC1F Amb25312348 [1,1,0,0,0,0|0,0,0]=2 3694 B9R1.41 OC(=O)[C@H]1NCC[C@@H]1S Amb24548407 [1,1,0,0,0,0|0,0,0]=2 3695 B9R1.41 OC1CCCC1C(=O)Cl Amb24524192 [1,1,0,0,0,0|2,0,0]=4 3696 B9R1.41 OC1CCCC1C(O)=O Amb19148040 [1,1,0,0,0,0|1,0,0]=3 3697 B9R1.41 OC1CCNC1C(O)=O Amb22387784 [1,1,0,0,0,0|0,0,0]=2 3698 B9R1.41 OC1CCN[C@@H]1C(=O)O Amb10604192 [1,1,0,0,0,0|0,0,0]=2 3699 B9R1.41 OC1CCN[C@H]1C(O)=O Amb24359065 [1,1,0,0,0,0|0,0,0]=2 3700 B9R1.41 OC1CCSC1C(O)=O Amb24061424 [1,1,0,0,0,0|1,0,0]=3 3701 B9R1.41 OC1CNCC1C(O)=O Amb22886381 [1,1,0,0,0,0|2,0,0]=4 3702 B9R1.41 OC1CSCC1C(O)=O Amb18831363 [1,1,0,0,0,0|2,0,0]=4 3703 B9R1.41 OC=1CCCC1C(O)=O Amb25697344 [1,1,0,0,0,0|1,0,1]=4 3704 B9R1.41 O[C@@H]1CCC[C@@H]1C(O)=O Amb22747315 [1,1,0,0,0,0|1,0,0]=3 3705 B9R1.41 O[C@@H]1CCC[C@H]1C(O)=O Amb24120349 [1,1,0,0,0,0|1,0,0]=3 3706 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb22746928 [1,1,0,0,0,0|0,0,0]=2 3707 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb23439285 [1,1,0,0,0,0|0,0,0]=2 3708 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb24183503 [1,1,0,0,0,0|0,0,0]=2 3709 B9R1.41 O[C@@H]1CCN[C@H]1C(O)=O Amb22746713 [1,1,0,0,0,0|0,0,0]=2 3710 B9R1.41 O[C@@H]1CCN[C@H]1C(O)=O Amb24183557 [1,1,0,0,0,0|0,0,0]=2 3711 B9R1.41 O[C@@H]1CNC[C@H]1C(O)=O Amb24120417 [1,1,0,0,0,0|2,0,0]=4 3712 B9R1.41 O[C@H]1CCC[C@H]1C(=O)O Amb10844853 [1,1,0,0,0,0|1,0,0]=3 3713 B9R1.41 O[C@H]1CCN[C@@H]1C(O)=O Amb24055327 [1,1,0,0,0,0|0,0,0]=2 3714 B9R1.41 O[C@H]1CCN[C@H]1C(O)=O Amb22230426 [1,1,0,0,0,0|0,0,0]=2 3715 B9R1.41 O[C@H]1CNC[C@H]1C(O)=O Amb22274552 [1,1,0,0,0,0|2,0,0]=4 3716 B9R1.163 CC(=C)C1(C)CCCN1 Amb25304722 [1,1,0,0,0,0|2,0,0]=4 3717 B9R1.163 CC(=O)C1(C)CCCC1 Amb17593318 [1,1,0,0,0,0|2,0,0]=4 3718 B9R1.163 CC(=O)C1(C)CCCN1 Amb25789427 [1,1,0,0,0,0|1,0,0]=3 3719 B9R1.163 CC(=O)C1(C)CCCO1 Amb24332633 [1,1,0,0,0,0|2,0,0]=4 3720 B9R1.163 CC(=O)C1(C)CCCS1 Amb25188952 [1,1,0,0,0,0|2,0,0]=4 3721 B9R1.163 CC(=O)C1(C)NCCS1 Amb24105966 [1,1,0,0,0,0|2,0,0]=4 3722 B9R1.163 CC(=O)C1(N)CCCC1 Amb1091405 [1,1,0,0,0,0|2,0,0]=4 3723 B9R1.163 CC(=O)C1(N)CCCC1 Amb22283948 [1,1,0,0,0,0|2,0,0]=4 3724 B9R1.163 CC(=O)C1(O)CCCC1 Amb17593345 [1,1,0,0,0,0|2,0,0]=4 3725 B9R1.163 CC1(CC=NN1)C(O)=O Amb25249522 [1,1,0,0,0,0|1,0,1]=4 3726 B9R1.163 CC1(CCC=C1)C(O)=O Amb18642405 [1,1,0,0,0,0|1,0,1]=4 3727 B9R1.163 CC1(CCCC1)C(=O)Cl Amb24476587 [1,1,0,0,0,0|2,0,0]=4 3728 B9R1.163 CC1(CCCN1)C(N)=O Amb20061427 [1,1,0,0,0,0|1,0,0]=3 3729 B9R1.163 CC1(CCCN1)C(N)=O Amb21960323 [1,1,0,0,0,0|1,0,0]=3 3730 B9R1.163 CC1(CCCN1)C(O)=O Amb22587331 [1,1,0,0,0,0|0,0,0]=2 3731 B9R1.163 CC1(CCCO1)C(N)=O Amb25313257 [1,1,0,0,0,0|2,0,0]=4 3732 B9R1.163 CC1(CCCS1)C(O)=O Amb20623191 [1,1,0,0,0,0|1,0,0]=3 3733 B9R1.163 CC1(CNCC1)C(O)=O Amb20634439 [1,1,0,0,0,0|2,0,0]=4 3734 B9R1.163 CC1(COCC1)C(O)=O Amb18280535 [1,1,0,0,0,0|2,0,0]=4 3735 B9R1.163 CC1(OCCO1)C(O)=O Amb19516908 [1,1,0,0,0,0|2,0,0]=4 3736 B9R1.163 CC1(SCCS1)C(O)=O Amb24381702 [1,1,0,0,0,0|2,0,0]=4 3737 B9R1.163 C[C@@]1(C=CCN1)C(O)=O Amb25842794 [1,1,0,0,0,0|0,0,2]=4 3738 B9R1.163 C[C@@]1(CCCN1)C(N)=O Amb25146194 [1,1,0,0,0,0|1,0,0]=3 3739 B9R1.163 C[C@@]1(CCCN1)C(O)=O Amb22406107 [1,1,0,0,0,0|0,0,0]=2 3740 B9R1.163 C[C@@]1(CCCO1)C(O)=O Amb24117235 [1,1,0,0,0,0|1,0,0]=3 3741 B9R1.163 C[C@]1(CCCN1)C(N)=O Amb24410858 [1,1,0,0,0,0|1,0,0]=3 3742 B9R1.163 C[C@]1(CCCN1)C(O)=O Amb22405952 [1,1,0,0,0,0|0,0,0]=2 3743 B9R1.163 C[C@]1(CNCC1)C(O)=O Amb24346794 [1,1,0,0,0,0|2,0,0]=4 3744 B9R1.163 NC(=O)C1(N)CCCC1 Amb19265774 [1,1,0,0,0,0|2,0,0]=4 3745 B9R1.163 NC(=O)C1(O)CCCC1 Amb24116816 [1,1,0,0,0,0|2,0,0]=4 3746 B9R1.163 NC1(CCCC1)P(O)=O Amb24561449 [1,1,0,0,0,0|2,0,0]=4 3747 B9R1.163 NC1(CNCC1)C(O)=O Amb22490624 [1,1,0,0,0,0|2,0,0]=4 3748 B9R1.163 NC1(COCC1)C(O)=O Amb22274600 [1,1,0,0,0,0|2,0,0]=4 3749 B9R1.163 NC1(CSCC1)C(O)=O Amb22274058 [1,1,0,0,0,0|2,0,0]=4 3750 B9R1.163 N[C@@]1(COCC1)C(O)=O Amb20241211 [1,1,0,0,0,0|2,0,0]=4 3751 B9R1.163 N[C@]1(COCC1)C(O)=O Amb20241209 [1,1,0,0,0,0|2,0,0]=4 3752 B9R1.163 N[C@]1(CSCC1)C(O)=O Amb24476636 [1,1,0,0,0,0|2,0,0]=4 3753 B9R1.163 O=C(Cl)C1(Cl)CCCC1 Amb25106802 [1,1,0,0,0,0|2,0,0]=4 3754 B9R1.163 OC(=O)C1(Br)CCCC1 Amb17595053 [1,1,0,0,0,0|1,0,0]=3 3755 B9R1.163 OC(=O)C1(C)CCCN1 Amb15701407 [1,1,0,0,0,0|0,0,0]=2 3756 B9R1.163 OC(=O)C1(C)CCCO1 Amb1088877 [1,1,0,0,0,0|1,0,0]=3 3757 B9R1.163 OC(=O)C1(F)CNCC1 Amb24120613 [1,1,0,0,0,0|2,0,0]=4 3758 B9R1.163 OC(=O)C1(F)COCC1 Amb24420228 [1,1,0,0,0,0|2,0,0]=4 3759 B9R1.163 OC(=O)C1(F)CSCC1 Amb24541152 [1,1,0,0,0,0|2,0,0]=4 3760 B9R1.163 OC(=O)C1(N)CCCC1 Amb1838882 [1,1,0,0,0,0|1,0,0]=3 3761 B9R1.163 OC(=O)C1(N)COCC1 Amb16232669 [1,1,0,0,0,0|2,0,0]=4 3762 B9R1.163 OC(=O)C1(O)CCCC1 Amb1159211 [1,1,0,0,0,0|1,0,0]=3 3763 B9R1.163 OC(=O)C1(O)CNCC1 Amb22500918 [1,1,0,0,0,0|2,0,0]=4 3764 B9R1.163 OC(=O)C1(O)CNCC1 Amb22899772 [1,1,0,0,0,0|2,0,0]=4 3765 B9R1.163 OC(=O)C1(O)CSCC1 Amb18944714 [1,1,0,0,0,0|2,0,0]=4 3766 B9R1.163 OC(=O)[C@@]1(F)CCCN1 Amb22748241 [1,1,0,0,0,0|0,0,0]=2 3767 B9R1.163 OC(=O)[C@]1(C)CCCN1 Amb10603262 [1,1,0,0,0,0|0,0,0]=2 3768 B9R1.163 OC(=O)[C@]1(O)COCC1 Amb24389865 [1,1,0,0,0,0|2,0,0]=4 3769 B9R1.163 [2H]C1(CCCN1)C(O)=O Amb22367354 [1,1,0,0,0,0|0,0,0]=2 3770 B9R1.163 [NH3+]C1(C[NH2+]CC1)C(O)=O Amb22583868 [1,1,0,0,0,0|2,0,0]=4 3771 B9R1.51 CS(=O)(=O)C1CC(O)C1 Amb24570498 [0,1,0,0,1,0|1,0,1]=4 3772 B9R1.51 NC1CC(C1)P(O)(O)=O Amb25328470 [0,1,0,0,1,0|2,0,0]=4 3773 B9R1.55 CC(=O)C1CC(Cl)C1Cl Amb25689885 [0,1,0,0,1,0|2,0,0]=4 3774 B9R1.55 CC(=O)[C@@H]1C[C@@H](Cl)[C@@H]1Cl Amb24552931 [0,1,0,0,1,0|2,0,0]=4 3775 B9R1.55 CC1C(CC1C)C(C)=O Amb24476715 [0,1,0,0,1,0|2,0,0]=4 3776 B9R1.55 CC1C(CC1C)C(O)=O Amb23456159 [0,1,0,0,1,0|1,0,0]=3 3777 B9R1.55 CC1C(NC1=O)C(O)=O Amb25339232 [0,1,0,0,1,0|0,0,2]=4 3778 B9R1.55 CN1C(CC1=O)C(O)=O Amb22011579 [0,1,0,0,1,0|0,0,2]=4 3779 B9R1.55 C[C@@H]1C[C@@H](C(=O)Cl)N1C Amb25336470 [0,1,0,0,1,0|2,0,0]=4 3780 B9R1.55 C[C@@H]1C[C@@H](C(O)=O)N1C Amb24683087 [0,1,0,0,1,0|1,0,0]=3 3781 B9R1.55 C[C@H]1[C@@H](C[C@H]1C)C(O)=O Amb24745807 [0,1,0,0,1,0|1,0,0]=3 3782 B9R1.55 C[C@H]1[C@H](C[C@@H]1C)C(O)=O Amb24629706 [0,1,0,0,1,0|1,0,0]=3 3783 B9R1.55 N[C@@H]1[C@H](C[C@@H]1O)C(O)=O Amb24514844 [0,1,0,0,1,0|0,0,0]=2 3784 B9R1.82 C#CC(=O)N1CC(O)C1 Amb25127461 [0,1,0,0,1,0|2,0,0]=4 3785 B9R1.82 CC1CC(C1)C(=O)CC Amb23589656 [0,1,0,0,1,0|2,0,0]=4 3786 B9R1.82 CC1CC(C1)C(=O)NC Amb24633011 [0,1,0,0,1,0|2,0,0]=4 3787 B9R1.82 CC1CC(C1)C(=O)NN Amb25275433 [0,1,0,0,1,0|2,0,0]=4 3788 B9R1.82 CC1CC(C1)C(=O)NN Amb25717377 [0,1,0,0,1,0|2,0,0]=4 3789 B9R1.82 CC1CC(C1)C(=O)OC Amb25771219 [0,1,0,0,1,0|1,0,0]=3 3790 B9R1.82 CC1CC(O1)C(=O)OC Amb22737249 [0,1,0,0,1,0|2,0,0]=4 3791 B9R1.82 CC1CN(C1)C(=O)CO Amb25115577 [0,1,0,0,1,0|2,0,0]=4 3792 B9R1.82 CCC(=O)N1CC(O)C1 Amb25746604 [0,1,0,0,1,0|2,0,0]=4 3793 B9R1.82 CNC(=O)C1CC(N)C1 Amb25690251 [0,1,0,0,1,0|2,0,0]=4 3794 B9R1.82 CNC(=O)C1CC(O)C1 Amb19888985 [0,1,0,0,1,0|1,0,0]=3 3795 B9R1.82 CNC(=O)N1CC(O)C1 Amb25695155 [0,1,0,0,1,0|2,0,0]=4 3796 B9R1.82 COC(=O)C1CC(=C)C1 Amb21962131 [0,1,0,0,1,0|1,0,1]=4 3797 B9R1.82 COC(=O)C1CC(=O)C1 Amb17597687 [0,1,0,0,1,0|0,0,2]=4 3798 B9R1.82 COC(=O)C1CC(=O)N1 Amb24711580 [0,1,0,0,1,0|0,0,2]=4 3799 B9R1.82 COC(=O)C1CC(Br)C1 Amb23439345 [0,1,0,0,1,0|1,0,0]=3 3800 B9R1.82 COC(=O)C1CC(Cl)C1 Amb21962427 [0,1,0,0,1,0|1,0,0]=3 3801 B9R1.82 COC(=O)C1CC(F)C1 Amb24480349 [0,1,0,0,1,0|1,0,0]=3 3802 B9R1.82 COC(=O)C1CC(N)C1 Amb20622659 [0,1,0,0,1,0|1,0,0]=3 3803 B9R1.82 COC(=O)C1CC(N)C1 Amb21963494 [0,1,0,0,1,0|1,0,0]=3 3804 B9R1.82 COC(=O)C1CC(O)C1 Amb19516177 [0,1,0,0,1,0|0,0,0]=2 3805 B9R1.82 COC(=O)N1CC(F)C1 Amb24476710 [0,1,0,0,1,0|2,0,0]=4 3806 B9R1.82 COC(=O)N1CC(N)C1 Amb20668343 [0,1,0,0,1,0|2,0,0]=4 3807 B9R1.82 COC(=O)N1CC(O)C1 Amb24056451 [0,1,0,0,1,0|1,0,0]=3 3808 B9R1.82 COC(=O)[C@@H]1CC(=O)N1 Amb22747568 [0,1,0,0,1,0|0,0,2]=4 3809 B9R1.82 COC(=O)[C@@H]1CC(=S)N1 Amb24478569 [0,1,0,0,1,0|0,1,1]=4 3810 B9R1.82 COC(=O)[C@@H]1C[C@@H](Br)C1 Amb23439405 [0,1,0,0,1,0|1,0,0]=3 3811 B9R1.82 COC(=O)[C@@H]1C[C@@H](N)C1 Amb19148540 [0,1,0,0,1,0|1,0,0]=3 3812 B9R1.82 COC(=O)[C@@H]1C[C@@H](N)C1 Amb22747954 [0,1,0,0,1,0|1,0,0]=3 3813 B9R1.82 COC(=O)[C@@H]1C[C@@H](O)C1 Amb22746996 [0,1,0,0,1,0|0,0,0]=2 3814 B9R1.82 COC(=O)[C@@H]1C[C@H](N)C1 Amb22757971 [0,1,0,0,1,0|1,0,0]=3 3815 B9R1.82 COC(=O)[C@@H]1C[C@H](O)C1 Amb22754751 [0,1,0,0,1,0|0,0,0]=2 3816 B9R1.82 COC(=O)[C@H]1C[C@@H](Br)C1 Amb24361749 [0,1,0,0,1,0|1,0,0]=3 3817 B9R1.82 COC(=O)[C@H]1C[C@@H](Cl)C1 Amb25032105 [0,1,0,0,1,0|1,0,0]=3 3818 B9R1.82 C[C@@H]1C[C@H](O1)C(=O)OC Amb24056487 [0,1,0,0,1,0|2,0,0]=4 3819 B9R1.82 NC(=NO)N1CC(O)C1 Amb25262518 [0,1,0,0,1,0|2,0,0]=4 3820 B9R1.95 CC(O)C1CC(C1)OC Amb25738082 [0,1,0,0,1,0|1,0,1]=4 3821 B9R1.95 CCC1CC(C1)C(=O)Cl Amb25791521 [0,1,0,0,1,0|2,0,0]=4 3822 B9R1.95 CCC1CC(C1)C(C)=O Amb25046444 [0,1,0,0,1,0|2,0,0]=4 3823 B9R1.95 CCC1CC(C1)C(N)=O Amb25690385 [0,1,0,0,1,0|2,0,0]=4 3824 B9R1.95 CCC1CC(C1)C(O)=O Amb23456004 [0,1,0,0,1,0|1,0,0]=3 3825 B9R1.95 CCN1CC(C1)C(O)=O Amb24117130 [0,1,0,0,1,0|2,0,0]=4 3826 B9R1.95 CC[C@@H]1C[C@@H](C1)C(O)=O Amb25129624 [0,1,0,0,1,0|1,0,0]=3 3827 B9R1.95 CNC1CC(C1)C(O)=O Amb20622656 [0,1,0,0,1,0|1,0,0]=3 3828 B9R1.95 COC1CC(C1)C(C)=O Amb24595933 [0,1,0,0,1,0|1,0,0]=3 3829 B9R1.95 COC1CC(C1)C(N)=N Amb24733631 [0,1,0,0,1,0|2,0,0]=4 3830 B9R1.95 CO[C@@H]1C[C@@H](C1)C(O)=O Amb23440276 [0,1,0,0,1,0|0,0,0]=2 3831 B9R1.95 CO[C@@H]1C[C@H](C1)C(O)=O Amb23440277 [0,1,0,0,1,0|0,0,0]=2 3832 B9R1.95 NC(=O)N1CC(CO)C1 Amb24478714 [0,1,0,0,1,0|2,0,0]=4 3833 B9R1.95 NN=C1CC(C1)C(O)=O Amb23570285 [0,1,0,0,1,0|1,0,1]=4 3834 B9R1.95 OC(=O)C1CC(C1)=NO Amb23452648 [0,1,0,0,1,0|0,0,1]=3 3835 B9R1.95 OC(=O)C1CC(CBr)C1 Amb19958667 [0,1,0,0,1,0|1,0,0]=3 3836 B9R1.95 OC(=O)[C@H]1C[C@@H](CBr)C1 Amb25116147 [0,1,0,0,1,0|1,0,0]=3 3837 B9R1.95 OCC1CC(C1)C(O)=O Amb22002175 [0,1,0,0,1,0|0,0,0]=2 3838 B9R1.95 OC[C@@H]1C[C@@H](N1)C(O)=O Amb24556421 [0,1,0,0,1,0|0,0,0]=2 3839 B9R1.152 CC1(CC(=O)C1)C(O)=O Amb22406208 [0,1,0,0,1,0|0,0,2]=4 3840 B9R1.152 CC1CC(C)(C1)C(O)=O Amb23448860 [0,1,0,0,1,0|1,0,0]=3 3841 B9R1.152 CC1CC(N)(C1)C(O)=O Amb25821754 [0,1,0,0,1,0|1,0,0]=3 3842 B9R1.152 CC1CC(O)(C1)C(N)=O Amb25314653 [0,1,0,0,1,0|2,0,0]=4 3843 B9R1.152 CC1CC(O)(C1)C(O)=O Amb24522784 [0,1,0,0,1,0|1,0,0]=3 3844 B9R1.152 C[C@@]1(C[C@@H](N)C1)C(O)=O Amb23440223 [0,1,0,0,1,0|1,0,0]=3 3845 B9R1.152 C[C@@]1(C[C@@H](N)C1)C(O)=O Amb24730954 [0,1,0,0,1,0|1,0,0]=3 3846 B9R1.152 C[C@@]1(C[C@H](N)C1)C(O)=O Amb23439475 [0,1,0,0,1,0|1,0,0]=3 3847 B9R1.152 C[C@]1(C[C@@H](N)C1)C(O)=O Amb25275111 [0,1,0,0,1,0|1,0,0]=3 3848 B9R1.152 NC1CC(F)(C1)C(O)=O Amb25784332 [0,1,0,0,1,0|1,0,0]=3 3849 B9R1.152 N[C@@]1(C[C@H](F)C1)C(O)=O Amb22746505 [0,1,0,0,1,0|1,0,0]=3 3850 B9R1.152 N[C@]1(C[C@@H](O)C1)C(O)=O Amb25297893 [0,1,0,0,1,0|0,0,0]=2 3851 B9R1.164 CC(=O)C1CC(C)(C)C1 Amb24614703 [0,1,0,0,1,0|2,0,0]=4 3852 B9R1.164 CC(=O)C1CC(C)(O)C1 Amb25773446 [0,1,0,0,1,0|1,0,0]=3 3853 B9R1.164 CC(=O)C1CC(F)(F)C1 Amb24517327 [0,1,0,0,1,0|2,0,0]=4 3854 B9R1.164 CC(=O)[C@@H]1C[C@@](C)(O)C1 Amb25320013 [0,1,0,0,1,0|1,0,0]=3 3855 B9R1.164 CC(=O)[C@@H]1C[C@](C)(O)C1 Amb25735730 [0,1,0,0,1,0|1,0,0]=3 3856 B9R1.164 CC1(C)CC(C1)C(=O)Cl Amb22642158 [0,1,0,0,1,0|2,0,0]=4 3857 B9R1.164 CC1(C)CC(C1)C(N)=O Amb22643161 [0,1,0,0,1,0|2,0,0]=4 3858 B9R1.164 CC1(C)CC(N1)C(O)=O Amb24117447 [0,1,0,0,1,0|1,0,0]=3 3859 B9R1.164 CC1(Cl)CC(C1)C(=O)Cl Amb25337558 [0,1,0,0,1,0|2,0,0]=4 3860 B9R1.164 CC1(F)CC(C1)C(O)=O Amb23439467 [0,1,0,0,1,0|1,0,0]=3 3861 B9R1.164 CC1(O)CC(C1)C(O)=O Amb19958862 [0,1,0,0,1,0|0,0,0]=2 3862 B9R1.164 C[C@@]1(O)C[C@@H](C1)C(O)=O Amb23440037 [0,1,0,0,1,0|0,0,0]=2 3863 B9R1.164 C[C@@]1(O)C[C@H](C1)C(O)=O Amb23440038 [0,1,0,0,1,0|0,0,0]=2 3864 B9R1.164 NC(=O)C1CC(F)(F)C1 Amb22896712 [0,1,0,0,1,0|2,0,0]=4 3865 B9R1.52 CC1CC(C)C1C(O)=O Amb25047286 [0,1,0,0,1,0|2,0,0]=4 3866 B9R1.81 CC1CCC1C(=O)OC Amb25110041 [0,1,0,0,1,0|2,0,0]=4 3867 B9R1.81 COC(=O)C1=CCC1O Amb25335472 [0,1,0,0,1,0|1,0,1]=4 3868 B9R1.81 COC(=O)C1CCC1N Amb25363640 [0,1,0,0,1,0|2,0,0]=4 3869 B9R1.81 COC(=O)C1CCC1O Amb24448430 [0,1,0,0,1,0|1,0,0]=3 3870 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb22232595 [0,1,0,0,1,0|2,0,0]=4 3871 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb23439308 [0,1,0,0,1,0|2,0,0]=4 3872 B9R1.81 COC(=O)[C@@H]1CC[C@H]1Cl Amb24635677 [0,1,0,0,1,0|2,0,0]=4 3873 B9R1.81 COC(=O)[C@H]1CC[C@@H]1N Amb25261158 [0,1,0,0,1,0|2,0,0]=4 3874 B9R1.81 COC(=O)[C@H]1CC[C@H]1N Amb22232608 [0,1,0,0,1,0|2,0,0]=4 3875 B9R1.81 COC(=O)[C@H]1NCC1=O Amb24471980 [0,1,0,0,1,0|0,0,2]=4 3876 B9R1.81 COC(=O)[C@H]1NC[C@H]1O Amb24573017 [0,1,0,0,1,0|0,0,0]=2 3877 B9R1.81 C[C@H]1CC[C@H]1C(=O)OC Amb24559896 [0,1,0,0,1,0|2,0,0]=4 3878 B9R1.81 OC(C=O)C1SCC1O Amb25190373 [0,1,0,0,1,0|1,0,1]=4 3879 B9R1.81 OCC(O)C1NCC1O Amb25102544 [0,1,0,0,1,0|0,0,2]=4 3880 B9R1.81 OC[C@H](O)[C@@H]1NC[C@@H]1O Amb24573509 [0,1,0,0,1,0|0,0,2]=4 3881 B9R1.96 CCC1CCC1C(O)=O Amb25727014 [0,1,0,0,1,0|2,0,0]=4 3882 B9R1.96 CNC1CCC1C(O)=O Amb25340658 [0,1,0,0,1,0|2,0,0]=4 3883 B9R1.96 CSC1CCC1C(O)=O Amb25118114 [0,1,0,0,1,0|1,1,0]=4 3884 B9R1.96 C\C=C/1\CNC1C(O)=O Amb25338611 [0,1,0,0,1,0|1,0,1]=4 3885 B9R1.96 C\C=C\1/CN[C@@H]1C(O)=O Amb25075476 [0,1,0,0,1,0|1,0,1]=4 3886 B9R1.96 NCC1CCC1C(O)=O Amb25269589 [0,1,0,0,1,0|2,0,0]=4 3887 B9R1.96 NC[C@H]1CC[C@H]1C(O)=O Amb24579352 [0,1,0,0,1,0|2,0,0]=4 3888 B9R1.96 OC(=O)C1CCC1C=O Amb25302625 [0,1,0,0,1,0|1,0,1]=4 3889 B9R1.96 OC(=O)C1CCC1CF Amb20667674 [0,1,0,0,1,0|2,0,0]=4 3890 B9R1.96 OCC1CCC1C(O)=O Amb24340315 [0,1,0,0,1,0|1,0,0]=3 3891 B9R1.96 OCC1CCN1C(O)=O Amb22756926 [0,1,0,0,1,0|2,0,0]=4 3892 B9R1.96 ONC1CCC1C(O)=O Amb24471809 [0,1,0,0,1,0|1,0,0]=3 3893 B9R1.96 [O-]C(=O)[C@H]1CC[C@H]1CO Amb25176734 [0,1,0,0,1,0|1,0,1]=4 3894 B9R1.159 CC1(N=CC1O)C(O)=O Amb24078332 [0,1,0,0,1,0|0,0,2]=4 3895 B9R1.159 CC1CCC1(N)C(O)=O Amb23456072 [0,1,0,0,1,0|2,0,0]=4 3896 B9R1.159 C[C@@H]1CC[C@]1(N)C(O)=O Amb24586126 [0,1,0,0,1,0|2,0,0]=4 3897 B9R1.159 C[C@H]1CC[C@@]1(C)C(O)=O Amb24575030 [0,1,0,0,1,0|2,0,0]=4 3898 B9R1.159 NC1(CCC1F)C(O)=O Amb25223441 [0,1,0,0,1,0|2,0,0]=4 3899 B9R1.159 N[C@@H]1CC[C@]1(N)C(O)=O Amb25233319 [0,1,0,0,1,0|2,0,0]=4 3900 B9R1.159 N[C@@]1(CC[C@H]1O)C(O)=O Amb25313173 [0,1,0,0,1,0|1,0,0]=3 3901 B9R1.159 OC1CCC1(O)C(O)=O Amb24477886 [0,1,0,0,1,0|1,0,0]=3 3902 B9R1.166 CC1(C)CCC1C(O)=O Amb25032090 [0,1,0,0,1,0|2,0,0]=4 3903 B9R1.166 CC1(C)CNC1C(O)=O Amb24117326 [0,1,0,0,1,0|1,0,0]=3 3904 B9R1.166 NC(=O)C1NCC1(F)F Amb24467750 [0,1,0,0,1,0|2,0,0]=4 3905 B9R1.166 OC(=O)C1CCC1(F)F Amb24452747 [0,1,0,0,1,0|2,0,0]=4 3906 B11R1.3 C=CC1CCC(CC1)C(O)=O Amb25027907 [0,1,0,0,0,1|2,0,0]=4 3907 B11R1.3 CC(=O)C1CCC(CO)CC1 Amb24357200 [0,1,0,0,0,1|2,0,0]=4 3908 B11R1.3 CC(=O)[C@H]1CC[C@@H](CO)CC1 Amb25151555 [0,1,0,0,0,1|2,0,0]=4 3909 B11R1.3 CCC1CCC(CC1)C(=O)O Amb2413128 [0,1,0,0,0,1|2,0,0]=4 3910 B11R1.3 CCC1CCC(CN1)C(O)=O Amb25848341 [0,1,0,0,0,1|2,0,0]=4 3911 B11R1.3 CCC1CCC(NC1)C(O)=O Amb18126073 [0,1,0,0,0,1|1,0,0]=3 3912 B11R1.3 CNC1CCC(CC1)C(O)=O Amb18949863 [0,1,0,0,0,1|2,0,0]=4 3913 B11R1.3 COC1CCC(CC1)C(C)=O Amb24570436 [0,1,0,0,0,1|2,0,0]=4 3914 B11R1.3 CO[C@@H]1CC[C@@H](CC1)C(C)=O Amb24509803 [0,1,0,0,0,1|2,0,0]=4 3915 B11R1.3 CO[C@@H]1CC[C@H](CC1)C(O)=O Amb24183374 [0,1,0,0,0,1|1,0,0]=3 3916 B11R1.3 N#CC1CCC(CC1)C(O)=O Amb18125541 [0,1,0,0,0,1|2,0,0]=4 3917 B11R1.3 N#C[C@@H]1CC[C@@H](CC1)C(O)=O Amb24740677 [0,1,0,0,0,1|2,0,0]=4 3918 B11R1.3 NCC1CCC(OC1)C(O)=O Amb18126184 [0,1,0,0,0,1|2,0,0]=4 3919 B11R1.3 NCC1COC(CO1)C(O)=O Amb18126282 [0,1,0,0,0,1|2,0,0]=4 3920 B11R1.3 NC[C@@H]1CC[C@@H](CC1)C(=O)O Amb17620787 [0,1,0,0,0,1|2,0,0]=4 3921 B11R1.3 NC[C@@H]1CC[C@@H](CC1)C(O)=O Amb24095009 [0,1,0,0,0,1|2,0,0]=4 3922 B11R1.3 OC(=O)C1CCC(CC1)=NO Amb24487946 [0,1,0,0,0,1|1,0,1]=4 3923 B11R1.3 OC(=O)C1CCC(CF)NC1 Amb25209958 [0,1,0,0,0,1|2,0,0]=4 3924 B11R1.3 OC(=O)[C@@H]1CC[C@@H](CF)CC1 Amb25351015 [0,1,0,0,0,1|2,0,0]=4 3925 B11R1.3 OCC1CCC(CC1)C(=O)Cl Amb25151904 [0,1,0,0,0,1|2,0,0]=4 3926 B11R1.3 OC[C@@H]1CC[C@@H](CC1)C(=O)Cl Amb25098561 [0,1,0,0,0,1|2,0,0]=4 3927 B11R1.3 OC[C@@H]1CC[C@H](CC1)C(O)=O Amb22750650 [0,1,0,0,0,1|1,0,0]=3 3928 B11R1.3 OC[C@H]1CC[C@H](CN1)C(O)=O Amb24105564 [0,1,0,0,0,1|1,0,0]=3 3929 B11R1.3 ONC1CCC(CC1)C(O)=O Amb24626142 [0,1,0,0,0,1|1,0,0]=3 3930 B11R1.3 [15NH2][13CH2]C1CCC(CC1)[13C](=O)O Amb17620788 [0,1,0,0,0,1|2,0,0]=4 3931 B11R1.19 OC1CCC(CC1)S(O)(=O)=O Amb24363793 [0,1,0,0,0,1|2,0,0]=4 3932 B11R1.19 O[C@H]1CC[C@H](CC1)S(O)(=O)=O Amb25149738 [0,1,0,0,0,1|2,0,0]=4 3933 B11R1.21 CC1CC(CCC1N)C(O)=O Amb25262562 [0,1,0,0,0,1|2,0,0]=4 3934 B11R1.21 CC1CC(CNC1C)C(O)=O Amb24418637 [0,1,0,0,0,1|2,0,0]=4 3935 B11R1.21 CC1CCC(CC1N)C(O)=O Amb25065260 [0,1,0,0,0,1|2,0,0]=4 3936 B11R1.21 CC1CCC(CN1C)C(O)=O Amb23571840 [0,1,0,0,0,1|2,0,0]=4 3937 B11R1.21 CC1COC(CC1C)C(O)=O Amb25189134 [0,1,0,0,0,1|2,0,0]=4 3938 B11R1.21 CC1SCC(NC1=O)C(O)=O Amb23590306 [0,1,0,0,0,1|1,0,1]=4 3939 B11R1.21 CC1SCC(SC1C)C(O)=O Amb24369390 [0,1,0,0,0,1|2,0,0]=4 3940 B11R1.21 C[C@@H]1CC[C@H](CC1O)C(O)=O Amb24677766 [0,1,0,0,0,1|2,0,0]=4 3941 B11R1.21 C[C@@H]1CC[C@H](C[C@H]1O)C(O)=O Amb24692813 [0,1,0,0,0,1|2,0,0]=4 3942 B11R1.21 C[C@@H]1C[C@@H](CC[C@@H]1Cl)C(O)=O Amb24726368 [0,1,0,0,0,1|2,0,0]=4 3943 B11R1.21 N[C@H]1CC[C@H](NC1=O)C(O)=O Amb25274959 [0,1,0,0,0,1|1,0,1]=4 3944 B11R1.21 OC(=O)C1=CC(O)C(O)CO1 Amb25108185 [0,1,0,0,0,1|1,0,1]=4 3945 B11R1.21 OC(=O)C1CC(=O)C(O)CN1 Amb25279578 [0,1,0,0,0,1|0,0,0]=2 3946 B11R1.21 OC(=O)C1CC(=O)C(O)CO1 Amb24390226 [0,1,0,0,0,1|1,0,0]=3 3947 B11R1.21 OC(=O)C1CC(F)C(F)CC1 Amb25294326 [0,1,0,0,0,1|2,0,0]=4 3948 B11R1.21 OC(=O)C=1CC(O)C(O)CC1 Amb25233071 [0,1,0,0,0,1|1,0,1]=4 3949 B11R1.21 OC(=O)C=1CCC(O)C(O)C1 Amb25032363 [0,1,0,0,0,1|1,0,1]=4 3950 B11R1.21 OC(=O)C=1CC[C@@H](O)[C@@H](O)C1 Amb24565748 [0,1,0,0,0,1|1,0,1]=4 3951 B11R1.21 OC(=O)C=1CC[C@@H](O)[C@H](O)C1 Amb25241514 [0,1,0,0,0,1|1,0,1]=4 3952 B11R1.21 OC(=O)C=1CC[C@H](O)[C@H](O)C1 Amb25337766 [0,1,0,0,0,1|1,0,1]=4 3953 B11R1.21 OC(=O)[C@@H]1CC(=O)[C@@H](O)CC1 Amb25337755 [0,1,0,0,0,1|1,0,0]=3 3954 B11R1.21 OC1CC(CCC1Cl)C(O)=O Amb24484624 [0,1,0,0,0,1|2,0,0]=4 3955 B11R1.21 OC1CC(CCC1O)C(O)=O Amb25701852 [0,1,0,0,0,1|1,0,0]=3 3956 B11R1.21 OC1CNC(CC1O)C(O)=O Amb24538231 [0,1,0,0,0,1|0,0,0]=2 3957 B11R1.21 O[C@@H]1CN[C@@H](C[C@H]1O)C(O)=O Amb24595228 [0,1,0,0,0,1|0,0,0]=2 3958 B11R1.21 O[C@H]1CNC(C[C@H]1O)C(O)=O Amb25211630 [0,1,0,0,0,1|0,0,0]=2 3959 B11R1.21 O[C@H]1C[C@@H](CC[C@@H]1Cl)C(O)=O Amb24519210 [0,1,0,0,0,1|2,0,0]=4 3960 B11R1.22 CC1CCC(CC1)C(=O)NO Amb25280648 [0,1,0,0,0,1|2,0,0]=4 3961 B11R1.22 CC1CCC(CC1)C(=O)OC Amb24738407 [0,1,0,0,0,1|2,0,0]=4 3962 B11R1.22 CC1CCC(CN1)C(=O)NO Amb25259941 [0,1,0,0,0,1|2,0,0]=4 3963 B11R1.22 CC1CCC(CN1)C(=O)OC Amb21961304 [0,1,0,0,0,1|2,0,0]=4 3964 B11R1.22 CC1CNC(CN1)C(=O)NC Amb18126075 [0,1,0,0,0,1|2,0,0]=4 3965 B11R1.22 CC1CNC(CN1)C(=O)OC Amb24533023 [0,1,0,0,0,1|1,0,0]=3 3966 B11R1.22 CC1CNC(CO1)C(=O)OC Amb25253188 [0,1,0,0,0,1|1,0,0]=3 3967 B11R1.22 CC1CNC(SC1)C(=O)OC Amb25222511 [0,1,0,0,0,1|1,0,0]=3 3968 B11R1.22 CC1COC(CN1)C(=O)OC Amb24511483 [0,1,0,0,0,1|2,0,0]=4 3969 B11R1.22 CNC(=O)C1CCC(O)CC1 Amb25142086 [0,1,0,0,0,1|2,0,0]=4 3970 B11R1.22 COC(=O)C1CCC(Br)CC1 Amb25377448 [0,1,0,0,0,1|2,0,0]=4 3971 B11R1.22 COC(=O)C1CCC(Br)CO1 Amb20621567 [0,1,0,0,0,1|2,0,0]=4 3972 B11R1.22 COC(=O)C1CCC(F)CN1 Amb25258615 [0,1,0,0,0,1|1,0,0]=3 3973 B11R1.22 COC(=O)C1CCC(N)CC1 Amb18548678 [0,1,0,0,0,1|2,0,0]=4 3974 B11R1.22 COC(=O)C1CCC(N)CN1 Amb25294690 [0,1,0,0,0,1|1,0,0]=3 3975 B11R1.22 COC(=O)C1CCC(O)CN1 Amb25246969 [0,1,0,0,0,1|0,0,0]=2 3976 B11R1.22 COC(=O)C1CNC(=O)CN1 Amb24419888 [0,1,0,0,0,1|0,0,2]=4 3977 B11R1.22 COC(=O)C1CNC(=S)CN1 Amb25043192 [0,1,0,0,0,1|0,1,1]=4 3978 B11R1.22 COC(=O)C1CNC(Cl)CN1 Amb19516141 [0,1,0,0,0,1|1,0,0]=3 3979 B11R1.22 COC(=O)[C@@H]1CC[C@@H](CC1)N Amb16183877 [0,1,0,0,0,1|2,0,0]=4 3980 B11R1.22 COC(=O)[C@@H]1CC[C@@H](Cl)CC1 Amb25332637 [0,1,0,0,0,1|2,0,0]=4 3981 B11R1.22 COC(=O)[C@@H]1CC[C@@H](N)CO1 Amb24697841 [0,1,0,0,0,1|2,0,0]=4 3982 B11R1.22 COC(=O)[C@@H]1CC[C@@H](O)CC1 Amb22756640 [0,1,0,0,0,1|1,0,0]=3 3983 B11R1.22 COC(=O)[C@@H]1CC[C@H](CC1)N Amb16183878 [0,1,0,0,0,1|2,0,0]=4 3984 B11R1.22 COC(=O)[C@@H]1CC[C@H](N)CC1 Amb22755441 [0,1,0,0,0,1|2,0,0]=4 3985 B11R1.22 COC(=O)[C@@H]1CC[C@H](O)CC1 Amb23439292 [0,1,0,0,0,1|1,0,0]=3 3986 B11R1.22 COC(=O)[C@@H]1CC[C@H](O)CN1 Amb24571184 [0,1,0,0,0,1|0,0,0]=2 3987 B11R1.22 COC(=O)[C@@H]1CNC(=O)CN1 Amb10608895 [0,1,0,0,0,1|0,0,2]=4 3988 B11R1.22 COC(=O)[C@@H]1CNC(=O)CN1 Amb22748852 [0,1,0,0,0,1|0,0,2]=4 3989 B11R1.22 COC(=O)[C@H]1CC[C@@H](Cl)CC1 Amb25798978 [0,1,0,0,0,1|2,0,0]=4 3990 B11R1.22 COC(=O)[C@H]1CNC(=O)CN1 Amb10608896 [0,1,0,0,0,1|0,0,2]=4 3991 B11R1.22 C[C@@H]1CC[C@@H](CN1)C(=O)OC Amb23439745 [0,1,0,0,0,1|2,0,0]=4 3992 B11R1.22 C[C@@H]1CC[C@H](CN1)C(=O)OC Amb22886452 [0,1,0,0,0,1|2,0,0]=4 3993 B11R1.22 C[C@@H]1CC[C@H](CN1)C(=O)OC Amb24655066 [0,1,0,0,0,1|2,0,0]=4 3994 B11R1.22 NCC(=O)C1CCC(O)CC1 Amb24106021 [0,1,0,0,0,1|2,0,0]=4 3995 B11R1.22 NNC(=O)C1CCC(O)CC1 Amb25801116 [0,1,0,0,0,1|2,0,0]=4 3996 B11R1.22 O[C@@H]1CC[C@@H](CC1)C(=O)CCl Amb24373125 [0,1,0,0,0,1|2,0,0]=4 3997 B11R1.166 CC1CC(Cl)CCC1C(O)=O Amb24065967 [0,1,0,0,0,1|2,0,0]=4 3998 B11R1.166 CC1CC(O)C(CN1)C(O)=O Amb18830395 [0,1,0,0,0,1|2,0,0]=4 3999 B11R1.166 CC1CC(O)CCC1C(C)=O Amb25149671 [0,1,0,0,0,1|2,0,0]=4 4000 B11R1.166 CC1CC(O)CCC1C(O)=O Amb25227872 [0,1,0,0,0,1|1,0,0]=3 4001 B11R1.166 CC1CCC(C(C)=O)N(C)C1 Amb25151493 [0,1,0,0,0,1|2,0,0]=4 4002 B11R1.166 CC1CCC(C(C)N1)C(O)=O Amb25138873 [0,1,0,0,0,1|2,0,0]=4 4003 B11R1.166 CC1CCC(C(C)O1)C(O)=O Amb24484632 [0,1,0,0,0,1|2,0,0]=4 4004 B11R1.166 CC1CCC(C(S)C1)C(O)=O Amb18178147 [0,1,0,0,0,1|2,0,0]=4 4005 B11R1.166 CC1OC(C)CNC1C(N)=O Amb25150193 [0,1,0,0,0,1|2,0,0]=4 4006 B11R1.166 CC1OC(C)CNC1C(O)=O Amb25238030 [0,1,0,0,0,1|1,0,0]=3 4007 B11R1.166 C[C@@H]1CC[C@@H]([C@H](C)O1)C(O)=O Amb25173183 [0,1,0,0,0,1|2,0,0]=4 4008 B11R1.166 C[C@@H]1CC[C@H]([C@H](C)O1)C(O)=O Amb25247949 [0,1,0,0,0,1|2,0,0]=4 4009 B11R1.166 C[C@H]1C[C@@H](C)[C@@H](CC1)C(O)=O Amb24565702 [0,1,0,0,0,1|2,0,0]=4 4010 B11R1.166 C[C@H]1C[C@@H](O)[C@@H](CC1)C(O)=O Amb24726153 [0,1,0,0,0,1|2,0,0]=4 4011 B11R1.166 C[C@H]1C[C@H](O)[C@@H](CC1)C(O)=O Amb24602306 [0,1,0,0,0,1|2,0,0]=4 4012 B11R1.166 NC(=O)C1CNC(O)CC1=O Amb24458624 [0,1,0,0,0,1|2,0,0]=4 4013 B11R1.166 NC(=O)C1NCC(O)CC1O Amb24356605 [0,1,0,0,0,1|1,0,0]=3 4014 B11R1.166 NC1CC(O)CCC1C(O)=O Amb25269549 [0,1,0,0,0,1|1,0,0]=3 4015 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 4016 B11R1.166 OC(=O)C1CCC(Cl)NC1Cl Amb24514282 [0,1,0,0,0,1|2,0,0]=4 4017 B11R1.220 CC(=O)C1(C)CCC(O)CC1 Amb25320133 [0,1,0,0,0,1|2,0,0]=4 4018 B11R1.220 CC1(CCC(Cl)CC1)C(O)=O Amb18127808 [0,1,0,0,0,1|2,0,0]=4 4019 B11R1.220 CC1(CCC(F)CC1)C(O)=O Amb23456113 [0,1,0,0,0,1|2,0,0]=4 4020 B11R1.220 CC1(CCC(N)CC1)C(O)=O Amb23536219 [0,1,0,0,0,1|2,0,0]=4 4021 B11R1.220 CC1(CCC(O)C=C1)C(O)=O Amb18125969 [0,1,0,0,0,1|1,0,1]=4 4022 B11R1.220 CC1(CCC(O)CC1)C(O)=O Amb18126139 [0,1,0,0,0,1|1,0,0]=3 4023 B11R1.220 CC1(CNC(=O)CN1)C(O)=O Amb24742044 [0,1,0,0,0,1|0,0,2]=4 4024 B11R1.220 CC1CCC(C)(CC1)C(O)=O Amb25083864 [0,1,0,0,0,1|2,0,0]=4 4025 B11R1.220 CC1CCC(O)(CC1)C(O)=O Amb18944702 [0,1,0,0,0,1|2,0,0]=4 4026 B11R1.220 CC1CNC(C)(CO1)C(N)=O Amb25335807 [0,1,0,0,0,1|2,0,0]=4 4027 B11R1.220 C[C@@]1(CC[C@@H](O)CC1)C(O)=O Amb25085529 [0,1,0,0,0,1|1,0,0]=3 4028 B11R1.220 C[C@]1(CC[C@@H](Cl)CC1)C(O)=O Amb25210850 [0,1,0,0,0,1|2,0,0]=4 4029 B11R1.220 C[C@]1(CC[C@@H](N)CC1)C(O)=O Amb25074620 [0,1,0,0,0,1|2,0,0]=4 4030 B11R1.220 NC1CCC(F)(CC1)C(O)=O Amb24105434 [0,1,0,0,0,1|2,0,0]=4 4031 B11R1.220 NC1CCC(O)(CC1)C(O)=O Amb24116860 [0,1,0,0,0,1|2,0,0]=4 4032 B11R1.220 N[C@]1(CC[C@@H](O)CC1)C(O)=O Amb25088436 [0,1,0,0,0,1|1,0,0]=3 4033 B11R1.220 OC(=O)C1(O)CCC(Cl)CC1 Amb25257426 [0,1,0,0,0,1|2,0,0]=4 4034 B11R1.220 O[C@@H]1CC[C@](O)(CC1)C(O)=O Amb24390390 [0,1,0,0,0,1|1,0,0]=3 4035 B11R1.727 CC(=O)C1CCC(C)(O)CC1 Amb24486267 [0,1,0,0,0,1|2,0,0]=4 4036 B11R1.727 CC(=O)C1CCC(CC1)(N)O Amb16233808 [0,1,0,0,0,1|2,0,0]=4 4037 B11R1.727 CC1(C)CCC(CC1)C(O)=O Amb18644844 [0,1,0,0,0,1|2,0,0]=4 4038 B11R1.727 CC1(C)CCC(CO1)C(O)=O Amb24312659 [0,1,0,0,0,1|2,0,0]=4 4039 B11R1.727 CC1(C)CNC(CC1)C(N)=O Amb24422946 [0,1,0,0,0,1|2,0,0]=4 4040 B11R1.727 CC1(C)CNC(CC1)C(O)=O Amb24649754 [0,1,0,0,0,1|1,0,0]=3 4041 B11R1.727 CC1(C)CNC(CO1)C(O)=O Amb19889803 [0,1,0,0,0,1|1,0,0]=3 4042 B11R1.727 CC1(C)CN[C@@H](CO1)C(O)=O Amb19889802 [0,1,0,0,0,1|1,0,0]=3 4043 B11R1.727 CC1(C)CN[C@@H](CO1)C(O)=O Amb25111013 [0,1,0,0,0,1|1,0,0]=3 4044 B11R1.727 CC1(C)CN[C@H](CO1)C(O)=O Amb25207391 [0,1,0,0,0,1|1,0,0]=3 4045 B11R1.727 CC1(C)COC(CN1)C(O)=O Amb25148099 [0,1,0,0,0,1|2,0,0]=4 4046 B11R1.727 CC1(C)COC(CO1)C(O)=O Amb24558775 [0,1,0,0,0,1|2,0,0]=4 4047 B11R1.727 CC1(C)COC(OC1)C(O)=O Amb24433318 [0,1,0,0,0,1|2,0,0]=4 4048 B11R1.727 CC1(Cl)CCC(CC1)C(O)=O Amb18648011 [0,1,0,0,0,1|2,0,0]=4 4049 B11R1.727 C[C@]1(O)CC[C@H](CC1)C(O)=O Amb25059131 [0,1,0,0,0,1|1,0,0]=3 4050 B11R1.727 OC(=O)C1CCC(F)(F)CN1 Amb23439100 [0,1,0,0,0,1|1,0,0]=3 4051 B11R1.727 OC(=O)C1NCC(OC1)(C)C Amb10608911 [0,1,0,0,0,1|1,0,0]=3 4052 B11R1.39 C#CC(=O)N[C@H]1CC[C@@H](O)C1 Amb25240757 [0,1,0,0,0,1|2,0,0]=4 4053 B11R1.39 CC1CC(CC1)NC(=O)CO Amb24732735 [0,1,0,0,0,1|2,0,0]=4 4054 B11R1.39 CC1CCC(C1)CC(=O)OC Amb25120585 [0,1,0,0,0,1|2,0,0]=4 4055 B11R1.39 CCC(=O)N[C@H]1CC[C@@H](O)C1 Amb25344683 [0,1,0,0,0,1|2,0,0]=4 4056 B11R1.39 CNC(=O)C[C@@H]1C[C@@H](O)CN1 Amb25179132 [0,1,0,0,0,1|1,0,0]=3 4057 B11R1.39 CNC(=O)N[C@@H]1C[C@H](O)CC1 Amb25334465 [0,1,0,0,0,1|2,0,0]=4 4058 B11R1.39 COC(=O)CC1CC(=O)CN1 Amb24596599 [0,1,0,0,0,1|0,0,2]=4 4059 B11R1.39 COC(=O)CC1CC(O)C=C1 Amb24484577 [0,1,0,0,0,1|1,0,1]=4 4060 B11R1.39 COC(=O)CN1CC(O)CC1 Amb18177629 [0,1,0,0,0,1|2,0,0]=4 4061 B11R1.39 COC(=O)CN1CC(O)CO1 Amb25252635 [0,1,0,0,0,1|2,0,0]=4 4062 B11R1.39 COC(=O)CN1C[C@H](O)CO1 Amb24502031 [0,1,0,0,0,1|2,0,0]=4 4063 B11R1.39 COC(=O)C[C@@H]1CC[C@H](N)C1 Amb24734862 [0,1,0,0,0,1|2,0,0]=4 4064 B11R1.39 COC(=O)C[C@@H]1CC[C@H](O)C1 Amb25054455 [0,1,0,0,0,1|1,0,0]=3 4065 B11R1.39 COC(=O)C[C@@H]1C[C@H](O)C=C1 Amb22747624 [0,1,0,0,0,1|1,0,1]=4 4066 B11R1.39 COC(=O)C[C@H]1CC[C@@H](O)C1 Amb24598237 [0,1,0,0,0,1|1,0,0]=3 4067 B11R1.39 COC(=O)C[C@H]1CC[C@H](Cl)C1 Amb25238339 [0,1,0,0,0,1|2,0,0]=4 4068 B11R1.39 COC(=O)N[C@H]1CC[C@@H](O)C1 Amb24619117 [0,1,0,0,0,1|1,0,0]=3 4069 B11R1.39 COC(=O)N[C@H]1C[C@@H](O)C=C1 Amb24587774 [0,1,0,0,0,1|1,0,1]=4 4070 B11R1.39 COC(=O)O[C@@H]1C[C@H](O)C=C1 Amb25256712 [0,1,0,0,0,1|1,0,1]=4 4071 B11R1.39 CON(C)CC1CC(O)CN1 Amb24556355 [0,1,0,0,0,1|2,0,0]=4 4072 B11R1.39 O[C@@H]1CC[C@@H](C1)NC(=O)CO Amb25762593 [0,1,0,0,0,1|1,0,0]=3 4073 B11R1.43 CC(=O)NC1CCC(CO)C1 Amb24380802 [0,1,0,0,0,1|2,0,0]=4 4074 B11R1.43 CC(=O)N[C@H]1CC[C@@H](CO)C1 Amb24582062 [0,1,0,0,0,1|2,0,0]=4 4075 B11R1.43 CCC1CC(CC1)CC(O)=O Amb25715115 [0,1,0,0,0,1|2,0,0]=4 4076 B11R1.43 COC1CC(CC1)NC(C)=O Amb25701076 [0,1,0,0,0,1|2,0,0]=4 4077 B11R1.43 COC1CC(CC1)OC(C)=O Amb25370099 [0,1,0,0,0,1|2,0,0]=4 4078 B11R1.43 COC1CN(CC(O)=O)CC1 Amb21860464 [0,1,0,0,0,1|2,0,0]=4 4079 B11R1.43 COC1CNC(C1)CC(O)=O Amb25149435 [0,1,0,0,0,1|0,0,0]=2 4080 B11R1.43 CO[C@@H]1CN(CC(O)=O)CC1 Amb24369951 [0,1,0,0,0,1|2,0,0]=4 4081 B11R1.43 CO[C@@H]1CN(CC(O)=O)CC1 Amb24485093 [0,1,0,0,0,1|2,0,0]=4 4082 B11R1.43 CO[C@@H]1C[C@@H](CC(O)=O)CC1 Amb25260453 [0,1,0,0,0,1|1,0,0]=3 4083 B11R1.43 N#CC1CC(CC(O)=O)CC1 Amb18201140 [0,1,0,0,0,1|2,0,0]=4 4084 B11R1.43 NC(=O)NC1CCC(CO)C1 Amb25101955 [0,1,0,0,0,1|2,0,0]=4 4085 B11R1.43 OCC1CC(CC1)CC(O)=O Amb25054034 [0,1,0,0,0,1|1,0,0]=3 4086 B11R1.43 OCC1CN(CC(O)=O)CC1 Amb18296497 [0,1,0,0,0,1|2,0,0]=4 4087 B11R1.43 OC[C@@H]1C[C@H](CN1)NC(O)=O Amb22756254 [0,1,0,0,0,1|2,0,0]=4 4088 B11R1.43 OC[C@H]1CN(CC(O)=O)CC1 Amb24644125 [0,1,0,0,0,1|2,0,0]=4 4089 B11R1.76 OC1CCC(C1)CS(O)(=O)=O Amb24653599 [0,1,0,0,0,1|2,0,0]=4 4090 B11R1.76 O[C@@H]1CC[C@H](C1)CS(O)(=O)=O Amb25175032 [0,1,0,0,0,1|2,0,0]=4 4091 B11R1.80 NC1CC(CC(O)=O)NC1=O Amb24559191 [0,1,0,0,0,1|1,0,1]=4 4092 B11R1.80 N[C@H]1C[C@@H](CC(O)=O)NC1=O Amb24563703 [0,1,0,0,0,1|1,0,1]=4 4093 B11R1.80 N[C@H]1C[C@H](CC(O)=O)NC1=O Amb25274953 [0,1,0,0,0,1|1,0,1]=4 4094 B11R1.80 OC(=O)CN1CC(O)C(O)C1 Amb25695312 [0,1,0,0,0,1|2,0,0]=4 4095 B11R1.80 OC(=O)CN1C[C@@H](O)[C@H](O)C1 Amb24749924 [0,1,0,0,0,1|2,0,0]=4 4096 B11R1.80 OC1CC(CC(O)=O)OC1O Amb25351438 [0,1,0,0,0,1|1,0,0]=3 4097 B11R1.80 O[C@@H]1C[C@@H](CC(O)=O)O[C@H]1O Amb24642039 [0,1,0,0,0,1|1,0,0]=3 4098 B11R1.313 CC(=O)N[C@@H]1CC[C@@H](O)[C@H]1O Amb25234759 [0,1,0,0,0,1|2,0,0]=4 4099 B11R1.313 CC(=O)N[C@H]1CC[C@@H](O)[C@H]1O Amb24576658 [0,1,0,0,0,1|2,0,0]=4 4100 B11R1.313 NC(=O)C[C@H]1NC[C@@H](O)[C@H]1O Amb24601822 [0,1,0,0,0,1|1,0,0]=3 4101 B11R1.313 OC(O)C[C@H]1NC[C@H](O)[C@@H]1O Amb25232522 [0,1,0,0,0,1|0,0,2]=4 4102 B11R1.313 OC1CNC(CC(O)=O)C1O Amb25057693 [0,1,0,0,0,1|0,0,0]=2 4103 B11R1.313 O[C@@H]1CN[C@@H](CC(O)=O)[C@@H]1O Amb25231755 [0,1,0,0,0,1|0,0,0]=2 4104 B11R1.314 CC(C(O)=O)N1CC(O)CC1 Amb18965687 [0,1,0,0,0,1|2,0,0]=4 4105 B11R1.314 CC(C(O)=O)N1CC(O)CO1 Amb25761532 [0,1,0,0,0,1|2,0,0]=4 4106 B11R1.314 CC(C(O)=O)N1C[C@H](O)CO1 Amb25225721 [0,1,0,0,0,1|2,0,0]=4 4107 B11R1.314 CC(C1CC(O)C=C1)C(O)=O Amb24366670 [0,1,0,0,0,1|1,0,1]=4 4108 B11R1.314 CC(C1CC(O)CC1)C(O)=O Amb24639274 [0,1,0,0,0,1|1,0,0]=3 4109 B11R1.314 CC([C@@H]1C[C@H](O)C=C1)C(O)=O Amb25179118 [0,1,0,0,0,1|1,0,1]=4 4110 B11R1.314 CC([C@H]1C[C@@H](O)C=C1)C(O)=O Amb24635891 [0,1,0,0,0,1|1,0,1]=4 4111 B11R1.314 CC([C@H]1C[C@H](O)C=C1)C(O)=O Amb25227527 [0,1,0,0,0,1|1,0,1]=4 4112 B11R1.314 CC1CC(CC1)C(O)C(O)=O Amb25149222 [0,1,0,0,0,1|2,0,0]=4 4113 B11R1.314 NC(C1CC(O)CO1)C(O)=O Amb24436005 [0,1,0,0,0,1|1,0,0]=3 4114 B11R1.314 OC(=O)C(=O)N1CC(O)CC1 Amb18948670 [0,1,0,0,0,1|2,0,0]=4 4115 B11R1.314 O[C@H]1CN[C@@H](C1)[C@H](O)C(O)=O Amb24652516 [0,1,0,0,0,1|0,0,0]=2 4116 B11R1.645 CC1CC(CC(C)=O)N(C)C1 Amb24662369 [0,1,0,0,0,1|2,0,0]=4 4117 B11R1.645 CC1CC(CC(O)=O)C(=O)C1 Amb25074617 [0,1,0,0,0,1|2,0,0]=4 4118 B11R1.645 OC(=O)CN1CC(O)CC1=O Amb18126173 [0,1,0,0,0,1|2,0,0]=4 4119 B11R1.710 OC(=O)CC1CC(F)(F)CN1 Amb24688181 [0,1,0,0,0,1|1,0,0]=3 4120 B11R1.23 C=C(C=O)C1CCCC(O)C1 Amb25783773 [0,1,0,0,0,1|2,0,0]=4 4121 B11R1.23 CC1CC(CCC1)C(=O)NO Amb24386557 [0,1,0,0,0,1|2,0,0]=4 4122 B11R1.23 CC1CC(CCN1)C(=O)NO Amb25708809 [0,1,0,0,0,1|2,0,0]=4 4123 B11R1.23 CC1CC(CCN1)C(=O)OC Amb25104902 [0,1,0,0,0,1|2,0,0]=4 4124 B11R1.23 CC1CC(CCO1)C(=O)OC Amb25730422 [0,1,0,0,0,1|2,0,0]=4 4125 B11R1.23 CC1CC(CCO1)C(=O)ON Amb25313398 [0,1,0,0,0,1|2,0,0]=4 4126 B11R1.23 CC1CC(CCO1)C(=O)OO Amb22295735 [0,1,0,0,0,1|2,0,0]=4 4127 B11R1.23 CC1CC(CNC1)C(=O)C#C Amb24599646 [0,1,0,0,0,1|2,0,0]=4 4128 B11R1.23 CC1CC(CNC1)C(=O)C=C Amb24542993 [0,1,0,0,0,1|2,0,0]=4 4129 B11R1.23 CC1CC(CNC1)C(=O)NO Amb24542959 [0,1,0,0,0,1|1,0,0]=3 4130 B11R1.23 CC1CC(NCC1)C(=O)NO Amb25349891 [0,1,0,0,0,1|1,0,0]=3 4131 B11R1.23 CC1CCNC(S1)C(=O)OC Amb24697186 [0,1,0,0,0,1|2,0,0]=4 4132 B11R1.23 CC1CNCC(C1)C(=O)OC Amb22728513 [0,1,0,0,0,1|1,0,0]=3 4133 B11R1.23 CC1CNCC(O1)C(=O)OC Amb24761259 [0,1,0,0,0,1|2,0,0]=4 4134 B11R1.23 CC=1C[C@H](NCC1)C(=O)OC Amb25087820 [0,1,0,0,0,1|1,0,1]=4 4135 B11R1.23 CNC(=O)C1CC(O)CCN1 Amb24691531 [0,1,0,0,0,1|1,0,0]=3 4136 B11R1.23 CNC(=O)C1CCCC(O)C1 Amb25792016 [0,1,0,0,0,1|2,0,0]=4 4137 B11R1.23 COC(=O)C1CC(=O)CCN1 Amb13889092 [0,1,0,0,0,1|0,0,2]=4 4138 B11R1.23 COC(=O)C1CC(=O)CCN1 Amb22899628 [0,1,0,0,0,1|0,0,2]=4 4139 B11R1.23 COC(=O)C1CC(=O)CNC1 Amb25178940 [0,1,0,0,0,1|0,0,2]=4 4140 B11R1.23 COC(=O)C1CC(Cl)CCO1 Amb24635840 [0,1,0,0,0,1|2,0,0]=4 4141 B11R1.23 COC(=O)C1CC(F)CCN1 Amb25270013 [0,1,0,0,0,1|1,0,0]=3 4142 B11R1.23 COC(=O)C1CC(F)CCO1 Amb25046184 [0,1,0,0,0,1|2,0,0]=4 4143 B11R1.23 COC(=O)C1CC(N)CC=C1 Amb25691413 [0,1,0,0,0,1|2,0,0]=4 4144 B11R1.23 COC(=O)C1CC(N)CCN1 Amb13886365 [0,1,0,0,0,1|1,0,0]=3 4145 B11R1.23 COC(=O)C1CC(N)CCO1 Amb24638116 [0,1,0,0,0,1|2,0,0]=4 4146 B11R1.23 COC(=O)C1CC(O)CCN1 Amb21856404 [0,1,0,0,0,1|0,0,0]=2 4147 B11R1.23 COC(=O)C1CC(O)CCN1 Amb21963536 [0,1,0,0,0,1|0,0,0]=2 4148 B11R1.23 COC(=O)C1CCCC(Cl)C1 Amb24390370 [0,1,0,0,0,1|2,0,0]=4 4149 B11R1.23 COC(=O)C1CCCC(F)C1 Amb24439491 [0,1,0,0,0,1|2,0,0]=4 4150 B11R1.23 COC(=O)C1CCCC(N)C1 Amb18288448 [0,1,0,0,0,1|2,0,0]=4 4151 B11R1.23 COC(=O)C1CCCC(N)C1 Amb20668217 [0,1,0,0,0,1|2,0,0]=4 4152 B11R1.23 COC(=O)C1CCCC(O)C1 Amb19516181 [0,1,0,0,0,1|1,0,0]=3 4153 B11R1.23 COC(=O)C1CNCC(C1)F Amb13889097 [0,1,0,0,0,1|1,0,0]=3 4154 B11R1.23 COC(=O)C1CNCC(C1)O Amb13885763 [0,1,0,0,0,1|0,0,0]=2 4155 B11R1.23 COC(=O)C1CNCC(O)C1 Amb17739877 [0,1,0,0,0,1|0,0,0]=2 4156 B11R1.23 COC(=O)C1CSCC(N)C1 Amb24581425 [0,1,0,0,0,1|2,0,0]=4 4157 B11R1.23 COC(=O)C1NCCC(C1)C Amb13886431 [0,1,0,0,0,1|1,0,0]=3 4158 B11R1.23 COC(=O)C1NCCN(C1)C Amb15692177 [0,1,0,0,0,1|2,0,0]=4 4159 B11R1.23 COC(=O)C=1CC(O)CCC1 Amb25043658 [0,1,0,0,0,1|1,0,1]=4 4160 B11R1.23 COC(=O)N1CC(O)CC=C1 Amb25172124 [0,1,0,0,0,1|2,0,0]=4 4161 B11R1.23 COC(=O)N1C[C@H](O)CCC1 Amb24528215 [0,1,0,0,0,1|2,0,0]=4 4162 B11R1.23 COC(=O)[C@@H]1CC(=O)CCN1 Amb13889085 [0,1,0,0,0,1|0,0,2]=4 4163 B11R1.23 COC(=O)[C@@H]1CC(O)C=CO1 Amb24474250 [0,1,0,0,0,1|1,0,1]=4 4164 B11R1.23 COC(=O)[C@@H]1CC=C[C@H](O)C1 Amb25176273 [0,1,0,0,0,1|1,0,1]=4 4165 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](N)C1 Amb24563866 [0,1,0,0,0,1|2,0,0]=4 4166 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](O)C1 Amb22899456 [0,1,0,0,0,1|1,0,0]=3 4167 B11R1.23 COC(=O)[C@@H]1CCC[C@H](C1)N Amb10873181 [0,1,0,0,0,1|2,0,0]=4 4168 B11R1.23 COC(=O)[C@@H]1CCC[C@H](Cl)C1 Amb25328848 [0,1,0,0,0,1|2,0,0]=4 4169 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 Amb22747531 [0,1,0,0,0,1|2,0,0]=4 4170 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 Amb23438867 [0,1,0,0,0,1|2,0,0]=4 4171 B11R1.23 COC(=O)[C@@H]1C[C@@H](F)CCN1 Amb24709324 [0,1,0,0,0,1|1,0,0]=3 4172 B11R1.23 COC(=O)[C@@H]1C[C@@H](F)CCO1 Amb25163703 [0,1,0,0,0,1|2,0,0]=4 4173 B11R1.23 COC(=O)[C@@H]1C[C@@H](O)CCN1 Amb22748265 [0,1,0,0,0,1|0,0,0]=2 4174 B11R1.23 COC(=O)[C@@H]1C[C@H](F)CCO1 Amb24693283 [0,1,0,0,0,1|2,0,0]=4 4175 B11R1.23 COC(=O)[C@@H]1C[C@H](O)CCN1 Amb10606654 [0,1,0,0,0,1|0,0,0]=2 4176 B11R1.23 COC(=O)[C@H]1CC(=C)CCN1 Amb24605746 [0,1,0,0,0,1|1,0,1]=4 4177 B11R1.23 COC(=O)[C@H]1CC(F)CCN1 Amb25704379 [0,1,0,0,0,1|1,0,0]=3 4178 B11R1.23 COC(=O)[C@H]1CC=C[C@@H](O)C1 Amb24555180 [0,1,0,0,0,1|1,0,1]=4 4179 B11R1.23 COC(=O)[C@H]1CCC[C@@H](Cl)C1 Amb24602426 [0,1,0,0,0,1|2,0,0]=4 4180 B11R1.23 COC(=O)[C@H]1CCC[C@@H](O)C1 Amb25198846 [0,1,0,0,0,1|1,0,0]=3 4181 B11R1.23 COC(=O)[C@H]1CCC[C@H](O)C1 Amb25225913 [0,1,0,0,0,1|1,0,0]=3 4182 B11R1.23 COC(=O)[C@H]1COC[C@H](O)C1 Amb24076400 [0,1,0,0,0,1|1,0,0]=3 4183 B11R1.23 COC(=O)[C@H]1C[C@@H](Cl)CCO1 Amb25210489 [0,1,0,0,0,1|2,0,0]=4 4184 B11R1.23 COC(=O)[C@H]1C[C@@H](O)CCN1 Amb10606701 [0,1,0,0,0,1|0,0,0]=2 4185 B11R1.23 COC(=O)[C@H]1C[C@H](Cl)CCN1 Amb24634317 [0,1,0,0,0,1|1,0,0]=3 4186 B11R1.23 COC(=O)[C@H]1C[C@H](F)CCO1 Amb24620300 [0,1,0,0,0,1|2,0,0]=4 4187 B11R1.23 COC(=O)[C@H]1C[C@H](N)CCN1 Amb25174839 [0,1,0,0,0,1|1,0,0]=3 4188 B11R1.23 COC(=O)[C@H]1C[C@H](O)CCN1 Amb13886334 [0,1,0,0,0,1|0,0,0]=2 4189 B11R1.23 C[C@@H]1CCN[C@H](C1)C(=O)OC Amb22586131 [0,1,0,0,0,1|1,0,0]=3 4190 B11R1.23 C[C@@H]1CNCC(O1)C(=O)OC Amb25684325 [0,1,0,0,0,1|2,0,0]=4 4191 B11R1.23 C[C@@H]1CNC[C@@H](C1)C(=O)OC Amb24062236 [0,1,0,0,0,1|1,0,0]=3 4192 B11R1.23 C[C@@H]1CNC[C@@H](O1)C(=O)OC Amb24555590 [0,1,0,0,0,1|2,0,0]=4 4193 B11R1.23 C[C@@H]1CNC[C@H](C1)C(=O)OC Amb24062238 [0,1,0,0,0,1|1,0,0]=3 4194 B11R1.23 C[C@@H]1C[C@@H](CCN1)C(=O)OC Amb22406179 [0,1,0,0,0,1|2,0,0]=4 4195 B11R1.23 C[C@@H]1C[C@@H](CCN1)C(=O)OC Amb23440187 [0,1,0,0,0,1|2,0,0]=4 4196 B11R1.23 C[C@@H]1C[C@H](OCC1)C(=O)NO Amb24749481 [0,1,0,0,0,1|2,0,0]=4 4197 B11R1.23 C[C@H]1CNC[C@@H](C1)C(=O)OC Amb22736671 [0,1,0,0,0,1|1,0,0]=3 4198 B11R1.23 C[C@H]1CNC[C@H](C1)C(=O)OC Amb24062237 [0,1,0,0,0,1|1,0,0]=3 4199 B11R1.23 NCC(=O)C1CCCC(O)C1 Amb25315833 [0,1,0,0,0,1|2,0,0]=4 4200 B11R1.23 NCC(=O)[C@@H]1CCC[C@H](O)C1 Amb24106037 [0,1,0,0,0,1|2,0,0]=4 4201 B11R1.23 NNC(=O)C1CCCC(O)C1 Amb25381484 [0,1,0,0,0,1|2,0,0]=4 4202 B11R1.23 OCC(=O)N1CC(O)CCC1 Amb24636770 [0,1,0,0,0,1|2,0,0]=4 4203 B11R1.23 O[C@H]1C[C@@H](CCC1)C(=O)CBr Amb25694930 [0,1,0,0,0,1|2,0,0]=4 4204 B11R1.23 O[C@H]1C[C@H](CCC1)C(=O)CBr Amb25694940 [0,1,0,0,0,1|2,0,0]=4 4205 B11R1.74 CC1CC(=O)CC(N1)C(O)=O Amb18200027 [0,1,0,0,0,1|0,0,2]=4 4206 B11R1.74 CC1CC(CC(=O)C1)C(O)=O Amb25227466 [0,1,0,0,0,1|2,0,0]=4 4207 B11R1.74 CC1CC(CC(C)N1)C(O)=O Amb23535943 [0,1,0,0,0,1|2,0,0]=4 4208 B11R1.74 CC1CC(CC(C)O1)C(O)=O Amb18830483 [0,1,0,0,0,1|2,0,0]=4 4209 B11R1.74 CC1CC(NC(=O)C1)C(N)=O Amb25834138 [0,1,0,0,0,1|2,0,0]=4 4210 B11R1.74 CC1CC(NC(C)C1)C(O)=O Amb24588101 [0,1,0,0,0,1|1,0,0]=3 4211 B11R1.74 CC1CC(O)CC(C1)C(O)=O Amb24740731 [0,1,0,0,0,1|1,0,0]=3 4212 B11R1.74 CC1CC(OC(C)C1)C(O)=O Amb18830486 [0,1,0,0,0,1|2,0,0]=4 4213 B11R1.74 CC1CS(=O)CC(N1)C(O)=O Amb22304712 [0,1,0,0,0,1|1,0,1]=4 4214 B11R1.74 C[C@@H]1CN(C)C[C@@H](O1)C(O)=O Amb24586051 [0,1,0,0,0,1|2,0,0]=4 4215 B11R1.74 C[C@@H]1C[C@@H](C[C@H](C)C1)C(O)=O Amb24487888 [0,1,0,0,0,1|2,0,0]=4 4216 B11R1.74 C[C@@H]1C[C@H](NC(=S)N1)C(=O)O Amb10608553 [0,1,0,0,0,1|1,0,1]=4 4217 B11R1.74 C[C@H]1CS(=O)C[C@@H](N1)C(O)=O Amb24565788 [0,1,0,0,0,1|1,0,1]=4 4218 B11R1.74 NC1CC(NC(=O)C1)C(O)=O Amb18199921 [0,1,0,0,0,1|1,0,0]=3 4219 B11R1.74 OC(=O)C1CC(=O)CC(=O)N1 Amb18200050 [0,1,0,0,0,1|0,0,2]=4 4220 B11R1.74 OC(=O)C1CC(=O)NC(O)N1 Amb24415418 [0,1,0,0,0,1|0,0,2]=4 4221 B11R1.74 OC(=O)C1CC(F)CC(F)C1 Amb25854232 [0,1,0,0,0,1|2,0,0]=4 4222 B11R1.74 OC(=O)C=1CC(O)CC(=O)C1 Amb25046744 [0,1,0,0,0,1|1,0,1]=4 4223 B11R1.74 OC(=O)C=1C[C@@H](O)CC(=O)C1 Amb25074471 [0,1,0,0,0,1|1,0,1]=4 4224 B11R1.74 OC(=O)C=1C[C@@H](O)C[C@@H](O)C1 Amb24572553 [0,1,0,0,0,1|1,0,1]=4 4225 B11R1.74 OC(=O)[C@@H]1C[C@H](O)CC(=O)N1 Amb24693924 [0,1,0,0,0,1|0,0,0]=2 4226 B11R1.155 OC1CCCC(C1)S(O)(=O)=O Amb25763889 [0,1,0,0,0,1|2,0,0]=4 4227 B11R1.155 O[C@H]1CCCC(C1)S(O)(=O)=O Amb25763981 [0,1,0,0,0,1|2,0,0]=4 4228 B11R1.155 O[C@H]1CCC[C@@H](C1)S(O)(=O)=O Amb24608066 [0,1,0,0,0,1|2,0,0]=4 4229 B11R1.159 CC(=O)C1CCC[C@@H](O)[C@H]1O Amb24631178 [0,1,0,0,0,1|2,0,0]=4 4230 B11R1.159 CC(O)[C@H]1CNC[C@@H](O)[C@@H]1O Amb25176199 [0,1,0,0,0,1|1,0,1]=4 4231 B11R1.159 CC1C(CCCC1O)C(O)=O Amb25072619 [0,1,0,0,0,1|1,0,0]=3 4232 B11R1.159 CC1C(Cl)CCCC1C(O)=O Amb25780658 [0,1,0,0,0,1|2,0,0]=4 4233 B11R1.159 CC1CCCC(C1C)C(O)=O Amb25189114 [0,1,0,0,0,1|2,0,0]=4 4234 B11R1.159 CC1CCCC(C1O)C(O)=O Amb25216945 [0,1,0,0,0,1|2,0,0]=4 4235 B11R1.159 CC1CNCC(C1C)C(O)=O Amb25071710 [0,1,0,0,0,1|1,0,0]=3 4236 B11R1.159 CC1CNCC(C1O)C(O)=O Amb24566176 [0,1,0,0,0,1|1,0,0]=3 4237 B11R1.159 CC1[C@H](CCC[C@@H]1O)C(O)=O Amb24512159 [0,1,0,0,0,1|1,0,0]=3 4238 B11R1.159 C[C@H]1CNC[C@@H]([C@@H]1O)C(O)=O Amb25238074 [0,1,0,0,0,1|1,0,0]=3 4239 B11R1.159 C[C@H]1[C@H](CCC[C@H]1O)C(O)=O Amb24634320 [0,1,0,0,0,1|1,0,0]=3 4240 B11R1.159 C[C@H]1[C@H](NCC[C@H]1O)C(O)=O Amb24580494 [0,1,0,0,0,1|0,0,0]=2 4241 B11R1.159 NC1C(CC=CC1O)C(O)=O Amb25796310 [0,1,0,0,0,1|1,0,1]=4 4242 B11R1.159 N[C@@H]1C(CCCC1O)C(O)=O Amb25693587 [0,1,0,0,0,1|1,0,0]=3 4243 B11R1.159 N[C@H]1CCC[C@@H]([C@@H]1O)C(O)=O Amb24557744 [0,1,0,0,0,1|2,0,0]=4 4244 B11R1.159 N[C@H]1[C@@H](CCC[C@@H]1O)C(O)=O Amb24607358 [0,1,0,0,0,1|1,0,0]=3 4245 B11R1.159 OC(=O)C1=CCCC(O)C1O Amb25350593 [0,1,0,0,0,1|1,0,1]=4 4246 B11R1.159 OC(=O)C1=CCC[C@H](O)[C@@H]1O Amb25232550 [0,1,0,0,0,1|1,0,1]=4 4247 B11R1.159 OC1C(NNCC1O)C(O)=O Amb24062289 [0,1,0,0,0,1|0,0,0]=2 4248 B11R1.159 OC1CCNC(C1O)C(O)=O Amb24443006 [0,1,0,0,0,1|0,0,0]=2 4249 B11R1.159 O[C@@H]1CNC[C@H]([C@H]1O)C(O)=O Amb24511922 [0,1,0,0,0,1|0,0,0]=2 4250 B11R1.167 CC(=O)C1CC(C)CNC1=O Amb25366055 [0,1,0,0,0,1|2,0,0]=4 4251 B11R1.167 CC1=CCC(O)CC1C(O)=O Amb25241210 [0,1,0,0,0,1|1,0,0]=3 4252 B11R1.167 CC1CC(C(=O)NN1)C(O)=O Amb24609286 [0,1,0,0,0,1|2,0,0]=4 4253 B11R1.167 CC1CC(C(N)CC1)C(O)=O Amb18200001 [0,1,0,0,0,1|2,0,0]=4 4254 B11R1.167 CC1CCC(Cl)CC1C(O)=O Amb25260877 [0,1,0,0,0,1|2,0,0]=4 4255 B11R1.167 CC1CCC(O)C(C1)C(O)=O Amb25210516 [0,1,0,0,0,1|2,0,0]=4 4256 B11R1.167 CC1CCC(O)CC1C(O)=O Amb24392245 [0,1,0,0,0,1|1,0,0]=3 4257 B11R1.167 CC1CCN(C)C(C1)C(N)=O Amb25304431 [0,1,0,0,0,1|2,0,0]=4 4258 B11R1.167 CC1CCN(C)C(C1)C(O)=O Amb25053811 [0,1,0,0,0,1|1,0,0]=3 4259 B11R1.167 CC1CC[C@@H](O)C[C@H]1C(O)=O Amb25233392 [0,1,0,0,0,1|1,0,0]=3 4260 B11R1.167 CN1CC(C(O)=O)N(C)CC1 Amb25760074 [0,1,0,0,0,1|2,0,0]=4 4261 B11R1.167 CN1CCC(=O)CC1C(O)=O Amb18200028 [0,1,0,0,0,1|0,0,2]=4 4262 B11R1.167 CN1CCN(C(C1)C(=O)O)C Amb10982458 [0,1,0,0,0,1|2,0,0]=4 4263 B11R1.167 CN1CC[C@H](O)C[C@H]1C(O)=O Amb25210559 [0,1,0,0,0,1|0,0,0]=2 4264 B11R1.167 C[C@@H]1C[C@H]([C@H](C)CC1)C(O)=O Amb24595391 [0,1,0,0,0,1|2,0,0]=4 4265 B11R1.167 C[C@H]1C[C@H]([C@@H](C)CC1)C(O)=O Amb24511944 [0,1,0,0,0,1|2,0,0]=4 4266 B11R1.167 NC1CC(C(=O)NC1)C(O)=O Amb24689369 [0,1,0,0,0,1|1,0,0]=3 4267 B11R1.167 NC1CCC(O)CC1C(O)=O Amb25139597 [0,1,0,0,0,1|1,0,0]=3 4268 B11R1.167 O=C(Cl)C1CC(Cl)CNC1=O Amb25150505 [0,1,0,0,0,1|2,0,0]=4 4269 B11R1.167 OC1C=CC(O)CC1C(O)=O Amb25349399 [0,1,0,0,0,1|1,0,1]=4 4270 B11R1.167 OC1CC(C(O)CC1)C(O)=O Amb25809422 [0,1,0,0,0,1|1,0,0]=3 4271 B11R1.266 CCC1CC(CCC1)C(O)=O Amb24486034 [0,1,0,0,0,1|2,0,0]=4 4272 B11R1.266 CCC1CC(CCN1)C(O)=O Amb18199986 [0,1,0,0,0,1|2,0,0]=4 4273 B11R1.266 CCC1CC(CCO1)C(O)=O Amb25679263 [0,1,0,0,0,1|2,0,0]=4 4274 B11R1.266 CCC1CC(NCC1)C(O)=O Amb18830613 [0,1,0,0,0,1|1,0,0]=3 4275 B11R1.266 CCC1CCNC(N1)C(O)=O Amb24484693 [0,1,0,0,0,1|2,0,0]=4 4276 B11R1.266 CC[C@@H]1C[C@@H](CCC1)C(O)=O Amb25179101 [0,1,0,0,0,1|2,0,0]=4 4277 B11R1.266 CC[C@H]1CCN[C@H](N1)C(O)=O Amb25179308 [0,1,0,0,0,1|2,0,0]=4 4278 B11R1.266 CNC1CC(CCC1)C(O)=O Amb18288393 [0,1,0,0,0,1|2,0,0]=4 4279 B11R1.266 COC1CC(=CCC1)C(O)=O Amb25109290 [0,1,0,0,0,1|1,0,1]=4 4280 B11R1.266 COC1CC(CC=C1)C(O)=O Amb18125968 [0,1,0,0,0,1|1,0,1]=4 4281 B11R1.266 COC1CC(CCC1)C(N)=O Amb25277256 [0,1,0,0,0,1|2,0,0]=4 4282 B11R1.266 COC1CCNC(C1)C(=O)O Amb13886061 [0,1,0,0,0,1|0,0,0]=2 4283 B11R1.266 COC1CCNC(C1)C(=O)O Amb13886211 [0,1,0,0,0,1|0,0,0]=2 4284 B11R1.266 CO[C@H]1C[C@@H](CCC1)C(O)=O Amb24739740 [0,1,0,0,0,1|1,0,0]=3 4285 B11R1.266 N#CC1CC(CCC1)C(O)=O Amb18201139 [0,1,0,0,0,1|2,0,0]=4 4286 B11R1.266 N#CC1CNCC(N1)C(O)=O Amb24390401 [0,1,0,0,0,1|2,0,0]=4 4287 B11R1.266 NCC1CC(CCC1)C(O)=O Amb25684748 [0,1,0,0,0,1|2,0,0]=4 4288 B11R1.266 OC(=O)C1CC(CCC1)C=O Amb25849368 [0,1,0,0,0,1|1,0,1]=4 4289 B11R1.266 OC(=O)C1C\C(\CCC1)=N/O Amb24563845 [0,1,0,0,0,1|1,0,1]=4 4290 B11R1.266 OC(=O)C1C\C(\CCC1)=N\O Amb23453123 [0,1,0,0,0,1|1,0,1]=4 4291 B11R1.266 OCC1CC(CCC1)C(O)=O Amb24488127 [0,1,0,0,0,1|1,0,0]=3 4292 B11R1.266 OC[C@@H]1CCC[C@@H](N1)C(O)=O Amb25348501 [0,1,0,0,0,1|2,0,0]=4 4293 B11R1.266 OC[C@@H]1C[C@@H](CCC1)C(O)=O Amb24596686 [0,1,0,0,0,1|1,0,0]=3 4294 B11R1.266 ONC1CC(CCC1)C(O)=O Amb24488171 [0,1,0,0,0,1|1,0,0]=3 4295 B11R1.667 CC1(CC(=O)CCN1)C(O)=O Amb24615760 [0,1,0,0,0,1|0,0,2]=4 4296 B11R1.667 CC1(CC(Cl)CCC1)C(O)=O Amb18127807 [0,1,0,0,0,1|2,0,0]=4 4297 B11R1.667 CC1(CC(N)CCC1)C(O)=O Amb24511317 [0,1,0,0,0,1|2,0,0]=4 4298 B11R1.667 CC1(CC(O)CCC1)C(O)=O Amb24356065 [0,1,0,0,0,1|1,0,0]=3 4299 B11R1.667 CC1CC(O)(CCC1)C(O)=O Amb18278640 [0,1,0,0,0,1|2,0,0]=4 4300 B11R1.667 CC1CC(O)(CCO1)C(O)=O Amb25744122 [0,1,0,0,0,1|2,0,0]=4 4301 B11R1.667 CC1CNCC(C)(C1)C(O)=O Amb24543143 [0,1,0,0,0,1|1,0,0]=3 4302 B11R1.667 CC1C[C@](C)(CCC1)C(O)=O Amb24373142 [0,1,0,0,0,1|2,0,0]=4 4303 B11R1.667 C[C@@H]1C[C@@](C)(CCC1)C(O)=O Amb24571744 [0,1,0,0,0,1|2,0,0]=4 4304 B11R1.667 C[C@@H]1C[C@](N)(CCC1)C(O)=O Amb24609910 [0,1,0,0,0,1|2,0,0]=4 4305 B11R1.667 C[C@@]1(C[C@@H](O)CCC1)C(O)=O Amb24540831 [0,1,0,0,0,1|1,0,0]=3 4306 B11R1.667 C[C@@]1(C[C@H](Cl)CCC1)C(O)=O Amb25232600 [0,1,0,0,0,1|2,0,0]=4 4307 B11R1.667 C[C@H]1C[C@@](O)(CCC1)C(O)=O Amb24595362 [0,1,0,0,0,1|2,0,0]=4 4308 B11R1.667 NC1CNCC(N)(C1)C(O)=O Amb24359121 [0,1,0,0,0,1|1,0,0]=3 4309 B11R1.667 N[C@@]1(C[C@@H](O)CCC1)C(O)=O Amb25264396 [0,1,0,0,0,1|1,0,0]=3 4310 B11R1.667 N[C@@]1(C[C@H](O)CCC1)C(O)=O Amb25377812 [0,1,0,0,0,1|1,0,0]=3 4311 B11R1.667 N[C@]1(C[C@H](O)CCC1)C(O)=O Amb25288503 [0,1,0,0,0,1|1,0,0]=3 4312 B11R1.667 OC1COCC(O)(C1)C(O)=O Amb25828589 [0,1,0,0,0,1|1,0,0]=3 4313 B11R1.667 O[C@@H]1COC[C@@](O)(C1)C(O)=O Amb25240635 [0,1,0,0,0,1|1,0,0]=3 4314 B11R1.730 CC1(C)CC(CCC1)C(O)=O Amb22059548 [0,1,0,0,0,1|2,0,0]=4 4315 B11R1.730 CC1(C)CC(CCN1)C(O)=O Amb23590785 [0,1,0,0,0,1|2,0,0]=4 4316 B11R1.730 CC1(C)CC(NCC1)C(O)=O Amb23589292 [0,1,0,0,0,1|1,0,0]=3 4317 B11R1.730 CC1(C)CNCC(O1)C(O)=O Amb24509651 [0,1,0,0,0,1|2,0,0]=4 4318 B11R1.730 CC1(C)C[C@H](CCC1)C(O)=O Amb24538171 [0,1,0,0,0,1|2,0,0]=4 4319 B11R1.730 CC1(Cl)CC(CCC1)C(O)=O Amb18648012 [0,1,0,0,0,1|2,0,0]=4 4320 B11R1.730 CC1(N)CC(CCC1)C(O)=O Amb24594199 [0,1,0,0,0,1|2,0,0]=4 4321 B11R1.730 CC1(O)CC(CCC1)C(O)=O Amb18126140 [0,1,0,0,0,1|1,0,0]=3 4322 B11R1.730 NC(=O)C1CNCC(F)(F)C1 Amb24546043 [0,1,0,0,0,1|2,0,0]=4 4323 B11R1.730 OC(=O)C1CC(F)(F)CCC1 Amb22738663 [0,1,0,0,0,1|2,0,0]=4 4324 B11R1.730 OC(=O)C1CC(O)(O)CCN1 Amb24743215 [0,1,0,0,0,1|0,0,0]=2 4325 B11R1.730 OC(=O)C1CCSC(C1)(C)C Amb17594418 [0,1,0,0,0,1|2,0,0]=4 4326 B11R1.730 OC(=O)C1CNCC(F)(F)C1 Amb22411162 [0,1,0,0,0,1|1,0,0]=3 4327 B11R1.730 OC(=O)C1CNCC(F)(F)C1 Amb25259159 [0,1,0,0,0,1|1,0,0]=3 4328 B11R1.730 OC(=O)C1CS(=O)(=O)CCN1 Amb23603855 [0,1,0,0,0,1|1,0,1]=4 4329 B11R1.730 OC(=O)[C@H]1CC(O)(O)CCN1 Amb25282121 [0,1,0,0,0,1|0,0,0]=2 4330 B11R1.11 C\C=C(\CO)/C1CC(O)CC1 Amb25225650 [0,2,0,0,0,0|2,0,0]=4 4331 B11R1.11 C\C=C(\CO)/[C@@H]1CC(O)CC1 Amb25787391 [0,2,0,0,0,0|2,0,0]=4 4332 B11R1.15 CC(COC)C1CC(O)CN1 Amb24675906 [0,2,0,0,0,0|1,0,1]=4 4333 B11R1.15 CC1CC(CC1)C(=O)CCO Amb24736252 [0,2,0,0,0,0|2,0,0]=4 4334 B11R1.15 CC1CCC(C1)C(=O)OCC Amb25119717 [0,2,0,0,0,0|2,0,0]=4 4335 B11R1.15 CC1CN[C@@H](C1)C(=O)OCC Amb22736075 [0,2,0,0,0,0|1,0,0]=3 4336 B11R1.15 CCNC(=O)C1CC(F)CN1 Amb25044792 [0,2,0,0,0,0|2,0,0]=4 4337 B11R1.15 CCNC(=O)[C@H]1C[C@@H](O)CN1 Amb24387599 [0,2,0,0,0,0|1,0,0]=3 4338 B11R1.15 CCNC(=O)[C@H]1C[C@H](F)CN1 Amb25796986 [0,2,0,0,0,0|2,0,0]=4 4339 B11R1.15 CCNC(=O)[C@H]1C[C@H](O)CN1 Amb24721157 [0,2,0,0,0,0|1,0,0]=3 4340 B11R1.15 CCOC(=O)C1CC(CN1)O Amb1091858 [0,2,0,0,0,0|0,0,0]=2 4341 B11R1.15 CCOC(=O)C1CC(Cl)CN1 Amb24484684 [0,2,0,0,0,0|1,0,0]=3 4342 B11R1.15 CCOC(=O)C1CC(F)CN1 Amb23597508 [0,2,0,0,0,0|1,0,0]=3 4343 B11R1.15 CCOC(=O)C1CC(N)CN1 Amb24484678 [0,2,0,0,0,0|1,0,0]=3 4344 B11R1.15 CCOC(=O)C1CC(O)CN1 Amb21955583 [0,2,0,0,0,0|0,0,0]=2 4345 B11R1.15 CCOC(=O)C1CC(O)CO1 Amb22230657 [0,2,0,0,0,0|1,0,0]=3 4346 B11R1.15 CCOC(=O)C1CCC(N)C1 Amb20669463 [0,2,0,0,0,0|2,0,0]=4 4347 B11R1.15 CCOC(=O)C1CCC(N)C1 Amb22059628 [0,2,0,0,0,0|2,0,0]=4 4348 B11R1.15 CCOC(=O)C1CCC(O)C1 Amb22754536 [0,2,0,0,0,0|1,0,0]=3 4349 B11R1.15 CCOC(=O)C1CCC(O)O1 Amb25032368 [0,2,0,0,0,0|2,0,0]=4 4350 B11R1.15 CCOC(=O)N1CC(O)CC1 Amb18177628 [0,2,0,0,0,0|2,0,0]=4 4351 B11R1.15 CCOC(=O)N1CC(O)CO1 Amb25152191 [0,2,0,0,0,0|2,0,0]=4 4352 B11R1.15 CCOC(=O)N1C[C@H](O)CC1 Amb25169528 [0,2,0,0,0,0|2,0,0]=4 4353 B11R1.15 CCOC(=O)N1C[C@H](O)CO1 Amb24437496 [0,2,0,0,0,0|2,0,0]=4 4354 B11R1.15 CCOC(=O)[C@@H]1CC(O)CN1 Amb18792067 [0,2,0,0,0,0|0,0,0]=2 4355 B11R1.15 CCOC(=O)[C@@H]1CC[C@@H](O)C1 Amb25791928 [0,2,0,0,0,0|1,0,0]=3 4356 B11R1.15 CCOC(=O)[C@@H]1CC[C@@H](O)O1 Amb24613347 [0,2,0,0,0,0|2,0,0]=4 4357 B11R1.15 CCOC(=O)[C@@H]1CC[C@H](N)C1 Amb24079839 [0,2,0,0,0,0|2,0,0]=4 4358 B11R1.15 CCOC(=O)[C@@H]1C[C@@H](F)CN1 Amb23439395 [0,2,0,0,0,0|1,0,0]=3 4359 B11R1.15 CCOC(=O)[C@@H]1C[C@@H](O)CN1 Amb22748330 [0,2,0,0,0,0|0,0,0]=2 4360 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)O Amb10601386 [0,2,0,0,0,0|0,0,0]=2 4361 B11R1.15 CCOC(=O)[C@@H]1C[C@H](O)CN1 Amb22747710 [0,2,0,0,0,0|0,0,0]=2 4362 B11R1.15 CCOC(=O)[C@H]1CCC(O)O1 Amb24485924 [0,2,0,0,0,0|2,0,0]=4 4363 B11R1.15 CCOC(=O)[C@H]1C[C@@H](O)CN1 Amb20242578 [0,2,0,0,0,0|0,0,0]=2 4364 B11R1.15 CCOC(=O)[C@H]1C[C@H](F)CN1 Amb25222540 [0,2,0,0,0,0|1,0,0]=3 4365 B11R1.15 CCOC(=O)[C@H]1C[C@H](N)CN1 Amb25264410 [0,2,0,0,0,0|1,0,0]=3 4366 B11R1.15 CCOC(=O)[C@H]1O[C@H](O)CS1 Amb25261794 [0,2,0,0,0,0|2,0,0]=4 4367 B11R1.15 COCC(=O)C1CCC(N)C1 Amb25188782 [0,2,0,0,0,0|2,0,0]=4 4368 B11R1.15 COCC(=O)N1CC(O)CC1 Amb18177627 [0,2,0,0,0,0|2,0,0]=4 4369 B11R1.15 COCC(=O)N1CC(O)CO1 Amb25137462 [0,2,0,0,0,0|2,0,0]=4 4370 B11R1.15 COCC(=O)N1C[C@@H](O)CO1 Amb25152194 [0,2,0,0,0,0|2,0,0]=4 4371 B11R1.15 COCC(=O)N1C[C@H](O)CC1 Amb25149171 [0,2,0,0,0,0|2,0,0]=4 4372 B11R1.15 CONC(=O)C1CC(O)CN1 Amb24355580 [0,2,0,0,0,0|0,0,0]=2 4373 B11R1.15 CONC(=O)C1CCC(N)C1 Amb25032461 [0,2,0,0,0,0|2,0,0]=4 4374 B11R1.15 CONC(=O)[C@@H]1CC[C@@H](O)C1 Amb25031689 [0,2,0,0,0,0|1,0,0]=3 4375 B11R1.15 CONC(=O)[C@H]1C[C@H](F)CN1 Amb25173572 [0,2,0,0,0,0|1,0,0]=3 4376 B11R1.15 CONC(=O)[C@H]1C[C@H](O)CN1 Amb25130987 [0,2,0,0,0,0|0,0,0]=2 4377 B11R1.15 C[C@H]1CN[C@H](C1)C(=O)OCC Amb24602836 [0,2,0,0,0,0|1,0,0]=3 4378 B11R1.15 N#CNC(=O)C1CC(O)CN1 Amb24382202 [0,2,0,0,0,0|1,0,0]=3 4379 B11R1.44 CNC(=O)C1CC(CN1)OC Amb18951795 [0,2,0,0,0,0|1,0,0]=3 4380 B11R1.44 CNC(=O)[C@@H]1C[C@@H](CN1)OC Amb24390969 [0,2,0,0,0,0|1,0,0]=3 4381 B11R1.44 CNC(=O)[C@@H]1C[C@@H](CN1)OC Amb25362021 [0,2,0,0,0,0|1,0,0]=3 4382 B11R1.44 CNC(=O)[C@H]1C[C@@H](CN1)OC Amb24590871 [0,2,0,0,0,0|1,0,0]=3 4383 B11R1.44 CNC1CC(NC1)C(=O)OC Amb24665667 [0,2,0,0,0,0|1,0,0]=3 4384 B11R1.44 COC(=O)C1CC(CC1)C=O Amb18644789 [0,2,0,0,0,0|1,0,1]=4 4385 B11R1.44 COC(=O)C1CC(CN1)C#N Amb18125702 [0,2,0,0,0,0|1,0,0]=3 4386 B11R1.44 COC(=O)C1CC(CN1)OC Amb19408202 [0,2,0,0,0,0|0,0,0]=2 4387 B11R1.44 COC(=O)C1CC(CO)C=C1 Amb25276484 [0,2,0,0,0,0|1,0,1]=4 4388 B11R1.44 COC(=O)C1CC(CO)CN1 Amb24501895 [0,2,0,0,0,0|0,0,0]=2 4389 B11R1.44 COC(=O)C1CCC(N1)OC Amb25087834 [0,2,0,0,0,0|2,0,0]=4 4390 B11R1.44 COC(=O)C1CCC(O1)CO Amb13951705 [0,2,0,0,0,0|2,0,0]=4 4391 B11R1.44 COC(=O)N1CC(CC1)OC Amb24728120 [0,2,0,0,0,0|2,0,0]=4 4392 B11R1.44 COC(=O)N1CC(CO)CC1 Amb18182409 [0,2,0,0,0,0|2,0,0]=4 4393 B11R1.44 COC(=O)N1C[C@@H](CC1)OC Amb24748088 [0,2,0,0,0,0|2,0,0]=4 4394 B11R1.44 COC(=O)N1C[C@H](CC1)OC Amb25372656 [0,2,0,0,0,0|2,0,0]=4 4395 B11R1.44 COC(=O)N1C[C@H](CO)CC1 Amb25829556 [0,2,0,0,0,0|2,0,0]=4 4396 B11R1.44 COC(=O)[C@@H]1CC[C@H](CO)O1 Amb25168854 [0,2,0,0,0,0|2,0,0]=4 4397 B11R1.44 COC(=O)[C@@H]1C[C@@H](CN1)OC Amb25179328 [0,2,0,0,0,0|0,0,0]=2 4398 B11R1.44 COC(=O)[C@@H]1C[C@H](CN1)OC Amb24596399 [0,2,0,0,0,0|0,0,0]=2 4399 B11R1.44 COC(=O)[C@@H]1C[C@H](CN1)OCl Amb22831245 [0,2,0,0,0,0|0,0,0]=2 4400 B11R1.44 COC(=O)[C@@H]1C[C@H](CO)CN1 Amb25256760 [0,2,0,0,0,0|0,0,0]=2 4401 B11R1.44 COC(=O)[C@H]1C[C@@H](CC1)C=O Amb25335264 [0,2,0,0,0,0|1,0,1]=4 4402 B11R1.44 COC(=O)[C@H]1C[C@@H](CO)C=C1 Amb24515131 [0,2,0,0,0,0|1,0,1]=4 4403 B11R1.44 COC(=O)[C@H]1C[C@H](CN1)OC Amb24656111 [0,2,0,0,0,0|0,0,0]=2 4404 B11R1.44 COC1CNC(C1)C(=O)C#C Amb24393037 [0,2,0,0,0,0|1,0,0]=3 4405 B11R1.44 COC1CNC(C1)C(=O)NN Amb25117059 [0,2,0,0,0,0|1,0,0]=3 4406 B11R1.44 COC1CNC(C1)C(=O)NO Amb25770429 [0,2,0,0,0,0|0,0,0]=2 4407 B11R1.44 CO[C@@H]1CN[C@@H](C1)C(=O)NN Amb25323617 [0,2,0,0,0,0|1,0,0]=3 4408 B11R1.44 CO[C@@H]1CN[C@H](C1)C(=O)NN Amb24627789 [0,2,0,0,0,0|1,0,0]=3 4409 B11R1.44 CO[C@H]1CN[C@@H](C1)C(=O)NN Amb24526354 [0,2,0,0,0,0|1,0,0]=3 4410 B11R1.225 CC1CC(O)CN1C(=O)OC Amb24485347 [0,2,0,0,0,0|2,0,0]=4 4411 B11R1.225 CN1CC(O)CC1C(=O)NN Amb24548975 [0,2,0,0,0,0|1,0,0]=3 4412 B11R1.225 CN1C[C@@H](C[C@H]1C(=O)OC)N Amb15701328 [0,2,0,0,0,0|1,0,0]=3 4413 B11R1.225 CN1C[C@@H](O)C[C@@H]1C(=O)NN Amb25229676 [0,2,0,0,0,0|1,0,0]=3 4414 B11R1.225 CN1C[C@@H](O)C[C@H]1C(=O)NN Amb25229316 [0,2,0,0,0,0|1,0,0]=3 4415 B11R1.225 CN1C[C@H](C[C@H]1C(=O)OC)N Amb15701327 [0,2,0,0,0,0|1,0,0]=3 4416 B11R1.225 COC(=O)C1CC(F)CN1C Amb24387653 [0,2,0,0,0,0|1,0,0]=3 4417 B11R1.225 COC(=O)C1CC(N)CN1C Amb24484570 [0,2,0,0,0,0|1,0,0]=3 4418 B11R1.225 COC(=O)C1CC(O)CN1C Amb24406309 [0,2,0,0,0,0|0,0,0]=2 4419 B11R1.225 COC(=O)[C@@H]1CC(O)CN1C Amb24484989 [0,2,0,0,0,0|0,0,0]=2 4420 B11R1.225 COC(=O)[C@@H]1C[C@@H](F)CN1C Amb25187211 [0,2,0,0,0,0|1,0,0]=3 4421 B11R1.225 COC(=O)[C@@H]1C[C@@H](N)CN1C Amb22587280 [0,2,0,0,0,0|1,0,0]=3 4422 B11R1.225 COC(=O)[C@@H]1C[C@@H](O)CN1C Amb24057512 [0,2,0,0,0,0|0,0,0]=2 4423 B11R1.225 COC(=O)[C@@H]1C[C@H](N)CN1C Amb22587279 [0,2,0,0,0,0|1,0,0]=3 4424 B11R1.225 COC(=O)[C@H]1CC(O)CN1C Amb25230168 [0,2,0,0,0,0|0,0,0]=2 4425 B11R1.226 CC1=CC(CC1O)C(=O)OC Amb24371253 [0,2,0,0,0,0|1,0,1]=4 4426 B11R1.226 CC1=C[C@@H](C[C@@H]1O)C(=O)OC Amb25221006 [0,2,0,0,0,0|1,0,1]=4 4427 B11R1.226 CC1CC(NC1=O)C(=O)OC Amb24682118 [0,2,0,0,0,0|1,0,1]=4 4428 B11R1.226 CC1CN(CC1O)C(=O)CO Amb24450824 [0,2,0,0,0,0|2,0,0]=4 4429 B11R1.226 CC1CN(CC1O)C(=O)OC Amb24485161 [0,2,0,0,0,0|2,0,0]=4 4430 B11R1.226 CC1C[C@@H](CC1O)C(=O)OC Amb25149737 [0,2,0,0,0,0|1,0,0]=3 4431 B11R1.226 CC1O[C@H](C[C@H]1O)C(=O)OC Amb25206624 [0,2,0,0,0,0|1,0,0]=3 4432 B11R1.226 COC(=O)C1CC(N)C(=O)N1 Amb18126108 [0,2,0,0,0,0|1,0,1]=4 4433 B11R1.226 COC(=O)C1CC(N)C(O)C1 Amb25228978 [0,2,0,0,0,0|1,0,0]=3 4434 B11R1.226 COC(=O)C1CC(O)C(Br)C1 Amb25149412 [0,2,0,0,0,0|1,0,0]=3 4435 B11R1.226 COC(=O)C1CC(O)C(F)C1 Amb22898817 [0,2,0,0,0,0|1,0,0]=3 4436 B11R1.226 COC(=O)C1CC(O)C(O)C1 Amb25686051 [0,2,0,0,0,0|1,0,0]=3 4437 B11R1.226 COC(=O)C1C[C@@H](N)[C@H](O)C1 Amb23456143 [0,2,0,0,0,0|1,0,0]=3 4438 B11R1.226 COC(=O)C1C[C@@H](O)[C@H](Br)C1 Amb24112913 [0,2,0,0,0,0|1,0,0]=3 4439 B11R1.226 COC(=O)C1C[C@@H](O)[C@H](O)C1 Amb24632510 [0,2,0,0,0,0|1,0,0]=3 4440 B11R1.226 COC(=O)C1C[C@H](O)[C@@H](O)C1 Amb24607309 [0,2,0,0,0,0|1,0,0]=3 4441 B11R1.226 COC(=O)C1C[C@H](O)[C@H](O)C1 Amb25357463 [0,2,0,0,0,0|1,0,0]=3 4442 B11R1.226 COC(=O)N1CC(F)C(O)C1 Amb25238813 [0,2,0,0,0,0|2,0,0]=4 4443 B11R1.226 COC(=O)N1C[C@H](O)[C@H](O)C1 Amb25374893 [0,2,0,0,0,0|2,0,0]=4 4444 B11R1.226 COC(=O)[C@@H]1CC(O)C(=O)N1 Amb24392740 [0,2,0,0,0,0|0,0,1]=3 4445 B11R1.226 COC(=O)[C@@H]1C[C@@H](O)C(=O)O1 Amb24719560 [0,2,0,0,0,0|1,0,1]=4 4446 B11R1.226 COC(=O)[C@@H]1C[C@@H](O)[C@H](F)C1 Amb22756938 [0,2,0,0,0,0|1,0,0]=3 4447 B11R1.226 COC(=O)[C@@H]1C[C@H](F)C(=O)N1 Amb24512998 [0,2,0,0,0,0|1,0,1]=4 4448 B11R1.226 COC(=O)[C@@H]1C[C@H](N)C(=O)N1 Amb25217050 [0,2,0,0,0,0|1,0,1]=4 4449 B11R1.226 COC(=O)[C@@H]1C[C@H](O)C(=O)N1 Amb24555635 [0,2,0,0,0,0|0,0,1]=3 4450 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 4451 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 4452 B11R1.226 C[C@H]1C[C@H](NC1=O)C(=O)OC Amb25256067 [0,2,0,0,0,0|1,0,1]=4 4453 B11R1.226 OCC(=O)N1C[C@H](O)[C@H](O)C1 Amb24541330 [0,2,0,0,0,0|2,0,0]=4 4454 B11R1.865 CC1CNC(C1O)C(=O)OC Amb25067355 [0,2,0,0,0,0|1,0,0]=3 4455 B11R1.865 CCC(O)C1NCC(O)C1O Amb24424083 [0,2,0,0,0,0|1,0,1]=4 4456 B11R1.865 CCC(O)C1NC[C@@H](O)[C@@H]1O Amb25179154 [0,2,0,0,0,0|1,0,1]=4 4457 B11R1.865 CCC(O)[C@@H]1NC[C@H](O)[C@H]1O Amb25179155 [0,2,0,0,0,0|1,0,1]=4 4458 B11R1.865 CCC(O)[C@H]1NC[C@@H](O)[C@@H]1O Amb24649936 [0,2,0,0,0,0|1,0,1]=4 4459 B11R1.865 CC[C@@H](O)[C@@H]1NC[C@H](O)[C@H]1O Amb25241136 [0,2,0,0,0,0|1,0,1]=4 4460 B11R1.865 CC[C@H](O)[C@H]1NC[C@@H](O)[C@@H]1O Amb25179084 [0,2,0,0,0,0|1,0,1]=4 4461 B11R1.865 CNC(=O)[C@H]1NC[C@@H](O)[C@@H]1O Amb25233482 [0,2,0,0,0,0|1,0,0]=3 4462 B11R1.865 COC(=O)C1CCC(O)C1O Amb23456142 [0,2,0,0,0,0|1,0,0]=3 4463 B11R1.865 COC(=O)C1NCC(O)C1O Amb25350594 [0,2,0,0,0,0|0,0,0]=2 4464 B11R1.865 COC(=O)C1OCC(O)C1O Amb25185233 [0,2,0,0,0,0|1,0,0]=3 4465 B11R1.865 COC(=O)[C@@H]1NC[C@H](Cl)[C@@H]1Cl Amb23541064 [0,2,0,0,0,0|1,0,0]=3 4466 B11R1.865 COC(=O)[C@H]1CC[C@@H](O)[C@@H]1Cl Amb25328923 [0,2,0,0,0,0|1,0,0]=3 4467 B11R1.865 COC(=O)[C@H]1CC[C@H](O)[C@H]1Cl Amb25245353 [0,2,0,0,0,0|1,0,0]=3 4468 B11R1.865 COC(=O)[C@H]1OC[C@@H](O)[C@H]1O Amb24675359 [0,2,0,0,0,0|1,0,0]=3 4469 B11R1.865 C[C@@H]1CC[C@@H]([C@H]1N)C(=O)OC Amb24637037 [0,2,0,0,0,0|2,0,0]=4 4470 B11R1.865 C[C@@H]1[C@@H](O)CC[C@H]1C(=O)OC Amb24606653 [0,2,0,0,0,0|1,0,0]=3 4471 B11R1.865 C[C@@H]1[C@H](NCC1=O)C(=O)OC Amb25249931 [0,2,0,0,0,0|0,0,2]=4 4472 B11R1.865 C[C@@H]1[C@H](O)CCN1C(=O)OC Amb24398209 [0,2,0,0,0,0|2,0,0]=4 4473 B11R1.865 C[C@H]1CC[C@@H]([C@@H]1O)C(=O)OC Amb24632556 [0,2,0,0,0,0|2,0,0]=4 4474 B11R1.865 C[C@H]1CN[C@@H]([C@H]1O)C(=O)OC Amb25179111 [0,2,0,0,0,0|1,0,0]=3 4475 B11R1.865 NC[C@@H](O)[C@H]1NC[C@@H](O)[C@H]1O Amb24612209 [0,2,0,0,0,0|1,0,1]=4 4476 B11R1.865 OC1C(OCC1O)C(O)C=O Amb25151565 [0,2,0,0,0,0|1,0,1]=4 4477 B11R1.865 OC1C(SCC1O)C(O)C=O Amb25128937 [0,2,0,0,0,0|1,0,1]=4 4478 B11R1.865 OCC(=O)C1OCC(O)C1O Amb25748972 [0,2,0,0,0,0|1,0,0]=3 4479 B11R1.865 OCC(=O)[C@H]1OC[C@@H](O)[C@H]1O Amb24676791 [0,2,0,0,0,0|1,0,0]=3 4480 B11R1.865 OCC(O)[C@H]1NC[C@@H](O)[C@H]1O Amb25175457 [0,2,0,0,0,0|0,0,2]=4 4481 B11R1.865 OC[C@@H](O)[C@@H]1NC[C@@H](O)[C@@H]1O Amb24745782 [0,2,0,0,0,0|0,0,2]=4 4482 B11R1.865 OC[C@@H](O)[C@@H]1NC[C@H](O)[C@@H]1O Amb25268190 [0,2,0,0,0,0|0,0,2]=4 4483 B11R1.865 OC[C@@H](O)[C@H]1NCC(O)[C@H]1O Amb24629189 [0,2,0,0,0,0|0,0,2]=4 4484 B11R1.865 OC[C@H](O)[C@H]1NC[C@@H](O)[C@H]1O Amb24519548 [0,2,0,0,0,0|0,0,2]=4 4485 B11R1.865 OC[C@H](O)[C@H]1NC[C@H](O)[C@H]1O Amb24512007 [0,2,0,0,0,0|0,0,2]=4 4486 B11R1.865 O[C@H]1C(OC[C@H]1O)[C@@H](O)C=O Amb24567144 [0,2,0,0,0,0|1,0,1]=4 4487 B11R1.865 O[C@H]1[C@@H](OC[C@@H]1O)[C@H](O)C=O Amb24513204 [0,2,0,0,0,0|1,0,1]=4 4488 B11R1.865 O[C@H]1[C@@H](OC[C@H]1O)[C@H](O)C=O Amb24669115 [0,2,0,0,0,0|1,0,1]=4 4489 B11R1.865 O[C@H]1[C@H](OC[C@H]1O)[C@@H](O)C=O Amb24513041 [0,2,0,0,0,0|1,0,1]=4 4490 B11R1.866 CNC(=O)C1CC(F)(F)CN1 Amb25096205 [0,2,0,0,0,0|2,0,0]=4 4491 B11R1.866 COC(=O)C1CC(C)(C)CN1 Amb24540936 [0,2,0,0,0,0|1,0,0]=3 4492 B11R1.866 COC(=O)C1CC(C)(F)CC1 Amb25130296 [0,2,0,0,0,0|2,0,0]=4 4493 B11R1.866 COC(=O)C1CC(F)(F)CC1 Amb22899319 [0,2,0,0,0,0|2,0,0]=4 4494 B11R1.866 COC(=O)C1CC(F)(F)CN1 Amb23585430 [0,2,0,0,0,0|1,0,0]=3 4495 B11R1.866 COC(=O)C1C[Si](C)(C)CN1 Amb25843486 [0,2,0,0,0,0|1,1,0]=4 4496 B11R1.866 COC(=O)N1CC(C)(O)CC1 Amb25148412 [0,2,0,0,0,0|2,0,0]=4 4497 B11R1.866 COC(=O)[C@@H]1CC(F)(F)CC1 Amb24413944 [0,2,0,0,0,0|2,0,0]=4 4498 B11R1.866 COC(=O)[C@@H]1CC(F)(F)CN1 Amb22406226 [0,2,0,0,0,0|1,0,0]=3 4499 B11R1.866 COC(=O)[C@@H]1CC(F)(F)CN1 Amb23438988 [0,2,0,0,0,0|1,0,0]=3 4500 B11R1.866 COC(=O)[C@@H]1C[Si](C)(C)CN1 Amb25028135 [0,2,0,0,0,0|1,1,0]=4 4501 B11R1.866 COC(=O)[C@H]1CC(F)(F)CC1 Amb25188886 [0,2,0,0,0,0|2,0,0]=4 4502 B11R1.866 COC(=O)[C@H]1CC(F)(F)CN1 Amb25049283 [0,2,0,0,0,0|1,0,0]=3 4503 B11R1.866 ONC(=O)C1CC(F)(F)CC1 Amb25858304 [0,2,0,0,0,0|2,0,0]=4 4504 B11R1.885 CC1(CCC(O)O1)C(=O)CO Amb25086604 [0,2,0,0,0,0|2,0,0]=4 4505 B11R1.885 COC(=O)C1(C)CC(C)CC1 Amb23454042 [0,2,0,0,0,0|2,0,0]=4 4506 B11R1.885 COC(=O)C1(C)CC(Cl)CC1 Amb25350338 [0,2,0,0,0,0|2,0,0]=4 4507 B11R1.885 COC(=O)C1(C)CC(O)CC1 Amb23454229 [0,2,0,0,0,0|1,0,0]=3 4508 B11R1.885 COC(=O)C1(N)CC(C)CC1 Amb25061739 [0,2,0,0,0,0|2,0,0]=4 4509 B11R1.885 COC(=O)C1(O)CC(C)CC1 Amb24563255 [0,2,0,0,0,0|2,0,0]=4 4510 B11R1.885 COC(=O)C1(O)C[C@@H](O)CO1 Amb25152040 [0,2,0,0,0,0|1,0,0]=3 4511 B11R1.885 COC(=O)[C@]1(C)COC(O)C1 Amb24362782 [0,2,0,0,0,0|2,0,0]=4 4512 B11R1.48 CC1CC(CC1CC)C(O)=O Amb24534431 [0,2,0,0,0,0|2,0,0]=4 4513 B11R1.48 CC1CC(CC1CO)C(C)=O Amb24484595 [0,2,0,0,0,0|2,0,0]=4 4514 B11R1.48 CC1CC(NC1CC)C(O)=O Amb18200003 [0,2,0,0,0,0|1,0,0]=3 4515 B11R1.48 CC1CC(OC1CC)C(O)=O Amb24400033 [0,2,0,0,0,0|2,0,0]=4 4516 B11R1.48 CCC1CC(NC1=O)C(O)=O Amb24340377 [0,2,0,0,0,0|1,0,1]=4 4517 B11R1.48 CCC1C[C@H](NC1=O)C(O)=O Amb25088385 [0,2,0,0,0,0|1,0,1]=4 4518 B11R1.48 NCC1CC(NC1=O)C(O)=O Amb25288332 [0,2,0,0,0,0|1,0,1]=4 4519 B11R1.48 NC[C@@H]1O[C@@H](C[C@H]1O)C(O)=O Amb17933205 [0,2,0,0,0,0|1,0,0]=3 4520 B11R1.48 NC[C@@H]1O[C@H](C[C@H]1O)C(O)=O Amb17933206 [0,2,0,0,0,0|1,0,0]=3 4521 B11R1.48 NC[C@H]1C[C@H](NC1=O)C(O)=O Amb25348489 [0,2,0,0,0,0|1,0,1]=4 4522 B11R1.48 NC[C@H]1O[C@@H](C[C@@H]1O)C(=O)O Amb10066960 [0,2,0,0,0,0|1,0,0]=3 4523 B11R1.48 NC[C@H]1O[C@H](C[C@@H]1O)C(=O)O Amb10066959 [0,2,0,0,0,0|1,0,0]=3 4524 B11R1.48 OC1CC(NC1CO)C(O)=O Amb24356688 [0,2,0,0,0,0|0,0,0]=2 4525 B11R1.48 O[C@H]1C[C@@H](N[C@H]1CO)C(O)=O Amb25176112 [0,2,0,0,0,0|0,0,0]=2 4526 B11R1.48 O[C@H]1C[C@H](N[C@H]1CO)C(O)=O Amb25273969 [0,2,0,0,0,0|0,0,0]=2 4527 B11R1.50 CC1CC(CO)OC1C(O)=O Amb24509126 [0,2,0,0,0,0|2,0,0]=4 4528 B11R1.50 CCC1CC(C(O)=O)N(C)C1 Amb25101595 [0,2,0,0,0,0|1,0,0]=3 4529 B11R1.50 CN1C[C@@H](C[C@H]1C(O)=O)OC Amb24653984 [0,2,0,0,0,0|0,0,0]=2 4530 B11R1.50 COC1C[C@H](O)[C@H](O1)C(O)=O Amb24740762 [0,2,0,0,0,0|2,0,0]=4 4531 B11R1.50 OC(=O)C1CC(CO)OC1=O Amb24552873 [0,2,0,0,0,0|2,0,0]=4 4532 B11R1.50 OC1CC(CO)OC1C(O)=O Amb25799063 [0,2,0,0,0,0|2,0,0]=4 4533 B11R1.50 O[C@@H]1C[C@@H](CO)O[C@H]1C(O)=O Amb24634250 [0,2,0,0,0,0|2,0,0]=4 4534 B11R1.124 C=CCC1CNC(C1)C(O)=O Amb25027902 [0,2,0,0,0,0|1,0,0]=3 4535 B11R1.124 C=CC[C@@H]1CN[C@H](C1)C(O)=O Amb22752941 [0,2,0,0,0,0|1,0,0]=3 4536 B11R1.124 C=CC[C@@H]1CN[C@H](C1)C(O)=O Amb22752975 [0,2,0,0,0,0|1,0,0]=3 4537 B11R1.124 CC#C[C@H]1C[C@H](NC1)C(O)=O Amb24550228 [0,2,0,0,0,0|1,0,0]=3 4538 B11R1.124 CCCC1CC(CC1)C(O)=O Amb24650608 [0,2,0,0,0,0|2,0,0]=4 4539 B11R1.124 CCCC1CC(NC1)C(O)=O Amb18126070 [0,2,0,0,0,0|1,0,0]=3 4540 B11R1.124 CCCC1C[C@H](NC1)C(O)=O Amb24487717 [0,2,0,0,0,0|1,0,0]=3 4541 B11R1.124 CCC[C@H]1C[C@H](NC1)C(O)=O Amb24692815 [0,2,0,0,0,0|1,0,0]=3 4542 B11R1.124 CCNC1CC(CC1)C(O)=O Amb23454120 [0,2,0,0,0,0|2,0,0]=4 4543 B11R1.124 CCO[C@@H]1CN[C@@H](C1)C(O)=O Amb24558205 [0,2,0,0,0,0|0,0,0]=2 4544 B11R1.124 CCO[C@@H]1CN[C@H](C1)C(O)=O Amb24627143 [0,2,0,0,0,0|0,0,0]=2 4545 B11R1.124 COCC1CC(CC1)C(O)=O Amb25780193 [0,2,0,0,0,0|1,0,0]=3 4546 B11R1.124 COCC1CCC(N1)C(O)=O Amb24441382 [0,2,0,0,0,0|2,0,0]=4 4547 B11R1.124 COCC1CCC(O1)C(O)=O Amb18988012 [0,2,0,0,0,0|2,0,0]=4 4548 B11R1.124 COC[C@@H]1CC[C@H](N1)C(O)=O Amb24547011 [0,2,0,0,0,0|2,0,0]=4 4549 B11R1.124 COC[C@H]1CC[C@H](N1)C(O)=O Amb25369771 [0,2,0,0,0,0|2,0,0]=4 4550 B11R1.124 CO\N=C/1\CCC(C1)C(O)=O Amb23454128 [0,2,0,0,0,0|1,0,1]=4 4551 B11R1.124 C\C=C/C1C[C@H](NC1)C(O)=O Amb24715912 [0,2,0,0,0,0|1,0,0]=3 4552 B11R1.124 N#CCC1CNC(C1)C(O)=O Amb18125706 [0,2,0,0,0,0|1,0,0]=3 4553 B11R1.124 N#CC[C@H]1CN[C@@H](C1)C(O)=O Amb25179025 [0,2,0,0,0,0|1,0,0]=3 4554 B11R1.124 OC(=O)C1CCC(CCF)C1 Amb24742558 [0,2,0,0,0,0|2,0,0]=4 4555 B11R1.124 OC(=O)[C@H]1C[C@H](CC1)NC=O Amb24630669 [0,2,0,0,0,0|1,0,1]=4 4556 B11R1.124 OCCN1CC(CC1)C(O)=O Amb18302792 [0,2,0,0,0,0|2,0,0]=4 4557 B11R1.124 [N-]=[N+]=NC1CNC(C1)C(N)=O Amb24725485 [0,2,0,0,0,0|2,0,0]=4 4558 B11R1.124 [N-]=[N+]=NC1CNC(C1)C(O)=O Amb25054733 [0,2,0,0,0,0|1,0,0]=3 4559 B11R1.175 CC(=C)C1CNC(C1)C(O)=O Amb25109928 [0,2,0,0,0,0|1,0,0]=3 4560 B11R1.175 CC(=O)C1CC(CO1)C(O)=O Amb24374536 [0,2,0,0,0,0|2,0,0]=4 4561 B11R1.175 CC(=O)C1CCC(C1)C(O)=O Amb24373216 [0,2,0,0,0,0|1,0,1]=4 4562 B11R1.175 CC(C)C1CC(NC1)C(O)=O Amb24752524 [0,2,0,0,0,0|1,0,0]=3 4563 B11R1.175 CN(C)C1CC(CC1)C(O)=O Amb24509743 [0,2,0,0,0,0|2,0,0]=4 4564 B11R1.175 CN(C)[C@@H]1CN[C@@H](C1)C(N)=O Amb25223159 [0,2,0,0,0,0|2,0,0]=4 4565 B11R1.175 CN(C)[C@@H]1CN[C@@H](C1)C(O)=O Amb22587285 [0,2,0,0,0,0|1,0,0]=3 4566 B11R1.175 CN(C)[C@H]1CN[C@@H](C1)C(O)=O Amb22587286 [0,2,0,0,0,0|1,0,0]=3 4567 B11R1.175 CN(C)[C@H]1CN[C@H](C1)C(O)=O Amb24519419 [0,2,0,0,0,0|1,0,0]=3 4568 B11R1.175 CN([C@H]1CN[C@@H](C1)C(=O)O)C Amb15701330 [0,2,0,0,0,0|1,0,0]=3 4569 B11R1.175 NC(=O)C1CCC(C1)C(O)=O Amb18126050 [0,2,0,0,0,0|1,0,1]=4 4570 B11R1.175 OC(=O)C1CC(CO1)C(O)=O Amb23454154 [0,2,0,0,0,0|1,0,0]=3 4571 B11R1.175 OC(=O)C1CC(CS1)C(O)=O Amb18647960 [0,2,0,0,0,0|1,0,0]=3 4572 B11R1.175 OC(=O)C1CC(SS1)C(O)=O Amb24433441 [0,2,0,0,0,0|2,0,0]=4 4573 B11R1.175 OC(=O)C1CCC(C1)C(=O)O Amb2505466 [0,2,0,0,0,0|1,0,0]=3 4574 B11R1.175 OC(=O)C1CCC(O1)C(O)=O Amb18126226 [0,2,0,0,0,0|2,0,0]=4 4575 B11R1.175 OC(=O)C1SCC(N1)C(=O)O Amb2421539 [0,2,0,0,0,0|2,0,0]=4 4576 B11R1.175 OC(=O)C=1CC(CC1)C(O)=O Amb24365900 [0,2,0,0,0,0|1,0,1]=4 4577 B11R1.175 OC(=O)[C@@H]1CC[C@@H](O1)C(=O)O Amb17620468 [0,2,0,0,0,0|2,0,0]=4 4578 B11R1.175 OC(=O)[C@@H]1CC[C@@H](S1)C(O)=O Amb23560340 [0,2,0,0,0,0|2,0,0]=4 4579 B11R1.175 OC(=O)[C@@H]1CC[C@H](N1)C(O)=O Amb25174831 [0,2,0,0,0,0|2,0,0]=4 4580 B11R1.175 OC(=O)[C@@H]1CC[C@H](S1)C(O)=O Amb23560341 [0,2,0,0,0,0|2,0,0]=4 4581 B11R1.175 OC(=O)[C@@H]1COC(N1)C(O)=O Amb24375687 [0,2,0,0,0,0|2,0,0]=4 4582 B11R1.175 OC(=O)[C@@H]1C[C@@H](CN1)C(O)=O Amb22262950 [0,2,0,0,0,0|0,0,0]=2 4583 B11R1.175 OC(=O)[C@@H]1C[C@@H](CS1)C(O)=O Amb24692652 [0,2,0,0,0,0|1,0,0]=3 4584 B11R1.175 OC(=O)[C@@H]1C[C@H](CC1)C(O)=O Amb22744933 [0,2,0,0,0,0|1,0,0]=3 4585 B11R1.175 OC(=O)[C@@H]1C[C@H](CN1)C(O)=O Amb19930523 [0,2,0,0,0,0|0,0,0]=2 4586 B11R1.175 OC(=O)[C@@H]1C[C@H](CS1)C(O)=O Amb25295506 [0,2,0,0,0,0|1,0,0]=3 4587 B11R1.175 OC(=O)[C@@H]1C[C@H](NN1)C(O)=O Amb24626610 [0,2,0,0,0,0|1,0,0]=3 4588 B11R1.175 OC(=O)[C@@H]1SC[C@H](N1)C(=O)O Amb16203732 [0,2,0,0,0,0|2,0,0]=4 4589 B11R1.175 OC(=O)[C@H]1CC(CN1)C(O)=O Amb25701728 [0,2,0,0,0,0|0,0,0]=2 4590 B11R1.175 OC(=O)[C@H]1CC[C@@H](O1)C(O)=O Amb25241964 [0,2,0,0,0,0|2,0,0]=4 4591 B11R1.175 OC(=O)[C@H]1CC[C@@H](S1)C(O)=O Amb24611890 [0,2,0,0,0,0|2,0,0]=4 4592 B11R1.175 OC(=O)[C@H]1CC[C@H](N1)C(O)=O Amb24538157 [0,2,0,0,0,0|2,0,0]=4 4593 B11R1.175 OC(=O)[C@H]1CO[C@H](O1)C(O)=O Amb24584796 [0,2,0,0,0,0|2,0,0]=4 4594 B11R1.175 OC(=O)[C@H]1CSC(N1)C(O)=O Amb24759082 [0,2,0,0,0,0|2,0,0]=4 4595 B11R1.175 OC(=O)[C@H]1CS[C@@H](N1)C(O)=O Amb24635691 [0,2,0,0,0,0|2,0,0]=4 4596 B11R1.175 OC(=O)[C@H]1CS[C@H](N1)C(O)=O Amb25179305 [0,2,0,0,0,0|2,0,0]=4 4597 B11R1.175 OC(=O)[C@H]1C[C@@H](CN1)C(O)=O Amb24559908 [0,2,0,0,0,0|0,0,0]=2 4598 B11R1.175 OC(=O)[C@H]1C[C@@H](NN1)C(O)=O Amb24061688 [0,2,0,0,0,0|1,0,0]=3 4599 B11R1.175 OC(=O)[C@H]1C[C@H](NN1)C(O)=O Amb24061689 [0,2,0,0,0,0|1,0,0]=3 4600 B11R1.175 OC(=O)[C@H]1C[C@H](SS1)C(O)=O Amb25101012 [0,2,0,0,0,0|2,0,0]=4 4601 B11R1.175 [C@H]1(CSC(N1)C(O)=O)C(O)=O Amb17872022 [0,2,0,0,0,0|2,0,0]=4 4602 B11R1.175 [O-][N+](=O)C1CC(CC1)C(O)=O Amb25212728 [0,2,0,0,0,0|1,0,1]=4 4603 B11R1.417 C#CC1(O)CC(CC1)C(O)=O Amb23454112 [0,2,0,0,0,0|1,0,0]=3 4604 B11R1.417 OC(=O)C1CC(F)(CBr)CC1 Amb24502007 [0,2,0,0,0,0|2,0,0]=4 4605 B11R1.473 CC(O)C1NCC(CO)C1N Amb24462006 [0,2,0,0,0,0|1,0,1]=4 4606 B11R1.473 CC/1C(NC\C1=C\C)C(O)=O Amb25787352 [0,2,0,0,0,0|1,0,1]=4 4607 B11R1.473 CC1C(CCC1C(O)=O)C=C Amb24355854 [0,2,0,0,0,0|2,0,0]=4 4608 B11R1.473 COC1CNC(C1O)C(O)=O Amb25846151 [0,2,0,0,0,0|0,0,0]=2 4609 B11R1.473 CO[C@@H]1CC[C@H]([C@H]1N)C(O)=O Amb24693846 [0,2,0,0,0,0|1,0,0]=3 4610 B11R1.473 CO[C@@H]1CN[C@@H]([C@H]1F)C(O)=O Amb25176252 [0,2,0,0,0,0|0,0,0]=2 4611 B11R1.473 CO[C@@H]1CN[C@@H]([C@H]1O)C(O)=O Amb24612041 [0,2,0,0,0,0|0,0,0]=2 4612 B11R1.473 CO[C@H]1CN[C@@H]([C@@H]1O)C(O)=O Amb24610033 [0,2,0,0,0,0|0,0,0]=2 4613 B11R1.1229 CC1(C\C(\CC1)=N/O)C(O)=O Amb25331146 [0,2,0,0,0,0|1,0,1]=4 4614 B11R1.1229 CCC1CC(C)(CC1)C(O)=O Amb25696378 [0,2,0,0,0,0|2,0,0]=4 4615 B11R1.1229 CCC1CC(N)(CC1)C(O)=O Amb25060576 [0,2,0,0,0,0|2,0,0]=4 4616 B11R1.1229 COC1CC(N)(CC1)C(N)=O Amb24667268 [0,2,0,0,0,0|2,0,0]=4 4617 B11R1.1229 COC1CC(N)(CC1)C(O)=O Amb25678284 [0,2,0,0,0,0|1,0,0]=3 4618 B11R1.1229 CS[C@@H]1C[C@@](N)(CC1)C(O)=O Amb24607274 [0,2,0,0,0,0|1,1,0]=4 4619 B11R1.1229 N[C@]1(CO[C@H](C1)CO)C(O)=O Amb25216968 [0,2,0,0,0,0|2,0,0]=4 4620 B11R1.1229 OCC1CC(O)(CO1)C(O)=O Amb18645568 [0,2,0,0,0,0|2,0,0]=4 4621 B11R1.316 OC1C(NCC1O)S(O)(=O)=O Amb24538230 [0,2,0,0,0,0|1,0,0]=3 4622 B11R1.316 O[C@@H]1[C@@H](NC[C@H]1O)S(O)(=O)=O Amb25227418 [0,2,0,0,0,0|1,0,0]=3 4623 B11R1.487 CC1CC(O)(NC1=O)C(O)=O Amb24694924 [0,2,0,0,0,0|1,0,1]=4 4624 B11R1.487 OC(=O)C1(O)CC(O)C(=O)O1 Amb25320929 [0,2,0,0,0,0|1,0,1]=4 4625 B11R1.644 CC1(C)CC(NC1O)C(O)=O Amb24633393 [0,2,0,0,0,0|1,0,0]=3 4626 B11R1.644 CC1(C)C[C@@H](NC1=O)C(O)=O Amb19131986 [0,2,0,0,0,0|1,0,1]=4 4627 B11R1.644 NC1CC(CC1(F)F)C(O)=O Amb24374636 [0,2,0,0,0,0|2,0,0]=4 4628 B11R1.644 OC(=O)C1CC(F)(F)C(=O)N1 Amb25828417 [0,2,0,0,0,0|1,0,1]=4 4629 B11R1.644 OC(=O)[C@@H]1CC(F)(F)C(=O)N1 Amb24509315 [0,2,0,0,0,0|1,0,1]=4 4630 B11R1.644 OC(=O)[C@H]1NC(=O)C(C1)(C)C Amb17613371 [0,2,0,0,0,0|1,0,1]=4 4631 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 4632 B11R1.672 CC1C(C)CC(C(O)=O)N1C Amb25274056 [0,2,0,0,0,0|1,0,0]=3 4633 B11R1.672 CC1C(NC(=O)C1C)C(O)=O Amb24424008 [0,2,0,0,0,0|1,0,1]=4 4634 B11R1.672 CC1C(OC(=O)C1O)C(O)=O Amb25191183 [0,2,0,0,0,0|1,0,1]=4 4635 B11R1.672 CC1C[C@@H](C(O)=O)N(C)C1=C Amb25226829 [0,2,0,0,0,0|1,0,1]=4 4636 B11R1.672 CC1N[C@@H](C(O)C1=O)C(O)=O Amb25319073 [0,2,0,0,0,0|0,0,2]=4 4637 B11R1.672 CC1[C@H](NC(=O)C1C)C(O)=O Amb25109295 [0,2,0,0,0,0|1,0,1]=4 4638 B11R1.672 C[C@@H]1[C@@H](O)C[C@H]([C@@H]1C)C(C)=O Amb25262290 [0,2,0,0,0,0|2,0,0]=4 4639 B11R1.672 C[C@@H]1[C@H](NC(=O)[C@@H]1C)C(O)=O Amb24558161 [0,2,0,0,0,0|1,0,1]=4 4640 B11R1.672 C[C@H]1N[C@H]([C@H](O)[C@@H]1O)C(O)=O Amb24512198 [0,2,0,0,0,0|0,0,0]=2 4641 B11R1.672 NC1C(Br)C(CC1O)C(O)=O Amb25144702 [0,2,0,0,0,0|1,0,0]=3 4642 B11R1.672 NC1C(Br)CC(C1Br)C(O)=O Amb25191239 [0,2,0,0,0,0|2,0,0]=4 4643 B11R1.672 NC1C(O)[C@H](NC1=O)C(O)=O Amb24582227 [0,2,0,0,0,0|1,0,1]=4 4644 B11R1.672 NC1CC(C(O)C1O)C(O)=O Amb25095206 [0,2,0,0,0,0|1,0,0]=3 4645 B11R1.672 N[C@@H]1[C@@H](Br)C[C@@H]([C@H]1Br)C(O)=O Amb25346118 [0,2,0,0,0,0|2,0,0]=4 4646 B11R1.672 N[C@@H]1[C@@H](C[C@@H](O)[C@H]1O)C(O)=O Amb24650968 [0,2,0,0,0,0|1,0,0]=3 4647 B11R1.672 N[C@H]1[C@@H](C[C@H](O)[C@@H]1O)C(O)=O Amb25362275 [0,2,0,0,0,0|1,0,0]=3 4648 B11R1.672 OC(=O)[C@@H]1OC(=O)[C@@H](O)[C@H]1O Amb24711456 [0,2,0,0,0,0|1,0,1]=4 4649 B11R1.672 OC(=O)[C@H]1NC(=O)[C@@H](O)[C@H]1O Amb25241663 [0,2,0,0,0,0|0,0,1]=3 4650 B11R1.672 OC1C(O)OC(C1O)C(O)=O Amb24445981 [0,2,0,0,0,0|1,0,0]=3 4651 B11R1.672 O[C@@H]1[C@@H](O)O[C@@H]([C@@H]1O)C(O)=O Amb25363244 [0,2,0,0,0,0|1,0,0]=3 4652 B11R1.672 O[C@@H]1[C@H](O)C[C@H]([C@H]1O)C(O)=O Amb25176132 [0,2,0,0,0,0|1,0,0]=3 4653 B11R1.672 O[C@H]1C(O)OC([C@@H]1O)C(O)=O Amb25302346 [0,2,0,0,0,0|1,0,0]=3 4654 B11R1.672 O[C@H]1[C@@H](O)O[C@@H]([C@@H]1O)C(O)=O Amb24739647 [0,2,0,0,0,0|1,0,0]=3 4655 B11R1.672 O[C@H]1[C@@H](O)O[C@@H]([C@H]1O)C(O)=O Amb25361091 [0,2,0,0,0,0|1,0,0]=3 4656 B11R1.49 CCN1CC(=O)CC1C(O)=O Amb25722959 [0,2,0,0,0,0|0,0,2]=4 4657 B11R1.49 CCN1CC(F)CC1C(N)=O Amb25328462 [0,2,0,0,0,0|2,0,0]=4 4658 B11R1.49 CCN1CC(O)CC1C(O)=O Amb24533163 [0,2,0,0,0,0|0,0,0]=2 4659 B11R1.49 CCN1C[C@H](F)C[C@H]1C(N)=O Amb24563570 [0,2,0,0,0,0|2,0,0]=4 4660 B11R1.49 NC(=O)C1CC(O)CN1C=O Amb24487673 [0,2,0,0,0,0|1,0,0]=3 4661 B11R1.49 O=NN1C[C@@H](C[C@H]1C(=O)O)O Amb17618587 [0,2,0,0,0,0|0,0,0]=2 4662 B11R1.49 OC(=O)C1CC(F)CN1N=O Amb25685795 [0,2,0,0,0,0|1,0,0]=3 4663 B11R1.49 OC1CC(C(O)=O)N(C1)C=O Amb18278524 [0,2,0,0,0,0|0,0,0]=2 4664 B11R1.49 OC1CC(C(O)=O)N(C1)N=O Amb22733909 [0,2,0,0,0,0|0,0,0]=2 4665 B11R1.49 OC1C[C@@H](C(O)=O)N(C1)C=O Amb18792058 [0,2,0,0,0,0|0,0,0]=2 4666 B11R1.49 OC1C[C@@H](C(O)=O)N(C1)N=O Amb24487956 [0,2,0,0,0,0|0,0,0]=2 4667 B11R1.488 CC1(C)CC(C(N)C1)C(O)=O Amb25258848 [0,2,0,0,0,0|2,0,0]=4 4668 B11R1.488 CC1(C)CC(O)C(C1)C(O)=O Amb18126148 [0,2,0,0,0,0|2,0,0]=4 4669 B11R1.488 CC1(C)C[C@@H]([C@H](N)C1)C(O)=O Amb24610183 [0,2,0,0,0,0|2,0,0]=4 4670 B11R1.488 CC1(C)C[C@H](O)[C@H](C1)C(O)=O Amb24519229 [0,2,0,0,0,0|2,0,0]=4 4671 B11R1.488 CC1(C)C[C@H]([C@@H](N)C1)C(O)=O Amb24760817 [0,2,0,0,0,0|2,0,0]=4 4672 B11R1.488 CN1CC(C)(C)CC1C(O)=O Amb25150795 [0,2,0,0,0,0|1,0,0]=3 4673 B11R1.488 CN1CC(C)(C)C[C@H]1C(O)=O Amb25148306 [0,2,0,0,0,0|1,0,0]=3 4674 B11R1.488 CN1CC(F)(F)CC1C(O)=O Amb24509569 [0,2,0,0,0,0|1,0,0]=3 4675 B11R1.488 CN1CC(F)(F)C[C@@H]1C(O)=O Amb22899541 [0,2,0,0,0,0|1,0,0]=3 4676 B11R1.488 CN1CC(F)(F)C[C@H]1C(O)=O Amb24640323 [0,2,0,0,0,0|1,0,0]=3 4677 B11R1.488 N[C@H]1CC(F)(F)C[C@H]1C(O)=O Amb25264858 [0,2,0,0,0,0|2,0,0]=4 4678 B11R1.489 C[N+]1(C)CC(O)CC1C([O-])=O Amb20246389 [0,2,0,0,0,0|0,0,2]=4 4679 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 4680 B11R1.489 O[C@@H]1C[C@H]([N+](C1)(C)C)C(=O)[O-] Amb16193271 [0,2,0,0,0,0|0,0,2]=4 4681 B11R1.490 CC1CC(C)C(O)(C1)C(O)=O Amb24693751 [0,2,0,0,0,0|2,0,0]=4 4682 B11R1.64 CC1CCC(C1CN)C(O)=O Amb20623956 [0,2,0,0,0,0|2,0,0]=4 4683 B11R1.64 CC[C@@H]1[C@H](NCC1=O)C(O)=O Amb18830650 [0,2,0,0,0,0|0,0,2]=4 4684 B11R1.315 CC1(C)C(CCC1O)C(O)=O Amb23536041 [0,2,0,0,0,0|1,0,0]=3 4685 B11R1.315 CC1(C)C(NCC1=O)C(O)=O Amb25282876 [0,2,0,0,0,0|0,0,2]=4 4686 B11R1.315 CC1(C)[C@H](NCC1O)C(O)=O Amb25274036 [0,2,0,0,0,0|0,0,0]=2 4687 B11R1.315 CC1CCC(C(O)=O)C1(C)C Amb23536032 [0,2,0,0,0,0|2,0,0]=4 4688 B11R1.515 CC1C(CCC1(C)C)C(O)=O Amb25700977 [0,2,0,0,0,0|2,0,0]=4 4689 B11R1.515 C[C@H]1[C@@H](CC[C@@]1(C)O)C(C)=O Amb24512752 [0,2,0,0,0,0|2,0,0]=4 4690 B11R1.515 C[C@H]1[C@@H](CC[C@]1(C)O)C(C)=O Amb25294270 [0,2,0,0,0,0|2,0,0]=4 4691 B11R1.515 N[C@H]1[C@H](CCC1(F)F)C(O)=O Amb25226854 [0,2,0,0,0,0|2,0,0]=4 4692 B11R1.1270 CC(=O)[C@]1(O)OC[C@@H](O)[C@H]1O Amb25221032 [0,2,0,0,0,0|2,0,0]=4 4693 B11R1.1270 CC1(NCC(O)C1O)C(O)=O Amb24484626 [0,2,0,0,0,0|0,0,0]=2 4694 B11R1.1270 CC1CCC(C)(C1O)C(O)=O Amb24420524 [0,2,0,0,0,0|2,0,0]=4 4695 B11R1.1270 C[C@]1(NC[C@H](O)[C@H]1O)C(O)=O Amb25264822 [0,2,0,0,0,0|0,0,0]=2 4696 B11R1.1270 OC1C(O)COC1(O)C(O)=O Amb25243018 [0,2,0,0,0,0|1,0,0]=3 4697 B11R1.1270 OC1CCC(O)(C1Cl)C(O)=O Amb24484555 [0,2,0,0,0,0|1,0,0]=3 4698 B11R1.1270 O[C@@H]1CCC(O)([C@@H]1Cl)C(O)=O Amb24626658 [0,2,0,0,0,0|1,0,0]=3 4699 B11R1.1270 O[C@H]1[C@@H](O)COC1(O)C(O)=O Amb25241156 [0,2,0,0,0,0|1,0,0]=3 4700 B11R1.738 CC1(C)CCC(O)(C1)C(O)=O Amb24373558 [0,2,0,0,0,0|2,0,0]=4 4701 B11R1.738 CC1(CC(F)(F)CC1)C(O)=O Amb25212373 [0,2,0,0,0,0|2,0,0]=4 4702 B11R1.738 C[C@@]1(CC(F)(F)CN1)C(O)=O Amb24373234 [0,2,0,0,0,0|1,0,0]=3 4703 B11R1.416 CC1CC(CC1)(CO)C(O)=O Amb25150685 [0,2,0,0,0,0|2,0,0]=4 4704 B11R1.416 CC1CC(CN)(CC1)C(O)=O Amb24687912 [0,2,0,0,0,0|2,0,0]=4 4705 B11R1.416 CCC1(CC(N)CC1)C(O)=O Amb23454123 [0,2,0,0,0,0|2,0,0]=4 4706 B11R1.416 CCC1(CC(O)CC1)C(O)=O Amb23454240 [0,2,0,0,0,0|1,0,0]=3 4707 B11R1.416 CNC1(CC(C)CC1)C(O)=O Amb24624991 [0,2,0,0,0,0|2,0,0]=4 4708 B11R1.416 COC1(CC(C)CC1)C(O)=O Amb25151845 [0,2,0,0,0,0|2,0,0]=4 4709 B11R1.416 CSC1(CC(C)CC1)C(O)=O Amb18127332 [0,2,0,0,0,0|2,0,0]=4 4710 B9R1.5 CC1NCCCNC1=O Amb22496434 [0,0,1,1,0,0|2,0,0]=4 4711 B9R1.5 C[C@@H]1NCCCNC1=O Amb25733316 [0,0,1,1,0,0|2,0,0]=4 4712 B9R1.5 C[C@H]1NCCCNC1=O Amb25146171 [0,0,1,1,0,0|2,0,0]=4 4713 B9R1.6 CC(=O)C1CCCCN1 Amb21962174 [0,0,1,1,0,0|2,0,0]=4 4714 B9R1.6 CC(=O)C1COCCN1 Amb24761214 [0,0,1,1,0,0|1,0,0]=3 4715 B9R1.6 CC(=O)C1COCCO1 Amb20669104 [0,0,1,1,0,0|2,0,0]=4 4716 B9R1.6 CC(=O)C1CSCCN1 Amb25305093 [0,0,1,1,0,0|1,1,0]=4 4717 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb25072730 [0,0,1,1,0,0|2,0,0]=4 4718 B9R1.6 NC(=O)C1CCCCN1 Amb2370929 [0,0,1,1,0,0|2,0,0]=4 4719 B9R1.6 NC(=O)C1CNCCN1 Amb1158016 [0,0,1,1,0,0|2,0,0]=4 4720 B9R1.6 NC(=O)C1COCCN1 Amb22059486 [0,0,1,1,0,0|1,0,0]=3 4721 B9R1.6 NC(=O)[C@@H]1CCCCN1 Amb25315367 [0,0,1,1,0,0|2,0,0]=4 4722 B9R1.6 NC(=O)[C@@H]1CNCCN1 Amb24183728 [0,0,1,1,0,0|2,0,0]=4 4723 B9R1.6 NC(=O)[C@@H]1COCCN1 Amb24712516 [0,0,1,1,0,0|1,0,0]=3 4724 B9R1.6 O=C(Cl)C1CCCCN1 Amb24061326 [0,0,1,1,0,0|2,0,0]=4 4725 B9R1.6 O=C(Cl)C1COCCC1 Amb18280558 [0,0,1,1,0,0|2,0,0]=4 4726 B9R1.6 O=C(Cl)C1COCCN1 Amb24738488 [0,0,1,1,0,0|1,0,0]=3 4727 B9R1.6 O=C(Cl)C1COCCO1 Amb18280665 [0,0,1,1,0,0|2,0,0]=4 4728 B9R1.6 O=C(Cl)[C@@H]1CCCCN1 Amb24548250 [0,0,1,1,0,0|2,0,0]=4 4729 B9R1.6 O=C(Cl)[C@H]1CCCCN1 Amb24560223 [0,0,1,1,0,0|2,0,0]=4 4730 B9R1.6 OC(=O)C1C=CCCN1 Amb25145978 [0,0,1,1,0,0|1,0,1]=4 4731 B9R1.6 OC(=O)C1CCCCS1 Amb18202314 [0,0,1,1,0,0|2,0,0]=4 4732 B9R1.6 OC(=O)C1CCCNC1 Amb1151304 [0,0,1,1,0,0|2,0,0]=4 4733 B9R1.6 OC(=O)C1CCCOC1 Amb1102367 [0,0,1,1,0,0|1,0,0]=3 4734 B9R1.6 OC(=O)C1CCSCN1 Amb1102215 [0,0,1,1,0,0|2,0,0]=4 4735 B9R1.6 OC(=O)C1CCSCN1 Amb22284134 [0,0,1,1,0,0|2,0,0]=4 4736 B9R1.6 OC(=O)C1CNCCN1 Amb22490901 [0,0,1,1,0,0|1,0,0]=3 4737 B9R1.6 OC(=O)C1CNCCN1 Amb22490977 [0,0,1,1,0,0|1,0,0]=3 4738 B9R1.6 OC(=O)C1CNCCO1 Amb16232076 [0,0,1,1,0,0|2,0,0]=4 4739 B9R1.6 OC(=O)C1COCCN1 Amb10607157 [0,0,1,1,0,0|0,0,0]=2 4740 B9R1.6 OC(=O)C1CSCCC1 Amb18202321 [0,0,1,1,0,0|1,1,0]=4 4741 B9R1.6 OC(=O)C1CSCCN1 Amb19888398 [0,0,1,1,0,0|0,1,0]=3 4742 B9R1.6 OC(=O)C1CSCCO1 Amb25241709 [0,0,1,1,0,0|1,1,0]=4 4743 B9R1.6 OC(=O)C1CSCCS1 Amb20622962 [0,0,1,1,0,0|1,1,0]=4 4744 B9R1.6 OC(=O)C1NCCCS1 Amb22899084 [0,0,1,1,0,0|2,0,0]=4 4745 B9R1.6 OC(=O)C=1COCCC1 Amb19958529 [0,0,1,1,0,0|1,0,1]=4 4746 B9R1.6 OC(=O)[C@@H]1CCCCO1 Amb22746821 [0,0,1,1,0,0|2,0,0]=4 4747 B9R1.6 OC(=O)[C@@H]1CCCNC1 Amb16232354 [0,0,1,1,0,0|2,0,0]=4 4748 B9R1.6 OC(=O)[C@@H]1CCCNN1 Amb22747164 [0,0,1,1,0,0|2,0,0]=4 4749 B9R1.6 OC(=O)[C@@H]1CCSCN1 Amb24465168 [0,0,1,1,0,0|2,0,0]=4 4750 B9R1.6 OC(=O)[C@@H]1CNCCN1 Amb22748956 [0,0,1,1,0,0|1,0,0]=3 4751 B9R1.6 OC(=O)[C@@H]1CNCCO1 Amb22737231 [0,0,1,1,0,0|2,0,0]=4 4752 B9R1.6 OC(=O)[C@@H]1COCCC1 Amb24118033 [0,0,1,1,0,0|1,0,0]=3 4753 B9R1.6 OC(=O)[C@@H]1COCCN1 Amb10576585 [0,0,1,1,0,0|0,0,0]=2 4754 B9R1.6 OC(=O)[C@@H]1COCCO1 Amb23438856 [0,0,1,1,0,0|1,0,0]=3 4755 B9R1.6 OC(=O)[C@@H]1CSCCN1 Amb22386830 [0,0,1,1,0,0|0,1,0]=3 4756 B9R1.6 OC(=O)[C@H]1CC=CCN1 Amb25757299 [0,0,1,1,0,0|1,0,1]=4 4757 B9R1.6 OC(=O)[C@H]1CCSCN1 Amb25773953 [0,0,1,1,0,0|2,0,0]=4 4758 B9R1.6 OC(=O)[C@H]1CNCCN1 Amb20241207 [0,0,1,1,0,0|1,0,0]=3 4759 B9R1.6 OC(=O)[C@H]1CNCCO1 Amb10067023 [0,0,1,1,0,0|2,0,0]=4 4760 B9R1.6 OC(=O)[C@H]1CNCCO1 Amb22737232 [0,0,1,1,0,0|2,0,0]=4 4761 B9R1.6 OC(=O)[C@H]1COCCN1 Amb16232575 [0,0,1,1,0,0|0,0,0]=2 4762 B9R1.6 O[13C](=O)C1CCCCN1 Amb22363349 [0,0,1,1,0,0|1,0,0]=3 4763 B9R1.45 CC(C1CC1C)C(O)=O Amb25708709 [0,0,1,1,0,0|2,0,0]=4 4764 B9R1.59 CCCC1CC1C(O)=O Amb19001459 [0,0,1,1,0,0|2,0,0]=4 4765 B9R1.59 CCC[C@@H]1C[C@H]1C(O)=O Amb25368727 [0,0,1,1,0,0|2,0,0]=4 4766 B9R1.59 OC(=O)[C@@H]1C[C@H]1CCBr Amb24519204 [0,0,1,1,0,0|2,0,0]=4 4767 B9R1.69 CC1CCC(O)OC1=O Amb25306421 [0,0,1,1,0,0|1,0,0]=3 4768 B9R1.69 CC1NCC(C)NC1=O Amb18642668 [0,0,1,1,0,0|2,0,0]=4 4769 B9R1.69 C[C@@H]1CC[C@@H](O)CC1=O Amb24602949 [0,0,1,1,0,0|2,0,0]=4 4770 B9R1.69 C[C@@H]1CC[C@H](O)CC1=O Amb25205775 [0,0,1,1,0,0|2,0,0]=4 4771 B9R1.69 C[C@@H]1NC[C@@H](C)NC1=O Amb22587597 [0,0,1,1,0,0|2,0,0]=4 4772 B9R1.69 C[C@@H]1NC[C@H](C)NC1=O Amb22587599 [0,0,1,1,0,0|2,0,0]=4 4773 B9R1.69 C[C@@H]1NC[C@H](C)NC1=O Amb23385307 [0,0,1,1,0,0|2,0,0]=4 4774 B9R1.69 C[C@H]1CC[C@H](O)CC1=O Amb24512547 [0,0,1,1,0,0|2,0,0]=4 4775 B9R1.69 C[C@H]1NC[C@@H](C)NC1=O Amb22587536 [0,0,1,1,0,0|2,0,0]=4 4776 B9R1.69 C[C@H]1NC[C@@H](C)NC1=O Amb23385259 [0,0,1,1,0,0|2,0,0]=4 4777 B9R1.69 C[C@H]1NC[C@H](C)NC1=O Amb22587547 [0,0,1,1,0,0|2,0,0]=4 4778 B9R1.69 C[C@H]1NC[C@H](C)NC1=O Amb23385266 [0,0,1,1,0,0|2,0,0]=4 4779 B9R1.93 CC1(CC1CN)C(O)=O Amb24550226 [0,0,1,1,0,0|2,0,0]=4 4780 B9R1.93 CC1(CC1CO)C(O)=O Amb24559345 [0,0,1,1,0,0|1,0,0]=3 4781 B9R1.93 CC1(OC1CO)C(O)=O Amb24746000 [0,0,1,1,0,0|1,0,0]=3 4782 B9R1.93 CCC1OC1(C)C(O)=O Amb25843946 [0,0,1,1,0,0|2,0,0]=4 4783 B9R1.93 C[C@]1(C[C@@H]1CN)C(O)=O Amb25339704 [0,0,1,1,0,0|2,0,0]=4 4784 B9R1.93 NC1(CC1CO)C(O)=O Amb25828351 [0,0,1,1,0,0|2,0,0]=4 4785 B9R1.93 N[C@@]1(C[C@H]1CO)C(O)=O Amb25101898 [0,0,1,1,0,0|2,0,0]=4 4786 B9R1.93 N[C@]1(C[C@@H]1CO)C(O)=O Amb24581240 [0,0,1,1,0,0|2,0,0]=4 4787 B9R1.110 CC(C(=O)O)C1CCC1 Amb17087517 [0,0,1,1,0,0|2,0,0]=4 4788 B9R1.110 CC(C(N)=O)N1CCC1 Amb25857238 [0,0,1,1,0,0|2,0,0]=4 4789 B9R1.110 CC(C(O)=O)N1CCC1 Amb24178905 [0,0,1,1,0,0|1,0,0]=3 4790 B9R1.110 C[C@@H](C1CCC1)C(O)=O Amb22748271 [0,0,1,1,0,0|2,0,0]=4 4791 B9R1.110 C[C@H](C1CCC1)C(O)=O Amb24360449 [0,0,1,1,0,0|2,0,0]=4 4792 B9R1.112 CC(NC1CC1)C(C)=O Amb25119978 [0,0,1,1,0,0|2,0,0]=4 4793 B9R1.112 CC(SC1CC1)C(O)=O Amb25337757 [0,0,1,1,0,0|2,0,0]=4 4794 B9R1.112 C[C@@H](NC1CC1)C(O)=O Amb24398132 [0,0,1,1,0,0|1,0,0]=3 4795 B9R1.112 NC(CC1CO1)C(O)=O Amb25800055 [0,0,1,1,0,0|2,0,0]=4 4796 B9R1.112 N[C@@H](CC1CO1)C(O)=O Amb25709170 [0,0,1,1,0,0|2,0,0]=4 4797 B9R1.135 CC1C(CCO)NC1=O Amb25320276 [0,0,1,1,0,0|2,0,0]=4 4798 B9R1.135 C[C@@H]1[C@H](CCO)NC1=O Amb24681501 [0,0,1,1,0,0|2,0,0]=4 4799 B9R1.1 NCC1CCC(=O)CC1 Amb20247631 [0,0,1,1,0,0|2,0,0]=4 4800 B9R1.1 NCC1CNC(=O)CC1 Amb18832607 [0,0,1,1,0,0|2,0,0]=4 4801 B9R1.1 NCC1CNC(=O)CO1 Amb22235660 [0,0,1,1,0,0|2,0,0]=4 4802 B9R1.1 NCC1CNC(=O)CO1 Amb24682214 [0,0,1,1,0,0|2,0,0]=4 4803 B9R1.49 CC1CCOC(=O)CC1 Amb24059359 [0,0,1,1,0,0|2,0,0]=4 4804 B9R1.49 NC1CCOC(=O)CC1 Amb23598291 [0,0,1,1,0,0|2,0,0]=4 4805 B9R1.49 O=C1CCC(Br)CCO1 Amb25188931 [0,0,1,1,0,0|2,0,0]=4 4806 B9R1.49 O=C1CCC(Cl)CCO1 Amb24480302 [0,0,1,1,0,0|2,0,0]=4 4807 B9R1.49 O=C1CC[C@@H](Cl)CCO1 Amb24518083 [0,0,1,1,0,0|2,0,0]=4 4808 B9R1.49 O=C1CC[C@H](Cl)CCO1 Amb25123845 [0,0,1,1,0,0|2,0,0]=4 4809 B9R1.49 OC1CCOC(=O)CC1 Amb23598292 [0,0,1,1,0,0|1,0,0]=3 4810 B9R1.49 O[C@@H]1CCCC(=O)CC1 Amb24689806 [0,0,1,1,0,0|2,0,0]=4 4811 B9R1.67 CC1CCC1CC(O)=O Amb24466547 [0,0,1,1,0,0|2,0,0]=4 4812 B9R1.67 N[C@H]1CC[C@@H]1CC(O)=O Amb24700074 [0,0,1,1,0,0|2,0,0]=4 4813 B9R1.84 NC(=O)CCC1CNC1 Amb24627864 [0,0,1,1,0,0|2,0,0]=4 4814 B9R1.84 OC(=O)CNC1CNC1 Amb25254651 [0,0,1,1,0,0|2,0,0]=4 4815 B9R1.84 OC(=O)COC1CNC1 Amb24454311 [0,0,1,1,0,0|2,0,0]=4 4816 B9R1.84 OC(=O)CSC1CNC1 Amb24759226 [0,0,1,1,0,0|2,0,0]=4 4817 B9R1.86 C=CC1OC1CC(O)=O Amb25701827 [0,0,1,1,0,0|1,0,1]=4 4818 B9R1.86 C=C[C@H]1O[C@@H]1CC(O)=O Amb25217275 [0,0,1,1,0,0|1,0,1]=4 4819 B9R1.86 OC(=O)CC1CC1CBr Amb25269489 [0,0,1,1,0,0|2,0,0]=4 4820 B9R1.127 CC1(CC1C(O)=O)CO Amb24529046 [0,0,1,1,0,0|2,0,0]=4 4821 B9R1.127 CCC1(C)CC1C(O)=O Amb18285802 [0,0,1,1,0,0|2,0,0]=4 4822 B9R1.127 C[C@@]1(CN)C[C@H]1C(O)=O Amb24517240 [0,0,1,1,0,0|1,0,0]=3 4823 B9R1.127 OC[C@@]1(Cl)C[C@H]1C(O)=O Amb24511974 [0,0,1,1,0,0|2,0,0]=4 4824 B9R1.127 OC[C@]1(Cl)C[C@H]1C(O)=O Amb25201489 [0,0,1,1,0,0|2,0,0]=4 4825 B9R1.147 CC(=O)CCC1(O)CC1 Amb25278414 [0,0,1,1,0,0|2,0,0]=4 4826 B9R1.147 NC1(CCC(O)=O)CC1 Amb18832570 [0,0,1,1,0,0|2,0,0]=4 4827 B9R1.15 CC[C@H]1CCCOC1=O Amb24477860 [0,0,1,1,0,0|2,0,0]=4 4828 B9R1.15 CNC1CCCNC1=O Amb18946630 [0,0,1,1,0,0|2,0,0]=4 4829 B9R1.15 CNC1CCOCC1O Amb25145591 [0,0,1,1,0,0|1,0,1]=4 4830 B9R1.25 CC1C(CO)C1C(O)=O Amb25131333 [0,0,1,1,0,0|1,0,0]=3 4831 B9R1.25 C[C@@H]1[C@@H](CO)[C@@H]1C(O)=O Amb25264080 [0,0,1,1,0,0|1,0,0]=3 4832 B9R1.25 C[C@@H]1[C@@H](CO)[C@H]1C(O)=O Amb24560911 [0,0,1,1,0,0|1,0,0]=3 4833 B9R1.33 CCCC1CCOC1=O Amb25032145 [0,0,1,1,0,0|2,0,0]=4 4834 B9R1.33 NCCC1CCOC1=O Amb25141974 [0,0,1,1,0,0|2,0,0]=4 4835 B9R1.33 O=C1OCCC1CCBr Amb20667717 [0,0,1,1,0,0|2,0,0]=4 4836 B9R1.33 OCCC1=CCOC1=O Amb25346085 [0,0,1,1,0,0|1,0,1]=4 4837 B9R1.33 OCCC1CCNC1=O Amb22491563 [0,0,1,1,0,0|2,0,0]=4 4838 B9R1.33 OCCC1CCOC1=O Amb25293532 [0,0,1,1,0,0|1,0,0]=3 4839 B9R1.33 OCC[C@H]1OCCC1=O Amb25730039 [0,0,1,1,0,0|2,0,0]=4 4840 B9R1.90 CC[C@H]1[C@H](CO)NC1=O Amb25174779 [0,0,1,1,0,0|2,0,0]=4 4841 B9R1.116 CCC(C1CC1)C(O)=O Amb18832627 [0,0,1,1,0,0|2,0,0]=4 4842 B9R1.116 CNC(C1CC1)C(N)=O Amb18975566 [0,0,1,1,0,0|2,0,0]=4 4843 B9R1.116 CNC(C1CC1)C(O)=O Amb18975569 [0,0,1,1,0,0|1,0,0]=3 4844 B9R1.116 COC(C1CC1)C(O)=O Amb24524177 [0,0,1,1,0,0|2,0,0]=4 4845 B9R1.119 CCC1(CCC1)C(O)=O Amb20622799 [0,0,1,1,0,0|2,0,0]=4 4846 B9R1.119 CCC1(CCN1)C(O)=O Amb25758412 [0,0,1,1,0,0|2,0,0]=4 4847 B9R1.119 CCC1(CCO1)C(O)=O Amb25073494 [0,0,1,1,0,0|1,0,0]=3 4848 B9R1.119 CNC1(CCC1)C(C)=O Amb25694506 [0,0,1,1,0,0|2,0,0]=4 4849 B9R1.119 CNC1(CCC1)C(N)=O Amb18523737 [0,0,1,1,0,0|2,0,0]=4 4850 B9R1.119 CNC1(CCC1)C(O)=O Amb18285791 [0,0,1,1,0,0|1,0,0]=3 4851 B9R1.119 COC1(CCC1)C(O)=O Amb23596685 [0,0,1,1,0,0|2,0,0]=4 4852 B9R1.119 CSC1(CCC1)C(O)=O Amb25721376 [0,0,1,1,0,0|2,0,0]=4 4853 B9R1.130 CC[C@@]1(C[C@@H]1F)C(O)=O Amb24356743 [0,0,1,1,0,0|2,0,0]=4 4854 B9R1.130 CC[C@@]1(C[C@H]1F)C(O)=O Amb25082106 [0,0,1,1,0,0|2,0,0]=4 4855 B9R1.130 CNC1(CC1C)C(O)=O Amb24532866 [0,0,1,1,0,0|1,0,0]=3 4856 B9R1.130 CSC1(CC1C)C(O)=O Amb24540432 [0,0,1,1,0,0|2,0,0]=4 4857 B9R1.179 CCCC1(CC1)C(O)=O Amb18062273 [0,0,1,1,0,0|2,0,0]=4 4858 B9R1.179 NC(=O)C1(CCO)CC1 Amb25187752 [0,0,1,1,0,0|2,0,0]=4 4859 B9R1.179 NCCC1(CC1)C(O)=O Amb20668330 [0,0,1,1,0,0|2,0,0]=4 4860 B9R1.179 OC(=O)C1(CCF)CC1 Amb24751115 [0,0,1,1,0,0|2,0,0]=4 4861 B9R1.36 CC1(C)CC(Br)C(=O)O1 Amb24340074 [0,0,1,1,0,0|2,0,0]=4 4862 B9R1.36 CC1(C)CC(Cl)C(=O)O1 Amb24513845 [0,0,1,1,0,0|2,0,0]=4 4863 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb18124322 [0,0,1,1,0,0|1,0,0]=3 4864 B9R1.36 CC1(C)CC(O)C(=O)O1 Amb25245118 [0,0,1,1,0,0|2,0,0]=4 4865 B9R1.36 CC1(C)C[C@H](Cl)C(=O)O1 Amb25743067 [0,0,1,1,0,0|2,0,0]=4 4866 B9R1.36 CC1(C)C[C@H](N)C(=O)O1 Amb24476611 [0,0,1,1,0,0|1,0,0]=3 4867 B9R1.36 CC1CC(C)(C)OC1=O Amb24444118 [0,0,1,1,0,0|2,0,0]=4 4868 B9R1.38 CC1CC(N)P(O)(=O)O1 Amb25843150 [0,0,1,1,0,0|1,0,0]=3 4869 B9R1.161 CC(C)C1CC1C(O)=O Amb18285139 [0,0,1,1,0,0|2,0,0]=4 4870 B9R1.161 CC(C)[C@@H]1O[C@@H]1C(O)=O Amb24546994 [0,0,1,1,0,0|2,0,0]=4 4871 B9R1.161 CC(C)[C@H]1O[C@@H]1C(O)=O Amb25229035 [0,0,1,1,0,0|2,0,0]=4 4872 B9R1.161 CC(O)C1OC1C(O)=O Amb25227852 [0,0,1,1,0,0|1,0,0]=3 4873 B9R1.161 C[C@@H](O)[C@H]1O[C@@H]1C(O)=O Amb25224671 [0,0,1,1,0,0|1,0,0]=3 4874 B9R1.161 C[C@H](O)[C@@H]1O[C@@H]1C(O)=O Amb25368573 [0,0,1,1,0,0|1,0,0]=3 4875 B9R1.169 CC1(C)CC1(C)C(O)=O Amb25793545 [0,0,1,1,0,0|2,0,0]=4 4876 B9R1.169 CC1(C)CC1(N)C(N)=O Amb24741207 [0,0,1,1,0,0|2,0,0]=4 4877 B9R1.169 NC1(CC1(F)F)C(O)=O Amb25233043 [0,0,1,1,0,0|2,0,0]=4 4878 B9R1.169 N[C@]1(CC1(F)F)C(O)=O Amb25097067 [0,0,1,1,0,0|2,0,0]=4 4879 B9R1.53 C=C(Br)CN1CC(O)C1 Amb25804637 [0,0,1,1,0,0|2,0,0]=4 4880 B9R1.53 CC(=O)CN1CC(O)C1 Amb25231501 [0,0,1,1,0,0|1,0,0]=3 4881 B9R1.53 CC(C)CN1CC(=O)C1 Amb25340866 [0,0,1,1,0,0|2,0,0]=4 4882 B9R1.53 C[C@@H](O)CN1CC(O)C1 Amb25262620 [0,0,1,1,0,0|1,0,1]=4 4883 B9R1.53 C[C@@H]1C[C@H](CC(O)=O)C1 Amb24372826 [0,0,1,1,0,0|2,0,0]=4 4884 B9R1.53 NC(=N)CN1CC(O)C1 Amb25242038 [0,0,1,1,0,0|2,0,0]=4 4885 B9R1.53 NC(=O)CN1CC(O)C1 Amb24761040 [0,0,1,1,0,0|1,0,0]=3 4886 B9R1.53 NC1CC(CC(O)=O)C1 Amb23440231 [0,0,1,1,0,0|2,0,0]=4 4887 B9R1.53 NC1CN(C1)CC(O)=O Amb25347187 [0,0,1,1,0,0|1,0,0]=3 4888 B9R1.53 N[C@@H]1C[C@@H](CC(O)=O)C1 Amb23440233 [0,0,1,1,0,0|2,0,0]=4 4889 B9R1.53 N[C@@H]1C[C@H](CC(O)=O)C1 Amb23440232 [0,0,1,1,0,0|2,0,0]=4 4890 B9R1.53 N[C@@H]1C[C@H](CC(O)=O)C1 Amb24056536 [0,0,1,1,0,0|2,0,0]=4 4891 B9R1.53 OC(=O)CC1CC(Cl)C1 Amb25145965 [0,0,1,1,0,0|2,0,0]=4 4892 B9R1.53 OC1CC(C1)CC(O)=O Amb24481941 [0,0,1,1,0,0|1,0,0]=3 4893 B9R1.53 OC1CN(C1)CC(O)=O Amb25339150 [0,0,1,1,0,0|0,0,0]=2 4894 B9R1.53 O[C@@H]1C[C@H](C1)CC(O)=O Amb25204858 [0,0,1,1,0,0|1,0,0]=3 4895 B9R1.66 CC1(C)CNCC(=O)N1 Amb25858036 [0,0,1,1,0,0|2,0,0]=4 4896 B9R1.66 CC1(O)CCCC(=O)N1 Amb25373927 [0,0,1,1,0,0|2,0,0]=4 4897 B9R1.66 CC1(O)C[13CH2]CC(=O)C1 Amb22367566 [0,0,1,1,0,0|2,0,0]=4 4898 B9R1.85 NC(=O)CSC[C@@H]1CO1 Amb25098193 [0,0,1,1,0,0|2,0,0]=4 4899 B9R1.85 NC(=O)CSC[C@H]1CO1 Amb24395150 [0,0,1,1,0,0|2,0,0]=4 4900 B9R1.85 OC(=O)CCCC1CC1 Amb18832629 [0,0,1,1,0,0|2,0,0]=4 4901 B9R1.85 OC(=O)CCC[C@H]1CO1 Amb24427275 [0,0,1,1,0,0|1,0,0]=3 4902 B9R2.20 OC1COC2COC21 Amb25079233 [1,0,0,1,0,0|1,0,1]=4 4903 B9R2.20 O[C@H]1CO[C@@H]2CO[C@@H]21 Amb24644046 [1,0,0,1,0,0|1,0,1]=4 4904 B9R2.22 CC12CC(CC1)C2=O Amb25686583 [1,0,0,1,0,0|2,0,0]=4 4905 B9R2.33 OC1C[C@@H]2C=C[C@@H]2C1 Amb25741382 [1,0,0,1,0,0|2,0,0]=4 4906 B9R2.33 O[C@@H]1C[C@H]2C=C[C@H]2C1 Amb24431051 [1,0,0,1,0,0|2,0,0]=4 4907 B9R2.39 C1C2NCC1OC2=O Amb15692521 [1,0,0,1,0,0|0,0,0]=2 4908 B9R2.39 O=C1CC2COC1C2 Amb24734169 [1,0,0,1,0,0|2,0,0]=4 4909 B9R2.39 O=C1C[C@@H]2C[C@@H]1CC2 Amb25205819 [1,0,0,1,0,0|2,0,0]=4 4910 B9R2.39 O=C1C[C@@H]2C[C@H]1CC2 Amb24583541 [1,0,0,1,0,0|2,0,0]=4 4911 B9R2.39 O=C1C[C@H]2CO[C@@H]1C2 Amb24571771 [1,0,0,1,0,0|2,0,0]=4 4912 B9R2.39 O=C1NC2CC1CC2 Amb20623082 [1,0,0,1,0,0|2,0,0]=4 4913 B9R2.39 O=C1NC2CNC1C2 Amb18641690 [1,0,0,1,0,0|1,0,0]=3 4914 B9R2.39 O=C1NC2COC1C2 Amb24547028 [1,0,0,1,0,0|2,0,0]=4 4915 B9R2.39 O=C1NC2CSC1C2 Amb25204131 [1,0,0,1,0,0|2,0,0]=4 4916 B9R2.39 O=C1N[C@@H]2CN[C@H]1C2 Amb22587593 [1,0,0,1,0,0|1,0,0]=3 4917 B9R2.39 O=C1N[C@H]2CC1CC2 Amb25857407 [1,0,0,1,0,0|2,0,0]=4 4918 B9R2.39 O=C1N[C@H]2C[C@@H]1CC2 Amb25174368 [1,0,0,1,0,0|2,0,0]=4 4919 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 Amb19516242 [1,0,0,1,0,0|0,0,0]=2 4920 B9R2.39 O=C1O[C@H]2CN[C@@H]1C2 Amb24629670 [1,0,0,1,0,0|0,0,0]=2 4921 B9R2.39 OC1CC2CC1C=C2 Amb19958337 [1,0,0,1,0,0|2,0,0]=4 4922 B9R2.39 OC1CC2CCC1N2 Amb24482057 [1,0,0,1,0,0|1,0,1]=4 4923 B9R2.39 OC1CC2COC1C2 Amb25241390 [1,0,0,1,0,0|1,0,1]=4 4924 B9R2.39 O[C@@H]1CC2CC1C=C2 Amb25333573 [1,0,0,1,0,0|2,0,0]=4 4925 B9R2.39 O[C@@H]1C[C@@H]2C=C[C@H]1O2 Amb24749631 [1,0,0,1,0,0|2,0,0]=4 4926 B9R2.39 O[C@@H]1C[C@@H]2CC[C@@H]1N2 Amb25222600 [1,0,0,1,0,0|1,0,1]=4 4927 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 Amb23439253 [1,0,0,1,0,0|1,0,1]=4 4928 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1N2 Amb23439252 [1,0,0,1,0,0|1,0,1]=4 4929 B9R2.39 O[C@@H]1C[C@H]2CO[C@H]1C2 Amb24748508 [1,0,0,1,0,0|1,0,1]=4 4930 B9R2.39 O[C@@H]1C[C@H]2C[C@@H]1C=C2 Amb25236021 [1,0,0,1,0,0|2,0,0]=4 4931 B9R2.39 O[C@H]1CC2CC1C=C2 Amb25358289 [1,0,0,1,0,0|2,0,0]=4 4932 B9R2.39 O[C@H]1C[C@H]2CC[C@@H]1N2 Amb24621843 [1,0,0,1,0,0|1,0,1]=4 4933 B9R2.47 OCC1C[C@@H]2O[C@@H]2C1 Amb24423370 [1,0,0,1,0,0|1,0,1]=4 4934 B9R2.47 OC[C@@H]1C[C@@H]2O[C@@H]2C1 Amb25854390 [1,0,0,1,0,0|1,0,1]=4 4935 B9R2.61 OCC12CC(CN1)C2 Amb24409522 [1,0,0,1,0,0|1,0,1]=4 4936 B9R2.70 O=CC1CCC2CC21 Amb24616204 [1,0,0,1,0,0|2,0,0]=4 4937 B9R2.70 O=CC1OCC2OC12 Amb24722037 [1,0,0,1,0,0|1,0,0]=3 4938 B9R2.70 O=C[C@H]1OC[C@H]2O[C@@H]12 Amb25272531 [1,0,0,1,0,0|1,0,0]=3 4939 B9R2.70 OC[C@@H]1CC[C@@H]2O[C@@H]21 Amb25206596 [1,0,0,1,0,0|1,0,1]=4 4940 B9R2.70 OC[C@@H]1NC[C@@H]2C[C@@H]21 Amb23439459 [1,0,0,1,0,0|1,0,1]=4 4941 B9R2.70 OC[C@@H]1NC[C@H]2C[C@H]21 Amb25235945 [1,0,0,1,0,0|1,0,1]=4 4942 B9R2.70 OC[C@@H]1NC[C@H]2[C@@H]1C2 Amb13886216 [1,0,0,1,0,0|1,0,1]=4 4943 B9R2.70 OC[C@H]1NC[C@H]2C[C@H]21 Amb24519421 [1,0,0,1,0,0|1,0,1]=4 4944 B9R2.7 O=C1CC2CCCC12 Amb25106047 [1,0,0,1,0,0|2,0,0]=4 4945 B9R2.7 O=C1C[C@@H]2CCO[C@H]12 Amb22757944 [1,0,0,1,0,0|2,0,0]=4 4946 B9R2.7 O=C1NC2CCNC12 Amb24398777 [1,0,0,1,0,0|1,0,0]=3 4947 B9R2.7 O=C1N[C@@H]2CCC[C@H]12 Amb25278653 [1,0,0,1,0,0|2,0,0]=4 4948 B9R2.144 NC(=O)C12CC1CC2 Amb25678261 [1,0,0,1,0,0|2,0,0]=4 4949 B9R2.148 CC(=O)[C@@H]1[C@H]2CC[C@H]21 Amb24708035 [1,0,0,1,0,0|2,0,0]=4 4950 B9R2.148 OC(=O)C1C2CCC21 Amb24350799 [1,0,0,1,0,0|1,0,0]=3 4951 B9R2.148 OC(=O)[C@@H]1[C@@H]2CC[C@@H]21 Amb24568902 [1,0,0,1,0,0|1,0,0]=3 4952 B9R2.150 CC(=O)[C@@H]1C[C@@H]2C[C@@H]21 Amb25179150 [1,0,0,1,0,0|2,0,0]=4 4953 B9R2.150 OC(=O)C1CC2CC21 Amb25049722 [1,0,0,1,0,0|1,0,0]=3 4954 B9R2.150 OC(=O)C1NC2CC12 Amb25376606 [1,0,0,1,0,0|0,0,0]=2 4955 B9R2.19 O=C1C=C[C@H]2C[C@@H]1C2 Amb24691695 [0,0,0,1,1,0|2,0,0]=4 4956 B9R2.19 O=C1CCC2CC1C2 Amb22499413 [0,0,0,1,1,0|2,0,0]=4 4957 B9R2.19 O=C1CC[C@H]2C[C@@H]1C2 Amb25128839 [0,0,0,1,1,0|2,0,0]=4 4958 B9R2.19 O=C1NCC2CC1C2 Amb25221783 [0,0,0,1,1,0|2,0,0]=4 4959 B9R2.133 C[C@]12C[C@H](C1)C(=O)C2 Amb25271021 [0,0,0,1,1,0|2,0,0]=4 4960 B9R2.145 CC(=O)C12CC(C1)C2 Amb25093716 [0,0,0,1,1,0|2,0,0]=4 4961 B9R2.145 NC(=O)C12CC(C1)C2 Amb24058180 [0,0,0,1,1,0|2,0,0]=4 4962 B9R2.145 OC(=O)C12CC(C1)C2 Amb22493631 [0,0,0,1,1,0|1,0,0]=3 4963 B9R2.29 OC1CC2NC(=O)C21 Amb25272666 [0,0,0,1,1,0|2,0,0]=4 4964 B9R2.147 OC(=O)C1[C@@H]2C[C@H]1C2 Amb24409084 [0,0,0,1,1,0|2,0,0]=4 4965 B11R2.68 O=C1OC2CC1CCC2Cl Amb25185385 [0,0,0,1,0,1|2,0,0]=4 4966 B11R2.68 O=C1OC2CC1CCC2I Amb24375690 [0,0,0,1,0,1|2,0,0]=4 4967 B11R2.68 O=C1O[C@@H]2C[C@H]1CC[C@@H]2Br Amb24606112 [0,0,0,1,0,1|2,0,0]=4 4968 B11R2.68 O=C1O[C@@H]2C[C@H]1CC[C@@H]2Cl Amb24595263 [0,0,0,1,0,1|2,0,0]=4 4969 B11R2.68 O=C1O[C@H]2C[C@@H]1CC[C@@H]2Br Amb24519671 [0,0,0,1,0,1|2,0,0]=4 4970 B11R2.68 O[C@H]1CC[C@H]2C[C@@H]1OC2=O Amb25332134 [0,0,0,1,0,1|1,0,0]=3 4971 B11R2.696 OC12CC(=O)C(CC1)CC2 Amb24478327 [0,0,0,1,0,1|2,0,0]=4 4972 B11R2.821 OC(=O)C1CC[C@H]2C[C@@H]1C2 Amb24482502 [0,0,0,1,0,1|2,0,0]=4 4973 B11R2.839 CC(=O)C1CC2OC2CC1 Amb25146491 [0,0,0,1,0,1|2,0,0]=4 4974 B11R2.839 CC(=O)[C@@H]1C[C@@H]2O[C@@H]2CC1 Amb24612667 [0,0,0,1,0,1|2,0,0]=4 4975 B11R2.839 OC(=O)C1CC2OC2CC1 Amb22274789 [0,0,0,1,0,1|1,0,0]=3 4976 B11R2.839 OC(=O)C1CC2OC2CC1 Amb24671302 [0,0,0,1,0,1|1,0,0]=3 4977 B11R2.839 OC(=O)C1CC2OC2CN1 Amb25849260 [0,0,0,1,0,1|0,0,0]=2 4978 B11R2.839 OC(=O)C1CCC2CC2N1 Amb25342650 [0,0,0,1,0,1|1,0,0]=3 4979 B11R2.839 OC(=O)[C@@H]1C[C@@H]2C[C@@H]2CC1 Amb25174795 [0,0,0,1,0,1|2,0,0]=4 4980 B11R2.839 OC(=O)[C@H]1C[C@@H]2OC2CC1 Amb24514915 [0,0,0,1,0,1|1,0,0]=3 4981 B11R2.839 OC(=O)[C@H]1C[C@@H]2O[C@@H]2CC1 Amb25366365 [0,0,0,1,0,1|1,0,0]=3 4982 B11R2.1839 OC(=O)C12CCC(CC1)N2 Amb17719274 [0,0,0,1,0,1|2,0,0]=4 4983 B11R2.1839 OC(=O)C12CCC(CC1)O2 Amb23452647 [0,0,0,1,0,1|1,0,0]=3 4984 B11R2.1839 OC(=O)C12CCC(N1)CC2 Amb2372047 [0,0,0,1,0,1|2,0,0]=4 4985 B11R2.1839 OC(=O)C12CC[C@H](C1)NC2 Amb10610570 [0,0,0,1,0,1|2,0,0]=4 4986 B11R2.1839 OC(=O)C12CNC(C1)CC2 Amb25327811 [0,0,0,1,0,1|2,0,0]=4 4987 B11R2.1839 OC(=O)[C@@]12CC[C@@H](C1)CN2 Amb2372049 [0,0,0,1,0,1|1,0,0]=3 4988 B11R2.1839 OC(=O)[C@@]12CN[C@@H](C1)CC2 Amb24580488 [0,0,0,1,0,1|2,0,0]=4 4989 B11R2.1839 OC(=O)[C@@]12C[C@@H](CN1)CC2 Amb19148162 [0,0,0,1,0,1|1,0,0]=3 4990 B11R2.1839 OC(=O)[C@]12CC[C@H](C1)CN2 Amb2372048 [0,0,0,1,0,1|1,0,0]=3 4991 B11R2.1839 OC(=O)[C@]12CC[C@H](CC1)N2 Amb25146464 [0,0,0,1,0,1|2,0,0]=4 4992 B11R2.1839 OC(=O)[C@]12CN[C@H](C1)CC2 Amb24539198 [0,0,0,1,0,1|2,0,0]=4 4993 B11R2.1839 OC(=O)[C@]12C[C@H](CC1)CC2 Amb24621865 [0,0,0,1,0,1|2,0,0]=4 4994 B11R2.66 NC1CCC2CC(=O)OC21 Amb25725757 [0,0,0,1,0,1|2,0,0]=4 4995 B11R2.66 O=C1C[C@H]2CC[C@H](Cl)[C@H]2O1 Amb24666593 [0,0,0,1,0,1|2,0,0]=4 4996 B11R2.66 OC1CCC2OC(=O)CC21 Amb25056050 [0,0,0,1,0,1|2,0,0]=4 4997 B11R2.66 OC1CNC2CC(=O)OC21 Amb24374826 [0,0,0,1,0,1|0,0,0]=2 4998 B11R2.66 OC1COC2CC(=O)OC21 Amb24455262 [0,0,0,1,0,1|1,0,0]=3 4999 B11R2.66 OC1CSC2CC(=O)OC21 Amb25244158 [0,0,0,1,0,1|1,0,0]=3 5000 B11R2.66 OC1OCC2CC(=O)OC21 Amb25251382 [0,0,0,1,0,1|2,0,0]=4 5001 B11R2.66 OC1OCC2NC(=O)OC21 Amb25782532 [0,0,0,1,0,1|2,0,0]=4 5002 B11R2.66 OC1OC[C@@H]2CC(=O)O[C@@H]21 Amb24515188 [0,0,0,1,0,1|2,0,0]=4 5003 B11R2.66 O[C@@H]1CO[C@@H]2CC(=O)O[C@@H]21 Amb25176409 [0,0,0,1,0,1|1,0,0]=3 5004 B11R2.66 O[C@H]1C=C[C@@H]2NC(=O)O[C@@H]21 Amb25269985 [0,0,0,1,0,1|1,0,1]=4 5005 B11R2.66 O[C@H]1CC[C@H]2CC(=O)C[C@H]21 Amb25205645 [0,0,0,1,0,1|2,0,0]=4 5006 B11R2.66 O[C@H]1CC[C@H]2OC(=O)C[C@H]21 Amb25284405 [0,0,0,1,0,1|2,0,0]=4 5007 B11R2.139 OC1CC2CC(=O)CC2C1 Amb24477445 [0,0,0,1,0,1|2,0,0]=4 5008 B11R2.139 OC1C[C@@H]2CC(=O)C[C@@H]2C1 Amb25318974 [0,0,0,1,0,1|2,0,0]=4 5009 B11R2.139 O[C@@H]1C[C@@H]2CC(=O)C[C@@H]2C1 Amb24654615 [0,0,0,1,0,1|2,0,0]=4 5010 B11R2.139 O[C@@H]1C[C@@H]2CC(=O)O[C@@H]2C1 Amb22801805 [0,0,0,1,0,1|1,0,0]=3 5011 B11R2.139 O[C@@H]1C[C@H]2CC(=O)C[C@H]2C1 Amb24408293 [0,0,0,1,0,1|2,0,0]=4 5012 B11R2.139 O[C@@H]1C[C@H]2CC(=O)O[C@H]2C1 Amb24563936 [0,0,0,1,0,1|1,0,0]=3 5013 B11R2.359 O=C1CC2NCC(CO1)O2 Amb24381410 [0,0,0,1,0,1|2,0,0]=4 5014 B11R2.434 OC1CC2CC(=O)CC1N2 Amb24563981 [0,0,0,1,0,1|1,0,0]=3 5015 B11R2.434 OC1CC2CC(=O)CC1O2 Amb24478252 [0,0,0,1,0,1|2,0,0]=4 5016 B11R2.434 O[C@@H]1C[C@@H]2C[C@H]1CC(=O)O2 Amb25225944 [0,0,0,1,0,1|2,0,0]=4 5017 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 5018 B11R2.434 O[C@@H]1C[C@H]2CC(=O)C[C@@H]1N2 Amb24621884 [0,0,0,1,0,1|1,0,0]=3 5019 B11R2.434 O[C@H]1C[C@@H]2N[C@@H](C1)C[C@H]2O Amb24548394 [0,0,0,1,0,1|1,0,1]=4 5020 B11R2.530 OC1CCC2C1C2C(O)=O Amb25378714 [0,0,0,1,0,1|1,0,0]=3 5021 B11R2.845 OC(=O)C1=CC2CC1CC2 Amb17593494 [0,0,0,1,0,1|2,0,0]=4 5022 B11R2.845 OC(=O)C1C[C@@H]2C[C@H]1CC2 Amb24598959 [0,0,0,1,0,1|2,0,0]=4 5023 B11R2.845 OC(=O)[C@@H]1CC2CC1CC2 Amb24745677 [0,0,0,1,0,1|2,0,0]=4 5024 B11R2.845 OC(=O)[C@@H]1C[C@@H]2C[C@@H]1CC2 Amb24599985 [0,0,0,1,0,1|2,0,0]=4 5025 B11R2.845 OC(=O)[C@@H]1C[C@@H]2C[C@H]1CC2 Amb24630346 [0,0,0,1,0,1|2,0,0]=4 5026 B11R2.845 OC(=O)[C@@H]1C[C@H]2CC1CC2 Amb24615765 [0,0,0,1,0,1|2,0,0]=4 5027 B11R2.845 OC(=O)[C@@H]1C[C@H]2C[C@H]1CC2 Amb25175105 [0,0,0,1,0,1|2,0,0]=4 5028 B11R2.845 OC(=O)[C@@H]1N[C@@H]2C[C@@H]1CC2 Amb22745380 [0,0,0,1,0,1|2,0,0]=4 5029 B11R2.845 OC(=O)[C@@H]1N[C@@H]2C[C@H]1CC2 Amb18180724 [0,0,0,1,0,1|2,0,0]=4 5030 B11R2.845 OC(=O)[C@@H]1N[C@@H]2C[C@H]1CC2 Amb22748360 [0,0,0,1,0,1|2,0,0]=4 5031 B11R2.845 OC(=O)[C@@H]1N[C@H]2C[C@@H]1CC2 Amb24560741 [0,0,0,1,0,1|2,0,0]=4 5032 B11R2.845 OC(=O)[C@H]1C[C@@H]2C[C@@H]1CC2 Amb24615645 [0,0,0,1,0,1|2,0,0]=4 5033 B11R2.845 OC(=O)[C@H]1C[C@@H]2C[C@H]1CC2 Amb24548859 [0,0,0,1,0,1|2,0,0]=4 5034 B11R2.845 OC(=O)[C@H]1C[C@H]2C[C@H]1CC2 Amb25175104 [0,0,0,1,0,1|2,0,0]=4 5035 B11R2.845 OC(=O)[C@H]1N[C@@H]2CC[C@H]1C2 Amb17913041 [0,0,0,1,0,1|2,0,0]=4 5036 B11R2.845 OC(=O)[C@H]1N[C@H]2C[C@@H]1CC2 Amb2371885 [0,0,0,1,0,1|2,0,0]=4 5037 B11R2.857 OC(=O)CC12CC(CN1)C2 Amb24615640 [0,0,0,1,0,1|1,0,0]=3 5038 B11R2.932 CC(=O)CC1CCC2OC12 Amb24357264 [0,0,0,1,0,1|2,0,0]=4 5039 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 5040 B11R2.932 OC(=O)CC1CCC2CC21 Amb25766461 [0,0,0,1,0,1|2,0,0]=4 5041 B11R2.932 OC(=O)CC1NCC2CC21 Amb18831755 [0,0,0,1,0,1|1,0,0]=3 5042 B11R2.47 NC1CC2C=CC1OC2=O Amb24623832 [0,0,0,1,0,1|2,0,0]=4 5043 B11R2.47 N[C@H]1C[C@H]2C=C[C@@H]1OC2=O Amb25326645 [0,0,0,1,0,1|2,0,0]=4 5044 B11R2.47 O=C1O[C@H]2CC[C@@H]1C[C@@H]2Cl Amb24558189 [0,0,0,1,0,1|2,0,0]=4 5045 B11R2.47 OC1CC2CCC1CC2=O Amb25066452 [0,0,0,1,0,1|2,0,0]=4 5046 B11R2.47 OC1CC2CCC1OC2=O Amb25128536 [0,0,0,1,0,1|1,0,0]=3 5047 B11R2.47 O[C@@H]1C[C@@H]2C=C[C@H]1CC2=O Amb24723975 [0,0,0,1,0,1|2,0,0]=4 5048 B11R2.47 O[C@@H]1C[C@@H]2CC[C@H]1CC2=O Amb24590985 [0,0,0,1,0,1|2,0,0]=4 5049 B11R2.47 O[C@H]1CC2CCC1CC2=O Amb24524636 [0,0,0,1,0,1|2,0,0]=4 5050 B11R2.104 O=C1OC2C(Br)CC=CC12 Amb25044293 [0,0,0,1,0,1|2,0,0]=4 5051 B11R2.104 O=C1O[C@@H]2[C@@H](Br)CC=C[C@H]12 Amb25324957 [0,0,0,1,0,1|2,0,0]=4 5052 B11R2.104 O=C1O[C@H]2[C@H](Br)CC=C[C@@H]12 Amb25237572 [0,0,0,1,0,1|2,0,0]=4 5053 B11R2.357 O=C1NCC2CNCC1C2 Amb25069767 [0,0,0,1,0,1|2,0,0]=4 5054 B11R2.587 NC1C2C1CCC2C(O)=O Amb24716006 [0,0,0,1,0,1|2,0,0]=4 5055 B11R2.846 OC(=O)C1CC2CC(C1)C2 Amb25809306 [0,0,0,1,0,1|2,0,0]=4 5056 B11R2.1826 OC(=O)C12CC(C1)CCC2 Amb25261064 [0,0,0,1,0,1|2,0,0]=4 5057 B11R2.1826 OC(=O)C12CC(C1)CCN2 Amb24479083 [0,0,0,1,0,1|1,0,0]=3 5058 B11R2.1837 OC(=O)C1NCCC2CC21 Amb24758905 [0,0,0,1,0,1|1,0,0]=3 5059 B11R2.1837 OC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21 Amb24580476 [0,0,0,1,0,1|2,0,0]=4 5060 B11R2.60 C=C1CO[C@@H]2[C@H](O)CO[C@H]12 Amb25224389 [0,1,0,1,0,0|2,0,0]=4 5061 B11R2.60 OC1CCC2C1C=CC2=O Amb24690759 [0,1,0,1,0,0|2,0,0]=4 5062 B11R2.60 OC1CCC2C1CNC2=O Amb25241642 [0,1,0,1,0,0|2,0,0]=4 5063 B11R2.60 OC1CC[C@@H]2[C@H]1COC2=O Amb25215160 [0,1,0,1,0,0|1,0,0]=3 5064 B11R2.60 OC1COC2C1OCC2=O Amb24723987 [0,1,0,1,0,0|1,0,0]=3 5065 B11R2.60 O[C@@H]1CC[C@H]2[C@@H]1CCC2=O Amb25264584 [0,1,0,1,0,0|2,0,0]=4 5066 B11R2.60 O[C@H]1C=C[C@@H]2[C@H]1COC2=O Amb24520419 [0,1,0,1,0,0|1,0,1]=4 5067 B11R2.60 O[C@H]1CO[C@H]2[C@@H]1OCC2=O Amb24533352 [0,1,0,1,0,0|1,0,0]=3 5068 B11R2.130 O=C1C2CC(CC2)OC1=O Amb25146827 [0,1,0,1,0,0|1,0,1]=4 5069 B11R2.130 OC1=CC2CCC(C2)C1=O Amb24553636 [0,1,0,1,0,0|2,0,0]=4 5070 B11R2.130 OC1C2CC(CC2)OC1=O Amb25333566 [0,1,0,1,0,0|1,0,1]=4 5071 B11R2.130 OC1CC2CC(CC2)C1=O Amb25371743 [0,1,0,1,0,0|2,0,0]=4 5072 B11R2.162 OCC1CC2CC1NC2=O Amb24478286 [0,1,0,1,0,0|2,0,0]=4 5073 B11R2.162 OC[C@@H]1C[C@@H]2C[C@H]1NC2=O Amb24579560 [0,1,0,1,0,0|2,0,0]=4 5074 B11R2.162 OC[C@H]1C[C@@H]2C[C@H]1CC2=O Amb25373194 [0,1,0,1,0,0|2,0,0]=4 5075 B11R2.266 O=CC1=COC2CC1CC2 Amb18643242 [0,1,0,1,0,0|2,0,0]=4 5076 B11R2.410 CN1C2CC(O)CC2C1=O Amb25185263 [0,1,0,1,0,0|2,0,0]=4 5077 B11R2.410 CN1[C@H]2C[C@H](O)C[C@H]2C1=O Amb25271523 [0,1,0,1,0,0|2,0,0]=4 5078 B11R2.738 OC1C(Cl)C2OC1CC2=O Amb24358109 [0,1,0,1,0,0|2,0,0]=4 5079 B11R2.738 OC1C2CC(C1O)C(=O)N2 Amb25229024 [0,1,0,1,0,0|2,0,0]=4 5080 B11R2.738 OC1C2CC(CC2=O)C1O Amb25371818 [0,1,0,1,0,0|2,0,0]=4 5081 B11R2.738 OC1[C@@H](Cl)[C@@H]2O[C@H]1CC2=O Amb25173071 [0,1,0,1,0,0|2,0,0]=4 5082 B11R2.738 O[C@H]1[C@@H]2CC(=O)[C@@H](O2)[C@H]1O Amb24752256 [0,1,0,1,0,0|2,0,0]=4 5083 B11R2.738 O[C@H]1[C@H]2C[C@@H]([C@H]1O)C(=O)N2 Amb24669283 [0,1,0,1,0,0|2,0,0]=4 5084 B11R2.901 CNC(=O)C12CC(CN1)C2 Amb25319120 [0,1,0,1,0,0|2,0,0]=4 5085 B11R2.901 COC(=O)C12CC(CN1)C2 Amb24181912 [0,1,0,1,0,0|1,0,0]=3 5086 B11R2.911 CNC(=O)[C@H]1NC[C@H]2C[C@H]21 Amb25174787 [0,1,0,1,0,0|2,0,0]=4 5087 B11R2.911 COC(=O)C1NCC2CC21 Amb18831779 [0,1,0,1,0,0|1,0,0]=3 5088 B11R2.911 COC(=O)[C@@H]1NC[C@@H]2C[C@@H]21 Amb24183544 [0,1,0,1,0,0|1,0,0]=3 5089 B11R2.911 COC(=O)[C@@H]1NC[C@H]2C[C@H]21 Amb24183490 [0,1,0,1,0,0|1,0,0]=3 5090 B11R2.911 COC(=O)[C@H]1NC[C@@H]2CC21 Amb24760789 [0,1,0,1,0,0|1,0,0]=3 5091 B11R2.911 COC(=O)[C@H]1NC[C@@H]2C[C@@H]21 Amb25707726 [0,1,0,1,0,0|1,0,0]=3 5092 B11R2.911 COC(=O)[C@H]1NC[C@H]2C[C@H]21 Amb24514930 [0,1,0,1,0,0|1,0,0]=3 5093 B11R2.914 COC(=O)C1CC2CC2N1 Amb18831759 [0,1,0,1,0,0|1,0,0]=3 5094 B11R2.914 COC(=O)C1CC2OC2C1 Amb18633179 [0,1,0,1,0,0|1,0,0]=3 5095 B11R2.914 COC(=O)C1C[C@@H]2O[C@H]2C1 Amb22756936 [0,1,0,1,0,0|1,0,0]=3 5096 B11R2.914 COC(=O)N1CC2OC2C1 Amb25844558 [0,1,0,1,0,0|2,0,0]=4 5097 B11R2.914 COC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb24544766 [0,1,0,1,0,0|1,0,0]=3 5098 B11R2.914 COC(=O)[C@@H]1C[C@H]2O[C@H]2C1 Amb22756937 [0,1,0,1,0,0|1,0,0]=3 5099 B11R2.201 O=C1OC(=O)C2CC1CC2 Amb2221144 [0,1,0,1,0,0|1,0,1]=4 5100 B11R2.201 O=C1OC(=O)[C@@H]2C[C@H]1CC2 Amb25275974 [0,1,0,1,0,0|1,0,1]=4 5101 B11R2.201 OC1=CC(=O)C2CC1CC2 Amb25707477 [0,1,0,1,0,0|2,0,0]=4 5102 B11R2.221 COC12CC(CC1)C(=O)C2 Amb25849640 [0,1,0,1,0,0|2,0,0]=4 5103 B11R2.822 OC(=O)C1OCC2CCC21 Amb24523153 [0,1,0,1,0,0|2,0,0]=4 5104 B11R2.822 OC(=O)[C@@H]1OC[C@H]2CC[C@H]21 Amb25209300 [0,1,0,1,0,0|2,0,0]=4 5105 B11R2.842 OC(=O)C1CC2CCC2C1 Amb25256091 [0,1,0,1,0,0|2,0,0]=4 5106 B11R2.842 OC(=O)C1C[C@@H]2CC[C@@H]2C1 Amb24460735 [0,1,0,1,0,0|2,0,0]=4 5107 B11R2.842 OC(=O)[C@@H]1C[C@@H]2CC[C@@H]2C1 Amb24446426 [0,1,0,1,0,0|2,0,0]=4 5108 B11R2.842 OC(=O)[C@@H]1C[C@H]2CC[C@H]2C1 Amb24472881 [0,1,0,1,0,0|2,0,0]=4 5109 B11R2.1151 N#C[C@]12C[C@]1(CC2)C(O)=O Amb24597312 [0,1,0,1,0,0|2,0,0]=4 5110 B11R2.1868 OC(=O)[C@@H]1CC2(CN1)CC2 Amb24462994 [0,1,0,1,0,0|1,0,0]=3 5111 B11R2.1868 OC(=O)[C@@H]1CC2(CN1)N=N2 Amb25707442 [0,1,0,1,0,0|1,0,0]=3 5112 B11R2.684 C[C@@]1(O)C[C@H]2C[C@@H]1CC2=O Amb24753035 [0,1,0,1,0,0|2,0,0]=4 5113 B11R2.684 C[C@]1(O)C[C@H]2C[C@@H]1CC2=O Amb25262736 [0,1,0,1,0,0|2,0,0]=4 5114 B11R2.684 C[C@]1(O)C[C@H]2C[C@H]1CC2=O Amb25202693 [0,1,0,1,0,0|2,0,0]=4 5115 B11R2.682 CC12CC(CC1O)C(=O)C2 Amb25714006 [0,1,0,1,0,0|2,0,0]=4 5116 B11R2.785 OC1CC2C(CC2=O)C1Br Amb24383083 [0,1,0,1,0,0|2,0,0]=4 5117 B11R2.785 OC1CC2C(CC2=O)C1Cl Amb25686014 [0,1,0,1,0,0|2,0,0]=4 5118 B11R2.785 OC1CC2C(CC2=O)C1O Amb25053122 [0,1,0,1,0,0|2,0,0]=4 5119 B11R2.785 O[C@@H]1CC2C(CC2=O)C1Br Amb24666673 [0,1,0,1,0,0|2,0,0]=4 5120 B11R2.608 CN1C2CC2CC1C(O)=O Amb18831778 [0,1,0,1,0,0|1,0,0]=3 5121 B11R2.730 CN1CC2CC2C1C(O)=O Amb18831780 [0,1,0,1,0,0|1,0,0]=3 5122 B11R2.783 OC1SC2C(O)C1OC2=O Amb24445543 [0,1,0,1,0,0|2,0,0]=4 5123 B11R2.63 O=C1OCC2CCC1C2Br Amb25759019 [0,1,0,1,0,0|2,0,0]=4 5124 B11R2.63 O=C1OCC2CCC1C2Cl Amb25061376 [0,1,0,1,0,0|2,0,0]=4 5125 B11R2.716 OC1CC2CC(=O)C2C1Br Amb24453837 [0,1,0,1,0,0|2,0,0]=4 5126 B11R2.2454 CC12CC(CC1)(C2)C(O)=O Amb25305546 [0,1,0,1,0,0|2,0,0]=4 5127 B11R2.2454 OC(=O)C12NCC(C1)(C2)F Amb10610659 [0,1,0,1,0,0|1,0,0]=3 5128 B11R2.820 NC1(CC2CC1C2)C(O)=O Amb25362310 [0,1,0,1,0,0|2,0,0]=4 5129 B11R2.820 OC(=O)C1(O)CC2CC1C2 Amb25241628 [0,1,0,1,0,0|2,0,0]=4 5130 B11R2.849 NC1(CCC2CC12)C(O)=O Amb19148505 [0,1,0,1,0,0|2,0,0]=4 5131 B11R2.849 OC(=O)C1(O)CCC2CC12 Amb25314065 [0,1,0,1,0,0|2,0,0]=4 5132 B11R2.1850 NC1(CC2OC2C1)C(O)=O Amb25672225 [0,1,0,1,0,0|1,0,0]=3 5133 B11R3.19 O=C1CC2CC1C3OC23 Amb25713026 [0,0,0,2,0,0|2,0,0]=4 5134 B11R3.19 O=C1CC2OC1C3OC32 Amb25319921 [0,0,0,2,0,0|2,0,0]=4 5135 B11R3.19 O=C1C[C@@H]2CC1[C@H]3O[C@@H]23 Amb24627516 [0,0,0,2,0,0|2,0,0]=4 5136 B11R3.19 O=C1C[C@@H]2O[C@H]1C3OC32 Amb24578289 [0,0,0,2,0,0|2,0,0]=4 5137 B11R3.19 O=C1C[C@H]2C[C@@H]1[C@@H]3O[C@H]23 Amb24512695 [0,0,0,2,0,0|2,0,0]=4 5138 B11R3.19 O=C1C[C@H]2O[C@@H]1[C@@H]3O[C@@H]32 Amb24610199 [0,0,0,2,0,0|2,0,0]=4 5139 B11R3.19 O=C1NC2CC1C3OC32 Amb24595881 [0,0,0,2,0,0|2,0,0]=4 5140 B11R3.19 O=C1N[C@@H]2C[C@H]1[C@H]3O[C@H]32 Amb25367320 [0,0,0,2,0,0|2,0,0]=4 5141 B11R3.19 O=C1N[C@H]2C[C@@H]1[C@@H]3O[C@@H]32 Amb25244126 [0,0,0,2,0,0|2,0,0]=4 5142 B11R3.30 O=C1CC2C3OC3CC12 Amb24645847 [0,0,0,2,0,0|2,0,0]=4 5143 B11R3.30 O=C1C[C@@H]2[C@@H]3O[C@@H]3C[C@H]12 Amb25327905 [0,0,0,2,0,0|2,0,0]=4 5144 B11R3.30 O=C1N[C@H]2[C@@H]1C[C@H]3O[C@@H]23 Amb24553940 [0,0,0,2,0,0|2,0,0]=4 5145 B11R3.130 O=C1C2OC3CC1CC32 Amb24582918 [0,0,0,2,0,0|2,0,0]=4 5146 B7R0.16 CC(=C)C(N)C(O)=O Amb18641831 [0,0,1,0,1,0|1,0,1]=4 5147 B7R0.16 CC(=O)C(N)C(O)=O Amb21962887 [0,0,1,0,1,0|0,0,2]=4 5148 B7R0.16 CC(Br)C(N)C(O)=O Amb25775046 [0,0,1,0,1,0|1,0,0]=3 5149 B7R0.16 CC(C(=O)O)C(C)C Amb17087469 [0,0,1,0,1,0|2,0,0]=4 5150 B7R0.16 CC(C(C(=O)C)C)O Amb17593202 [0,0,1,0,1,0|2,0,0]=4 5151 B7R0.16 CC(C(C(=O)O)Br)O Amb17594710 [0,0,1,0,1,0|1,0,0]=3 5152 B7R0.16 CC(C(C(=O)O)C)O Amb17615515 [0,0,1,0,1,0|1,0,0]=3 5153 B7R0.16 CC(C(C(=O)O)Cl)O Amb17593522 [0,0,1,0,1,0|1,0,0]=3 5154 B7R0.16 CC(C(C(=O)O)N)F Amb10838661 [0,0,1,0,1,0|1,0,0]=3 5155 B7R0.16 CC(C(C(=O)O)N)S Amb17593434 [0,0,1,0,1,0|0,1,0]=3 5156 B7R0.16 CC(C(C)Br)C(O)=O Amb25111271 [0,0,1,0,1,0|2,0,0]=4 5157 B7R0.16 CC(C(C)N)C(O)=O Amb18124261 [0,0,1,0,1,0|2,0,0]=4 5158 B7R0.16 CC(C(C)O)C(N)=O Amb24481579 [0,0,1,0,1,0|2,0,0]=4 5159 B7R0.16 CC(C(C)S)C(O)=O Amb25842057 [0,0,1,0,1,0|1,1,0]=4 5160 B7R0.16 CC(C(O)=O)N(C)O Amb24714002 [0,0,1,0,1,0|2,0,0]=4 5161 B7R0.16 CC(C)C(F)C(O)=O Amb19957386 [0,0,1,0,1,0|2,0,0]=4 5162 B7R0.16 CC(C)C(N)C(=O)S Amb25064101 [0,0,1,0,1,0|1,1,0]=4 5163 B7R0.16 CC(C)C(N)C(C)=O Amb23536905 [0,0,1,0,1,0|2,0,0]=4 5164 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [0,0,1,0,1,0|2,0,0]=4 5165 B7R0.16 CC(C)C(N)[13C](O)=O Amb22338653 [0,0,1,0,1,0|1,0,0]=3 5166 B7R0.16 CC(C)C(S)C(O)=O Amb18282761 [0,0,1,0,1,0|2,0,0]=4 5167 B7R0.16 CC(C)C([15NH2])C(O)=O Amb22363191 [0,0,1,0,1,0|1,0,0]=3 5168 B7R0.16 CC(C)[13CH](N)C(O)=O Amb22367349 [0,0,1,0,1,0|1,0,0]=3 5169 B7R0.16 CC(C)[C@@H](Cl)C(O)=O Amb22353101 [0,0,1,0,1,0|2,0,0]=4 5170 B7R0.16 CC(C)[C@@H](F)C(O)=O Amb25083215 [0,0,1,0,1,0|2,0,0]=4 5171 B7R0.16 CC(C)[C@@H](N)C(C)=O Amb25757023 [0,0,1,0,1,0|2,0,0]=4 5172 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [0,0,1,0,1,0|2,0,0]=4 5173 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [0,0,1,0,1,0|2,0,0]=4 5174 B7R0.16 CC(C)[C@@H](N)C(O)=O Amb22746777 [0,0,1,0,1,0|1,0,0]=3 5175 B7R0.16 CC(C)[C@@H](S)C(O)=O Amb25320674 [0,0,1,0,1,0|2,0,0]=4 5176 B7R0.16 CC(C)[C@H](N)C(=O)Cl Amb25679283 [0,0,1,0,1,0|2,0,0]=4 5177 B7R0.16 CC(C)[C@H](N)C(=O)S Amb24427323 [0,0,1,0,1,0|1,1,0]=4 5178 B7R0.16 CC(C)[C@H](N)C(O)=O Amb22351111 [0,0,1,0,1,0|1,0,0]=3 5179 B7R0.16 CC(C)[C@H](N)[13C](O)=O Amb22354046 [0,0,1,0,1,0|1,0,0]=3 5180 B7R0.16 CC(C)[C@H](S)C(O)=O Amb25662094 [0,0,1,0,1,0|2,0,0]=4 5181 B7R0.16 CC(Cl)C(N)C(O)=O Amb25269614 [0,0,1,0,1,0|1,0,0]=3 5182 B7R0.16 CC(Cl)C(O)C(O)=O Amb25222028 [0,0,1,0,1,0|2,0,0]=4 5183 B7R0.16 CC(F)C(Br)C(O)=O Amb25304346 [0,0,1,0,1,0|2,0,0]=4 5184 B7R0.16 CC(F)C(F)C(O)=O Amb24687273 [0,0,1,0,1,0|2,0,0]=4 5185 B7R0.16 CC(F)C(O)C(O)=O Amb24385715 [0,0,1,0,1,0|2,0,0]=4 5186 B7R0.16 CC(N)C(N)C(O)=O Amb17678795 [0,0,1,0,1,0|1,0,0]=3 5187 B7R0.16 CC(N)C(N)C(O)=O Amb22728051 [0,0,1,0,1,0|1,0,0]=3 5188 B7R0.16 CC(N)C(O)C(O)=O Amb18641970 [0,0,1,0,1,0|2,0,0]=4 5189 B7R0.16 CC(N)[C@H](N)C(O)=O Amb25083113 [0,0,1,0,1,0|1,0,0]=3 5190 B7R0.16 CC(O)C(=O)C(O)=O Amb24481396 [0,0,1,0,1,0|1,0,1]=4 5191 B7R0.16 CC(O)C(N)C(C)=O Amb25026434 [0,0,1,0,1,0|1,0,0]=3 5192 B7R0.16 CC(O)C(N)C(C)O Amb24374632 [0,0,1,0,1,0|1,0,1]=4 5193 B7R0.16 CC(O)C(N)C(N)=O Amb18641954 [0,0,1,0,1,0|1,0,0]=3 5194 B7R0.16 CC(O)C(N)P(O)=O Amb24428649 [0,0,1,0,1,0|1,0,0]=3 5195 B7R0.16 CC(O)C(N)P(O)O Amb25305040 [0,0,1,0,1,0|1,0,1]=4 5196 B7R0.16 CC(O)C(O)C(O)=O Amb18124272 [0,0,1,0,1,0|1,0,0]=3 5197 B7R0.16 CC(O)N(C)C(O)=O Amb22641864 [0,0,1,0,1,0|2,0,0]=4 5198 B7R0.16 CC(O)[C@@H](C)C(O)=O Amb25857406 [0,0,1,0,1,0|1,0,0]=3 5199 B7R0.16 CC(S)[C@@H](N)C(O)=O Amb24606864 [0,0,1,0,1,0|0,1,0]=3 5200 B7R0.16 CC(S)[C@H](N)C(O)=O Amb25684204 [0,0,1,0,1,0|0,1,0]=3 5201 B7R0.16 CC([C@@H](C)N)C(O)=O Amb24680995 [0,0,1,0,1,0|2,0,0]=4 5202 B7R0.16 CN(C)C(N)C(O)=O Amb24746695 [0,0,1,0,1,0|2,0,0]=4 5203 B7R0.16 C[C@@H](C(=O)O)C(C)C Amb10844600 [0,0,1,0,1,0|2,0,0]=4 5204 B7R0.16 C[C@@H](Cl)[C@@H](Br)C(O)=O Amb24526448 [0,0,1,0,1,0|2,0,0]=4 5205 B7R0.16 C[C@@H](Cl)[C@@H](O)C(O)=O Amb24445574 [0,0,1,0,1,0|2,0,0]=4 5206 B7R0.16 C[C@@H](F)[C@H](N)C(O)=O Amb25789807 [0,0,1,0,1,0|1,0,0]=3 5207 B7R0.16 C[C@@H](N)[C@@H](N)C(O)=O Amb22745396 [0,0,1,0,1,0|1,0,0]=3 5208 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb22745441 [0,0,1,0,1,0|1,0,0]=3 5209 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb24481409 [0,0,1,0,1,0|1,0,0]=3 5210 B7R0.16 C[C@@H](O)C(C)C(O)=O Amb24469914 [0,0,1,0,1,0|1,0,0]=3 5211 B7R0.16 C[C@@H](O)C(N)C(C)O Amb24394814 [0,0,1,0,1,0|1,0,1]=4 5212 B7R0.16 C[C@@H](O)[13C@H](N)[13C](O)=O Amb22336905 [0,0,1,0,1,0|0,0,0]=2 5213 B7R0.16 C[C@@H](O)[C@@H](C)C(O)=O Amb24481394 [0,0,1,0,1,0|1,0,0]=3 5214 B7R0.16 C[C@@H](O)[C@@H](N)C(C)=O Amb25238428 [0,0,1,0,1,0|1,0,0]=3 5215 B7R0.16 C[C@@H](O)[C@@H](O)C(C)=O Amb24701454 [0,0,1,0,1,0|2,0,0]=4 5216 B7R0.16 C[C@@H](O)[C@H](F)C(O)=O Amb24470562 [0,0,1,0,1,0|1,0,0]=3 5217 B7R0.16 C[C@@H](O)[C@H](N)C(C)O Amb25141789 [0,0,1,0,1,0|1,0,1]=4 5218 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O Amb17942942 [0,0,1,0,1,0|1,0,0]=3 5219 B7R0.16 C[C@@H](O)[C@H](N)C(O)=O Amb22351168 [0,0,1,0,1,0|0,0,0]=2 5220 B7R0.16 C[C@@H](O)[C@H](O)C(C)=O Amb24481484 [0,0,1,0,1,0|2,0,0]=4 5221 B7R0.16 C[C@@H](O)[C@H]([15NH2])C(O)=O Amb22353591 [0,0,1,0,1,0|0,0,0]=2 5222 B7R0.16 C[C@@H](S)[C@@H](N)C(O)=O Amb24333717 [0,0,1,0,1,0|0,1,0]=3 5223 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24117242 [0,0,1,0,1,0|0,1,0]=3 5224 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24726915 [0,0,1,0,1,0|0,1,0]=3 5225 B7R0.16 C[C@@H]([C@@H](C)N)C(O)=O Amb24410324 [0,0,1,0,1,0|2,0,0]=4 5226 B7R0.16 C[C@@H]([C@H](C(=O)O)C)O Amb10844569 [0,0,1,0,1,0|1,0,0]=3 5227 B7R0.16 C[C@H](Br)[C@H](N)C(O)=O Amb24711401 [0,0,1,0,1,0|1,0,0]=3 5228 B7R0.16 C[C@H](C(=O)O)C(C)C Amb10844601 [0,0,1,0,1,0|2,0,0]=4 5229 B7R0.16 C[C@H](F)[C@H](N)C(O)=O Amb25805291 [0,0,1,0,1,0|1,0,0]=3 5230 B7R0.16 C[C@H](N)C(O)C(O)=O Amb24649032 [0,0,1,0,1,0|2,0,0]=4 5231 B7R0.16 C[C@H](N)[C@@H](F)C(O)=O Amb25293984 [0,0,1,0,1,0|2,0,0]=4 5232 B7R0.16 C[C@H](N)[C@@H](N)C(O)=O Amb17678796 [0,0,1,0,1,0|1,0,0]=3 5233 B7R0.16 C[C@H](N)[C@H](N)C(O)=O Amb17678797 [0,0,1,0,1,0|1,0,0]=3 5234 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb19929490 [0,0,1,0,1,0|2,0,0]=4 5235 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb24407396 [0,0,1,0,1,0|2,0,0]=4 5236 B7R0.16 C[C@H](O)C(N)C(O)=O Amb24377632 [0,0,1,0,1,0|0,0,0]=2 5237 B7R0.16 C[C@H](O)[C@@H](O)C(O)=O Amb25844932 [0,0,1,0,1,0|1,0,0]=3 5238 B7R0.16 C[C@H](O)[C@H](N)C(N)=O Amb25746274 [0,0,1,0,1,0|1,0,0]=3 5239 B7R0.16 C[C@H](S)[C@H](N)C(O)=O Amb25131648 [0,0,1,0,1,0|0,1,0]=3 5240 B7R0.16 C[C@H]([C@@H](C(=O)N)N)O Amb16183845 [0,0,1,0,1,0|1,0,0]=3 5241 B7R0.16 C[C@H]([C@@H](C(=O)O)C)O Amb10844572 [0,0,1,0,1,0|1,0,0]=3 5242 B7R0.16 C[C@H]([C@@H](C)N)C(O)=O Amb25679842 [0,0,1,0,1,0|2,0,0]=4 5243 B7R0.16 C[C@H]([C@@H](C)O)C(C)=O Amb25144117 [0,0,1,0,1,0|2,0,0]=4 5244 B7R0.16 C[C@H]([C@@H]([13C](=O)O)N)O Amb17620634 [0,0,1,0,1,0|0,0,0]=2 5245 B7R0.16 C[C@H]([C@H](C)S)C(O)=O Amb24481380 [0,0,1,0,1,0|1,1,0]=4 5246 B7R0.16 C\C(\O)=C(\N)/C(O)=O Amb25320750 [0,0,1,0,1,0|0,0,2]=4 5247 B7R0.16 Cl[C@H](C(=O)O)C(C)C Amb16232072 [0,0,1,0,1,0|2,0,0]=4 5248 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,0,1,0,1,0|1,0,1]=4 5249 B7R0.16 NC(C(Cl)Cl)C(O)=O Amb24433439 [0,0,1,0,1,0|2,0,0]=4 5250 B7R0.16 NC(C(F)F)C(O)=O Amb24713127 [0,0,1,0,1,0|2,0,0]=4 5251 B7R0.16 NC(C(O)=O)S(O)=O Amb24464759 [0,0,1,0,1,0|2,0,0]=4 5252 B7R0.16 NC(C(O)O)C(O)=O Amb25682498 [0,0,1,0,1,0|1,0,0]=3 5253 B7R0.16 N[C@@H](C(Cl)Cl)C(O)=O Amb25101008 [0,0,1,0,1,0|2,0,0]=4 5254 B7R0.16 N[C@@H](C(F)F)C(O)=O Amb24433723 [0,0,1,0,1,0|2,0,0]=4 5255 B7R0.16 N[C@H](C(=O)N)C(C)C Amb16183986 [0,0,1,0,1,0|2,0,0]=4 5256 B7R0.16 N[C@H](C(=O)N)C(C)C Amb16231400 [0,0,1,0,1,0|2,0,0]=4 5257 B7R0.16 N[C@H](C(F)F)C(O)=O Amb24659125 [0,0,1,0,1,0|2,0,0]=4 5258 B7R0.16 OC(C(=O)O)C(C)C Amb2582547 [0,0,1,0,1,0|2,0,0]=4 5259 B7R0.16 O[C@@H](C(=O)O)C(C)C Amb10071589 [0,0,1,0,1,0|2,0,0]=4 5260 B7R0.16 [13CH3][13C@@H](O)[13C@H]([15NH2])[13C](O)=O Amb22353590 [0,0,1,0,1,0|0,0,0]=2 5261 B7R0.16 [13CH3][13CH]([13CH3])[13C@H]([15NH2])[13C](O)=O Amb22338876 [0,0,1,0,1,0|1,0,0]=3 5262 B7R0.16 [14CH3][14CH](O)[14CH](N)[14C](O)=O Amb22352529 [0,0,1,0,1,0|0,0,0]=2 5263 B7R1.8 C=CC1CCC1O Amb25848177 [1,0,0,0,1,0|2,0,0]=4 5264 B7R1.8 CC1CNC1CO Amb25310037 [1,0,0,0,1,0|1,0,1]=4 5265 B7R1.8 C[C@@H]1CN[C@@H]1CO Amb25230021 [1,0,0,0,1,0|1,0,1]=4 5266 B7R1.8 C[C@H]1CC[C@H]1C=O Amb25373249 [1,0,0,0,1,0|2,0,0]=4 5267 B7R1.8 OC1CNC1CO Amb25276544 [1,0,0,0,1,0|0,0,1]=3 5268 B7R1.8 OC1CSC1CO Amb25044422 [1,0,0,0,1,0|1,0,1]=4 5269 B7R1.8 O[C@@H]1CC[C@@H]1CO Amb25662759 [1,0,0,0,1,0|1,0,1]=4 5270 B7R1.8 O[C@@H]1CN[C@H]1CO Amb25663178 [1,0,0,0,1,0|0,0,1]=3 5271 B7R1.10 C=C1CC(C1)C=O Amb22896623 [1,0,0,0,1,0|1,0,1]=4 5272 B7R1.10 C=CC1CC(O)C1 Amb25746805 [1,0,0,0,1,0|1,0,0]=3 5273 B7R1.10 CC1CC(CO)C1 Amb23556375 [1,0,0,0,1,0|1,0,1]=4 5274 B7R1.10 CCC1CC(O)C1 Amb24654646 [1,0,0,0,1,0|1,0,1]=4 5275 B7R1.10 CNC1CC(O)C1 Amb19149003 [1,0,0,0,1,0|2,0,0]=4 5276 B7R1.10 CNC1CC(O)C1 Amb20623567 [1,0,0,0,1,0|2,0,0]=4 5277 B7R1.10 CN[C@@H]1C[C@@H](O)C1 Amb23440035 [1,0,0,0,1,0|2,0,0]=4 5278 B7R1.10 CN[C@@H]1C[C@@H](O)C1 Amb25173769 [1,0,0,0,1,0|2,0,0]=4 5279 B7R1.10 CN[C@@H]1C[C@H](O)C1 Amb23440266 [1,0,0,0,1,0|2,0,0]=4 5280 B7R1.10 CSC1CC(O)C1 Amb24581791 [1,0,0,0,1,0|2,0,0]=4 5281 B7R1.10 N#CC1CC(O)C1 Amb21857679 [1,0,0,0,1,0|1,0,1]=4 5282 B7R1.10 N#C[C@H]1C[C@@H](O)C1 Amb24480982 [1,0,0,0,1,0|1,0,1]=4 5283 B7R1.10 NC1CC(C1)NO Amb24376134 [1,0,0,0,1,0|2,0,0]=4 5284 B7R1.10 NC1CC(CO)C1 Amb21960726 [1,0,0,0,1,0|1,0,1]=4 5285 B7R1.10 NC1CC(CO)C1 Amb23570501 [1,0,0,0,1,0|1,0,1]=4 5286 B7R1.10 NCC1CC(O)C1 Amb21962033 [1,0,0,0,1,0|1,0,1]=4 5287 B7R1.10 NCC1CC(O)C1 Amb22405901 [1,0,0,0,1,0|1,0,1]=4 5288 B7R1.10 NC[C@@H]1C[C@@H](O)C1 Amb22899712 [1,0,0,0,1,0|1,0,1]=4 5289 B7R1.10 NC[C@@H]1C[C@@H](O)C1 Amb22899737 [1,0,0,0,1,0|1,0,1]=4 5290 B7R1.10 NC[C@@H]1C[C@H](O)C1 Amb22831753 [1,0,0,0,1,0|1,0,1]=4 5291 B7R1.10 NC[C@@H]1C[C@H](O)C1 Amb22899743 [1,0,0,0,1,0|1,0,1]=4 5292 B7R1.10 N[C@@H]1C[C@@H](CO)C1 Amb23439196 [1,0,0,0,1,0|1,0,1]=4 5293 B7R1.10 N[C@@H]1C[C@@H](CO)C1 Amb25124019 [1,0,0,0,1,0|1,0,1]=4 5294 B7R1.10 N[C@@H]1C[C@H](CO)C1 Amb22745997 [1,0,0,0,1,0|1,0,1]=4 5295 B7R1.10 N[C@@H]1C[C@H](CO)C1 Amb22747308 [1,0,0,0,1,0|1,0,1]=4 5296 B7R1.10 O=CC1CC(=O)N1 Amb24479772 [1,0,0,0,1,0|0,0,2]=4 5297 B7R1.10 OC1CC(C1)CO Amb22284484 [1,0,0,0,1,0|0,0,1]=3 5298 B7R1.10 OC1CC(CCl)C1 Amb25083416 [1,0,0,0,1,0|1,0,1]=4 5299 B7R1.10 OC1CN(C1)C=O Amb24479855 [1,0,0,0,1,0|1,0,0]=3 5300 B7R1.10 OCC1CC(Cl)C1 Amb21962428 [1,0,0,0,1,0|1,0,1]=4 5301 B7R1.10 OCC1CC(F)C1 Amb22886692 [1,0,0,0,1,0|1,0,1]=4 5302 B7R1.10 O[C@H]1C[C@H](C1)CO Amb24665713 [1,0,0,0,1,0|0,0,1]=3 5303 B7R1.18 CC(=C)C1CCC1 Amb25662691 [1,0,0,0,1,0|2,0,0]=4 5304 B7R1.18 CC(=O)C1CCO1 Amb25745997 [1,0,0,0,1,0|2,0,0]=4 5305 B7R1.18 CC(=O)C1CCS1 Amb24105980 [1,0,0,0,1,0|2,0,0]=4 5306 B7R1.18 CC(=O)C1CNC1 Amb23400009 [1,0,0,0,1,0|2,0,0]=4 5307 B7R1.18 CC(=O)C1CNC1 Amb23401240 [1,0,0,0,1,0|2,0,0]=4 5308 B7R1.18 CC(=O)N1CCC1 Amb22008358 [1,0,0,0,1,0|2,0,0]=4 5309 B7R1.18 CC(C1CCC1)O Amb10603414 [1,0,0,0,1,0|1,0,1]=4 5310 B7R1.18 CC(O)C1CCN1 Amb25195548 [1,0,0,0,1,0|1,0,1]=4 5311 B7R1.18 C[C@@H](O)C1CCC1 Amb24478546 [1,0,0,0,1,0|1,0,1]=4 5312 B7R1.18 C[C@H](O)C1CCC1 Amb25145632 [1,0,0,0,1,0|1,0,1]=4 5313 B7R1.18 NC(=N)C1CCC1 Amb19894979 [1,0,0,0,1,0|2,0,0]=4 5314 B7R1.18 NC(=N)[C@H]1CCN1 Amb24542766 [1,0,0,0,1,0|2,0,0]=4 5315 B7R1.18 NC(=O)C1CCN1 Amb22230240 [1,0,0,0,1,0|1,0,0]=3 5316 B7R1.18 NC(=O)C1CCN1 Amb22491865 [1,0,0,0,1,0|1,0,0]=3 5317 B7R1.18 NC(=O)C1CCO1 Amb24478900 [1,0,0,0,1,0|2,0,0]=4 5318 B7R1.18 NC(=O)C1CNC1 Amb10976072 [1,0,0,0,1,0|2,0,0]=4 5319 B7R1.18 NC(=O)C1CNC1 Amb20061301 [1,0,0,0,1,0|2,0,0]=4 5320 B7R1.18 NC(=O)C1CNC1 Amb21960249 [1,0,0,0,1,0|2,0,0]=4 5321 B7R1.18 NC(=O)N1CCC1 Amb25326782 [1,0,0,0,1,0|2,0,0]=4 5322 B7R1.18 NC(=S)C1CCC1 Amb18108358 [1,0,0,0,1,0|1,1,0]=4 5323 B7R1.18 O=C(Cl)C1COC1 Amb25201101 [1,0,0,0,1,0|2,0,0]=4 5324 B7R1.18 OB(C1CCC1)O Amb10071491 [1,0,0,0,1,0|1,0,1]=4 5325 B7R1.18 OC(=O)C1=CCC1 Amb17593068 [1,0,0,0,1,0|0,0,2]=4 5326 B7R1.18 OC(=O)C1CCN1 Amb2371568 [1,0,0,0,1,0|0,0,0]=2 5327 B7R1.18 OC(=O)C1CCO1 Amb2383526 [1,0,0,0,1,0|1,0,0]=3 5328 B7R1.18 OC(=O)C1CNC1 Amb2444164 [1,0,0,0,1,0|1,0,0]=3 5329 B7R1.18 OC(=O)C1CSC1 Amb20171470 [1,0,0,0,1,0|1,0,0]=3 5330 B7R1.18 OP(=O)C1CNC1 Amb25212879 [1,0,0,0,1,0|2,0,0]=4 5331 B7R1.18 [O-][N+](=O)C1CCC1 Amb13883563 [1,0,0,0,1,0|1,0,1]=4 5332 B7R1.12 C=C1C[C@@H]1C(O)=O Amb24683036 [0,0,0,0,2,0|1,0,1]=4 5333 B7R1.12 C=C1C[C@H]1C(O)=O Amb24368112 [0,0,0,0,2,0|1,0,1]=4 5334 B7R1.12 CC(=O)C1CC1Br Amb24426068 [0,0,0,0,2,0|2,0,0]=4 5335 B7R1.12 CC(=O)C1CC1Cl Amb25321894 [0,0,0,0,2,0|2,0,0]=4 5336 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Br Amb25745820 [0,0,0,0,2,0|2,0,0]=4 5337 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Cl Amb24595358 [0,0,0,0,2,0|2,0,0]=4 5338 B7R1.12 CC(=O)[C@@H]1C[C@H]1Br Amb25110221 [0,0,0,0,2,0|2,0,0]=4 5339 B7R1.12 CC(=O)[C@@H]1C[C@H]1Cl Amb25179033 [0,0,0,0,2,0|2,0,0]=4 5340 B7R1.12 CC1CC1C(C)=O Amb25720437 [0,0,0,0,2,0|2,0,0]=4 5341 B7R1.12 CC1OC1C(=O)O Amb17593088 [0,0,0,0,2,0|2,0,0]=4 5342 B7R1.12 C[C@@H]1C[C@@H]1C(C)=O Amb24670522 [0,0,0,0,2,0|2,0,0]=4 5343 B7R1.12 C[C@@H]1C[C@@H]1C(N)=O Amb25745425 [0,0,0,0,2,0|2,0,0]=4 5344 B7R1.12 C[C@@H]1C[C@@H]1C(O)=O Amb25851678 [0,0,0,0,2,0|1,0,0]=3 5345 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [0,0,0,0,2,0|2,0,0]=4 5346 B7R1.12 C[C@@H]1C[C@H]1C(O)=O Amb22735875 [0,0,0,0,2,0|1,0,0]=3 5347 B7R1.12 C[C@@H]1N[C@H]1C(O)=O Amb24120621 [0,0,0,0,2,0|1,0,0]=3 5348 B7R1.12 C[C@@H]1O[C@H]1C(O)=O Amb25738149 [0,0,0,0,2,0|2,0,0]=4 5349 B7R1.12 C[C@H]1C[C@@H]1C(O)=O Amb22735974 [0,0,0,0,2,0|1,0,0]=3 5350 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [0,0,0,0,2,0|1,0,0]=3 5351 B7R1.12 C[C@H]1C[C@H]1C(C)=O Amb25236374 [0,0,0,0,2,0|2,0,0]=4 5352 B7R1.12 NC(=O)[C@@H]1C[C@@H]1Br Amb24519223 [0,0,0,0,2,0|2,0,0]=4 5353 B7R1.12 NC1CC1C(N)=O Amb18279694 [0,0,0,0,2,0|2,0,0]=4 5354 B7R1.12 N[C@@H]1C[C@@H]1C(O)=O Amb25708637 [0,0,0,0,2,0|1,0,0]=3 5355 B7R1.12 N[C@@H]1C[C@H]1C(=O)O Amb2372566 [0,0,0,0,2,0|1,0,0]=3 5356 B7R1.12 N[C@H]1C[C@@H]1C(O)=O Amb25204284 [0,0,0,0,2,0|1,0,0]=3 5357 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1Cl Amb25320863 [0,0,0,0,2,0|2,0,0]=4 5358 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1F Amb24403332 [0,0,0,0,2,0|2,0,0]=4 5359 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [0,0,0,0,2,0|2,0,0]=4 5360 B7R1.12 OC(=O)C1CC1F Amb22490547 [0,0,0,0,2,0|1,0,0]=3 5361 B7R1.12 OC(=O)C1CC1S Amb20246988 [0,0,0,0,2,0|0,1,0]=3 5362 B7R1.12 OC(=O)[C@@H]1C[C@@H]1Cl Amb25209184 [0,0,0,0,2,0|1,0,0]=3 5363 B7R1.12 OC(=O)[C@@H]1C[C@@H]1F Amb22737600 [0,0,0,0,2,0|1,0,0]=3 5364 B7R1.12 OC(=O)[C@@H]1C[C@@H]1I Amb22756600 [0,0,0,0,2,0|1,0,0]=3 5365 B7R1.12 OC(=O)[C@@H]1C[C@H]1Br Amb24570997 [0,0,0,0,2,0|1,0,0]=3 5366 B7R1.12 OC(=O)[C@@H]1C[C@H]1F Amb22737604 [0,0,0,0,2,0|1,0,0]=3 5367 B7R1.12 OC(=O)[C@H]1C[C@@H]1F Amb22736113 [0,0,0,0,2,0|1,0,0]=3 5368 B7R1.12 OC(=O)[C@H]1C[C@H]1F Amb22738580 [0,0,0,0,2,0|1,0,0]=3 5369 B7R1.12 OC(=O)[C@H]1C[C@H]1I Amb22736654 [0,0,0,0,2,0|1,0,0]=3 5370 B7R1.12 OC1CC1C(O)=O Amb24360896 [0,0,0,0,2,0|0,0,0]=2 5371 B9R0.4 CC(CC(C)=O)SCCO Amb25777590 [0,0,1,0,0,1|2,0,0]=4 5372 B9R0.4 CC(CC(N)=O)NCCBr Amb24482960 [0,0,1,0,0,1|2,0,0]=4 5373 B9R0.4 CC(CC(N)=O)NCCF Amb25225173 [0,0,1,0,0,1|2,0,0]=4 5374 B9R0.4 CC(CC(N)=O)NCCO Amb19981205 [0,0,1,0,0,1|1,0,0]=3 5375 B9R0.4 CC(CC(O)=O)NCC#N Amb24376473 [0,0,1,0,0,1|1,0,1]=4 5376 B9R0.4 CC(CC(O)=O)NCCCl Amb25806095 [0,0,1,0,0,1|1,0,0]=3 5377 B9R0.4 CC(CC(O)=O)SCCF Amb24399399 [0,0,1,0,0,1|2,0,0]=4 5378 B9R0.4 CC(CC(O)=O)SCCN Amb18788220 [0,0,1,0,0,1|2,0,0]=4 5379 B9R0.4 CC(CCCCl)CC(O)=O Amb18646190 [0,0,1,0,0,1|2,0,0]=4 5380 B9R0.4 CC(CCCN)CC(O)=O Amb24761313 [0,0,1,0,0,1|2,0,0]=4 5381 B9R0.4 CC(CCCO)NC(N)=O Amb25197805 [0,0,1,0,0,1|2,0,0]=4 5382 B9R0.4 CC(CCCO)OC(C)=O Amb24387041 [0,0,1,0,0,1|2,0,0]=4 5383 B9R0.4 CC(CS(C)=O)NCCO Amb24524661 [0,0,1,0,0,1|2,0,0]=4 5384 B9R0.4 CCCNC(CC(=O)N)C Amb17231986 [0,0,1,0,0,1|2,0,0]=4 5385 B9R0.4 CCCO[C@H](C)CC(O)=O Amb24450437 [0,0,1,0,0,1|2,0,0]=4 5386 B9R0.4 C[C@@H](CCCN)CC(O)=O Amb24744945 [0,0,1,0,0,1|2,0,0]=4 5387 B9R0.4 C[C@H](CC(O)=O)OCCO Amb24713383 [0,0,1,0,0,1|1,0,0]=3 5388 B9R0.4 C[C@H](CCCN)CC(O)=O Amb24715301 [0,0,1,0,0,1|2,0,0]=4 5389 B9R0.4 C[C@H](CCCS)CC(O)=O Amb24358051 [0,0,1,0,0,1|1,1,0]=4 5390 B9R0.4 C\C(=C/C(C)=O)\NCCO Amb22351177 [0,0,1,0,0,1|1,0,1]=4 5391 B9R0.4 C\C(=C\C(C)=O)\NCCO Amb24358034 [0,0,1,0,0,1|1,0,1]=4 5392 B9R0.4 OC(=O)CC(=O)NCCO Amb25683950 [0,0,1,0,0,1|1,0,1]=4 5393 B9R0.14 C=CC(CCO)CC(O)=O Amb24595877 [0,0,1,0,0,1|1,0,1]=4 5394 B9R0.14 C=C[C@H](CCO)CC(O)=O Amb24674139 [0,0,1,0,0,1|1,0,1]=4 5395 B9R0.14 CCC(CCO)NC(C)=O Amb25265131 [0,0,1,0,0,1|2,0,0]=4 5396 B9R0.14 CCCC(CC(N)=O)NC Amb25069096 [0,0,1,0,0,1|2,0,0]=4 5397 B9R0.14 CCCC(CC(O)=O)CC Amb18124694 [0,0,1,0,0,1|2,0,0]=4 5398 B9R0.14 CCCC(CC(O)=O)OC Amb25844554 [0,0,1,0,0,1|2,0,0]=4 5399 B9R0.14 CCC[C@H](CC(O)=O)CC Amb24480703 [0,0,1,0,0,1|2,0,0]=4 5400 B9R0.14 COC(CCO)=CC(O)=O Amb24759166 [0,0,1,0,0,1|1,0,1]=4 5401 B9R0.55 CC(Br)CCCCC(O)=O Amb25309392 [0,0,1,0,0,1|2,0,0]=4 5402 B9R0.55 CC(C)CNOCC(C)=O Amb24478134 [0,0,1,0,0,1|2,0,0]=4 5403 B9R0.55 CC(C)CNOCC(N)=O Amb24667538 [0,0,1,0,0,1|2,0,0]=4 5404 B9R0.55 CC(C)CONCC(O)=O Amb24740299 [0,0,1,0,0,1|1,0,0]=3 5405 B9R0.55 CC(C)C\C=C\CC(O)=O Amb24681011 [0,0,1,0,0,1|2,0,0]=4 5406 B9R0.55 CC(C)ONCCC(O)=O Amb24619964 [0,0,1,0,0,1|2,0,0]=4 5407 B9R0.55 CC(CCCCC(=O)O)C Amb10576144 [0,0,1,0,0,1|2,0,0]=4 5408 B9R0.55 CC(CCNCC(=O)N)C Amb1112311 [0,0,1,0,0,1|2,0,0]=4 5409 B9R0.55 CC(CCNCC(=O)O)C Amb1111021 [0,0,1,0,0,1|1,0,0]=3 5410 B9R0.55 CC(CCSCC(=O)O)C Amb1137397 [0,0,1,0,0,1|2,0,0]=4 5411 B9R0.55 CC(CNCCC(=O)O)C Amb10609230 [0,0,1,0,0,1|1,0,0]=3 5412 B9R0.55 CC(CNCCC(=O)O)C Amb2372367 [0,0,1,0,0,1|1,0,0]=3 5413 B9R0.55 CC(Cl)CCCCC(O)=O Amb18646185 [0,0,1,0,0,1|2,0,0]=4 5414 B9R0.55 CC(F)COCCC(O)=O Amb25268355 [0,0,1,0,0,1|2,0,0]=4 5415 B9R0.55 CC(N)CCCCC(O)=O Amb18644199 [0,0,1,0,0,1|2,0,0]=4 5416 B9R0.55 CC(N)CCCCC(O)=O Amb19515386 [0,0,1,0,0,1|2,0,0]=4 5417 B9R0.55 CC(N)CSCCC(O)=O Amb24435179 [0,0,1,0,0,1|2,0,0]=4 5418 B9R0.55 CC(NCCCC(=O)O)C Amb1111231 [0,0,1,0,0,1|2,0,0]=4 5419 B9R0.55 CC(O)CCCCC(O)=O Amb18644264 [0,0,1,0,0,1|1,0,0]=3 5420 B9R0.55 CC(O)CCNCC(=C)Cl Amb25789297 [0,0,1,0,0,1|2,0,0]=4 5421 B9R0.55 CC(O)CCNCC(C)=C Amb25285801 [0,0,1,0,0,1|2,0,0]=4 5422 B9R0.55 CC(O)CCNCC(O)=O Amb25369892 [0,0,1,0,0,1|0,0,0]=2 5423 B9R0.55 CC(O)CC\C=C\C(O)=O Amb24680771 [0,0,1,0,0,1|1,0,1]=4 5424 B9R0.55 CC(O)CNCC=C(C)C Amb25701248 [0,0,1,0,0,1|2,0,0]=4 5425 B9R0.55 CC(O)CNCCS(C)=O Amb24704852 [0,0,1,0,0,1|2,0,0]=4 5426 B9R0.55 CC(O)CNOCC(C)=C Amb25303181 [0,0,1,0,0,1|2,0,0]=4 5427 B9R0.55 CC(O)CN\C=C\C(O)=O Amb24479663 [0,0,1,0,0,1|0,0,1]=3 5428 B9R0.55 CC(O)COCCC(O)=O Amb24746704 [0,0,1,0,0,1|1,0,0]=3 5429 B9R0.55 CC(O)CSCCC(O)=O Amb18792572 [0,0,1,0,0,1|1,0,0]=3 5430 B9R0.55 CC(O)\C=C\CCC(O)=O Amb24453133 [0,0,1,0,0,1|1,0,1]=4 5431 B9R0.55 CS(=O)CCNCC(O)=O Amb24396496 [0,0,1,0,0,1|1,0,1]=4 5432 B9R0.55 C[C@@H](O)CCCCC(C)=O Amb25114746 [0,0,1,0,0,1|2,0,0]=4 5433 B9R0.55 C[C@@H](O)CCCCC(O)=O Amb24427549 [0,0,1,0,0,1|1,0,0]=3 5434 B9R0.55 C[C@@H](O)CNCC=C(C)C Amb24481277 [0,0,1,0,0,1|2,0,0]=4 5435 B9R0.55 C[C@@H](O)CNCCC(N)=O Amb24447126 [0,0,1,0,0,1|1,0,0]=3 5436 B9R0.55 C[C@@H](O)CNCCS(C)=O Amb24424223 [0,0,1,0,0,1|2,0,0]=4 5437 B9R0.55 C[C@@H](O)CNOCC(C)=C Amb25229367 [0,0,1,0,0,1|2,0,0]=4 5438 B9R0.55 C[C@H](N)CCCCC(O)=O Amb25229790 [0,0,1,0,0,1|2,0,0]=4 5439 B9R0.55 C[C@H](O)CCCCC(O)=O Amb24671333 [0,0,1,0,0,1|1,0,0]=3 5440 B9R0.55 C[C@H](O)CNCC=C(C)C Amb24481274 [0,0,1,0,0,1|2,0,0]=4 5441 B9R0.55 C[C@H](O)CNCCC(C)O Amb25352546 [0,0,1,0,0,1|1,0,1]=4 5442 B9R0.55 OC(=O)CCCSC(C)C Amb17503621 [0,0,1,0,0,1|2,0,0]=4 5443 B9R0.55 OC(=O)CCNCC(F)F Amb18179466 [0,0,1,0,0,1|2,0,0]=4 5444 B9R0.55 OC(=O)CNCCC(F)F Amb24721262 [0,0,1,0,0,1|2,0,0]=4 5445 B9R0.55 OC(=O)CNCCC(O)=O Amb18098292 [0,0,1,0,0,1|1,0,1]=4 5446 B9R0.55 OC(=O)CNNCC(O)=O Amb23438062 [0,0,1,0,0,1|1,0,1]=4 5447 B9R1.2 C=CC1CCCC(O)C1 Amb25846990 [1,0,0,0,0,1|2,0,0]=4 5448 B9R1.2 C=C[C@H]1CCC[C@@H](O)C1 Amb25205028 [1,0,0,0,0,1|2,0,0]=4 5449 B9R1.2 CC1CC(C=O)OCC1 Amb25032291 [1,0,0,0,0,1|2,0,0]=4 5450 B9R1.2 CC1CC(C=O)OCO1 Amb25362501 [1,0,0,0,0,1|2,0,0]=4 5451 B9R1.2 CC1CC(CCC1)C=O Amb22059519 [1,0,0,0,0,1|2,0,0]=4 5452 B9R1.2 CC1CC(CCO1)C=O Amb18642617 [1,0,0,0,0,1|2,0,0]=4 5453 B9R1.2 CC1CC(CNC1)CO Amb24554370 [1,0,0,0,0,1|1,0,1]=4 5454 B9R1.2 CC1CC(CO)NCC1 Amb24571948 [1,0,0,0,0,1|1,0,1]=4 5455 B9R1.2 C[C@@H]1C[C@@H](CCO1)C=O Amb25195965 [1,0,0,0,0,1|2,0,0]=4 5456 B9R1.2 C[C@@H]1C[C@@H](CO)NCC1 Amb24586583 [1,0,0,0,0,1|1,0,1]=4 5457 B9R1.2 C[C@@H]1C[C@H](C=O)OCC1 Amb25366622 [1,0,0,0,0,1|2,0,0]=4 5458 B9R1.2 C[C@H]1CC(CCC1)C=O Amb24648931 [1,0,0,0,0,1|2,0,0]=4 5459 B9R1.2 C[C@H]1C[C@H](C=O)OCC1 Amb25339741 [1,0,0,0,0,1|2,0,0]=4 5460 B9R1.2 O=CC1CC(=O)CCN1 Amb25116003 [1,0,0,0,0,1|0,0,2]=4 5461 B9R1.2 O=CC1CCCC(F)C1 Amb24541768 [1,0,0,0,0,1|2,0,0]=4 5462 B9R1.2 OC1CC(CC=C1)C=O Amb24529059 [1,0,0,0,0,1|1,0,1]=4 5463 B9R1.2 OC1CC(CCC1)C=O Amb24456710 [1,0,0,0,0,1|1,0,0]=3 5464 B9R1.2 OC1CCCC(C1)CO Amb24429742 [1,0,0,0,0,1|1,0,1]=4 5465 B9R1.2 OC1CCCC(C=O)O1 Amb25063184 [1,0,0,0,0,1|2,0,0]=4 5466 B9R1.2 OCC1CC(F)CNC1 Amb13889103 [1,0,0,0,0,1|1,0,1]=4 5467 B9R1.2 OCC1CNCC(F)C1 Amb22886258 [1,0,0,0,0,1|1,0,1]=4 5468 B9R1.2 O[C@H]1CNC[C@H](C1)CO Amb24558018 [1,0,0,0,0,1|0,0,1]=3 5469 B9R1.13 CC(=C)CC1CCCN1 Amb25162820 [1,0,0,0,0,1|2,0,0]=4 5470 B9R1.13 CC(=O)CC1CCCN1 Amb24064067 [1,0,0,0,0,1|1,0,0]=3 5471 B9R1.13 CC(=O)CC1CCCO1 Amb13952621 [1,0,0,0,0,1|2,0,0]=4 5472 B9R1.13 CC(=O)C[C@@H]1CCCN1 Amb24709255 [1,0,0,0,0,1|1,0,0]=3 5473 B9R1.13 CC(=O)C[C@H]1CCCO1 Amb24752778 [1,0,0,0,0,1|2,0,0]=4 5474 B9R1.13 CC(=O)N[C@@H]1CCCN1 Amb25848370 [1,0,0,0,0,1|1,0,0]=3 5475 B9R1.13 CC(=O)OC1CCCO1 Amb22270198 [1,0,0,0,0,1|2,0,0]=4 5476 B9R1.13 CC(=O)OC1CCCS1 Amb24402377 [1,0,0,0,0,1|2,0,0]=4 5477 B9R1.13 CC(=O)SC1CCCC1 Amb22337902 [1,0,0,0,0,1|2,0,0]=4 5478 B9R1.13 CC(=O)\C=C/1\CCCN1 Amb17593301 [1,0,0,0,0,1|1,0,1]=4 5479 B9R1.13 CC(C)=C[C@@H]1CCCN1 Amb25835184 [1,0,0,0,0,1|2,0,0]=4 5480 B9R1.13 CC(O)CC1CCCN1 Amb22059496 [1,0,0,0,0,1|1,0,1]=4 5481 B9R1.13 CC(O)C[C@@H]1CCCN1 Amb25027963 [1,0,0,0,0,1|1,0,1]=4 5482 B9R1.13 CS(=O)CC1CCCN1 Amb25772181 [1,0,0,0,0,1|2,0,0]=4 5483 B9R1.13 ClC(=O)OC1CCCC1 Amb10070029 [1,0,0,0,0,1|2,0,0]=4 5484 B9R1.13 NC(=O)CC1CCCN1 Amb18282785 [1,0,0,0,0,1|1,0,0]=3 5485 B9R1.13 NC(=O)CC1NCCS1 Amb25308974 [1,0,0,0,0,1|2,0,0]=4 5486 B9R1.13 NC(=O)C[C@@H]1CCCN1 Amb24583408 [1,0,0,0,0,1|1,0,0]=3 5487 B9R1.13 NC(=O)NC1CCCC1 Amb1151267 [1,0,0,0,0,1|2,0,0]=4 5488 B9R1.13 NC(=O)NC1NCCN1 Amb22045018 [1,0,0,0,0,1|2,0,0]=4 5489 B9R1.13 NC(=O)NN1CCCN1 Amb25293012 [1,0,0,0,0,1|2,0,0]=4 5490 B9R1.13 NC(=O)\N=C\1/CCCN1 Amb22349282 [1,0,0,0,0,1|1,0,1]=4 5491 B9R1.13 O=C(Cl)OC1CCCO1 Amb24760352 [1,0,0,0,0,1|2,0,0]=4 5492 B9R1.13 O=C(Cl)O[C@@H]1CCCO1 Amb24638442 [1,0,0,0,0,1|2,0,0]=4 5493 B9R1.13 O=C(F)NC1CCCC1 Amb25711539 [1,0,0,0,0,1|2,0,0]=4 5494 B9R1.13 OB(O)C[C@@H]1CCCN1 Amb24670511 [1,0,0,0,0,1|1,0,1]=4 5495 B9R1.13 OC(=O)C=C1NCCN1 Amb18832637 [1,0,0,0,0,1|1,0,1]=4 5496 B9R1.13 OC(=O)CC1CCCC1 Amb16192937 [1,0,0,0,0,1|1,0,0]=3 5497 B9R1.13 OC(=O)CC1CCCN1 Amb20668514 [1,0,0,0,0,1|0,0,0]=2 5498 B9R1.13 OC(=O)CC1CCCO1 Amb1088908 [1,0,0,0,0,1|1,0,0]=3 5499 B9R1.13 OC(=O)CC1CCCS1 Amb18644290 [1,0,0,0,0,1|1,0,0]=3 5500 B9R1.13 OC(=O)CC1CCNO1 Amb25261098 [1,0,0,0,0,1|2,0,0]=4 5501 B9R1.13 OC(=O)CC1CSCC1 Amb18202318 [1,0,0,0,0,1|2,0,0]=4 5502 B9R1.13 OC(=O)CC1NCCS1 Amb18644340 [1,0,0,0,0,1|1,0,0]=3 5503 B9R1.13 OC(=O)CC1OCCO1 Amb22740193 [1,0,0,0,0,1|2,0,0]=4 5504 B9R1.13 OC(=O)CC1SCCS1 Amb25361118 [1,0,0,0,0,1|2,0,0]=4 5505 B9R1.13 OC(=O)CC=1CCCC1 Amb18642404 [1,0,0,0,0,1|1,0,1]=4 5506 B9R1.13 OC(=O)C[C@@H]1CCCN1 Amb13891876 [1,0,0,0,0,1|0,0,0]=2 5507 B9R1.13 OC(=O)C[C@@H]1CCCO1 Amb24271115 [1,0,0,0,0,1|1,0,0]=3 5508 B9R1.13 OC(=O)C[C@@H]1COCC1 Amb23401495 [1,0,0,0,0,1|2,0,0]=4 5509 B9R1.13 OC(=O)C[C@H]1CCC=C1 Amb25378723 [1,0,0,0,0,1|1,0,1]=4 5510 B9R1.13 OC(=O)C[C@H]1CCCN1 Amb16184011 [1,0,0,0,0,1|0,0,0]=2 5511 B9R1.13 OC(=O)C[C@H]1CCCO1 Amb24271109 [1,0,0,0,0,1|1,0,0]=3 5512 B9R1.13 OC(=O)C[C@H]1CNCC1 Amb10067024 [1,0,0,0,0,1|2,0,0]=4 5513 B9R1.13 OC(=O)NN1CCCC1 Amb24082039 [1,0,0,0,0,1|2,0,0]=4 5514 B11R1.20 CC(=O)N=C1NCC(O)CN1 Amb24679067 [0,0,0,0,0,2|1,0,1]=4 5515 B11R1.20 CC(=O)N[C@H]1CC[C@H](O)CC1 Amb17938052 [0,0,0,0,0,2|2,0,0]=4 5516 B11R1.20 CC(=O)OC1COC(O)CC1 Amb25149740 [0,0,0,0,0,2|2,0,0]=4 5517 B11R1.20 CC(=O)O[C@H]1CC[C@@H](O)CC1 Amb24429868 [0,0,0,0,0,2|2,0,0]=4 5518 B11R1.20 CC(=O)SC1CCC(O)CC1 Amb22396054 [0,0,0,0,0,2|2,0,0]=4 5519 B11R1.20 CC1CNC(CC(N)=O)SC1 Amb24382294 [0,0,0,0,0,2|2,0,0]=4 5520 B11R1.20 CC1COC(CN1)CC(O)=O Amb25307203 [0,0,0,0,0,2|2,0,0]=4 5521 B11R1.20 CC1CSC(CN1)CC(O)=O Amb25280304 [0,0,0,0,0,2|2,0,0]=4 5522 B11R1.20 C[C@@H]1CC[C@@H](CC(C)=O)NC1 Amb25351666 [0,0,0,0,0,2|2,0,0]=4 5523 B11R1.20 C[C@@H]1CC[C@@H](CC1)CC(=O)O Amb10843976 [0,0,0,0,0,2|2,0,0]=4 5524 B11R1.20 C[C@@H]1CS[C@H](CN1)CC(O)=O Amb25200645 [0,0,0,0,0,2|2,0,0]=4 5525 B11R1.20 C[C@H]1CC[C@@H](CC(C)=O)NC1 Amb24519236 [0,0,0,0,0,2|2,0,0]=4 5526 B11R1.20 NC(=O)N[C@@H]1CC[C@@H](O)CC1 Amb24486604 [0,0,0,0,0,2|2,0,0]=4 5527 B11R1.20 N[C@@H]1CC[C@@H](CC(O)=O)CC1 Amb22387640 [0,0,0,0,0,2|2,0,0]=4 5528 B11R1.20 N[C@@H]1CC[C@@H](CC(O)=O)CC1 Amb22746078 [0,0,0,0,0,2|2,0,0]=4 5529 B11R1.20 OC(=O)CC1CNC(=O)CN1 Amb24655930 [0,0,0,0,0,2|0,0,2]=4 5530 B11R1.20 OC(=O)C[C@@H]1CNC(=O)CN1 Amb25367224 [0,0,0,0,0,2|0,0,2]=4 5531 B11R1.20 OC1CCC(CC(O)=O)CC1 Amb18126157 [0,0,0,0,0,2|1,0,0]=3 5532 B11R1.20 OC1CCN(CC1)CC(=O)O Amb10609681 [0,0,0,0,0,2|2,0,0]=4 5533 B11R1.20 O[C@@H]1CC[C@@H](CC(O)=O)CC1 Amb24076397 [0,0,0,0,0,2|1,0,0]=3 5534 B11R1.20 O[C@@H]1CC[C@@H](CC1)NC(=O)C Amb10067907 [0,0,0,0,0,2|2,0,0]=4 5535 B11R1.20 O[C@@H]1CC[C@H](CC(O)=O)CC1 Amb24093224 [0,0,0,0,0,2|1,0,0]=3 5536 B11R1.565 CC1CCCC(CC1)C(O)=O Amb24487583 [0,0,0,0,0,2|2,0,0]=4 5537 B11R1.565 OC(=O)C1CCC(=O)NCN1 Amb25799038 [0,0,0,0,0,2|0,0,2]=4 5538 B11R1.565 OC(=O)C1CNC(=O)CCN1 Amb24697001 [0,0,0,0,0,2|0,0,2]=4 5539 B11R1.75 CC(=O)NCC1CC(O)CN1 Amb24358092 [0,0,0,0,0,2|1,0,0]=3 5540 B11R1.75 CC(=O)NC[C@@H]1C[C@@H](O)CN1 Amb25222149 [0,0,0,0,0,2|1,0,0]=3 5541 B11R1.75 CC(=O)NC[C@@H]1C[C@H](F)CN1 Amb24351937 [0,0,0,0,0,2|2,0,0]=4 5542 B11R1.75 CC(=O)NC[C@@H]1C[C@H](O)CN1 Amb24512027 [0,0,0,0,0,2|1,0,0]=3 5543 B11R1.75 CC(=O)OCC1CC(O)CN1 Amb25780646 [0,0,0,0,0,2|1,0,0]=3 5544 B11R1.75 CC(=O)OC[C@@H]1C[C@@H](O)CN1 Amb24559925 [0,0,0,0,0,2|1,0,0]=3 5545 B11R1.75 CC1CC(CC1)CCC(O)=O Amb25798904 [0,0,0,0,0,2|2,0,0]=4 5546 B11R1.75 CC1CC(CC1)NCC(O)=O Amb25274568 [0,0,0,0,0,2|2,0,0]=4 5547 B11R1.75 NC(=O)NCC1CCC(O)C1 Amb25743596 [0,0,0,0,0,2|2,0,0]=4 5548 B11R1.75 OC1CCC(C1)CCC(O)=O Amb24666025 [0,0,0,0,0,2|1,0,0]=3 5549 B11R1.75 OC1CN(CC1)CCC(O)=O Amb18999852 [0,0,0,0,0,2|2,0,0]=4 5550 B11R1.75 O[C@@H]1CON(C1)CCC(O)=O Amb25761315 [0,0,0,0,0,2|2,0,0]=4 5551 B11R1.75 O[C@H]1CN(CC1)CCC(O)=O Amb24469468 [0,0,0,0,0,2|2,0,0]=4 5552 B11R1.157 CC(=O)NC1CCCC(O)C1 Amb25806972 [0,0,0,0,0,2|2,0,0]=4 5553 B11R1.157 CC1CC(CC(O)=O)C=CC1 Amb18125730 [0,0,0,0,0,2|2,0,0]=4 5554 B11R1.157 CC1CC(CC(O)=O)SCC1 Amb24644201 [0,0,0,0,0,2|2,0,0]=4 5555 B11R1.157 CC1CCNC(C1)CC(C)=O Amb25746124 [0,0,0,0,0,2|2,0,0]=4 5556 B11R1.157 CN1CC(CC(O)=O)NCC1 Amb18830480 [0,0,0,0,0,2|2,0,0]=4 5557 B11R1.157 C[C@H]1CC(CC(O)=O)CCC1 Amb24677826 [0,0,0,0,0,2|2,0,0]=4 5558 B11R1.157 C[C@H]1C[C@@H](CC(O)=O)CCC1 Amb25179080 [0,0,0,0,0,2|2,0,0]=4 5559 B11R1.157 C[C@H]1C[C@@H](CNC1)NC(C)=O Amb25257956 [0,0,0,0,0,2|2,0,0]=4 5560 B11R1.157 NC(=O)NC1CCCC(O)C1 Amb25149524 [0,0,0,0,0,2|2,0,0]=4 5561 B11R1.157 NC1CC(CC(O)=O)CCC1 Amb18644926 [0,0,0,0,0,2|2,0,0]=4 5562 B11R1.157 N[C@H]1C[C@H](CC(O)=O)CCC1 Amb24627101 [0,0,0,0,0,2|2,0,0]=4 5563 B11R1.157 OC(=O)CC1CCCC(Cl)C1 Amb18648013 [0,0,0,0,0,2|2,0,0]=4 5564 B11R1.157 OC(=O)CC1CCCC(F)C1 Amb24651233 [0,0,0,0,0,2|2,0,0]=4 5565 B11R1.157 OC1CC(CC(O)=O)C=CC1 Amb24484705 [0,0,0,0,0,2|1,0,0]=3 5566 B11R1.157 OC1CCCC(C1)CC(O)=O Amb18645020 [0,0,0,0,0,2|1,0,0]=3 5567 B11R1.157 OC1CCCN(C1)CC(=O)O Amb15701257 [0,0,0,0,0,2|2,0,0]=4 5568 B11R1.157 O[C@@H]1CCC[C@H](C1)CC(O)=O Amb25257413 [0,0,0,0,0,2|1,0,0]=3 5569 B11R1.157 O[C@@H]1CN(CC(O)=O)CCC1 Amb22224789 [0,0,0,0,0,2|2,0,0]=4 5570 B11R1.157 O[C@H]1CCC[C@H](C1)CC(O)=O Amb24552923 [0,0,0,0,0,2|1,0,0]=3 5571 B11R1.157 O[C@H]1CN(CC(O)=O)CCC1 Amb22224754 [0,0,0,0,0,2|2,0,0]=4 5572 B11R1.497 CC(=O)N1CC(O)CNCC1 Amb22261486 [0,0,0,0,0,2|2,0,0]=4 5573 B11R1.497 CC(=O)N1CC(O)CNCC1 Amb22587605 [0,0,0,0,0,2|2,0,0]=4 5574 B11R1.497 CN1CC(CNCC1)C(O)=O Amb24554014 [0,0,0,0,0,2|2,0,0]=4 5575 B11R1.497 CN1CC(NCCC1)C(O)=O Amb25314145 [0,0,0,0,0,2|2,0,0]=4 5576 B11R1.497 NC1CC(COCC1)C(O)=O Amb24707410 [0,0,0,0,0,2|2,0,0]=4