0 B9R0.47 C#CCCCC(C)C(C)=O Amb25965398 [0,0,0,0,0,0|3,0,1]=4 1 B9R0.47 C#CCCCC(N)C(=O)O Amb27947457 [0,0,0,0,0,0|1,0,1]=2 2 B9R0.47 C#CCCCC(N)C(=O)O Amb33483976 [0,0,0,0,0,0|1,0,1]=2 3 B9R0.47 C#CCCCC(N)C(N)=O Amb26967363 [0,0,0,0,0,0|2,0,1]=3 4 B9R0.47 C#CCCC[C@@H](N)C(=O)O Amb24077358 [0,0,0,0,0,0|1,0,1]=2 5 B9R0.47 C#CCCC[C@H](N)C(=O)O Amb24088878 [0,0,0,0,0,0|1,0,1]=2 6 B9R0.47 C#CCCN[C@H](C)C(=O)O Amb27495158 [0,0,0,0,0,0|3,0,1]=4 7 B9R0.47 C#CCNCC(C)C(=O)O Amb9400290 [0,0,0,0,0,0|3,0,1]=4 8 B9R0.47 C#CCNCC(O)C(=O)O Amb27486394 [0,0,0,0,0,0|3,0,1]=4 9 B9R0.47 C#CCNC[C@H](S)C(=O)O Amb28077797 [0,0,0,0,0,0|3,0,1]=4 10 B9R0.47 C#CCOC[C@H](N)C(=O)O Amb27644036 [0,0,0,0,0,0|2,0,1]=3 11 B9R0.47 C#CCSCC(N)C(=O)O Amb6275547 [0,0,0,0,0,0|2,0,1]=3 12 B9R0.47 C#CCSC[C@H](N)C(=O)O Amb17935864 [0,0,0,0,0,0|2,0,1]=3 13 B9R0.47 C#C\C=C\CC(N)C(=O)O Amb25147384 [0,0,0,0,0,0|1,0,3]=4 14 B9R0.47 C=C(C)C(N)CCCOC Amb28455830 [0,0,0,0,0,0|4,0,0]=4 15 B9R0.47 C=C(C)C(O)CCCCO Amb27765710 [0,0,0,0,0,0|4,0,0]=4 16 B9R0.47 C=C(C)[C@@H](O)CCCCC Amb28065257 [0,0,0,0,0,0|4,0,0]=4 17 B9R0.47 C=C(CCCC#N)C(=O)O Amb27413507 [0,0,0,0,0,0|1,0,3]=4 18 B9R0.47 C=C(CCCNC)C(=O)O Amb28050053 [0,0,0,0,0,0|3,0,1]=4 19 B9R0.47 C=C(CNCCN)C(=O)O Amb27875593 [0,0,0,0,0,0|2,0,1]=3 20 B9R0.47 C=C(CSCCO)C(=O)O Amb27856969 [0,0,0,0,0,0|3,0,1]=4 21 B9R0.47 C=C(Cl)C(C)CCCCO Amb27260219 [0,0,0,0,0,0|4,0,0]=4 22 B9R0.47 C=CCCCC(C)C(C)=O Amb27839019 [0,0,0,0,0,0|3,0,1]=4 23 B9R0.47 C=CCCCC(N)C(=O)O Amb22002149 [0,0,0,0,0,0|1,0,1]=2 24 B9R0.47 C=CCCCC(N)C(=O)O Amb32752542 [0,0,0,0,0,0|1,0,1]=2 25 B9R0.47 C=CCCCC(N)C(N)=O Amb25988690 [0,0,0,0,0,0|2,0,1]=3 26 B9R0.47 C=CCCC[C@@H](N)C(=O)O Amb22831130 [0,0,0,0,0,0|1,0,1]=2 27 B9R0.47 C=CCCC[C@@H](N)C(=O)O Amb32687472 [0,0,0,0,0,0|1,0,1]=2 28 B9R0.47 C=CCCC[C@@H](O)C(C)=O Amb27453672 [0,0,0,0,0,0|3,0,1]=4 29 B9R0.47 C=CCCC[C@H](N)C(=O)O Amb2699129 [0,0,0,0,0,0|1,0,1]=2 30 B9R0.47 C=CCCOC(C)C(=O)O Amb9208711 [0,0,0,0,0,0|3,0,1]=4 31 B9R0.47 C=CCCO[C@@H](C)C(=O)O Amb27254188 [0,0,0,0,0,0|3,0,1]=4 32 B9R0.47 C=CCCO[C@H](C)C(=O)O Amb27976475 [0,0,0,0,0,0|3,0,1]=4 33 B9R0.47 C=CCNCC(N)C(=O)O Amb27945606 [0,0,0,0,0,0|2,0,1]=3 34 B9R0.47 C=CCOCC(N)C(=O)O Amb28048879 [0,0,0,0,0,0|2,0,1]=3 35 B9R0.47 C=CCOCC(N)C(N)=O Amb26499253 [0,0,0,0,0,0|3,0,1]=4 36 B9R0.47 C=CCOC[C@@H](N)C(=O)O Amb31030961 [0,0,0,0,0,0|2,0,1]=3 37 B9R0.47 C=CCOC[C@@H](N)C(=O)O Amb32941137 [0,0,0,0,0,0|2,0,1]=3 38 B9R0.47 C=CCOC[C@H](N)C(=O)O Amb24713287 [0,0,0,0,0,0|2,0,1]=3 39 B9R0.47 C=CCSCC(C)C(=O)O Amb27813038 [0,0,0,0,0,0|3,0,1]=4 40 B9R0.47 C=CCSCC(Cl)C(=O)O Amb27635176 [0,0,0,0,0,0|3,0,1]=4 41 B9R0.47 C=CCSCC(N)C(=O)O Amb6270069 [0,0,0,0,0,0|2,0,1]=3 42 B9R0.47 C=CCSCC(O)C(=O)O Amb27639084 [0,0,0,0,0,0|3,0,1]=4 43 B9R0.47 C=CCSC[C@@H](C)C(=O)O Amb27955284 [0,0,0,0,0,0|3,0,1]=4 44 B9R0.47 C=CCSC[C@@H](N)C(=O)O Amb10843878 [0,0,0,0,0,0|2,0,1]=3 45 B9R0.47 C=CCSC[C@H](N)C(=O)O Amb22231426 [0,0,0,0,0,0|2,0,1]=3 46 B9R0.47 C=CCSC[C@H](N)C(N)=O Amb28410940 [0,0,0,0,0,0|3,0,1]=4 47 B9R0.47 C=CSCCC(N)C(=O)O Amb26658187 [0,0,0,0,0,0|2,0,1]=3 48 B9R0.47 C=C\C=C\CC(N)C(=O)O Amb18643715 [0,0,0,0,0,0|1,0,3]=4 49 B9R0.47 CC#CCCC(C)C(=O)O Amb27412753 [0,0,0,0,0,0|2,0,2]=4 50 B9R0.47 CC#CCCC(N)C(=O)O Amb28285646 [0,0,0,0,0,0|1,0,2]=3 51 B9R0.47 CC#CCCC(N)C(N)=O Amb26893252 [0,0,0,0,0,0|2,0,2]=4 52 B9R0.47 CC#CCCC(O)C(=O)O Amb27615159 [0,0,0,0,0,0|2,0,2]=4 53 B9R0.47 CC#CCC[C@@H](N)C(=O)O Amb25835847 [0,0,0,0,0,0|1,0,2]=3 54 B9R0.47 CC#CCC[C@H](N)C(=O)O Amb28368944 [0,0,0,0,0,0|1,0,2]=3 55 B9R0.47 CC(=O)C(C)CCCCO Amb27787398 [0,0,0,0,0,0|3,0,0]=3 56 B9R0.47 CC(=O)C(C)OCCCN Amb18111504 [0,0,0,0,0,0|3,0,0]=3 57 B9R0.47 CC(=O)C(C)SCCCF Amb27424937 [0,0,0,0,0,0|4,0,0]=4 58 B9R0.47 CC(=O)C(C)SCCCS Amb28200050 [0,0,0,0,0,0|4,0,0]=4 59 B9R0.47 CC(=O)N(C)CCCCBr Amb27860570 [0,0,0,0,0,0|4,0,0]=4 60 B9R0.47 CC(C)C(N)CCCCF Amb27218723 [0,0,0,0,0,0|3,0,1]=4 61 B9R0.47 CC(CCCCBr)C(=O)O Amb27790626 [0,0,0,0,0,0|2,0,0]=2 62 B9R0.47 CC(CCCCF)C(=O)O Amb24370978 [0,0,0,0,0,0|2,0,0]=2 63 B9R0.47 CC(CCCCN)C(=O)O Amb31031269 [0,0,0,0,0,0|1,0,0]=1 64 B9R0.47 CC(CCCCO)C(=O)O Amb28040862 [0,0,0,0,0,0|2,0,0]=2 65 B9R0.47 CC(CCN=C=O)C(=O)O Amb33471413 [0,0,0,0,0,0|3,0,1]=4 66 B9R0.47 CC(CCN=C=S)C(=O)O Amb33471646 [0,0,0,0,0,0|3,0,1]=4 67 B9R0.47 CC(CCN=[N+]=[N-])C(=O)O Amb27455144 [0,0,0,0,0,0|3,0,1]=4 68 B9R0.47 CC(CCNC=O)C(=O)O Amb27474434 [0,0,0,0,0,0|3,0,1]=4 69 B9R0.47 CC(CNCCCl)C(=O)O Amb27974547 [0,0,0,0,0,0|3,0,0]=3 70 B9R0.47 CC(CNCCN)C(=O)O Amb27398545 [0,0,0,0,0,0|2,0,0]=2 71 B9R0.47 CC(CNCCN)S(C)=O Amb27458530 [0,0,0,0,0,0|4,0,0]=4 72 B9R0.47 CC(CNCCO)C(N)=O Amb9358396 [0,0,0,0,0,0|4,0,0]=4 73 B9R0.47 CC(CSCC#N)C(=O)O Amb27410286 [0,0,0,0,0,0|2,0,2]=4 74 B9R0.47 CC(CSCCN)C(=O)O Amb18788221 [0,0,0,0,0,0|2,0,0]=2 75 B9R0.47 CC(CSCCN)C(=O)O Amb28555435 [0,0,0,0,0,0|2,0,0]=2 76 B9R0.47 CC(NCCC#N)C(=O)O Amb4019288 [0,0,0,0,0,0|2,0,2]=4 77 B9R0.47 CC(NCCCF)C(N)=O Amb28136243 [0,0,0,0,0,0|4,0,0]=4 78 B9R0.47 CC(NCCCO)C(N)=O Amb9246629 [0,0,0,0,0,0|4,0,0]=4 79 B9R0.47 CC(OCCCN)C(=O)O Amb18111477 [0,0,0,0,0,0|2,0,0]=2 80 B9R0.47 CC(SCCC#N)C(=O)O Amb17502364 [0,0,0,0,0,0|2,0,2]=4 81 B9R0.47 CC(SCCCF)C(=O)O Amb28049559 [0,0,0,0,0,0|3,0,0]=3 82 B9R0.47 CC(SCCCN)C(=O)O Amb17500677 [0,0,0,0,0,0|2,0,0]=2 83 B9R0.47 CC(SCCCS)C(=O)O Amb18648366 [0,0,0,0,0,0|3,0,0]=3 84 B9R0.47 CCCCCC(=O)C(=O)Cl Amb24647840 [0,0,0,0,0,0|3,0,1]=4 85 B9R0.47 CCCCCC(=O)C(=O)O Amb18644122 [0,0,0,0,0,0|2,0,1]=3 86 B9R0.47 CCCCCC(Br)C(=O)O Amb18130346 [0,0,0,0,0,0|2,0,0]=2 87 B9R0.47 CCCCCC(Br)C(C)=O Amb26057111 [0,0,0,0,0,0|3,0,0]=3 88 B9R0.47 CCCCCC(Br)C(C)O Amb28049966 [0,0,0,0,0,0|3,0,1]=4 89 B9R0.47 CCCCCC(C)C(=O)Cl Amb25127828 [0,0,0,0,0,0|3,0,0]=3 90 B9R0.47 CCCCCC(C)[N+](=O)[O-] Amb25059956 [0,0,0,0,0,0|3,0,1]=4 91 B9R0.47 CCCCCC(Cl)C(=O)Cl Amb27845364 [0,0,0,0,0,0|3,0,0]=3 92 B9R0.47 CCCCCC(F)C(=O)O Amb17593693 [0,0,0,0,0,0|2,0,0]=2 93 B9R0.47 CCCCCC(F)C(C)O Amb27769908 [0,0,0,0,0,0|3,0,1]=4 94 B9R0.47 CCCCCC(N)C(=O)O Amb4134810 [0,0,0,0,0,0|1,0,0]=1 95 B9R0.47 CCCCCC(N)C(F)F Amb28135618 [0,0,0,0,0,0|3,0,1]=4 96 B9R0.47 CCCCCC(N)C(N)=O Amb25843277 [0,0,0,0,0,0|2,0,0]=2 97 B9R0.47 CCCCCC(N)[PH](=O)O Amb28421761 [0,0,0,0,0,0|2,0,0]=2 98 B9R0.47 CCCCCC(O)C(=O)O Amb17778103 [0,0,0,0,0,0|2,0,0]=2 99 B9R0.47 CCCCCC(O)C(C)=O Amb27658218 [0,0,0,0,0,0|3,0,0]=3 100 B9R0.47 CCCCCC(O)C(C)O Amb27835134 [0,0,0,0,0,0|3,0,1]=4 101 B9R0.47 CCCCCC(S)C(=O)O Amb27657706 [0,0,0,0,0,0|2,0,0]=2 102 B9R0.47 CCCCCN(N)C(=N)N Amb29471652 [0,0,0,0,0,0|4,0,0]=4 103 B9R0.47 CCCCC[C@@H](Br)C(=O)O Amb27234856 [0,0,0,0,0,0|2,0,0]=2 104 B9R0.47 CCCCC[C@@H](C)C(C)=O Amb28202105 [0,0,0,0,0,0|3,0,0]=3 105 B9R0.47 CCCCC[C@@H](N)C(=O)O Amb22745982 [0,0,0,0,0,0|1,0,0]=1 106 B9R0.47 CCCCC[C@@H](O)C(=O)O Amb28050131 [0,0,0,0,0,0|2,0,0]=2 107 B9R0.47 CCCCC[C@@H](O)C(C)=O Amb24480618 [0,0,0,0,0,0|3,0,0]=3 108 B9R0.47 CCCCC[C@H](Br)C(=O)O Amb28287684 [0,0,0,0,0,0|2,0,0]=2 109 B9R0.47 CCCCC[C@H](Br)[C@H](C)O Amb27830165 [0,0,0,0,0,0|3,0,1]=4 110 B9R0.47 CCCCC[C@H](C)C(=O)O Amb10844510 [0,0,0,0,0,0|2,0,0]=2 111 B9R0.47 CCCCC[C@H](F)C(=O)O Amb27784296 [0,0,0,0,0,0|2,0,0]=2 112 B9R0.47 CCCCC[C@H](N)C(=O)O Amb17943098 [0,0,0,0,0,0|1,0,0]=1 113 B9R0.47 CCCCC[C@H](N)[C@H](C)O Amb28250851 [0,0,0,0,0,0|2,0,1]=3 114 B9R0.47 CCCCC[C@H](O)[C@@H](C)O Amb27979805 [0,0,0,0,0,0|3,0,1]=4 115 B9R0.47 CCCCNC(=O)C(=O)O Amb9303865 [0,0,0,0,0,0|3,0,1]=4 116 B9R0.47 CCCCNC(=S)C(=O)O Amb27657804 [0,0,0,0,0,0|3,0,1]=4 117 B9R0.47 CCCCNC(C)C(=O)O Amb9326961 [0,0,0,0,0,0|3,0,0]=3 118 B9R0.47 CCCCNC(C)C(N)=O Amb9203273 [0,0,0,0,0,0|4,0,0]=4 119 B9R0.47 CCCCN[C@@H](C)C(=O)O Amb27192156 [0,0,0,0,0,0|3,0,0]=3 120 B9R0.47 CCCCN[C@H](C)C(=O)O Amb27461559 [0,0,0,0,0,0|3,0,0]=3 121 B9R0.47 CCCCOC(=O)C(=O)O Amb26367223 [0,0,0,0,0,0|3,0,1]=4 122 B9R0.47 CCCCOC(C)C(=O)O Amb8894957 [0,0,0,0,0,0|3,0,0]=3 123 B9R0.47 CCCCOC(C)C(N)=O Amb27852771 [0,0,0,0,0,0|4,0,0]=4 124 B9R0.47 CCCCOC(F)C(=O)O Amb27174586 [0,0,0,0,0,0|3,0,0]=3 125 B9R0.47 CCCCO[C@@H](C)C(=O)O Amb27216767 [0,0,0,0,0,0|3,0,0]=3 126 B9R0.47 CCCCSC(C)C(=O)O Amb6273551 [0,0,0,0,0,0|3,0,0]=3 127 B9R0.47 CCCCSC(F)C(=O)O Amb27850941 [0,0,0,0,0,0|3,0,0]=3 128 B9R0.47 CCCCSC(N)C(=O)O Amb27760526 [0,0,0,0,0,0|2,0,0]=2 129 B9R0.47 CCCCS[C@@H](C)C(=O)O Amb27408996 [0,0,0,0,0,0|3,0,0]=3 130 B9R0.47 CCCC\C=C(/Br)C(=O)O Amb27615132 [0,0,0,0,0,0|2,0,2]=4 131 B9R0.47 CCCC\C=C(\C)C(=O)O Amb27637394 [0,0,0,0,0,0|2,0,2]=4 132 B9R0.47 CCCC\C=C(\F)C(=O)O Amb28197633 [0,0,0,0,0,0|2,0,2]=4 133 B9R0.47 CCCC\C=C(\N)C(N)=O Amb27473333 [0,0,0,0,0,0|2,0,2]=4 134 B9R0.47 CCCNCC(N)C(N)=O Amb27952357 [0,0,0,0,0,0|3,0,0]=3 135 B9R0.47 CCCNCC(O)C(N)=O Amb27875874 [0,0,0,0,0,0|4,0,0]=4 136 B9R0.47 CCCOCC(=O)C(=O)O Amb27787004 [0,0,0,0,0,0|3,0,1]=4 137 B9R0.47 CCCOCC(Br)C(=O)O Amb27625667 [0,0,0,0,0,0|3,0,0]=3 138 B9R0.47 CCCOCC(N)C(=O)O Amb24621740 [0,0,0,0,0,0|2,0,0]=2 139 B9R0.47 CCCOCC(N)C(N)=O Amb27155900 [0,0,0,0,0,0|3,0,0]=3 140 B9R0.47 CCCOC[C@@H](N)C(=O)O Amb27480715 [0,0,0,0,0,0|2,0,0]=2 141 B9R0.47 CCCOC[C@H](N)C(=O)O Amb27223143 [0,0,0,0,0,0|2,0,0]=2 142 B9R0.47 CCCSCC(C)C(C)=O Amb27262876 [0,0,0,0,0,0|4,0,0]=4 143 B9R0.47 CCCSCC(N)C(=O)O Amb6265881 [0,0,0,0,0,0|2,0,0]=2 144 B9R0.47 CCCSCC(N)C(=O)O Amb9176295 [0,0,0,0,0,0|2,0,0]=2 145 B9R0.47 CCCSC[C@H](N)C(=O)O Amb27471340 [0,0,0,0,0,0|2,0,0]=2 146 B9R0.47 CCC\C=C/C(N)C(N)=O Amb28249181 [0,0,0,0,0,0|2,0,2]=4 147 B9R0.47 CCC\C=C\C(C)C(=O)O Amb33449140 [0,0,0,0,0,0|2,0,2]=4 148 B9R0.47 CCC\C=C\C(O)C(=O)O Amb32668856 [0,0,0,0,0,0|2,0,2]=4 149 B9R0.47 CCC\C=C\[C@@H](N)C(=O)O Amb27230868 [0,0,0,0,0,0|1,0,2]=3 150 B9R0.47 CCNCCC(C)C(=O)O Amb27473572 [0,0,0,0,0,0|3,0,0]=3 151 B9R0.47 CCNCCC(N)C(=O)O Amb932772 [0,0,0,0,0,0|2,0,0]=2 152 B9R0.47 CCNCC[C@@H](N)C(=O)O Amb28520031 [0,0,0,0,0,0|2,0,0]=2 153 B9R0.47 CCOCCC(C)C(C)=O Amb27837597 [0,0,0,0,0,0|4,0,0]=4 154 B9R0.47 CCOCCC(N)C(=O)O Amb32671298 [0,0,0,0,0,0|2,0,0]=2 155 B9R0.47 CCOCCC(N)C(=O)O Amb9316664 [0,0,0,0,0,0|2,0,0]=2 156 B9R0.47 CCOCCC(N)C(C)=O Amb28055992 [0,0,0,0,0,0|3,0,0]=3 157 B9R0.47 CCOCCC(N)C(N)=O Amb25354003 [0,0,0,0,0,0|3,0,0]=3 158 B9R0.47 CCOCC[C@@H](N)C(=O)O Amb28187742 [0,0,0,0,0,0|2,0,0]=2 159 B9R0.47 CCOCC[C@H](N)C(=O)O Amb26612670 [0,0,0,0,0,0|2,0,0]=2 160 B9R0.47 CCOCOC(C)C(=O)O Amb27426180 [0,0,0,0,0,0|4,0,0]=4 161 B9R0.47 CCOCO[C@H](C)C(=O)O Amb27765041 [0,0,0,0,0,0|4,0,0]=4 162 B9R0.47 CCONCC(C)C(=O)O Amb27265783 [0,0,0,0,0,0|4,0,0]=4 163 B9R0.47 CCONCC(N)C(N)=O Amb28045946 [0,0,0,0,0,0|4,0,0]=4 164 B9R0.47 CCSCCC(=O)C(=O)O Amb26652044 [0,0,0,0,0,0|3,0,1]=4 165 B9R0.47 CCSCCC(C)C(=O)O Amb10844082 [0,0,0,0,0,0|3,0,0]=3 166 B9R0.47 CCSCCC(Cl)C(N)=O Amb27614970 [0,0,0,0,0,0|4,0,0]=4 167 B9R0.47 CCSCCC(N)C(=O)O Amb2137050 [0,0,0,0,0,0|2,0,0]=2 168 B9R0.47 CCSCCC(N)C(N)=O Amb18177774 [0,0,0,0,0,0|3,0,0]=3 169 B9R0.47 CCSCCC(O)C(=O)O Amb24482157 [0,0,0,0,0,0|3,0,0]=3 170 B9R0.47 CCSCCC(O)C(N)=O Amb26926790 [0,0,0,0,0,0|4,0,0]=4 171 B9R0.47 CCSCC[C@@H](N)C(=O)O Amb17613843 [0,0,0,0,0,0|2,0,0]=2 172 B9R0.47 CCSCC[C@H](N)C(=O)O Amb17613844 [0,0,0,0,0,0|2,0,0]=2 173 B9R0.47 CCSSCC(N)C(N)=O Amb27201565 [0,0,0,0,0,0|4,0,0]=4 174 B9R0.47 CC\C=C\CC(C)C(=O)O Amb27838058 [0,0,0,0,0,0|2,0,2]=4 175 B9R0.47 CC\C=C\CC(N)C(=O)O Amb25255710 [0,0,0,0,0,0|1,0,2]=3 176 B9R0.47 CC\C=C\CC(N)C(=O)O Amb30666656 [0,0,0,0,0,0|1,0,2]=3 177 B9R0.47 CN(CCCCCl)C(=O)Cl Amb22338609 [0,0,0,0,0,0|4,0,0]=4 178 B9R0.47 CN(CCCCO)C(N)=O Amb27452604 [0,0,0,0,0,0|4,0,0]=4 179 B9R0.47 CNCCCC(N)C(=O)O Amb18644279 [0,0,0,0,0,0|2,0,0]=2 180 B9R0.47 CNCCOC(C)C(=O)O Amb18630742 [0,0,0,0,0,0|4,0,0]=4 181 B9R0.47 CNOCC[C@H](N)C(=O)O Amb27405026 [0,0,0,0,0,0|3,0,0]=3 182 B9R0.47 COCCCC(=O)C(=O)O Amb28050154 [0,0,0,0,0,0|3,0,1]=4 183 B9R0.47 COCCCC(C)C(=O)O Amb26653888 [0,0,0,0,0,0|3,0,0]=3 184 B9R0.47 COCCCC(C)C(C)=O Amb27657482 [0,0,0,0,0,0|4,0,0]=4 185 B9R0.47 COCCCC(C)C(N)=O Amb28190149 [0,0,0,0,0,0|4,0,0]=4 186 B9R0.47 COCCCC(N)C(=O)O Amb22058809 [0,0,0,0,0,0|2,0,0]=2 187 B9R0.47 COCCCC(N)C(=O)O Amb33549526 [0,0,0,0,0,0|2,0,0]=2 188 B9R0.47 COCCCC(N)C(N)=O Amb26331697 [0,0,0,0,0,0|3,0,0]=3 189 B9R0.47 COCCCC(O)C(=O)O Amb28050541 [0,0,0,0,0,0|3,0,0]=3 190 B9R0.47 COCCC[C@@H](N)C(=O)O Amb25081508 [0,0,0,0,0,0|2,0,0]=2 191 B9R0.47 COCCC[C@H](N)C(=O)O Amb25378737 [0,0,0,0,0,0|2,0,0]=2 192 B9R0.47 COCCNC(C)C(=O)O Amb33069032 [0,0,0,0,0,0|4,0,0]=4 193 B9R0.47 COCCNC(C)C(=O)O Amb9326996 [0,0,0,0,0,0|4,0,0]=4 194 B9R0.47 COCCN[C@@H](C)C(=O)O Amb27164971 [0,0,0,0,0,0|4,0,0]=4 195 B9R0.47 COCCN[C@H](C)C(=O)O Amb27454332 [0,0,0,0,0,0|4,0,0]=4 196 B9R0.47 COCCOC(C)C(=O)O Amb9719532 [0,0,0,0,0,0|4,0,0]=4 197 B9R0.47 COCCO[C@H](C)C(=O)O Amb27783895 [0,0,0,0,0,0|4,0,0]=4 198 B9R0.47 COCOCC(C)C(=O)O Amb27667113 [0,0,0,0,0,0|4,0,0]=4 199 B9R0.47 COCSCC(C)C(=O)O Amb27474867 [0,0,0,0,0,0|4,0,0]=4 200 B9R0.47 CONCC[C@H](N)C(=O)O Amb27623933 [0,0,0,0,0,0|3,0,0]=3 201 B9R0.47 CSCCCC(=O)C(=O)O Amb27490899 [0,0,0,0,0,0|3,0,1]=4 202 B9R0.47 CSCCCC(C)C(=O)O Amb25888073 [0,0,0,0,0,0|3,0,0]=3 203 B9R0.47 CSCCCC(C)C(C)=O Amb27841950 [0,0,0,0,0,0|4,0,0]=4 204 B9R0.47 CSCCCC(Cl)C(N)=O Amb27588927 [0,0,0,0,0,0|4,0,0]=4 205 B9R0.47 CSCCCC(N)C(=O)O Amb17594057 [0,0,0,0,0,0|2,0,0]=2 206 B9R0.47 CSCCCC(N)C(=O)O Amb35789017 [0,0,0,0,0,0|2,0,0]=2 207 B9R0.47 CSCCCC(N)C(N)=O Amb27770389 [0,0,0,0,0,0|3,0,0]=3 208 B9R0.47 CSCCCC(O)C(=O)O Amb25169340 [0,0,0,0,0,0|3,0,0]=3 209 B9R0.47 CSCCCC(O)C(N)=O Amb27197765 [0,0,0,0,0,0|4,0,0]=4 210 B9R0.47 CSCCC[C@@H](N)C(=O)O Amb27233529 [0,0,0,0,0,0|2,0,0]=2 211 B9R0.47 CSCCC[C@H](N)C(=O)O Amb27858783 [0,0,0,0,0,0|2,0,0]=2 212 B9R0.47 CSCCOC(C)C(=O)O Amb24482366 [0,0,0,0,0,0|4,0,0]=4 213 B9R0.47 CSCCO[C@H](C)C(=O)O Amb27865202 [0,0,0,0,0,0|4,0,0]=4 214 B9R0.47 CSCCSC(C)C(=O)O Amb28291750 [0,0,0,0,0,0|4,0,0]=4 215 B9R0.47 CSCSC[C@H](N)C(=O)O Amb26874540 [0,0,0,0,0,0|3,0,0]=3 216 B9R0.47 CSSCCC(N)C(=O)O Amb28456103 [0,0,0,0,0,0|3,0,0]=3 217 B9R0.47 C[C@@H](CCCCBr)C(=O)O Amb27794794 [0,0,0,0,0,0|2,0,0]=2 218 B9R0.47 C[C@@H](NCCC#N)C(=O)O Amb27445400 [0,0,0,0,0,0|2,0,2]=4 219 B9R0.47 C[C@@H](NCCCN)C(=O)O Amb25710680 [0,0,0,0,0,0|2,0,0]=2 220 B9R0.47 C[C@@H](OCCCN)C(=O)O Amb27465122 [0,0,0,0,0,0|2,0,0]=2 221 B9R0.47 C[C@H](NCCCO)C(=O)O Amb27454333 [0,0,0,0,0,0|3,0,0]=3 222 B9R0.47 C\C(=C/CCCCl)C(=O)O Amb27203326 [0,0,0,0,0,0|2,0,2]=4 223 B9R0.47 C\C=C\CCC(C)C(=O)O Amb27461427 [0,0,0,0,0,0|2,0,2]=4 224 B9R0.47 C\C=C\CCC(N)C(=O)O Amb27770583 [0,0,0,0,0,0|1,0,2]=3 225 B9R0.47 N#CCCCC(Cl)C(=O)Cl Amb28396535 [0,0,0,0,0,0|2,0,2]=4 226 B9R0.47 N#CCCCC(Cl)C(=O)O Amb17594023 [0,0,0,0,0,0|1,0,2]=3 227 B9R0.47 N#CCCCC(N)C(=O)O Amb25242567 [0,0,0,0,0,0|0,0,2]=2 228 B9R0.47 N#CCCCC(N)C(N)=O Amb33308858 [0,0,0,0,0,0|1,0,2]=3 229 B9R0.47 N#CCCC[C@@H](N)C(=O)O Amb28349132 [0,0,0,0,0,0|0,0,2]=2 230 B9R0.47 N#CCCC[C@H](N)C(=O)O Amb26043277 [0,0,0,0,0,0|0,0,2]=2 231 B9R0.47 N#CCSC[C@H](N)C(=O)O Amb18179968 [0,0,0,0,0,0|1,0,2]=3 232 B9R0.47 N#CNCCC(N)C(=O)O Amb27180972 [0,0,0,0,0,0|1,0,2]=3 233 B9R0.47 N#CSCCC(N)C(=O)O Amb27984671 [0,0,0,0,0,0|1,0,2]=3 234 B9R0.47 N#CSSCC(N)C(=O)O Amb27232837 [0,0,0,0,0,0|2,0,2]=4 235 B9R0.47 NC(=O)C(N)CCCCBr Amb28313246 [0,0,0,0,0,0|2,0,0]=2 236 B9R0.47 NC(=O)C(N)CCCCF Amb27977425 [0,0,0,0,0,0|2,0,0]=2 237 B9R0.47 NC(=O)C(N)CCCCO Amb33065912 [0,0,0,0,0,0|2,0,0]=2 238 B9R0.47 NC(=O)C(O)CNCCF Amb28320057 [0,0,0,0,0,0|4,0,0]=4 239 B9R0.47 NC(CC#CCCl)C(=O)O Amb28123330 [0,0,0,0,0,0|1,0,2]=3 240 B9R0.47 NC(CCCCF)C(=O)O Amb28193271 [0,0,0,0,0,0|1,0,0]=1 241 B9R0.47 NC(CCCCO)C(=O)O Amb2699159 [0,0,0,0,0,0|1,0,0]=1 242 B9R0.47 NC(CCSN=O)C(=O)O Amb26516416 [0,0,0,0,0,0|3,0,0]=3 243 B9R0.47 NC(COCCCl)C(=O)O Amb18126477 [0,0,0,0,0,0|2,0,0]=2 244 B9R0.47 NC(CSCCO)C(=O)O Amb6262852 [0,0,0,0,0,0|2,0,0]=2 245 B9R0.47 NC(CSCCS)C(=O)O Amb27837996 [0,0,0,0,0,0|2,0,0]=2 246 B9R0.47 NC(CS\C=C\Cl)C(=O)O Amb28325993 [0,0,0,0,0,0|2,0,2]=4 247 B9R0.47 NC(C\C=C/CO)C(=O)O Amb28046143 [0,0,0,0,0,0|1,0,2]=3 248 B9R0.47 NCC#CCC(N)C(=O)O Amb25369913 [0,0,0,0,0,0|0,0,2]=2 249 B9R0.47 NCC#CCC(N)C(=O)O Amb28555546 [0,0,0,0,0,0|0,0,2]=2 250 B9R0.47 NCC#CC[C@@H](N)C(=O)O Amb24118079 [0,0,0,0,0,0|0,0,2]=2 251 B9R0.47 NCC#CC[C@H](N)C(=O)O Amb28134098 [0,0,0,0,0,0|0,0,2]=2 252 B9R0.47 NCCCCC(=O)C(=O)O Amb33756866 [0,0,0,0,0,0|1,0,1]=2 253 B9R0.47 NCCCCC(Cl)=C(Cl)Cl Amb27173708 [0,0,0,0,0,0|3,0,1]=4 254 B9R0.47 NCCCCC(N)C(=O)O Amb22349470 [0,0,0,0,0,0|0,0,0]=0 255 B9R0.47 NCCCCC(N)C(=O)O Amb22489521 [0,0,0,0,0,0|0,0,0]=0 256 B9R0.47 NCCCCC(N)C(=O)O Amb3940540 [0,0,0,0,0,0|0,0,0]=0 257 B9R0.47 NCCCCC(N)C(=O)O Amb8516470 [0,0,0,0,0,0|0,0,0]=0 258 B9R0.47 NCCCCC(N)C(=O)O Amb8516682 [0,0,0,0,0,0|0,0,0]=0 259 B9R0.47 NCCCCC(N)C(F)F Amb27876508 [0,0,0,0,0,0|2,0,1]=3 260 B9R0.47 NCCCCC(N)C(N)=O Amb17593646 [0,0,0,0,0,0|1,0,0]=1 261 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb22750565 [0,0,0,0,0,0|0,0,0]=0 262 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb2720180 [0,0,0,0,0,0|0,0,0]=0 263 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb30621835 [0,0,0,0,0,0|0,0,0]=0 264 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb3940874 [0,0,0,0,0,0|0,0,0]=0 265 B9R0.47 NCCCC[C@@H](N)C(N)=O Amb27404620 [0,0,0,0,0,0|1,0,0]=1 266 B9R0.47 NCCCC[C@H](N)C(=O)O Amb2720055 [0,0,0,0,0,0|0,0,0]=0 267 B9R0.47 NCCCC[C@H](N)C(=O)O Amb3940762 [0,0,0,0,0,0|0,0,0]=0 268 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8395455 [0,0,0,0,0,0|0,0,0]=0 269 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8513720 [0,0,0,0,0,0|0,0,0]=0 270 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8628529 [0,0,0,0,0,0|0,0,0]=0 271 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8628598 [0,0,0,0,0,0|0,0,0]=0 272 B9R0.47 NCCCC[C@H](N)C(N)=O Amb33757921 [0,0,0,0,0,0|1,0,0]=1 273 B9R0.47 NCCCOC(N)C(=O)O Amb27838076 [0,0,0,0,0,0|1,0,0]=1 274 B9R0.47 NCCCS[C@H](N)C(=O)O Amb27410557 [0,0,0,0,0,0|1,0,0]=1 275 B9R0.47 NCCOCC(N)C(=O)O Amb27224745 [0,0,0,0,0,0|1,0,0]=1 276 B9R0.47 NCCOC[C@H](N)C(=O)O Amb26844671 [0,0,0,0,0,0|1,0,0]=1 277 B9R0.47 NCCSCC(=O)C(=O)O Amb33069793 [0,0,0,0,0,0|2,0,1]=3 278 B9R0.47 NCCSCC(O)C(=O)O Amb27789579 [0,0,0,0,0,0|2,0,0]=2 279 B9R0.47 NCCSC[C@@H](N)C(=O)O Amb27945627 [0,0,0,0,0,0|1,0,0]=1 280 B9R0.47 NCCSC[C@H](N)C(=O)O Amb22362775 [0,0,0,0,0,0|1,0,0]=1 281 B9R0.47 NCCSC[C@H](N)C(=O)O Amb25887551 [0,0,0,0,0,0|1,0,0]=1 282 B9R0.47 NCSCCC(N)C(=O)O Amb27468506 [0,0,0,0,0,0|1,0,0]=1 283 B9R0.47 NCSCC[C@H](N)C(=O)O Amb27425090 [0,0,0,0,0,0|1,0,0]=1 284 B9R0.47 NC\C=C\CC(N)C(=O)O Amb22800680 [0,0,0,0,0,0|0,0,2]=2 285 B9R0.47 NNCCOC(=O)C(=O)O Amb27652617 [0,0,0,0,0,0|3,0,1]=4 286 B9R0.47 NOCCCC(N)C(=O)O Amb24117962 [0,0,0,0,0,0|1,0,0]=1 287 B9R0.47 NOCCCC(N)C(=O)O Amb27222313 [0,0,0,0,0,0|1,0,0]=1 288 B9R0.47 NOCCC[C@H](N)C(=O)O Amb28397870 [0,0,0,0,0,0|1,0,0]=1 289 B9R0.47 N[C@@H](CCCC=O)C(=O)O Amb2695588 [0,0,0,0,0,0|1,0,1]=2 290 B9R0.47 N[C@@H](CCCCBr)C(=O)O Amb28208462 [0,0,0,0,0,0|1,0,0]=1 291 B9R0.47 N[C@@H](CCCCCl)C(=O)O Amb27267870 [0,0,0,0,0,0|1,0,0]=1 292 B9R0.47 N[C@@H](CCCCF)C(=O)O Amb27945388 [0,0,0,0,0,0|1,0,0]=1 293 B9R0.47 N[C@@H](CCCCO)C(=O)O Amb2695139 [0,0,0,0,0,0|1,0,0]=1 294 B9R0.47 N[C@@H](CCCCS)C(=O)O Amb25729289 [0,0,0,0,0,0|1,0,0]=1 295 B9R0.47 N[C@@H](CCCNO)C(=O)O Amb29083430 [0,0,0,0,0,0|2,0,0]=2 296 B9R0.47 N[C@@H](CCCNO)C(=O)O Amb30666629 [0,0,0,0,0,0|2,0,0]=2 297 B9R0.47 N[C@@H](CCSN=O)C(=O)O Amb24665147 [0,0,0,0,0,0|3,0,0]=3 298 B9R0.47 N[C@@H](CNCCO)C(=O)O Amb25146307 [0,0,0,0,0,0|2,0,0]=2 299 B9R0.47 N[C@@H](COCCCl)C(=O)O Amb28134274 [0,0,0,0,0,0|2,0,0]=2 300 B9R0.47 N[C@@H](CSCCCl)C(=O)O Amb25887675 [0,0,0,0,0,0|2,0,0]=2 301 B9R0.47 N[C@@H](CSCCF)C(=O)O Amb27837852 [0,0,0,0,0,0|2,0,0]=2 302 B9R0.47 N[C@@H](CSCCO)C(=O)O Amb2695551 [0,0,0,0,0,0|2,0,0]=2 303 B9R0.47 N[C@H](CC#CCO)C(=O)O Amb27391610 [0,0,0,0,0,0|1,0,2]=3 304 B9R0.47 N[C@H](CCCC=O)C(=O)O Amb27272621 [0,0,0,0,0,0|1,0,1]=2 305 B9R0.47 N[C@H](CCCCF)C(=O)O Amb26370180 [0,0,0,0,0,0|1,0,0]=1 306 B9R0.47 N[C@H](CCCCO)C(=O)O Amb26969244 [0,0,0,0,0,0|1,0,0]=1 307 B9R0.47 N[C@H](CSCCO)C(=O)O Amb8629048 [0,0,0,0,0,0|2,0,0]=2 308 B9R0.47 N[C@H](\C=C\CCO)C(=O)O Amb24603441 [0,0,0,0,0,0|1,0,2]=3 309 B9R0.47 O=C(O)C(=O)CCCCBr Amb27654991 [0,0,0,0,0,0|2,0,1]=3 310 B9R0.47 O=C(O)C(=O)CCCCO Amb27626027 [0,0,0,0,0,0|2,0,1]=3 311 B9R0.47 O=C(O)C(=O)CSCCBr Amb33069761 [0,0,0,0,0,0|3,0,1]=4 312 B9R0.47 O=C(O)C(=O)CSCCCl Amb33069754 [0,0,0,0,0,0|3,0,1]=4 313 B9R0.47 O=C(O)C(=O)CSCCO Amb33069731 [0,0,0,0,0,0|3,0,1]=4 314 B9R0.47 O=C(O)C(=O)CSCCS Amb33069996 [0,0,0,0,0,0|3,0,1]=4 315 B9R0.47 O=C(O)C(Cl)CC\C=C\Cl Amb27984937 [0,0,0,0,0,0|2,0,2]=4 316 B9R0.47 O=C(O)C(Cl)CSCCCl Amb27949681 [0,0,0,0,0,0|3,0,0]=3 317 B9R0.47 O=C(O)C(O)CCCCO Amb18644356 [0,0,0,0,0,0|2,0,0]=2 318 B9R0.47 O=C(O)C(O)CNCCO Amb27456529 [0,0,0,0,0,0|3,0,0]=3 319 B9R0.47 [N-]=[N+]=NCCC(N)C(=O)O Amb25766449 [0,0,0,0,0,0|2,0,1]=3 320 B9R0.47 [N-]=[N+]=NCC[C@@H](N)C(=O)O Amb19130389 [0,0,0,0,0,0|2,0,1]=3 321 B9R0.47 [N-]=[N+]=NCC[C@H](N)C(=O)O Amb16183915 [0,0,0,0,0,0|2,0,1]=3 322 B9R0.47 [N-]=[N+]=NCC[C@H](N)C(=O)O Amb30586484 [0,0,0,0,0,0|2,0,1]=3 323 B9R0.47 [N-]=[N+]=NCC[C@H](O)C(=O)O Amb27238260 [0,0,0,0,0,0|3,0,1]=4 324 B8R0.6 C#CC(O)CCCCN Amb28341771 [1,0,0,0,0,0|2,0,1]=4 325 B8R0.6 C#CCCCC(N)CO Amb28061736 [1,0,0,0,0,0|1,0,2]=4 326 B8R0.6 C#CCCC[C@@H](N)CO Amb32620213 [1,0,0,0,0,0|1,0,2]=4 327 B8R0.6 C#CCCC[C@H](N)CO Amb32620183 [1,0,0,0,0,0|1,0,2]=4 328 B8R0.6 C=C(C=O)CCCCC Amb18642442 [1,0,0,0,0,0|2,0,1]=4 329 B8R0.6 C=C(C=O)CCCCCl Amb27621755 [1,0,0,0,0,0|2,0,1]=4 330 B8R0.6 C=CC(C)CCCCC Amb27963700 [1,0,0,0,0,0|3,0,0]=4 331 B8R0.6 C=CC(N)CCCOC Amb28124519 [1,0,0,0,0,0|3,0,0]=4 332 B8R0.6 C=CC(O)CCCCBr Amb27666905 [1,0,0,0,0,0|3,0,0]=4 333 B8R0.6 C=CC(O)CCCCC Amb3940384 [1,0,0,0,0,0|3,0,0]=4 334 B8R0.6 C=CC(O)CCCCO Amb28193458 [1,0,0,0,0,0|3,0,0]=4 335 B8R0.6 C=CCCCC(C)C=O Amb27984474 [1,0,0,0,0,0|2,0,1]=4 336 B8R0.6 C=CCCCC(F)C=O Amb27623056 [1,0,0,0,0,0|2,0,1]=4 337 B8R0.6 C=CCCCC(N)CO Amb25147202 [1,0,0,0,0,0|1,0,2]=4 338 B8R0.6 C=CCCC[C@@H](C)C=O Amb27755054 [1,0,0,0,0,0|2,0,1]=4 339 B8R0.6 C=CCCC[C@H](C)C=O Amb27876153 [1,0,0,0,0,0|2,0,1]=4 340 B8R0.6 C=C[C@@H](O)CCCCC Amb8513277 [1,0,0,0,0,0|3,0,0]=4 341 B8R0.6 C=C[C@H](Cl)CCCCC Amb27863541 [1,0,0,0,0,0|3,0,0]=4 342 B8R0.6 C=C[C@H](O)CCCCC Amb8515093 [1,0,0,0,0,0|3,0,0]=4 343 B8R0.6 CC(C=O)CCCC=O Amb18642651 [1,0,0,0,0,0|2,0,1]=4 344 B8R0.6 CC(C=O)COCCO Amb28313015 [1,0,0,0,0,0|3,0,0]=4 345 B8R0.6 CC(CCCCN)NO Amb27956523 [1,0,0,0,0,0|2,0,0]=3 346 B8R0.6 CC(CO)CCCCO Amb27751851 [1,0,0,0,0,0|2,0,1]=4 347 B8R0.6 CC(CO)NCCCN Amb28367225 [1,0,0,0,0,0|2,0,1]=4 348 B8R0.6 CC(CO)SCCCN Amb27755869 [1,0,0,0,0,0|2,0,1]=4 349 B8R0.6 CCC(C)CCCCN Amb25146190 [1,0,0,0,0,0|2,0,1]=4 350 B8R0.6 CCCCCC(C)CO Amb21618749 [1,0,0,0,0,0|2,0,1]=4 351 B8R0.6 CCCCCC(Cl)C=O Amb18643792 [1,0,0,0,0,0|2,0,0]=3 352 B8R0.6 CCCCCC(N)CO Amb24524295 [1,0,0,0,0,0|1,0,1]=3 353 B8R0.6 CCCCCC(O)C=O Amb18642802 [1,0,0,0,0,0|2,0,0]=3 354 B8R0.6 CCCCCC(O)CO Amb22227711 [1,0,0,0,0,0|2,0,1]=4 355 B8R0.6 CCCCC[C@@H](C)C=O Amb28351479 [1,0,0,0,0,0|2,0,0]=3 356 B8R0.6 CCCCC[C@@H](C)CO Amb28318700 [1,0,0,0,0,0|2,0,1]=4 357 B8R0.6 CCCCC[C@@H](O)CO Amb28281704 [1,0,0,0,0,0|2,0,1]=4 358 B8R0.6 CCCCC[C@H](Cl)C=O Amb28400198 [1,0,0,0,0,0|2,0,0]=3 359 B8R0.6 CCCCC[C@H](O)C=O Amb28198840 [1,0,0,0,0,0|2,0,0]=3 360 B8R0.6 CCCCC[C@H](O)CO Amb27762354 [1,0,0,0,0,0|2,0,1]=4 361 B8R0.6 CCCOCC(C)C=O Amb28241425 [1,0,0,0,0,0|3,0,0]=4 362 B8R0.6 CCCSCC(N)CO Amb28364274 [1,0,0,0,0,0|2,0,1]=4 363 B8R0.6 CCOCC[C@H](N)CO Amb27488751 [1,0,0,0,0,0|2,0,1]=4 364 B8R0.6 CCSCCC(N)CO Amb25820753 [1,0,0,0,0,0|2,0,1]=4 365 B8R0.6 CN(C=O)CCCCO Amb27434543 [1,0,0,0,0,0|3,0,0]=4 366 B8R0.6 COCCCC(C)C=O Amb28118341 [1,0,0,0,0,0|3,0,0]=4 367 B8R0.6 COCCCC(Cl)C=O Amb28146758 [1,0,0,0,0,0|3,0,0]=4 368 B8R0.6 COCCCC(N)CO Amb26550641 [1,0,0,0,0,0|2,0,1]=4 369 B8R0.6 CSCCCC(C)C=O Amb27973193 [1,0,0,0,0,0|3,0,0]=4 370 B8R0.6 CSCCCC(N)CO Amb25888586 [1,0,0,0,0,0|2,0,1]=4 371 B8R0.6 C[C@H](C=O)CCCC=O Amb28388637 [1,0,0,0,0,0|2,0,1]=4 372 B8R0.6 C[C@H](CO)CCCCO Amb27804560 [1,0,0,0,0,0|2,0,1]=4 373 B8R0.6 N#CC(N)CCCCN Amb24477887 [1,0,0,0,0,0|1,0,1]=3 374 B8R0.6 NC(CO)COCCO Amb27956486 [1,0,0,0,0,0|2,0,1]=4 375 B8R0.6 NCCCCC(N)CN Amb27602480 [1,0,0,0,0,0|1,0,1]=3 376 B8R0.6 NCCCCC(N)CO Amb27403112 [1,0,0,0,0,0|0,0,1]=2 377 B8R0.6 NCCCCC(N)CS Amb27409203 [1,0,0,0,0,0|0,1,1]=3 378 B8R0.6 NCCCC[C@H](N)C=O Amb27230236 [1,0,0,0,0,0|0,0,0]=1 379 B8R0.6 NCCCC[C@H](N)CN Amb27173098 [1,0,0,0,0,0|1,0,1]=3 380 B8R0.6 NCCCC[C@H](N)CO Amb25883920 [1,0,0,0,0,0|0,0,1]=2 381 B8R0.6 NCCCC[C@H](N)CO Amb33801813 [1,0,0,0,0,0|0,0,1]=2 382 B8R0.6 NCCCC\C(N)=N\O Amb26494974 [1,0,0,0,0,0|1,0,1]=3 383 B8R0.6 NCCCN\C(N)=N\O Amb27468839 [1,0,0,0,0,0|2,0,1]=4 384 B8R0.6 NCCNCC(N)CO Amb27234820 [1,0,0,0,0,0|1,0,1]=3 385 B8R0.6 NCCNCC(O)CO Amb28198046 [1,0,0,0,0,0|2,0,1]=4 386 B8R0.6 NCCNC[C@H](N)CO Amb27218189 [1,0,0,0,0,0|1,0,1]=3 387 B8R0.6 NCCNC[C@H](O)CO Amb27480727 [1,0,0,0,0,0|2,0,1]=4 388 B8R0.6 N\C(CCCCBr)=N\O Amb2695919 [1,0,0,0,0,0|2,0,1]=4 389 B8R0.6 N\C(CCCCCl)=N\O Amb2696032 [1,0,0,0,0,0|2,0,1]=4 390 B8R0.6 N\C(CCCCF)=N/O Amb27793943 [1,0,0,0,0,0|2,0,1]=4 391 B8R0.6 OCC(O)CCCCBr Amb27444663 [1,0,0,0,0,0|2,0,1]=4 392 B8R0.6 OCCCCC(O)CO Amb8513368 [1,0,0,0,0,0|2,0,1]=4 393 B8R0.7 C#CCCCCC(=O)Cl Amb28312904 [1,0,0,0,0,0|2,0,1]=4 394 B8R0.7 C#CCCCCC(=O)O Amb2721485 [1,0,0,0,0,0|1,0,1]=3 395 B8R0.7 C#CCCOCC(=O)O Amb28118359 [1,0,0,0,0,0|2,0,1]=4 396 B8R0.7 C#CCOCCC(=O)O Amb9208654 [1,0,0,0,0,0|2,0,1]=4 397 B8R0.7 C=C(Br)CNCCCN Amb18330318 [1,0,0,0,0,0|3,0,0]=4 398 B8R0.7 C=C(C)CCCCCBr Amb28436917 [1,0,0,0,0,0|3,0,0]=4 399 B8R0.7 C=C(C)CCCCCC Amb6298939 [1,0,0,0,0,0|3,0,0]=4 400 B8R0.7 C=C(C)CCCCCO Amb27641867 [1,0,0,0,0,0|3,0,0]=4 401 B8R0.7 C=C(C)CCSCCN Amb28123809 [1,0,0,0,0,0|3,0,0]=4 402 B8R0.7 C=C(C)CNCCCN Amb28044366 [1,0,0,0,0,0|3,0,0]=4 403 B8R0.7 C=C(C)COCCCN Amb28123400 [1,0,0,0,0,0|3,0,0]=4 404 B8R0.7 C=C(Cl)CCCCCCl Amb6298881 [1,0,0,0,0,0|3,0,0]=4 405 B8R0.7 C=C(Cl)COCCCN Amb28197915 [1,0,0,0,0,0|3,0,0]=4 406 B8R0.7 C=CCCCCC(=O)O Amb6299578 [1,0,0,0,0,0|1,0,1]=3 407 B8R0.7 C=CCCCCC(C)=O Amb24546961 [1,0,0,0,0,0|2,0,1]=4 408 B8R0.7 C=CCCCCC(N)=O Amb27236725 [1,0,0,0,0,0|2,0,1]=4 409 B8R0.7 C=CCCOCC(=O)O Amb7793843 [1,0,0,0,0,0|2,0,1]=4 410 B8R0.7 C=CCCSCC(=O)O Amb27810806 [1,0,0,0,0,0|2,0,1]=4 411 B8R0.7 C=CCNCCC(=O)O Amb33527032 [1,0,0,0,0,0|2,0,1]=4 412 B8R0.7 C=CCNCCC(=O)O Amb7755724 [1,0,0,0,0,0|2,0,1]=4 413 B8R0.7 CC#CCCCC(=O)O Amb28046337 [1,0,0,0,0,0|1,0,2]=4 414 B8R0.7 CC(=O)CCCCC#N Amb18642300 [1,0,0,0,0,0|1,0,2]=4 415 B8R0.7 CC(=O)CCCCCBr Amb27401578 [1,0,0,0,0,0|2,0,0]=3 416 B8R0.7 CC(=O)CCCCCCl Amb26591097 [1,0,0,0,0,0|2,0,0]=3 417 B8R0.7 CC(=O)CCCCCN Amb22641918 [1,0,0,0,0,0|1,0,0]=2 418 B8R0.7 CC(=O)CCCCCN Amb24113384 [1,0,0,0,0,0|1,0,0]=2 419 B8R0.7 CC(=O)CCCCCO Amb27237283 [1,0,0,0,0,0|2,0,0]=3 420 B8R0.7 CC(=O)CCNCCO Amb24481900 [1,0,0,0,0,0|3,0,0]=4 421 B8R0.7 CC(=O)CCOCCBr Amb32651831 [1,0,0,0,0,0|3,0,0]=4 422 B8R0.7 CC(=O)CCOCCCl Amb27982282 [1,0,0,0,0,0|3,0,0]=4 423 B8R0.7 CC(=O)CCOCCN Amb18628609 [1,0,0,0,0,0|2,0,0]=3 424 B8R0.7 CC(=O)COCCCN Amb18630475 [1,0,0,0,0,0|2,0,0]=3 425 B8R0.7 CC(=O)CSCCCF Amb28065634 [1,0,0,0,0,0|3,0,0]=4 426 B8R0.7 CC(=O)NCCCCCl Amb25883586 [1,0,0,0,0,0|3,0,0]=4 427 B8R0.7 CC(=O)NCCCCF Amb27180576 [1,0,0,0,0,0|3,0,0]=4 428 B8R0.7 CC(=O)NCCCCI Amb27768800 [1,0,0,0,0,0|3,0,0]=4 429 B8R0.7 CC(=O)NCCCCN Amb17053700 [1,0,0,0,0,0|2,0,0]=3 430 B8R0.7 CC(=O)NCCCCO Amb17102977 [1,0,0,0,0,0|3,0,0]=4 431 B8R0.7 CC(=O)NCCCON Amb17138378 [1,0,0,0,0,0|3,0,0]=4 432 B8R0.7 CC(=O)NCCCON Amb6308549 [1,0,0,0,0,0|3,0,0]=4 433 B8R0.7 CC(=O)OCCCCBr Amb2725321 [1,0,0,0,0,0|3,0,0]=4 434 B8R0.7 CC(=O)OCCCCCl Amb3940275 [1,0,0,0,0,0|3,0,0]=4 435 B8R0.7 CC(=O)OCCCCI Amb2725257 [1,0,0,0,0,0|3,0,0]=4 436 B8R0.7 CC(=O)OCCCCN Amb24657282 [1,0,0,0,0,0|2,0,0]=3 437 B8R0.7 CC(=O)OCCCCO Amb25714960 [1,0,0,0,0,0|3,0,0]=4 438 B8R0.7 CC(=O)SCCCCBr Amb22641871 [1,0,0,0,0,0|3,0,0]=4 439 B8R0.7 CC(=O)SCCCCN Amb24117263 [1,0,0,0,0,0|2,0,0]=3 440 B8R0.7 CC(=O)SCCCCN Amb27429858 [1,0,0,0,0,0|2,0,0]=3 441 B8R0.7 CC(C)=CCCCCN Amb28345726 [1,0,0,0,0,0|2,0,1]=4 442 B8R0.7 CC(C)CCCCCN Amb18124327 [1,0,0,0,0,0|2,0,1]=4 443 B8R0.7 CC(O)CCCCCF Amb27660009 [1,0,0,0,0,0|2,0,1]=4 444 B8R0.7 CC(O)CCCCCO Amb27464322 [1,0,0,0,0,0|2,0,1]=4 445 B8R0.7 CC(O)CCNCCN Amb27768810 [1,0,0,0,0,0|2,0,1]=4 446 B8R0.7 CC(O)COCCCN Amb28318924 [1,0,0,0,0,0|2,0,1]=4 447 B8R0.7 CCC#CCCC(=O)O Amb28046178 [1,0,0,0,0,0|1,0,2]=4 448 B8R0.7 CCCC#CCC(=O)O Amb17593307 [1,0,0,0,0,0|1,0,2]=4 449 B8R0.7 CCCCC#CC(=O)O Amb2721486 [1,0,0,0,0,0|1,0,2]=4 450 B8R0.7 CCCCCCB(O)O Amb2722519 [1,0,0,0,0,0|2,0,1]=4 451 B8R0.7 CCCCCCC(=O)Cl Amb3940244 [1,0,0,0,0,0|2,0,0]=3 452 B8R0.7 CCCCCCC(=O)O Amb34915914 [1,0,0,0,0,0|1,0,0]=2 453 B8R0.7 CCCCCCC(=O)O Amb3499439 [1,0,0,0,0,0|1,0,0]=2 454 B8R0.7 CCCCCCC(=O)[O-] Amb22729026 [1,0,0,0,0,0|1,0,1]=3 455 B8R0.7 CCCCCCC(C)=O Amb6891961 [1,0,0,0,0,0|2,0,0]=3 456 B8R0.7 CCCCCCC(C)O Amb3940385 [1,0,0,0,0,0|2,0,1]=4 457 B8R0.7 CCCCCCC(N)=O Amb8858816 [1,0,0,0,0,0|2,0,0]=3 458 B8R0.7 CCCCCCC(O)O Amb27451028 [1,0,0,0,0,0|1,0,2]=4 459 B8R0.7 CCCCCC[C@@H](C)O Amb8513616 [1,0,0,0,0,0|2,0,1]=4 460 B8R0.7 CCCCCC[N+](=O)[O-] Amb17618424 [1,0,0,0,0,0|2,0,1]=4 461 B8R0.7 CCCCCNC(N)=O Amb6246936 [1,0,0,0,0,0|3,0,0]=4 462 B8R0.7 CCCCCOC(=O)Cl Amb10844803 [1,0,0,0,0,0|3,0,0]=4 463 B8R0.7 CCCCCOC(N)=O Amb27655610 [1,0,0,0,0,0|3,0,0]=4 464 B8R0.7 CCCCNCC(=O)Cl Amb27189998 [1,0,0,0,0,0|3,0,0]=4 465 B8R0.7 CCCCNCC(=O)O Amb7766471 [1,0,0,0,0,0|2,0,0]=3 466 B8R0.7 CCCCNCC(N)=O Amb1126543 [1,0,0,0,0,0|3,0,0]=4 467 B8R0.7 CCCCNCC(N)=O Amb7969721 [1,0,0,0,0,0|3,0,0]=4 468 B8R0.7 CCCCOCC(=O)O Amb8514871 [1,0,0,0,0,0|2,0,0]=3 469 B8R0.7 CCCCOCC(N)=O Amb27855875 [1,0,0,0,0,0|3,0,0]=4 470 B8R0.7 CCCCSCC(=O)O Amb1138789 [1,0,0,0,0,0|2,0,0]=3 471 B8R0.7 CCCC\C=C\C(=O)O Amb17778752 [1,0,0,0,0,0|1,0,2]=4 472 B8R0.7 CCCNCCC(=O)O Amb18633174 [1,0,0,0,0,0|2,0,0]=3 473 B8R0.7 CCCNCCC(=O)O Amb2372065 [1,0,0,0,0,0|2,0,0]=3 474 B8R0.7 CCCNCCC(C)=O Amb24700442 [1,0,0,0,0,0|3,0,0]=4 475 B8R0.7 CCCNCC[PH](=O)O Amb28056179 [1,0,0,0,0,0|3,0,0]=4 476 B8R0.7 CCCOCCC(=O)O Amb8874502 [1,0,0,0,0,0|2,0,0]=3 477 B8R0.7 CCCOCCC(C)=O Amb8874915 [1,0,0,0,0,0|3,0,0]=4 478 B8R0.7 CCCONCC(=O)O Amb27401902 [1,0,0,0,0,0|3,0,0]=4 479 B8R0.7 CCC\C=C\CC(=O)O Amb18642602 [1,0,0,0,0,0|1,0,2]=4 480 B8R0.7 CCNCCCC(=O)O Amb30585148 [1,0,0,0,0,0|2,0,0]=3 481 B8R0.7 CCNCCCC(=O)O Amb6253896 [1,0,0,0,0,0|2,0,0]=3 482 B8R0.7 CCNCCCC(N)=O Amb24709859 [1,0,0,0,0,0|3,0,0]=4 483 B8R0.7 CCOCCCC(=O)O Amb6257602 [1,0,0,0,0,0|2,0,0]=3 484 B8R0.7 CCSCCCC(=O)O Amb6680204 [1,0,0,0,0,0|2,0,0]=3 485 B8R0.7 CCSCCCC(C)=O Amb9660283 [1,0,0,0,0,0|3,0,0]=4 486 B8R0.7 CCSSCCC(=O)O Amb27837279 [1,0,0,0,0,0|3,0,0]=4 487 B8R0.7 CC\C=C/CCC(=O)O Amb25831265 [1,0,0,0,0,0|1,0,2]=4 488 B8R0.7 CC\C=C\CCC(=O)O Amb18642608 [1,0,0,0,0,0|1,0,2]=4 489 B8R0.7 CN(C)CCCCCN Amb2721306 [1,0,0,0,0,0|3,0,0]=4 490 B8R0.7 CN(C)CCCCCN Amb31291017 [1,0,0,0,0,0|3,0,0]=4 491 B8R0.7 CN(C)CCCCCN Amb33800157 [1,0,0,0,0,0|3,0,0]=4 492 B8R0.7 CNCCCCC(=O)O Amb10605773 [1,0,0,0,0,0|2,0,0]=3 493 B8R0.7 CNCCCCC(=O)O Amb24340485 [1,0,0,0,0,0|2,0,0]=3 494 B8R0.7 CNCCCCC(N)=O Amb27780478 [1,0,0,0,0,0|3,0,0]=4 495 B8R0.7 CNCCOCC(=O)O Amb18630741 [1,0,0,0,0,0|3,0,0]=4 496 B8R0.7 COCCCCC(=O)O Amb9207785 [1,0,0,0,0,0|2,0,0]=3 497 B8R0.7 COCCCCC(C)=O Amb9659801 [1,0,0,0,0,0|3,0,0]=4 498 B8R0.7 COCCNCC(=O)O Amb19514667 [1,0,0,0,0,0|3,0,0]=4 499 B8R0.7 COCCNCC(=O)O Amb7766415 [1,0,0,0,0,0|3,0,0]=4 500 B8R0.7 COCCOCC(=O)O Amb2721259 [1,0,0,0,0,0|3,0,0]=4 501 B8R0.7 COCCSCC(=O)O Amb6245777 [1,0,0,0,0,0|3,0,0]=4 502 B8R0.7 COCOCCC(=O)O Amb27784860 [1,0,0,0,0,0|3,0,0]=4 503 B8R0.7 COCSCCC(=O)O Amb27263382 [1,0,0,0,0,0|3,0,0]=4 504 B8R0.7 CS(=O)CCCCCCl Amb27173793 [1,0,0,0,0,0|3,0,0]=4 505 B8R0.7 CSCCCCC(=O)O Amb17503764 [1,0,0,0,0,0|2,0,0]=3 506 B8R0.7 CSCCCCC(C)=O Amb27815140 [1,0,0,0,0,0|3,0,0]=4 507 B8R0.7 CSCCCCC(N)=O Amb27662727 [1,0,0,0,0,0|3,0,0]=4 508 B8R0.7 CSCCNCC(=O)O Amb24401934 [1,0,0,0,0,0|3,0,0]=4 509 B8R0.7 CSCCNCC(=O)O Amb28934977 [1,0,0,0,0,0|3,0,0]=4 510 B8R0.7 CSCCOCC(=O)O Amb27392229 [1,0,0,0,0,0|3,0,0]=4 511 B8R0.7 CSCCSCC(=O)O Amb27964765 [1,0,0,0,0,0|3,0,0]=4 512 B8R0.7 CSSCCCC(=O)O Amb25269470 [1,0,0,0,0,0|3,0,0]=4 513 B8R0.7 C[C@@H](O)CCCCCO Amb28461367 [1,0,0,0,0,0|2,0,1]=4 514 B8R0.7 C[C@H](O)CNCCCN Amb27755469 [1,0,0,0,0,0|2,0,1]=4 515 B8R0.7 C\C=C\CCCC(=O)O Amb18642615 [1,0,0,0,0,0|1,0,2]=4 516 B8R0.7 N#CCCCCC(=O)O Amb17593332 [1,0,0,0,0,0|0,0,2]=3 517 B8R0.7 N#CCCCCC(N)=O Amb24108037 [1,0,0,0,0,0|1,0,2]=4 518 B8R0.7 N#CCCNCC(=O)O Amb2720474 [1,0,0,0,0,0|1,0,2]=4 519 B8R0.7 N#CCCSCC(=O)O Amb17502363 [1,0,0,0,0,0|1,0,2]=4 520 B8R0.7 N#CCSCCC(=O)O Amb6277440 [1,0,0,0,0,0|1,0,2]=4 521 B8R0.7 N=C(N)CCCCCO Amb27447678 [1,0,0,0,0,0|3,0,0]=4 522 B8R0.7 N=C(N)NCCCCN Amb19929571 [1,0,0,0,0,0|3,0,0]=4 523 B8R0.7 N=C(N)NCCCCN Amb2781574 [1,0,0,0,0,0|3,0,0]=4 524 B8R0.7 N=C(N)NCCCCN Amb3941521 [1,0,0,0,0,0|3,0,0]=4 525 B8R0.7 NC(=O)CCCCCBr Amb2685265 [1,0,0,0,0,0|2,0,0]=3 526 B8R0.7 NC(=O)CCCCCCl Amb27392074 [1,0,0,0,0,0|2,0,0]=3 527 B8R0.7 NC(=O)CCCCCF Amb27837777 [1,0,0,0,0,0|2,0,0]=3 528 B8R0.7 NC(=O)CCCCCO Amb22524369 [1,0,0,0,0,0|2,0,0]=3 529 B8R0.7 NC(=O)CCNCCO Amb4303499 [1,0,0,0,0,0|3,0,0]=4 530 B8R0.7 NC(=O)CCOCCO Amb28289325 [1,0,0,0,0,0|3,0,0]=4 531 B8R0.7 NC(=O)CCSCCBr Amb28367265 [1,0,0,0,0,0|3,0,0]=4 532 B8R0.7 NC(=O)CCSCCCl Amb27620677 [1,0,0,0,0,0|3,0,0]=4 533 B8R0.7 NC(=O)CNCCCO Amb9246617 [1,0,0,0,0,0|3,0,0]=4 534 B8R0.7 NC(=O)CSCCCCl Amb28397637 [1,0,0,0,0,0|3,0,0]=4 535 B8R0.7 NC(=O)CSCCCO Amb27408312 [1,0,0,0,0,0|3,0,0]=4 536 B8R0.7 NC(=O)CSCCCS Amb27965314 [1,0,0,0,0,0|3,0,0]=4 537 B8R0.7 NC(=O)NCCCCBr Amb27614497 [1,0,0,0,0,0|3,0,0]=4 538 B8R0.7 NC(=O)NCCCCF Amb27663218 [1,0,0,0,0,0|3,0,0]=4 539 B8R0.7 NC(=S)CCCCCF Amb27956470 [1,0,0,0,0,0|2,1,0]=4 540 B8R0.7 NCCCC#CC(=O)O Amb33168806 [1,0,0,0,0,0|0,0,2]=3 541 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [1,0,0,0,0,0|1,0,0]=2 542 B8R0.7 NCCCCCC(=O)O Amb17607928 [1,0,0,0,0,0|0,0,0]=1 543 B8R0.7 NCCCCCC(=O)O Amb1905625 [1,0,0,0,0,0|0,0,0]=1 544 B8R0.7 NCCCCCC(=O)[O-] Amb28990947 [1,0,0,0,0,0|0,0,1]=2 545 B8R0.7 NCCCCNC(=S)S Amb26625184 [1,0,0,0,0,0|1,2,0]=4 546 B8R0.7 NCCCCNC(N)=O Amb19026975 [1,0,0,0,0,0|2,0,0]=3 547 B8R0.7 NCCCCNC(N)=O Amb19374296 [1,0,0,0,0,0|2,0,0]=3 548 B8R0.7 NCCCCNC(N)=S Amb28041776 [1,0,0,0,0,0|2,1,0]=4 549 B8R0.7 NCCCOCC(=O)O Amb18111435 [1,0,0,0,0,0|1,0,0]=2 550 B8R0.7 NCCCOCC(=O)O Amb31217489 [1,0,0,0,0,0|1,0,0]=2 551 B8R0.7 NCCCSCC(=O)O Amb17500676 [1,0,0,0,0,0|1,0,0]=2 552 B8R0.7 NCCC\C=C\C(=O)O Amb25221789 [1,0,0,0,0,0|0,0,2]=3 553 B8R0.7 NCCNCCC(=O)O Amb20668304 [1,0,0,0,0,0|1,0,0]=2 554 B8R0.7 NCCNCCC(=O)O Amb22058790 [1,0,0,0,0,0|1,0,0]=2 555 B8R0.7 NCCNCCC(N)=O Amb27436823 [1,0,0,0,0,0|2,0,0]=3 556 B8R0.7 NCCNCC[SH](=O)=O Amb27816609 [1,0,0,0,0,0|2,0,1]=4 557 B8R0.7 NCCOCCC(=O)O Amb18630461 [1,0,0,0,0,0|1,0,0]=2 558 B8R0.7 NCCOCCC(=O)O Amb33330744 [1,0,0,0,0,0|1,0,0]=2 559 B8R0.7 NCCOCCC(N)=O Amb27751130 [1,0,0,0,0,0|2,0,0]=3 560 B8R0.7 NCCSCCC(=O)O Amb21988844 [1,0,0,0,0,0|1,0,0]=2 561 B8R0.7 NCCSSCC(=O)O Amb27658690 [1,0,0,0,0,0|2,0,0]=3 562 B8R0.7 NOCCCCC(=O)O Amb27596055 [1,0,0,0,0,0|1,0,0]=2 563 B8R0.7 NS(=O)CCCCCBr Amb32720462 [1,0,0,0,0,0|3,0,0]=4 564 B8R0.7 O=C(Cl)CCCCCBr Amb2685267 [1,0,0,0,0,0|2,0,0]=3 565 B8R0.7 O=C(Cl)CCCCCCl Amb10844967 [1,0,0,0,0,0|2,0,0]=3 566 B8R0.7 O=C(Cl)CCCCCO Amb28056558 [1,0,0,0,0,0|2,0,0]=3 567 B8R0.7 O=C(Cl)CCNCCCl Amb28121157 [1,0,0,0,0,0|3,0,0]=4 568 B8R0.7 O=C(Cl)CCOCCCl Amb27966437 [1,0,0,0,0,0|3,0,0]=4 569 B8R0.7 O=C(Cl)OCCCCCl Amb8515449 [1,0,0,0,0,0|3,0,0]=4 570 B8R0.7 O=C(F)CCCCCCl Amb27173031 [1,0,0,0,0,0|2,0,0]=3 571 B8R0.7 O=C(O)CCC#CCO Amb27949900 [1,0,0,0,0,0|1,0,2]=4 572 B8R0.7 O=C(O)CCCCCBr Amb2081955 [1,0,0,0,0,0|1,0,0]=2 573 B8R0.7 O=C(O)CCCCCCl Amb18796646 [1,0,0,0,0,0|1,0,0]=2 574 B8R0.7 O=C(O)CCCCCF Amb26063796 [1,0,0,0,0,0|1,0,0]=2 575 B8R0.7 O=C(O)CCCCCI Amb22736492 [1,0,0,0,0,0|1,0,0]=2 576 B8R0.7 O=C(O)CCCCCO Amb8515991 [1,0,0,0,0,0|1,0,0]=2 577 B8R0.7 O=C(O)CCCCNO Amb28410171 [1,0,0,0,0,0|2,0,0]=3 578 B8R0.7 O=C(O)CCCN=C=S Amb26330552 [1,0,0,0,0,0|2,0,1]=4 579 B8R0.7 O=C(O)CCNCCF Amb27954272 [1,0,0,0,0,0|2,0,0]=3 580 B8R0.7 O=C(O)CCNCCO Amb1110010 [1,0,0,0,0,0|2,0,0]=3 581 B8R0.7 O=C(O)CCNCCS Amb28285239 [1,0,0,0,0,0|2,0,0]=3 582 B8R0.7 O=C(O)CCOCCBr Amb24057757 [1,0,0,0,0,0|2,0,0]=3 583 B8R0.7 O=C(O)CCOCCF Amb27807548 [1,0,0,0,0,0|2,0,0]=3 584 B8R0.7 O=C(O)CCOCCO Amb6680916 [1,0,0,0,0,0|2,0,0]=3 585 B8R0.7 O=C(O)CCOCCS Amb27226892 [1,0,0,0,0,0|2,0,0]=3 586 B8R0.7 O=C(O)CCSCCBr Amb27468126 [1,0,0,0,0,0|2,0,0]=3 587 B8R0.7 O=C(O)CCSCCF Amb27172860 [1,0,0,0,0,0|2,0,0]=3 588 B8R0.7 O=C(O)CCSCCS Amb18126456 [1,0,0,0,0,0|2,0,0]=3 589 B8R0.7 O=C(O)CNCCCCl Amb28055692 [1,0,0,0,0,0|2,0,0]=3 590 B8R0.7 O=C(O)CNCCCF Amb27649256 [1,0,0,0,0,0|2,0,0]=3 591 B8R0.7 O=C(O)CNCCCO Amb9325805 [1,0,0,0,0,0|2,0,0]=3 592 B8R0.7 O=C(O)COCCCO Amb28288633 [1,0,0,0,0,0|2,0,0]=3 593 B8R0.7 O=C(O)C\C=C/CCO Amb28410474 [1,0,0,0,0,0|1,0,2]=4 594 B8R0.7 O=C(O)C\C=C\CCO Amb27221056 [1,0,0,0,0,0|1,0,2]=4 595 B8R0.7 O=C(O)C\C=C\CCS Amb27421360 [1,0,0,0,0,0|1,0,2]=4 596 B8R0.7 O=C(O)\C=C\CCCCl Amb18644386 [1,0,0,0,0,0|1,0,2]=4 597 B8R0.7 O=C([O-])CCCCCO Amb22491268 [1,0,0,0,0,0|1,0,1]=3 598 B8R0.7 O=C=NCCCC(=O)O Amb26014000 [1,0,0,0,0,0|2,0,1]=4 599 B8R0.7 O=CCCCCC(=O)O Amb18642763 [1,0,0,0,0,0|1,0,1]=3 600 B8R0.7 O=CNCCCC(=O)O Amb18305404 [1,0,0,0,0,0|2,0,1]=4 601 B8R0.7 O=COCCCC(=O)O Amb27217713 [1,0,0,0,0,0|2,0,1]=4 602 B8R0.7 O=S(Cl)CCCCCBr Amb32720461 [1,0,0,0,0,0|3,0,0]=4 603 B8R0.7 O=S([O-])CCCCCBr Amb32755703 [1,0,0,0,0,0|2,0,1]=4 604 B8R0.7 O=S([O-])CCCCCO Amb27394866 [1,0,0,0,0,0|2,0,1]=4 605 B8R0.7 O=[N+]([O-])CCCCCO Amb25911225 [1,0,0,0,0,0|2,0,1]=4 606 B8R0.7 OB(O)CCCCCBr Amb21856239 [1,0,0,0,0,0|2,0,1]=4 607 B8R0.7 OB(O)CCCCCCl Amb25047934 [1,0,0,0,0,0|2,0,1]=4 608 B8R0.7 OCCCCCB(O)O Amb27614305 [1,0,0,0,0,0|2,0,1]=4 609 B8R0.7 [N-]=[N+]=NCCCC(=O)O Amb10575820 [1,0,0,0,0,0|2,0,1]=4 610 B8R0.8 C#CCCC(C)C(=O)O Amb27464960 [1,0,0,0,0,0|1,0,2]=4 611 B8R0.8 C#CCCC(N)C(=O)O Amb6277526 [1,0,0,0,0,0|0,0,2]=3 612 B8R0.8 C#CCCC(N)C(N)=O Amb25703121 [1,0,0,0,0,0|1,0,2]=4 613 B8R0.8 C#CCC[C@@H](N)C(=O)O Amb24088809 [1,0,0,0,0,0|0,0,2]=3 614 B8R0.8 C#CCC[C@H](N)C(=O)O Amb24088866 [1,0,0,0,0,0|0,0,2]=3 615 B8R0.8 C#CCC[C@H](N)C(=O)O Amb33744060 [1,0,0,0,0,0|0,0,2]=3 616 B8R0.8 C=C(Br)C(O)CCCC Amb27978217 [1,0,0,0,0,0|3,0,0]=4 617 B8R0.8 C=C(C)C(Cl)CCCC Amb27433963 [1,0,0,0,0,0|3,0,0]=4 618 B8R0.8 C=C(C)C(N)CSCC Amb27252910 [1,0,0,0,0,0|3,0,0]=4 619 B8R0.8 C=C(C)C(O)CCCC Amb4037317 [1,0,0,0,0,0|3,0,0]=4 620 B8R0.8 C=C(C)[C@H](O)CCCC Amb28205959 [1,0,0,0,0,0|3,0,0]=4 621 B8R0.8 C=C(CCCC)C(=O)O Amb18642649 [1,0,0,0,0,0|1,0,1]=3 622 B8R0.8 C=C(CCCC)C(C)=O Amb27260457 [1,0,0,0,0,0|2,0,1]=4 623 B8R0.8 C=C(CCCO)C(=O)O Amb28313844 [1,0,0,0,0,0|2,0,1]=4 624 B8R0.8 C=C(CCOC)C(=O)O Amb26588153 [1,0,0,0,0,0|2,0,1]=4 625 B8R0.8 C=C(CCSC)C(=O)O Amb27188177 [1,0,0,0,0,0|2,0,1]=4 626 B8R0.8 C=C(COCC)C(=O)O Amb27444042 [1,0,0,0,0,0|2,0,1]=4 627 B8R0.8 C=C(CSCC)C(=O)O Amb26023918 [1,0,0,0,0,0|2,0,1]=4 628 B8R0.8 C=C=CCC(N)C(=O)O Amb25843448 [1,0,0,0,0,0|0,0,3]=4 629 B8R0.8 C=C=CC[C@@H](N)C(=O)O Amb28070890 [1,0,0,0,0,0|0,0,3]=4 630 B8R0.8 C=CCCC(Br)C(=O)O Amb28047448 [1,0,0,0,0,0|1,0,2]=4 631 B8R0.8 C=CCCC(C)C(=O)O Amb18642656 [1,0,0,0,0,0|1,0,2]=4 632 B8R0.8 C=CCCC(N)C(=O)O Amb24383848 [1,0,0,0,0,0|0,0,2]=3 633 B8R0.8 C=CCCC(N)C(=O)O Amb28934988 [1,0,0,0,0,0|0,0,2]=3 634 B8R0.8 C=CCCC(N)C(N)=O Amb24333721 [1,0,0,0,0,0|1,0,2]=4 635 B8R0.8 C=CCC[C@@H](N)C(=O)O Amb23439045 [1,0,0,0,0,0|0,0,2]=3 636 B8R0.8 C=CCC[C@@H](N)C(N)=O Amb27168705 [1,0,0,0,0,0|1,0,2]=4 637 B8R0.8 C=CCC[C@H](N)C(=O)O Amb28285244 [1,0,0,0,0,0|0,0,2]=3 638 B8R0.8 C=CCC[C@H](O)C(=O)O Amb28122952 [1,0,0,0,0,0|1,0,2]=4 639 B8R0.8 C=CSCC(N)C(=O)O Amb28321669 [1,0,0,0,0,0|1,0,2]=4 640 B8R0.8 CC#CCC(C)C(=O)O Amb28281174 [1,0,0,0,0,0|1,0,2]=4 641 B8R0.8 CC#CCC(N)C(=O)O Amb18988250 [1,0,0,0,0,0|0,0,2]=3 642 B8R0.8 CC#CCC(N)C(=O)O Amb33551077 [1,0,0,0,0,0|0,0,2]=3 643 B8R0.8 CC#CCC(N)C(N)=O Amb25793338 [1,0,0,0,0,0|1,0,2]=4 644 B8R0.8 CC#CC[C@@H](N)C(=O)O Amb22746783 [1,0,0,0,0,0|0,0,2]=3 645 B8R0.8 CC#CC[C@H](N)C(=O)O Amb27815040 [1,0,0,0,0,0|0,0,2]=3 646 B8R0.8 CC(=O)C(=O)CCCN Amb27666363 [1,0,0,0,0,0|2,0,1]=4 647 B8R0.8 CC(=O)C(C)CCCF Amb27593343 [1,0,0,0,0,0|3,0,0]=4 648 B8R0.8 CC(=O)C(C)CCCO Amb27628329 [1,0,0,0,0,0|3,0,0]=4 649 B8R0.8 CC(=O)C(C)OCCN Amb18111235 [1,0,0,0,0,0|3,0,0]=4 650 B8R0.8 CC(=O)C(Cl)CCCO Amb27860344 [1,0,0,0,0,0|3,0,0]=4 651 B8R0.8 CC(=O)N(C)CCCN Amb32666496 [1,0,0,0,0,0|3,0,0]=4 652 B8R0.8 CC(=O)N(C)CCCN Amb33533003 [1,0,0,0,0,0|3,0,0]=4 653 B8R0.8 CC(=O)N(N)CCCN Amb27404575 [1,0,0,0,0,0|2,0,0]=3 654 B8R0.8 CC(=O)[C@@H](N)CCCO Amb27835141 [1,0,0,0,0,0|2,0,0]=3 655 B8R0.8 CC(CCC#N)C(=O)O Amb24462559 [1,0,0,0,0,0|1,0,2]=4 656 B8R0.8 CC(CCCCl)C(=O)O Amb2720283 [1,0,0,0,0,0|2,0,0]=3 657 B8R0.8 CC(CCCF)C(=O)O Amb25244585 [1,0,0,0,0,0|2,0,0]=3 658 B8R0.8 CC(CCCN)C(=O)O Amb25146072 [1,0,0,0,0,0|1,0,0]=2 659 B8R0.8 CC(CCCN)C(=O)O Amb32686960 [1,0,0,0,0,0|1,0,0]=2 660 B8R0.8 CC(CCCN)C(N)=O Amb27667997 [1,0,0,0,0,0|2,0,0]=3 661 B8R0.8 CC(NCCS)C(=O)O Amb28057720 [1,0,0,0,0,0|3,0,0]=4 662 B8R0.8 CC(OCCF)C(=O)O Amb27240801 [1,0,0,0,0,0|3,0,0]=4 663 B8R0.8 CC(OCCN)C(=O)O Amb22546285 [1,0,0,0,0,0|2,0,0]=3 664 B8R0.8 CC(OCCO)C(=O)O Amb6680915 [1,0,0,0,0,0|3,0,0]=4 665 B8R0.8 CC(OCCS)C(=O)O Amb27857332 [1,0,0,0,0,0|3,0,0]=4 666 B8R0.8 CC(SCCCl)C(=O)O Amb27404902 [1,0,0,0,0,0|3,0,0]=4 667 B8R0.8 CC(SCCN)C(=O)O Amb17500447 [1,0,0,0,0,0|2,0,0]=3 668 B8R0.8 CCCCC(=O)C(=O)O Amb18642761 [1,0,0,0,0,0|1,0,1]=3 669 B8R0.8 CCCCC(=O)C(=O)[O-] Amb32664416 [1,0,0,0,0,0|1,0,2]=4 670 B8R0.8 CCCCC(=O)C(C)=O Amb2721315 [1,0,0,0,0,0|2,0,1]=4 671 B8R0.8 CCCCC(Br)C(=O)Br Amb22347914 [1,0,0,0,0,0|2,0,0]=3 672 B8R0.8 CCCCC(Br)C(=O)Cl Amb17569836 [1,0,0,0,0,0|2,0,0]=3 673 B8R0.8 CCCCC(Br)C(=O)O Amb9703129 [1,0,0,0,0,0|1,0,0]=2 674 B8R0.8 CCCCC(Br)C(C)O Amb27400344 [1,0,0,0,0,0|2,0,1]=4 675 B8R0.8 CCCCC(Br)C(N)=O Amb19514624 [1,0,0,0,0,0|2,0,0]=3 676 B8R0.8 CCCCC(Br)C(N)=S Amb27239240 [1,0,0,0,0,0|2,1,0]=4 677 B8R0.8 CCCCC(C)C(=O)O Amb3939937 [1,0,0,0,0,0|1,0,0]=2 678 B8R0.8 CCCCC(C)C(C)=O Amb4034582 [1,0,0,0,0,0|2,0,0]=3 679 B8R0.8 CCCCC(C)C(C)O Amb4017613 [1,0,0,0,0,0|2,0,1]=4 680 B8R0.8 CCCCC(C)C(N)=O Amb8504697 [1,0,0,0,0,0|2,0,0]=3 681 B8R0.8 CCCCC(C)S(=O)Cl Amb32720495 [1,0,0,0,0,0|3,0,0]=4 682 B8R0.8 CCCCC(C)S(=O)[O-] Amb32754844 [1,0,0,0,0,0|2,0,1]=4 683 B8R0.8 CCCCC(C)S(N)=O Amb32720496 [1,0,0,0,0,0|3,0,0]=4 684 B8R0.8 CCCCC(C)[N+](=O)[O-] Amb27229455 [1,0,0,0,0,0|2,0,1]=4 685 B8R0.8 CCCCC(Cl)C(=O)O Amb17593750 [1,0,0,0,0,0|1,0,0]=2 686 B8R0.8 CCCCC(Cl)C(N)=O Amb27803407 [1,0,0,0,0,0|2,0,0]=3 687 B8R0.8 CCCCC(F)C(=O)O Amb25238781 [1,0,0,0,0,0|1,0,0]=2 688 B8R0.8 CCCCC(F)C(C)=O Amb27228475 [1,0,0,0,0,0|2,0,0]=3 689 B8R0.8 CCCCC(F)C(N)=O Amb28060527 [1,0,0,0,0,0|2,0,0]=3 690 B8R0.8 CCCCC(N)B(O)O Amb26622066 [1,0,0,0,0,0|1,0,1]=3 691 B8R0.8 CCCCC(N)C(=O)O Amb4134813 [1,0,0,0,0,0|0,0,0]=1 692 B8R0.8 CCCCC(N)C(C)=O Amb1099238 [1,0,0,0,0,0|1,0,0]=2 693 B8R0.8 CCCCC(N)C(C)=O Amb22284085 [1,0,0,0,0,0|1,0,0]=2 694 B8R0.8 CCCCC(N)C(C)O Amb24351619 [1,0,0,0,0,0|1,0,1]=3 695 B8R0.8 CCCCC(N)C(C)O Amb28935013 [1,0,0,0,0,0|1,0,1]=3 696 B8R0.8 CCCCC(N)C(F)F Amb27852425 [1,0,0,0,0,0|2,0,1]=4 697 B8R0.8 CCCCC(N)C(N)=O Amb18303664 [1,0,0,0,0,0|1,0,0]=2 698 B8R0.8 CCCCC(N)[PH](=O)O Amb27863480 [1,0,0,0,0,0|1,0,0]=2 699 B8R0.8 CCCCC(O)C(=O)O Amb3941634 [1,0,0,0,0,0|1,0,0]=2 700 B8R0.8 CCCCC(O)C(C)=O Amb27877068 [1,0,0,0,0,0|2,0,0]=3 701 B8R0.8 CCCCC(O)C(N)=O Amb24116640 [1,0,0,0,0,0|2,0,0]=3 702 B8R0.8 CCCCC(O)[PH](=O)O Amb27488929 [1,0,0,0,0,0|2,0,0]=3 703 B8R0.8 CCCCC(S)C(=O)O Amb25323873 [1,0,0,0,0,0|1,0,0]=2 704 B8R0.8 CCCCN(C)C(=O)Cl Amb17563097 [1,0,0,0,0,0|3,0,0]=4 705 B8R0.8 CCCCN(C)C(N)=O Amb6245238 [1,0,0,0,0,0|3,0,0]=4 706 B8R0.8 CCCCN(N)C(C)=O Amb33191476 [1,0,0,0,0,0|2,0,0]=3 707 B8R0.8 CCCC[C@@H](C)C(=O)O Amb24590691 [1,0,0,0,0,0|1,0,0]=2 708 B8R0.8 CCCC[C@@H](C)[C@H](C)O Amb27763643 [1,0,0,0,0,0|2,0,1]=4 709 B8R0.8 CCCC[C@@H](Cl)B(O)O Amb27657838 [1,0,0,0,0,0|2,0,1]=4 710 B8R0.8 CCCC[C@@H](Cl)C(=O)O Amb27471038 [1,0,0,0,0,0|1,0,0]=2 711 B8R0.8 CCCC[C@@H](N)C(=O)O Amb1995006 [1,0,0,0,0,0|0,0,0]=1 712 B8R0.8 CCCC[C@H](Br)C(=O)O Amb28385588 [1,0,0,0,0,0|1,0,0]=2 713 B8R0.8 CCCC[C@H](C)C(=O)O Amb25850678 [1,0,0,0,0,0|1,0,0]=2 714 B8R0.8 CCCC[C@H](Cl)C(=O)Cl Amb28291526 [1,0,0,0,0,0|2,0,0]=3 715 B8R0.8 CCCC[C@H](Cl)C(=O)O Amb27955265 [1,0,0,0,0,0|1,0,0]=2 716 B8R0.8 CCCC[C@H](N)C(=O)O Amb1995007 [1,0,0,0,0,0|0,0,0]=1 717 B8R0.8 CCCC[C@H](N)C(N)=O Amb9813732 [1,0,0,0,0,0|1,0,0]=2 718 B8R0.8 CCCC[C@H](O)C(=O)O Amb27626002 [1,0,0,0,0,0|1,0,0]=2 719 B8R0.8 CCCC[C@H](O)[C@@H](C)O Amb28139279 [1,0,0,0,0,0|2,0,1]=4 720 B8R0.8 CCCNC(=O)C(=O)O Amb9303791 [1,0,0,0,0,0|2,0,1]=4 721 B8R0.8 CCCNC(C)C(=O)O Amb9326994 [1,0,0,0,0,0|2,0,0]=3 722 B8R0.8 CCCN[C@H](C)C(=O)O Amb28073462 [1,0,0,0,0,0|2,0,0]=3 723 B8R0.8 CCCOC(=O)C(=O)O Amb28399593 [1,0,0,0,0,0|2,0,1]=4 724 B8R0.8 CCCOC(C)C(=O)O Amb8874518 [1,0,0,0,0,0|2,0,0]=3 725 B8R0.8 CCCOC(C)C(N)=O Amb27424673 [1,0,0,0,0,0|3,0,0]=4 726 B8R0.8 CCCSC(=S)C(=O)O Amb27808849 [1,0,0,0,0,0|2,0,1]=4 727 B8R0.8 CCCSC(C)C(=O)O Amb6274283 [1,0,0,0,0,0|2,0,0]=3 728 B8R0.8 CCCSC(C)C(N)=O Amb28070722 [1,0,0,0,0,0|3,0,0]=4 729 B8R0.8 CCCSC(F)C(=O)O Amb27655346 [1,0,0,0,0,0|2,0,0]=3 730 B8R0.8 CCCSC(N)C(=O)O Amb27865736 [1,0,0,0,0,0|1,0,0]=2 731 B8R0.8 CCCSC(O)C(=O)O Amb27592135 [1,0,0,0,0,0|2,0,0]=3 732 B8R0.8 CCC\C=C(/Br)C(=O)O Amb27816159 [1,0,0,0,0,0|1,0,2]=4 733 B8R0.8 CCC\C=C(/C)C(=O)O Amb10844998 [1,0,0,0,0,0|1,0,2]=4 734 B8R0.8 CCC\C=C(\F)C(=O)O Amb27448669 [1,0,0,0,0,0|1,0,2]=4 735 B8R0.8 CCNCC(C)C(=O)O Amb13952782 [1,0,0,0,0,0|2,0,0]=3 736 B8R0.8 CCNCC(C)C(=O)O Amb9400285 [1,0,0,0,0,0|2,0,0]=3 737 B8R0.8 CCNCC(C)C(N)=O Amb8944545 [1,0,0,0,0,0|3,0,0]=4 738 B8R0.8 CCNCC(O)C(N)=O Amb28049207 [1,0,0,0,0,0|3,0,0]=4 739 B8R0.8 CCOCC(Br)C(=O)O Amb28458425 [1,0,0,0,0,0|2,0,0]=3 740 B8R0.8 CCOCC(C)C(=O)O Amb9172215 [1,0,0,0,0,0|2,0,0]=3 741 B8R0.8 CCOCC(C)C(N)=O Amb28067564 [1,0,0,0,0,0|3,0,0]=4 742 B8R0.8 CCOCC(N)C(=O)O Amb28048685 [1,0,0,0,0,0|1,0,0]=2 743 B8R0.8 CCOCC(N)C(=O)O Amb33542705 [1,0,0,0,0,0|1,0,0]=2 744 B8R0.8 CCOCC(N)C(N)=O Amb26973746 [1,0,0,0,0,0|2,0,0]=3 745 B8R0.8 CCOC[C@@H](C)C(=O)O Amb25790635 [1,0,0,0,0,0|2,0,0]=3 746 B8R0.8 CCOC[C@@H](N)C(=O)O Amb25889733 [1,0,0,0,0,0|1,0,0]=2 747 B8R0.8 CCOC[C@@H](N)C(=O)O Amb30585227 [1,0,0,0,0,0|1,0,0]=2 748 B8R0.8 CCOC[C@@H](O)C(=O)O Amb33347463 [1,0,0,0,0,0|2,0,0]=3 749 B8R0.8 CCOC[C@H](C)C(=O)O Amb10844265 [1,0,0,0,0,0|2,0,0]=3 750 B8R0.8 CCOC[C@H](N)C(=O)O Amb22737184 [1,0,0,0,0,0|1,0,0]=2 751 B8R0.8 CCOC[C@H](N)C(=O)O Amb24478577 [1,0,0,0,0,0|1,0,0]=2 752 B8R0.8 CCSCC(C)C(=O)O Amb9400067 [1,0,0,0,0,0|2,0,0]=3 753 B8R0.8 CCSCC(C)C(C)=O Amb27409600 [1,0,0,0,0,0|3,0,0]=4 754 B8R0.8 CCSCC(N)C(=O)O Amb6257004 [1,0,0,0,0,0|1,0,0]=2 755 B8R0.8 CCSCC(O)C(=O)O Amb27231753 [1,0,0,0,0,0|2,0,0]=3 756 B8R0.8 CCSC[C@H](O)C(=O)O Amb27983830 [1,0,0,0,0,0|2,0,0]=3 757 B8R0.8 CC\C=C\C(C)C(=O)O Amb33172515 [1,0,0,0,0,0|1,0,2]=4 758 B8R0.8 CC\C=C\C(N)C(=O)O Amb33449874 [1,0,0,0,0,0|0,0,2]=3 759 B8R0.8 CC\C=C\C(O)C(=O)O Amb27781864 [1,0,0,0,0,0|1,0,2]=4 760 B8R0.8 CC\C=C\[C@@H](N)C(=O)O Amb27239476 [1,0,0,0,0,0|0,0,2]=3 761 B8R0.8 CNCCC(C)C(N)=O Amb28368198 [1,0,0,0,0,0|3,0,0]=4 762 B8R0.8 COCCC(=O)C(=O)O Amb27959741 [1,0,0,0,0,0|2,0,1]=4 763 B8R0.8 COCCC(Br)C(=O)Cl Amb27209614 [1,0,0,0,0,0|3,0,0]=4 764 B8R0.8 COCCC(C)C(=O)O Amb18523823 [1,0,0,0,0,0|2,0,0]=3 765 B8R0.8 COCCC(Cl)C(=O)Cl Amb28118917 [1,0,0,0,0,0|3,0,0]=4 766 B8R0.8 COCCC(Cl)C(=O)O Amb27424361 [1,0,0,0,0,0|2,0,0]=3 767 B8R0.8 COCCC(N)C(=O)O Amb32675454 [1,0,0,0,0,0|1,0,0]=2 768 B8R0.8 COCCC(N)C(=O)O Amb6281324 [1,0,0,0,0,0|1,0,0]=2 769 B8R0.8 COCCC(N)C(N)=O Amb18311365 [1,0,0,0,0,0|2,0,0]=3 770 B8R0.8 COCCC(N)C(N)=O Amb32712112 [1,0,0,0,0,0|2,0,0]=3 771 B8R0.8 COCCC(O)C(=O)O Amb27647966 [1,0,0,0,0,0|2,0,0]=3 772 B8R0.8 COCCN(C)C(=O)O Amb32677018 [1,0,0,0,0,0|3,0,0]=4 773 B8R0.8 COCC[C@@H](N)C(=O)O Amb16183870 [1,0,0,0,0,0|1,0,0]=2 774 B8R0.8 COCC[C@H](N)C(=O)O Amb16183872 [1,0,0,0,0,0|1,0,0]=2 775 B8R0.8 COCC[C@H](N)C(=O)O Amb24054991 [1,0,0,0,0,0|1,0,0]=2 776 B8R0.8 COCOC(C)C(=O)O Amb28120688 [1,0,0,0,0,0|3,0,0]=4 777 B8R0.8 COCSC(C)C(=O)O Amb28410278 [1,0,0,0,0,0|3,0,0]=4 778 B8R0.8 CONCC(N)C(N)=O Amb27216151 [1,0,0,0,0,0|3,0,0]=4 779 B8R0.8 CO\C=C\[C@@H](N)C(=O)O Amb27427471 [1,0,0,0,0,0|1,0,2]=4 780 B8R0.8 CPOC[C@H](N)C(=O)O Amb27424475 [1,0,0,0,0,0|2,0,0]=3 781 B8R0.8 CSCCC(=N)C(=O)O Amb27196552 [1,0,0,0,0,0|1,0,2]=4 782 B8R0.8 CSCCC(=O)C(=O)O Amb18643588 [1,0,0,0,0,0|2,0,1]=4 783 B8R0.8 CSCCC(C)C(=O)O Amb24739356 [1,0,0,0,0,0|2,0,0]=3 784 B8R0.8 CSCCC(Cl)C(=O)O Amb27468599 [1,0,0,0,0,0|2,0,0]=3 785 B8R0.8 CSCCC(Cl)C(N)=O Amb18185555 [1,0,0,0,0,0|3,0,0]=4 786 B8R0.8 CSCCC(N)C(=O)O Amb9703095 [1,0,0,0,0,0|1,0,0]=2 787 B8R0.8 CSCCC(N)C(C)=O Amb28388741 [1,0,0,0,0,0|2,0,0]=3 788 B8R0.8 CSCCC(N)C(C)O Amb27655583 [1,0,0,0,0,0|2,0,1]=4 789 B8R0.8 CSCCC(N)C(N)=O Amb17142872 [1,0,0,0,0,0|2,0,0]=3 790 B8R0.8 CSCCC(N)C(N)=O Amb32752921 [1,0,0,0,0,0|2,0,0]=3 791 B8R0.8 CSCCC(O)C(=O)O Amb18304609 [1,0,0,0,0,0|2,0,0]=3 792 B8R0.8 CSCCC(O)C(=O)[O-] Amb8393072 [1,0,0,0,0,0|2,0,1]=4 793 B8R0.8 CSCCC(O)C(N)=O Amb20669403 [1,0,0,0,0,0|3,0,0]=4 794 B8R0.8 CSCC[C@@H](N)C(=O)O Amb2720567 [1,0,0,0,0,0|1,0,0]=2 795 B8R0.8 CSCC[C@@H](N)C(=O)[O-] Amb32414686 [1,0,0,0,0,0|1,0,1]=3 796 B8R0.8 CSCC[C@@H](N)C(N)=O Amb18035930 [1,0,0,0,0,0|2,0,0]=3 797 B8R0.8 CSCC[C@@H](N)C(N)=O Amb22750575 [1,0,0,0,0,0|2,0,0]=3 798 B8R0.8 CSCC[C@@H](O)C(=O)O Amb25124092 [1,0,0,0,0,0|2,0,0]=3 799 B8R0.8 CSCC[C@H](Cl)C(=O)O Amb28286496 [1,0,0,0,0,0|2,0,0]=3 800 B8R0.8 CSCC[C@H](N)C(=O)O Amb5720611 [1,0,0,0,0,0|1,0,0]=2 801 B8R0.8 CSCC[C@H](N)C(C)=O Amb27763449 [1,0,0,0,0,0|2,0,0]=3 802 B8R0.8 CSCC[C@H](N)C(N)=O Amb8390412 [1,0,0,0,0,0|2,0,0]=3 803 B8R0.8 CSCC[C@H](N)C(N)=O Amb9813735 [1,0,0,0,0,0|2,0,0]=3 804 B8R0.8 CSCC[C@H](O)C(=O)O Amb28285270 [1,0,0,0,0,0|2,0,0]=3 805 B8R0.8 CSCOC(N)C(=O)O Amb27634144 [1,0,0,0,0,0|2,0,0]=3 806 B8R0.8 CSCO[C@H](N)C(=O)O Amb28183053 [1,0,0,0,0,0|2,0,0]=3 807 B8R0.8 CSOCC(N)C(=O)O Amb28285144 [1,0,0,0,0,0|2,0,0]=3 808 B8R0.8 CSSCC(C)C(=O)O Amb27240302 [1,0,0,0,0,0|3,0,0]=4 809 B8R0.8 CSSC[C@@H](N)C(=O)O Amb28381312 [1,0,0,0,0,0|2,0,0]=3 810 B8R0.8 CSSC[C@H](N)C(=O)O Amb28118786 [1,0,0,0,0,0|2,0,0]=3 811 B8R0.8 CS\C=C/[C@H](N)C(=O)O Amb26006745 [1,0,0,0,0,0|1,0,2]=4 812 B8R0.8 CS\C=C\C(N)C(=O)O Amb27759361 [1,0,0,0,0,0|1,0,2]=4 813 B8R0.8 C[C@@H](CCC#N)C(=O)O Amb27870712 [1,0,0,0,0,0|1,0,2]=4 814 B8R0.8 C[C@@H](CCCN)C(=O)O Amb28314637 [1,0,0,0,0,0|1,0,0]=2 815 B8R0.8 C[C@@H](NCCF)C(=O)O Amb28073998 [1,0,0,0,0,0|3,0,0]=4 816 B8R0.8 C[C@@H](NCCO)C(=O)O Amb26885478 [1,0,0,0,0,0|3,0,0]=4 817 B8R0.8 C[C@@H](OCCF)C(=O)O Amb27763930 [1,0,0,0,0,0|3,0,0]=4 818 B8R0.8 C[C@@H](OCCO)C(=O)O Amb28318043 [1,0,0,0,0,0|3,0,0]=4 819 B8R0.8 C[C@@H](SCCN)C(=O)O Amb27170977 [1,0,0,0,0,0|2,0,0]=3 820 B8R0.8 C[C@H](NCCO)C(=O)O Amb28058421 [1,0,0,0,0,0|3,0,0]=4 821 B8R0.8 C[C@H](OCCN)C(=O)O Amb27479935 [1,0,0,0,0,0|2,0,0]=3 822 B8R0.8 C[C@H](OCCO)C(=O)O Amb27398048 [1,0,0,0,0,0|3,0,0]=4 823 B8R0.8 C[Se]CCC(N)C(=O)O Amb8514803 [1,0,0,0,0,0|1,0,0]=2 824 B8R0.8 C[Se]CC[C@@H](N)C(=O)O Amb31031165 [1,0,0,0,0,0|1,0,0]=2 825 B8R0.8 C[Se]CC[C@H](N)C(=O)O Amb8514895 [1,0,0,0,0,0|1,0,0]=2 826 B8R0.8 C\C(=C/CCN)C(=O)O Amb28397850 [1,0,0,0,0,0|1,0,2]=4 827 B8R0.8 C\C=C\CC(C)C(=O)O Amb18642630 [1,0,0,0,0,0|1,0,2]=4 828 B8R0.8 C\C=C\CC(F)C(=O)O Amb27959670 [1,0,0,0,0,0|1,0,2]=4 829 B8R0.8 C\C=C\CC(N)C(=O)O Amb6256663 [1,0,0,0,0,0|0,0,2]=3 830 B8R0.8 C\C=C\CC(N)C(N)=O Amb26904386 [1,0,0,0,0,0|1,0,2]=4 831 B8R0.8 C\C=C\C[C@@H](N)C(=O)O Amb33065673 [1,0,0,0,0,0|0,0,2]=3 832 B8R0.8 C\C=C\C[C@H](C)C(=O)O Amb28368854 [1,0,0,0,0,0|1,0,2]=4 833 B8R0.8 C\C=C\C[C@H](N)C(=O)O Amb27768785 [1,0,0,0,0,0|0,0,2]=3 834 B8R0.8 N#CCCC(Br)C(=O)O Amb27863558 [1,0,0,0,0,0|1,0,2]=4 835 B8R0.8 N#CCCC(N)C(=O)O Amb18642589 [1,0,0,0,0,0|0,0,2]=3 836 B8R0.8 N#CCCC(N)C(N)=O Amb26567424 [1,0,0,0,0,0|1,0,2]=4 837 B8R0.8 N#CCCC(O)C(=O)O Amb28239951 [1,0,0,0,0,0|1,0,2]=4 838 B8R0.8 N#CCCC([AlH5])C(=O)O Amb31132465 [1,0,0,0,0,0|1,0,2]=4 839 B8R0.8 N#CCC[C@@H](N)C(=O)O Amb25063958 [1,0,0,0,0,0|0,0,2]=3 840 B8R0.8 N#CCC[C@H](N)C(=O)O Amb16183912 [1,0,0,0,0,0|0,0,2]=3 841 B8R0.8 N#CCC[C@H](O)C(=O)O Amb28144260 [1,0,0,0,0,0|1,0,2]=4 842 B8R0.8 N#CSCC(N)C(=O)O Amb17593655 [1,0,0,0,0,0|1,0,2]=4 843 B8R0.8 NC(=O)C(N)CCCF Amb27424739 [1,0,0,0,0,0|2,0,0]=3 844 B8R0.8 NC(=O)C(N)CCCO Amb33066182 [1,0,0,0,0,0|2,0,0]=3 845 B8R0.8 NC(CCCBr)C(=O)O Amb24480263 [1,0,0,0,0,0|1,0,0]=2 846 B8R0.8 NC(CCCCl)B(O)O Amb27491021 [1,0,0,0,0,0|2,0,1]=4 847 B8R0.8 NC(CCCF)C(=O)O Amb25366994 [1,0,0,0,0,0|1,0,0]=2 848 B8R0.8 NC(CCCO)C(=O)O Amb18642915 [1,0,0,0,0,0|1,0,0]=2 849 B8R0.8 NC(CCCO)C(=O)O Amb22900028 [1,0,0,0,0,0|1,0,0]=2 850 B8R0.8 NC(CCCS)C(=O)O Amb27947968 [1,0,0,0,0,0|1,0,0]=2 851 B8R0.8 NC(CCNO)C(=O)O Amb28285114 [1,0,0,0,0,0|2,0,0]=3 852 B8R0.8 NC(CN=C=S)C(=O)O Amb28281778 [1,0,0,0,0,0|2,0,1]=4 853 B8R0.8 NC(C\C=C\Br)C(=O)O Amb27607572 [1,0,0,0,0,0|1,0,2]=4 854 B8R0.8 NC(C\C=C\Cl)C(=O)O Amb33037023 [1,0,0,0,0,0|1,0,2]=4 855 B8R0.8 NCCCC(Br)C(=O)O Amb17595166 [1,0,0,0,0,0|1,0,0]=2 856 B8R0.8 NCCCC(F)C(=O)O Amb27235092 [1,0,0,0,0,0|1,0,0]=2 857 B8R0.8 NCCCC(N)C(=O)O Amb22489477 [1,0,0,0,0,0|0,0,0]=1 858 B8R0.8 NCCCC(N)C(=O)O Amb4006442 [1,0,0,0,0,0|0,0,0]=1 859 B8R0.8 NCCCC(N)C(=O)O Amb9173756 [1,0,0,0,0,0|0,0,0]=1 860 B8R0.8 NCCCC(N)C(=S)S Amb27657930 [1,0,0,0,0,0|0,2,0]=3 861 B8R0.8 NCCCC(N)C(N)=O Amb24118008 [1,0,0,0,0,0|1,0,0]=2 862 B8R0.8 NCCCC(N)[PH](=O)O Amb27645413 [1,0,0,0,0,0|1,0,0]=2 863 B8R0.8 NCCC[C@@H](N)C(=O)O Amb32411789 [1,0,0,0,0,0|0,0,0]=1 864 B8R0.8 NCCC[C@@H](N)C(=O)O Amb6600152 [1,0,0,0,0,0|0,0,0]=1 865 B8R0.8 NCCC[C@@H](N)C(=O)O Amb8390415 [1,0,0,0,0,0|0,0,0]=1 866 B8R0.8 NCCC[C@H](N)C(=O)O Amb20240598 [1,0,0,0,0,0|0,0,0]=1 867 B8R0.8 NCCC[C@H](N)C(=O)O Amb22746434 [1,0,0,0,0,0|0,0,0]=1 868 B8R0.8 NCCC[C@H](N)C(=O)O Amb8513279 [1,0,0,0,0,0|0,0,0]=1 869 B8R0.8 NCCC[C@H](N)C(=O)O Amb8627869 [1,0,0,0,0,0|0,0,0]=1 870 B8R0.8 NCCC[C@H](O)C(=O)O Amb27804309 [1,0,0,0,0,0|1,0,0]=2 871 B8R0.8 NCC\C=C(\F)C(=O)O Amb27398392 [1,0,0,0,0,0|1,0,2]=4 872 B8R0.8 NCOCC(N)C(=O)O Amb27429950 [1,0,0,0,0,0|1,0,0]=2 873 B8R0.8 NCOC[C@@H](N)C(=O)O Amb27233969 [1,0,0,0,0,0|1,0,0]=2 874 B8R0.8 NC\C=C\[C@H](N)C(=O)O Amb24580033 [1,0,0,0,0,0|0,0,2]=3 875 B8R0.8 NOCCC(N)C(=O)O Amb17593409 [1,0,0,0,0,0|1,0,0]=2 876 B8R0.8 NOCCC(N)C(=O)O Amb21858490 [1,0,0,0,0,0|1,0,0]=2 877 B8R0.8 NOCC[C@H](N)C(=O)O Amb26346874 [1,0,0,0,0,0|1,0,0]=2 878 B8R0.8 NOCC[C@H](N)C(=O)O Amb33038084 [1,0,0,0,0,0|1,0,0]=2 879 B8R0.8 N[C@@H](CCCCl)C(=O)O Amb27227989 [1,0,0,0,0,0|1,0,0]=2 880 B8R0.8 N[C@@H](CCCF)C(=O)O Amb27223043 [1,0,0,0,0,0|1,0,0]=2 881 B8R0.8 N[C@@H](CCCO)C(=O)O Amb16183887 [1,0,0,0,0,0|1,0,0]=2 882 B8R0.8 N[C@@H](CCNO)C(=O)O Amb24117852 [1,0,0,0,0,0|2,0,0]=3 883 B8R0.8 N[C@@H](CSCO)C(=O)O Amb27470985 [1,0,0,0,0,0|2,0,0]=3 884 B8R0.8 N[C@@H](CSN=O)C(=O)O Amb28182982 [1,0,0,0,0,0|3,0,0]=4 885 B8R0.8 N[C@@H](C\C=C\Cl)C(=O)O Amb33065741 [1,0,0,0,0,0|1,0,2]=4 886 B8R0.8 N[C@H](CCCBr)C(=O)O Amb26080278 [1,0,0,0,0,0|1,0,0]=2 887 B8R0.8 N[C@H](CCCF)C(=O)O Amb26908418 [1,0,0,0,0,0|1,0,0]=2 888 B8R0.8 N[C@H](CCCO)C(=O)O Amb28120579 [1,0,0,0,0,0|1,0,0]=2 889 B8R0.8 N[C@H](CCCO)C(=O)O Amb34913429 [1,0,0,0,0,0|1,0,0]=2 890 B8R0.8 N[C@H](CSN=O)C(=O)O Amb27845439 [1,0,0,0,0,0|3,0,0]=4 891 B8R0.8 N[C@H](C\C=C\Cl)C(=O)O Amb33309034 [1,0,0,0,0,0|1,0,2]=4 892 B8R0.8 O=C(O)C(=O)CCCF Amb33196459 [1,0,0,0,0,0|2,0,1]=4 893 B8R0.8 O=C(O)C(=O)CCCO Amb27470301 [1,0,0,0,0,0|2,0,1]=4 894 B8R0.8 O=C(O)C(=O)CCCO Amb30666618 [1,0,0,0,0,0|2,0,1]=4 895 B8R0.8 O=C(O)C(Br)CCCCl Amb17595866 [1,0,0,0,0,0|2,0,0]=3 896 B8R0.8 O=C(O)C(Br)CCCO Amb28313364 [1,0,0,0,0,0|2,0,0]=3 897 B8R0.8 O=C(O)C(O)CCCF Amb33196454 [1,0,0,0,0,0|2,0,0]=3 898 B8R0.8 O=C(O)C(O)CCCO Amb18642939 [1,0,0,0,0,0|2,0,0]=3 899 B8R0.8 O=C([O-])C(O)CCCO Amb28935028 [1,0,0,0,0,0|2,0,1]=4 900 B8R0.8 [N-]=[N+]=NCC(N)C(=O)O Amb28342834 [1,0,0,0,0,0|2,0,1]=4 901 B8R0.8 [N-]=[N+]=NCC(N)C(=O)O Amb35752605 [1,0,0,0,0,0|2,0,1]=4 902 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O Amb26007532 [1,0,0,0,0,0|2,0,1]=4 903 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O Amb33734276 [1,0,0,0,0,0|2,0,1]=4 904 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O Amb25072668 [1,0,0,0,0,0|2,0,1]=4 905 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O Amb30586485 [1,0,0,0,0,0|2,0,1]=4 906 B10R0.5 CCCCCC(N)P(=O)(O)O Amb8516013 [0,1,0,0,0,0|2,0,0]=3 907 B10R0.26 C#CCN(C)CC(N)C(=O)O Amb27986636 [0,1,0,0,0,0|2,0,1]=4 908 B10R0.26 C=CCS(=O)C[C@@H](N)C(=O)O Amb16193379 [0,1,0,0,0,0|2,0,1]=4 909 B10R0.26 C=CCS(=O)C[C@H](N)C(=O)O Amb10843492 [0,1,0,0,0,0|2,0,1]=4 910 B10R0.26 CC(NC(=O)CCN)C(=O)O Amb18304954 [0,1,0,0,0,0|2,0,1]=4 911 B10R0.26 CCCC(=O)CC(N)C(=O)O Amb33065496 [0,1,0,0,0,0|1,0,1]=3 912 B10R0.26 CCCC(=O)CC(N)C(N)=O Amb33036932 [0,1,0,0,0,0|2,0,1]=4 913 B10R0.26 CCCC(=O)C[C@@H](N)C(=O)O Amb33036798 [0,1,0,0,0,0|1,0,1]=3 914 B10R0.26 CCCC(=O)C[C@H](N)C(=O)O Amb33065790 [0,1,0,0,0,0|1,0,1]=3 915 B10R0.26 CCCC(C)CC(=O)C(=O)O Amb18126145 [0,1,0,0,0,0|2,0,1]=4 916 B10R0.26 CCCC(C)CC(C)C(=O)O Amb18799967 [0,1,0,0,0,0|2,0,0]=3 917 B10R0.26 CCCC(C)CC(N)C(=O)O Amb18183357 [0,1,0,0,0,0|1,0,0]=2 918 B10R0.26 CCCC(C)CC(N)C(N)=O Amb33308991 [0,1,0,0,0,0|2,0,0]=3 919 B10R0.26 CCCC(C)CC(O)C(=O)O Amb33353286 [0,1,0,0,0,0|2,0,0]=3 920 B10R0.26 CCCC(C)C[C@@H](N)C(=O)O Amb33065585 [0,1,0,0,0,0|1,0,0]=2 921 B10R0.26 CCCC(C)C[C@H](N)C(=O)O Amb33127579 [0,1,0,0,0,0|1,0,0]=2 922 B10R0.26 CCCS(=O)C[C@@H](N)C(=O)O Amb22904243 [0,1,0,0,0,0|2,0,0]=3 923 B10R0.26 CCNC(=O)CC(N)C(=O)O Amb27990016 [0,1,0,0,0,0|2,0,1]=4 924 B10R0.26 CCOC(=O)CC(N)C(=O)O Amb4017449 [0,1,0,0,0,0|2,0,1]=4 925 B10R0.26 CCOC(=O)CC(N)C(=O)O Amb4019239 [0,1,0,0,0,0|2,0,1]=4 926 B10R0.26 CCOC(C)CC(C)C(=O)O Amb33474365 [0,1,0,0,0,0|3,0,0]=4 927 B10R0.26 CCOC(C)CC(N)C(=O)O Amb33425733 [0,1,0,0,0,0|2,0,0]=3 928 B10R0.26 CCOC(C)CC(O)C(=O)O Amb33079786 [0,1,0,0,0,0|3,0,0]=4 929 B10R0.26 COCC(=O)CC(N)C(=O)O Amb32789418 [0,1,0,0,0,0|2,0,1]=4 930 B10R0.26 COCC(=O)C[C@@H](N)C(=O)O Amb33308520 [0,1,0,0,0,0|2,0,1]=4 931 B10R0.26 COCC(=O)C[C@H](N)C(=O)O Amb33036839 [0,1,0,0,0,0|2,0,1]=4 932 B10R0.26 COCC(C)CC(O)C(=O)O Amb33353382 [0,1,0,0,0,0|3,0,0]=4 933 B10R0.26 COCC(O)CC(N)C(=O)O Amb33065944 [0,1,0,0,0,0|2,0,0]=3 934 B10R0.26 COCC(O)CC(N)C(N)=O Amb33309017 [0,1,0,0,0,0|3,0,0]=4 935 B10R0.26 COCC(O)C[C@@H](N)C(=O)O Amb33036693 [0,1,0,0,0,0|2,0,0]=3 936 B10R0.26 COCC(O)C[C@H](N)C(=O)O Amb33037070 [0,1,0,0,0,0|2,0,0]=3 937 B10R0.26 C[C@@H](NC(=O)CCN)C(=O)O Amb18179956 [0,1,0,0,0,0|2,0,1]=4 938 B10R0.26 C[C@H](NC(=O)CCN)C(=O)O Amb26660401 [0,1,0,0,0,0|2,0,1]=4 939 B10R0.26 C\C(=C/CO)C[C@H](N)C(=O)O Amb27990183 [0,1,0,0,0,0|1,0,2]=4 940 B10R0.26 N#CCS(=O)CC(N)C(=O)O Amb26081512 [0,1,0,0,0,0|1,0,2]=4 941 B10R0.26 N#CCS(=O)C[C@H](N)C(=O)O Amb26998029 [0,1,0,0,0,0|1,0,2]=4 942 B10R0.26 NCCC(Cl)CC(N)C(=O)O Amb29838276 [0,1,0,0,0,0|0,0,0]=1 943 B10R0.26 NCCC(O)CC(N)C(=O)O Amb31031050 [0,1,0,0,0,0|0,0,0]=1 944 B10R0.26 NCCS(=O)CC(=O)C(=O)O Amb33069856 [0,1,0,0,0,0|2,0,1]=4 945 B10R0.42 CC(C)(OCCCN)C(=O)O Amb18111566 [0,1,0,0,0,0|2,0,0]=3 946 B10R0.42 CC(C)(SCCCN)C(=O)O Amb17500718 [0,1,0,0,0,0|2,0,0]=3 947 B10R0.42 CC(C)(SCCCO)C(=O)O Amb17502859 [0,1,0,0,0,0|3,0,0]=4 948 B10R0.42 CC(N)(C\C=C\CN)C(=O)O Amb27673467 [0,1,0,0,0,0|0,0,2]=3 949 B10R0.42 CCCCCC(C)(C)C(=O)O Amb33531410 [0,1,0,0,0,0|2,0,0]=3 950 B10R0.42 CCCCCC(C)(O)C(=O)O Amb33359515 [0,1,0,0,0,0|2,0,0]=3 951 B10R0.42 CCCCSC(C)(C)C(=O)O Amb17501482 [0,1,0,0,0,0|3,0,0]=4 952 B10R0.42 CCCNCC(F)(F)C(=O)O Amb33170575 [0,1,0,0,0,0|3,0,0]=4 953 B10R0.42 CCCOCC(F)(F)C(=O)O Amb33171243 [0,1,0,0,0,0|3,0,0]=4 954 B10R0.42 CCCSCC(F)(F)C(=O)O Amb33171140 [0,1,0,0,0,0|3,0,0]=4 955 B10R0.42 CCSCCC(C)(C)C(=O)O Amb33429927 [0,1,0,0,0,0|3,0,0]=4 956 B10R0.42 CCSCCC(C)(O)C(=O)O Amb33323707 [0,1,0,0,0,0|3,0,0]=4 957 B10R0.42 COCCCC(C)(C)C(=O)O Amb18797801 [0,1,0,0,0,0|3,0,0]=4 958 B10R0.42 COCCCC(C)(O)C(=O)O Amb33378802 [0,1,0,0,0,0|3,0,0]=4 959 B10R0.42 CSCCCC(C)(C)C(=O)O Amb33172307 [0,1,0,0,0,0|3,0,0]=4 960 B10R0.42 CSCCCC(C)(O)C(=O)O Amb33197644 [0,1,0,0,0,0|3,0,0]=4 961 B10R0.42 NCCNCC(F)(F)C(=O)O Amb33170576 [0,1,0,0,0,0|2,0,0]=3 962 B10R0.42 NCCSCC(F)(F)C(=O)O Amb33171141 [0,1,0,0,0,0|2,0,0]=3 963 B10R0.42 O=C(O)C(F)(F)CNCCF Amb33170580 [0,1,0,0,0,0|3,0,0]=4 964 B10R0.42 O=C(O)C(F)(F)CNCCO Amb33170579 [0,1,0,0,0,0|3,0,0]=4 965 B10R0.42 O=C(O)C(F)(F)CSCCO Amb33171142 [0,1,0,0,0,0|3,0,0]=4 966 B10R0.42 O=C(O)C(O)(O)CCCCO Amb24113204 [0,1,0,0,0,0|2,0,0]=3 967 B10R0.75 C=CCCCCC(N)C(=O)O Amb34184143 [0,1,0,0,0,0|1,0,0]=2 968 B10R0.75 C=CCCCC[C@@H](N)C(=O)O Amb22747247 [0,1,0,0,0,0|1,0,0]=2 969 B10R0.75 C=CCCCC[C@H](N)C(=O)O Amb22270014 [0,1,0,0,0,0|1,0,0]=2 970 B10R0.75 C=CCOCCC(N)C(=O)O Amb33065557 [0,1,0,0,0,0|1,0,1]=3 971 B10R0.75 C=CCOCCC(N)C(N)=O Amb32788581 [0,1,0,0,0,0|2,0,1]=4 972 B10R0.75 C=CCOCC[C@@H](N)C(=O)O Amb33065682 [0,1,0,0,0,0|1,0,1]=3 973 B10R0.75 C=CCOCC[C@H](N)C(=O)O Amb33065627 [0,1,0,0,0,0|1,0,1]=3 974 B10R0.75 C=CCSCCC(N)C(=O)O Amb18180511 [0,1,0,0,0,0|1,0,1]=3 975 B10R0.75 C=CCSCCC(N)C(=O)O Amb32663205 [0,1,0,0,0,0|1,0,1]=3 976 B10R0.75 C=CCSCC[C@H](N)C(=O)O Amb32663418 [0,1,0,0,0,0|1,0,1]=3 977 B10R0.75 C=CCSCC[C@H](N)C(=O)O Amb32663419 [0,1,0,0,0,0|1,0,1]=3 978 B10R0.75 C=CCSSC[C@H](N)C(=O)O Amb33330242 [0,1,0,0,0,0|2,0,1]=4 979 B10R0.75 C=C\C=C\CCC(N)C(=O)O Amb33308773 [0,1,0,0,0,0|1,0,2]=4 980 B10R0.75 C=C\C=C\CC[C@@H](N)C(=O)O Amb33309012 [0,1,0,0,0,0|1,0,2]=4 981 B10R0.75 C=C\C=C\CC[C@H](N)C(=O)O Amb33066030 [0,1,0,0,0,0|1,0,2]=4 982 B10R0.75 CC#CCCCC(N)C(=O)O Amb27673466 [0,1,0,0,0,0|1,0,1]=3 983 B10R0.75 CC#CCNCC(N)C(=O)O Amb27988454 [0,1,0,0,0,0|1,0,2]=4 984 B10R0.75 CC#CCSCC(N)C(=O)O Amb18183766 [0,1,0,0,0,0|1,0,2]=4 985 B10R0.75 CC#CCSC[C@H](N)C(=O)O Amb27670833 [0,1,0,0,0,0|1,0,2]=4 986 B10R0.75 CC(=O)N(O)CCCCCN Amb33379128 [0,1,0,0,0,0|3,0,0]=4 987 B10R0.75 CC(=O)N(O)CCCCCN Amb33379129 [0,1,0,0,0,0|3,0,0]=4 988 B10R0.75 CC(CCCN=C=O)C(=O)O Amb33471417 [0,1,0,0,0,0|2,0,1]=4 989 B10R0.75 CC(CCCN=C=S)C(=O)O Amb33471652 [0,1,0,0,0,0|2,0,1]=4 990 B10R0.75 CC(SCCCC#N)C(=O)O Amb6280922 [0,1,0,0,0,0|1,0,2]=4 991 B10R0.75 CC(SCCCCN)C(=O)O Amb17500920 [0,1,0,0,0,0|1,0,0]=2 992 B10R0.75 CCCCCCC(Br)C(=O)Br Amb24061160 [0,1,0,0,0,0|3,0,0]=4 993 B10R0.75 CCCCCCC(C)C(=O)O Amb10843971 [0,1,0,0,0,0|2,0,0]=3 994 B10R0.75 CCCCCCC(F)C(=O)O Amb32663880 [0,1,0,0,0,0|2,0,0]=3 995 B10R0.75 CCCCCCC(N)C(=O)O Amb2613445 [0,1,0,0,0,0|1,0,0]=2 996 B10R0.75 CCCCCCC(N)C(N)=O Amb18791950 [0,1,0,0,0,0|2,0,0]=3 997 B10R0.75 CCCCCC[C@@H](N)C(=O)O Amb16183913 [0,1,0,0,0,0|1,0,0]=2 998 B10R0.75 CCCCCC[C@H](N)C(=O)O Amb16183914 [0,1,0,0,0,0|1,0,0]=2 999 B10R0.75 CCCOCCC(N)C(=O)O Amb18177730 [0,1,0,0,0,0|1,0,0]=2 1000 B10R0.75 CCCOCCC(N)C(N)=O Amb18787994 [0,1,0,0,0,0|2,0,0]=3 1001 B10R0.75 CCCOCC[C@@H](N)C(=O)O Amb33036139 [0,1,0,0,0,0|1,0,0]=2 1002 B10R0.75 CCCOCC[C@H](N)C(=O)O Amb33065384 [0,1,0,0,0,0|1,0,0]=2 1003 B10R0.75 CCC\C=C\CC(C)C(=O)O Amb33171981 [0,1,0,0,0,0|2,0,1]=4 1004 B10R0.75 CCC\C=C\CC(N)C(=O)O Amb33327187 [0,1,0,0,0,0|1,0,1]=3 1005 B10R0.75 CCOCCCC(N)C(=O)O Amb33036943 [0,1,0,0,0,0|1,0,0]=2 1006 B10R0.75 CCOCCCC(N)C(N)=O Amb33308891 [0,1,0,0,0,0|2,0,0]=3 1007 B10R0.75 CCOCCC[C@@H](N)C(=O)O Amb33065544 [0,1,0,0,0,0|1,0,0]=2 1008 B10R0.75 CCOCCC[C@H](N)C(=O)O Amb33065515 [0,1,0,0,0,0|1,0,0]=2 1009 B10R0.75 CCOCCOC(C)C(=O)O Amb6262432 [0,1,0,0,0,0|3,0,0]=4 1010 B10R0.75 CCSCCCC(C)C(=O)O Amb33449009 [0,1,0,0,0,0|2,0,0]=3 1011 B10R0.75 CCSCCCC(N)C(=O)O Amb32865930 [0,1,0,0,0,0|1,0,0]=2 1012 B10R0.75 CCSCCCC(N)C(N)=O Amb33065711 [0,1,0,0,0,0|2,0,0]=3 1013 B10R0.75 CCSCCC[C@@H](N)C(=O)O Amb33066174 [0,1,0,0,0,0|1,0,0]=2 1014 B10R0.75 CCSCCC[C@H](N)C(=O)O Amb32937037 [0,1,0,0,0,0|1,0,0]=2 1015 B10R0.75 CC\C=C\CCC(C)C(=O)O Amb33267859 [0,1,0,0,0,0|2,0,1]=4 1016 B10R0.75 CNCCCC[C@H](N)C(=O)O Amb33786042 [0,1,0,0,0,0|0,0,0]=1 1017 B10R0.75 CNCCSCC(=O)C(=O)O Amb33069826 [0,1,0,0,0,0|2,0,1]=4 1018 B10R0.75 COCC#CCC(N)C(=O)O Amb33065829 [0,1,0,0,0,0|1,0,2]=4 1019 B10R0.75 COCC#CC[C@@H](N)C(=O)O Amb33308826 [0,1,0,0,0,0|1,0,2]=4 1020 B10R0.75 COCC#CC[C@H](N)C(=O)O Amb33066259 [0,1,0,0,0,0|1,0,2]=4 1021 B10R0.75 COCCCCC(C)C(=O)O Amb32953450 [0,1,0,0,0,0|2,0,0]=3 1022 B10R0.75 COCCCCC(N)C(=O)O Amb33066324 [0,1,0,0,0,0|1,0,0]=2 1023 B10R0.75 COCCCCC(N)C(N)=O Amb33065768 [0,1,0,0,0,0|2,0,0]=3 1024 B10R0.75 COCCCC[C@@H](N)C(=O)O Amb33308996 [0,1,0,0,0,0|1,0,0]=2 1025 B10R0.75 COCCCC[C@H](N)C(=O)O Amb33036987 [0,1,0,0,0,0|1,0,0]=2 1026 B10R0.75 COCCOCC(N)C(=O)O Amb18177789 [0,1,0,0,0,0|2,0,0]=3 1027 B10R0.75 COCCOCC(N)C(N)=O Amb18788117 [0,1,0,0,0,0|3,0,0]=4 1028 B10R0.75 COCCOC[C@@H](N)C(=O)O Amb33308732 [0,1,0,0,0,0|2,0,0]=3 1029 B10R0.75 COCCOC[C@H](N)C(=O)O Amb32668352 [0,1,0,0,0,0|2,0,0]=3 1030 B10R0.75 COCCSCC(N)C(=O)O Amb6258105 [0,1,0,0,0,0|2,0,0]=3 1031 B10R0.75 CSCCCCC(C)C(=O)O Amb32953968 [0,1,0,0,0,0|2,0,0]=3 1032 B10R0.75 N#CCCCCC(N)C(=O)O Amb33042685 [0,1,0,0,0,0|0,0,1]=2 1033 B10R0.75 N#CCCCCC(N)C(N)=O Amb32789441 [0,1,0,0,0,0|1,0,1]=3 1034 B10R0.75 N#CCCCC[C@@H](N)C(=O)O Amb33308868 [0,1,0,0,0,0|0,0,1]=2 1035 B10R0.75 N#CCCCC[C@H](N)C(=O)O Amb32788598 [0,1,0,0,0,0|0,0,1]=2 1036 B10R0.75 N#[N+][N-]CCC[C@H](N)C(=O)O Amb33826504 [0,1,0,0,0,0|1,0,1]=3 1037 B10R0.75 NC(=O)C(N)CCCCCF Amb32789422 [0,1,0,0,0,0|2,0,0]=3 1038 B10R0.75 NC(=O)C(N)CCCCCO Amb33036732 [0,1,0,0,0,0|2,0,0]=3 1039 B10R0.75 NC(=O)C(N)CCOCCO Amb33308715 [0,1,0,0,0,0|2,0,0]=3 1040 B10R0.75 NC(CCC#CCCl)C(=O)O Amb28280148 [0,1,0,0,0,0|1,0,1]=3 1041 B10R0.75 NC(CCCCCF)C(=O)O Amb33036467 [0,1,0,0,0,0|1,0,0]=2 1042 B10R0.75 NC(CCCCCO)C(=O)O Amb33037096 [0,1,0,0,0,0|1,0,0]=2 1043 B10R0.75 NC(CCOCCO)C(=O)O Amb33065845 [0,1,0,0,0,0|1,0,0]=2 1044 B10R0.75 NC(CSCCCO)C(=O)O Amb8390352 [0,1,0,0,0,0|1,0,0]=2 1045 B10R0.75 NCCCSCC(=O)C(=O)O Amb33069797 [0,1,0,0,0,0|1,0,1]=3 1046 B10R0.75 NCCCSCC(N)C(=O)O Amb28652964 [0,1,0,0,0,0|0,0,0]=1 1047 B10R0.75 NCCCSCC(N)C(=O)O Amb32652572 [0,1,0,0,0,0|0,0,0]=1 1048 B10R0.75 NCCOCCC(N)C(=O)O Amb24081026 [0,1,0,0,0,0|0,0,0]=1 1049 B10R0.75 NCCOCCC(N)C(=O)O Amb32652927 [0,1,0,0,0,0|0,0,0]=1 1050 B10R0.75 NCCSCCC(N)C(=O)O Amb32652508 [0,1,0,0,0,0|0,0,0]=1 1051 B10R0.75 NCCSCCC(N)C(=O)O Amb32652509 [0,1,0,0,0,0|0,0,0]=1 1052 B10R0.75 NOCCSCC(=O)C(=O)O Amb33070037 [0,1,0,0,0,0|2,0,1]=4 1053 B10R0.75 N[C@@H](CCCCCF)C(=O)O Amb33065721 [0,1,0,0,0,0|1,0,0]=2 1054 B10R0.75 N[C@@H](CCCCCO)C(=O)O Amb33308918 [0,1,0,0,0,0|1,0,0]=2 1055 B10R0.75 N[C@@H](CCOCCO)C(=O)O Amb32864914 [0,1,0,0,0,0|1,0,0]=2 1056 B10R0.75 N[C@@H](CSCCCO)C(=O)O Amb8390824 [0,1,0,0,0,0|1,0,0]=2 1057 B10R0.75 N[C@H](CCCCCF)C(=O)O Amb33036618 [0,1,0,0,0,0|1,0,0]=2 1058 B10R0.75 N[C@H](CCCCCO)C(=O)O Amb33065614 [0,1,0,0,0,0|1,0,0]=2 1059 B10R0.75 N[C@H](CCOCCO)C(=O)O Amb33036125 [0,1,0,0,0,0|1,0,0]=2 1060 B10R0.75 O=C(O)C(=O)CSCCCBr Amb33069767 [0,1,0,0,0,0|2,0,1]=4 1061 B10R0.75 O=C(O)C(=O)CSCCCCl Amb33069762 [0,1,0,0,0,0|2,0,1]=4 1062 B10R0.75 O=C(O)C(=O)CSCCCO Amb33069718 [0,1,0,0,0,0|2,0,1]=4 1063 B10R0.75 O=C(O)C(=O)CSCCCS Amb33069988 [0,1,0,0,0,0|2,0,1]=4 1064 B10R0.81 CC(C(=O)O)C(=O)NCCN Amb27987763 [0,1,0,0,0,0|2,0,1]=4 1065 B10R0.81 CC(CCC#N)C(N)C(=O)O Amb33308536 [0,1,0,0,0,0|0,0,2]=3 1066 B10R0.81 CC(CCC#N)C(N)C(N)=O Amb33308717 [0,1,0,0,0,0|1,0,2]=4 1067 B10R0.81 CC(CCC#N)[C@@H](N)C(=O)O Amb33308700 [0,1,0,0,0,0|0,0,2]=3 1068 B10R0.81 CC(CCC#N)[C@H](N)C(=O)O Amb33065933 [0,1,0,0,0,0|0,0,2]=3 1069 B10R0.81 CCCCC(N)C(C)C(=O)O Amb33036302 [0,1,0,0,0,0|2,0,0]=3 1070 B10R0.81 CCCCC(N)C(O)C(=O)O Amb28652900 [0,1,0,0,0,0|2,0,0]=3 1071 B10R0.81 CCCCC(O)C(C)C(=O)O Amb18182520 [0,1,0,0,0,0|2,0,0]=3 1072 B10R0.81 CCCCC(O)C(N)C(=O)O Amb33358191 [0,1,0,0,0,0|1,0,0]=2 1073 B10R0.81 CCSCC(O)C(N)C(=O)O Amb33324016 [0,1,0,0,0,0|2,0,0]=3 1074 B10R0.81 CC\C=C\C(O)C(N)C(=O)O Amb33268260 [0,1,0,0,0,0|1,0,2]=4 1075 B10R0.81 COCCC(C)C(N)C(=O)O Amb33066103 [0,1,0,0,0,0|2,0,0]=3 1076 B10R0.81 COCCC(C)C(N)C(N)=O Amb33033598 [0,1,0,0,0,0|3,0,0]=4 1077 B10R0.81 COCCC(C)[C@@H](N)C(=O)O Amb33309204 [0,1,0,0,0,0|2,0,0]=3 1078 B10R0.81 COCCC(C)[C@H](N)C(=O)O Amb33308617 [0,1,0,0,0,0|2,0,0]=3 1079 B10R0.81 COCCC(O)C(N)C(=O)O Amb33377811 [0,1,0,0,0,0|2,0,0]=3 1080 B10R0.81 CSCCC(O)C(N)C(=O)O Amb33358674 [0,1,0,0,0,0|2,0,0]=3 1081 B10R0.81 N#CCC[C@H](O)[C@H](N)C(=O)O Amb26999779 [0,1,0,0,0,0|0,0,2]=3 1082 B10R0.82 C#CC(C)NCC(N)C(=O)O Amb27988083 [0,1,0,0,0,0|2,0,1]=4 1083 B10R0.82 C#CC(N)CCC(N)C(=O)O Amb24762938 [0,1,0,0,0,0|1,0,1]=3 1084 B10R0.82 CC(C#N)CCC(C)C(=O)O Amb27990264 [0,1,0,0,0,0|1,0,2]=4 1085 B10R0.82 CC(CN)CNC(=O)C(=O)O Amb28326383 [0,1,0,0,0,0|2,0,1]=4 1086 B10R0.82 CC(CN)SCC(=O)C(=O)O Amb33069794 [0,1,0,0,0,0|2,0,1]=4 1087 B10R0.82 CCC(C)CCC(C)C(=O)O Amb22641847 [0,1,0,0,0,0|2,0,0]=3 1088 B10R0.82 CCC(C)OCC(N)C(=O)O Amb18177727 [0,1,0,0,0,0|2,0,0]=3 1089 B10R0.82 CCC(C)OCC(N)C(N)=O Amb18177699 [0,1,0,0,0,0|3,0,0]=4 1090 B10R0.82 CCC(C)OC[C@@H](N)C(=O)O Amb32789388 [0,1,0,0,0,0|2,0,0]=3 1091 B10R0.82 CCC(C)OC[C@H](N)C(=O)O Amb33036875 [0,1,0,0,0,0|2,0,0]=3 1092 B10R0.82 CCN(C)CC[C@@H](N)C(=O)O Amb32698166 [0,1,0,0,0,0|2,0,0]=3 1093 B10R0.82 CNC(=O)CCC(N)C(=O)O Amb18645293 [0,1,0,0,0,0|2,0,1]=4 1094 B10R0.82 COC(=O)CCC(N)C(=O)O Amb9825413 [0,1,0,0,0,0|2,0,1]=4 1095 B10R0.82 COC(=O)CC[C@@H](N)C(=O)O Amb16183875 [0,1,0,0,0,0|2,0,1]=4 1096 B10R0.82 COC(=O)CC[C@@H](N)C(=O)O Amb22746068 [0,1,0,0,0,0|2,0,1]=4 1097 B10R0.82 COC(=O)CC[C@H](N)C(=O)O Amb2720571 [0,1,0,0,0,0|2,0,1]=4 1098 B10R0.82 NC(CCC(=O)NO)C(=O)O Amb22350145 [0,1,0,0,0,0|2,0,1]=4 1099 B10R0.82 NC(CC[PH](=O)CO)C(=O)[O-] Amb22167951 [0,1,0,0,0,0|2,0,1]=4 1100 B10R0.82 NC(CF)CCC(N)C(=O)O Amb31030977 [0,1,0,0,0,0|1,0,0]=2 1101 B10R0.82 NC(CF)CCC(N)C(=O)O Amb33204489 [0,1,0,0,0,0|1,0,0]=2 1102 B10R0.82 NC(CNC(=O)CCl)C(=O)O Amb27990068 [0,1,0,0,0,0|2,0,1]=4 1103 B10R0.82 NCC(F)CCC(N)C(=O)O Amb10839781 [0,1,0,0,0,0|0,0,0]=1 1104 B10R0.82 NCC(O)CCC(N)C(=O)O Amb2720125 [0,1,0,0,0,0|0,0,0]=1 1105 B10R0.82 NCC(O)CCC(N)C(=O)O Amb9809250 [0,1,0,0,0,0|0,0,0]=1 1106 B10R0.82 NCC(O)CC[C@H](N)C(=O)O Amb34175411 [0,1,0,0,0,0|0,0,0]=1 1107 B10R0.82 NC[C@@H](O)CC[C@H](N)C(=O)O Amb24117040 [0,1,0,0,0,0|0,0,0]=1 1108 B10R0.82 NC[C@H](O)CC[C@@H](N)C(=O)O Amb33802991 [0,1,0,0,0,0|0,0,0]=1 1109 B10R0.82 NC[C@H](O)CC[C@@H](N)C(=O)O Amb33804786 [0,1,0,0,0,0|0,0,0]=1 1110 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O Amb22747912 [0,1,0,0,0,0|0,0,0]=1 1111 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O Amb24121192 [0,1,0,0,0,0|0,0,0]=1 1112 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O Amb35788437 [0,1,0,0,0,0|0,0,0]=1 1113 B10R0.82 NNC(=O)CCC(N)C(=O)O Amb6366546 [0,1,0,0,0,0|1,0,1]=3 1114 B10R0.82 NNC(=O)CC[C@H](N)C(=O)O Amb25379957 [0,1,0,0,0,0|1,0,1]=3 1115 B10R0.82 N[C@@H](CCC(=O)NO)C(=O)O Amb27269199 [0,1,0,0,0,0|2,0,1]=4 1116 B10R0.82 N[C@@H](C\C=C(/Cl)CO)C(=O)O Amb27988484 [0,1,0,0,0,0|1,0,2]=4 1117 B10R0.83 C#CCCCC(N)C(=O)OC Amb33065464 [0,1,0,0,0,0|1,0,1]=3 1118 B10R0.83 C=CCCCC(N)C(=O)OC Amb32684483 [0,1,0,0,0,0|1,0,1]=3 1119 B10R0.83 C=CCOCC(N)C(=O)OC Amb33378986 [0,1,0,0,0,0|2,0,1]=4 1120 B10R0.83 C=CCOCC(N)C(=O)OC Amb33379009 [0,1,0,0,0,0|2,0,1]=4 1121 B10R0.83 C=CCSCC(N)C(=O)OC Amb33338835 [0,1,0,0,0,0|2,0,1]=4 1122 B10R0.83 CC#CCCC(N)C(=O)OC Amb27988390 [0,1,0,0,0,0|1,0,2]=4 1123 B10R0.83 CCCCCC(N)C(=O)OC Amb18792090 [0,1,0,0,0,0|1,0,0]=2 1124 B10R0.83 CCCCCC(N)C(=O)OC Amb33552080 [0,1,0,0,0,0|1,0,0]=2 1125 B10R0.83 CCCCCC(O)C(=O)OC Amb18183408 [0,1,0,0,0,0|2,0,0]=3 1126 B10R0.83 CCCOCC(N)C(=O)OC Amb18788065 [0,1,0,0,0,0|2,0,0]=3 1127 B10R0.83 CCC\C=C\C(N)C(=O)OC Amb32954819 [0,1,0,0,0,0|1,0,2]=4 1128 B10R0.83 CCNCCC(N)C(=O)OC Amb32993441 [0,1,0,0,0,0|2,0,0]=3 1129 B10R0.83 CCOCCC(N)C(=O)OC Amb18788075 [0,1,0,0,0,0|2,0,0]=3 1130 B10R0.83 CCSCCC(N)C(=O)OC Amb18790887 [0,1,0,0,0,0|2,0,0]=3 1131 B10R0.83 CCSCCC(O)C(=O)OC Amb33359216 [0,1,0,0,0,0|3,0,0]=4 1132 B10R0.83 CNC(=O)C(N)CCCCN Amb23443536 [0,1,0,0,0,0|1,0,0]=2 1133 B10R0.83 COC(=O)C(N)CCCC#N Amb31295592 [0,1,0,0,0,0|0,0,2]=3 1134 B10R0.83 COC(=O)C(N)CCCCF Amb33308782 [0,1,0,0,0,0|1,0,0]=2 1135 B10R0.83 COC(=O)C(N)CCCCN Amb782588 [0,1,0,0,0,0|0,0,0]=1 1136 B10R0.83 COC(=O)C(N)CCCCO Amb32789408 [0,1,0,0,0,0|1,0,0]=2 1137 B10R0.83 COC(=O)C(N)CCCCO Amb33625200 [0,1,0,0,0,0|1,0,0]=2 1138 B10R0.83 COC(=O)C(N)CCCSC Amb33065999 [0,1,0,0,0,0|2,0,0]=3 1139 B10R0.83 COC(=O)C(O)CCCSC Amb33358801 [0,1,0,0,0,0|3,0,0]=4 1140 B10R0.83 COC(=O)C([NH3+])CCCC[NH3+] Amb4259242 [0,1,0,0,0,0|0,0,2]=3 1141 B10R0.83 COC(=O)[C@@H](N)CCCCN Amb19930733 [0,1,0,0,0,0|0,0,0]=1 1142 B10R0.83 COC(=O)[C@H](N)CCCCN Amb33757553 [0,1,0,0,0,0|0,0,0]=1 1143 B10R0.83 COCCCC(N)C(=O)OC Amb32712059 [0,1,0,0,0,0|2,0,0]=3 1144 B10R0.83 COCCCC(N)C(=O)OC Amb33470192 [0,1,0,0,0,0|2,0,0]=3 1145 B10R0.83 COCCCC(O)C(=O)OC Amb33171907 [0,1,0,0,0,0|3,0,0]=4 1146 B10R0.86 CCC(OCCCN)C(=O)O Amb18628658 [0,1,0,0,0,0|2,0,0]=3 1147 B10R0.86 CCC(SCCCO)C(=O)O Amb17501362 [0,1,0,0,0,0|3,0,0]=4 1148 B10R0.86 CCCCCC(CC)C(=O)O Amb18791930 [0,1,0,0,0,0|2,0,0]=3 1149 B10R0.86 CCCCCC(OC)C(=O)O Amb32953478 [0,1,0,0,0,0|2,0,0]=3 1150 B10R0.86 CCCCSC(CC)C(=O)O Amb9675509 [0,1,0,0,0,0|3,0,0]=4 1151 B10R0.86 CCC\C=C\C(CN)C(=O)O Amb33224469 [0,1,0,0,0,0|1,0,2]=4 1152 B10R0.86 CCSCCC(OC)C(=O)O Amb33172115 [0,1,0,0,0,0|3,0,0]=4 1153 B10R0.86 CN[C@@H](CCCCN)C(=O)O Amb33876452 [0,1,0,0,0,0|0,0,0]=1 1154 B10R0.86 COC(CCCSC)C(=O)O Amb33359228 [0,1,0,0,0,0|3,0,0]=4 1155 B10R0.86 COCCCC(OC)C(=O)O Amb33377469 [0,1,0,0,0,0|3,0,0]=4 1156 B10R0.98 CC(=O)CCCC(N)C(=O)O Amb33036722 [0,1,0,0,0,0|1,0,1]=3 1157 B10R0.98 CC(=O)CCCC(N)C(N)=O Amb33308963 [0,1,0,0,0,0|2,0,1]=4 1158 B10R0.98 CC(=O)CCC[C@@H](N)C(=O)O Amb32937025 [0,1,0,0,0,0|1,0,1]=3 1159 B10R0.98 CC(=O)CCC[C@H](N)C(=O)O Amb32865922 [0,1,0,0,0,0|1,0,1]=3 1160 B10R0.98 CC(=O)NCC[C@H](N)C(=O)O Amb26659493 [0,1,0,0,0,0|2,0,1]=4 1161 B10R0.98 CC(C)=CCCC(N)C(=O)O Amb27001257 [0,1,0,0,0,0|1,0,2]=4 1162 B10R0.98 CC(C)=CCC[C@@H](N)C(=O)O Amb33065465 [0,1,0,0,0,0|1,0,2]=4 1163 B10R0.98 CC(C)=CCC[C@H](N)C(=O)O Amb25383796 [0,1,0,0,0,0|1,0,2]=4 1164 B10R0.98 CC(C)CCCC(=O)C(=O)O Amb18126138 [0,1,0,0,0,0|2,0,1]=4 1165 B10R0.98 CC(C)CCCC(C)C(=O)O Amb33358621 [0,1,0,0,0,0|2,0,0]=3 1166 B10R0.98 CC(C)CCCC(N)C(=O)O Amb30584746 [0,1,0,0,0,0|1,0,0]=2 1167 B10R0.98 CC(C)CCCC(N)C(=O)O Amb32679429 [0,1,0,0,0,0|1,0,0]=2 1168 B10R0.98 CC(C)CCCC(N)C(N)=O Amb32796888 [0,1,0,0,0,0|2,0,0]=3 1169 B10R0.98 CC(C)CCC[C@@H](C)C(=O)O Amb33727257 [0,1,0,0,0,0|2,0,0]=3 1170 B10R0.98 CC(C)CCC[C@@H](N)C(=O)O Amb22745714 [0,1,0,0,0,0|1,0,0]=2 1171 B10R0.98 CC(C)CCC[C@H](C)C(=O)O Amb33744631 [0,1,0,0,0,0|2,0,0]=3 1172 B10R0.98 CC(C)CCC[C@H](N)C(=O)O Amb34161240 [0,1,0,0,0,0|1,0,0]=2 1173 B10R0.98 CC(C)CCNC(C)C(=O)O Amb10609116 [0,1,0,0,0,0|3,0,0]=4 1174 B10R0.98 CC(C)CCNC(C)C(=O)O Amb1109923 [0,1,0,0,0,0|3,0,0]=4 1175 B10R0.98 CC(C)CCOC(C)C(=O)O Amb9728095 [0,1,0,0,0,0|3,0,0]=4 1176 B10R0.98 CC(C)CCSC(C)C(=O)O Amb6265720 [0,1,0,0,0,0|3,0,0]=4 1177 B10R0.98 CC(C)COCC(N)C(=O)O Amb18788052 [0,1,0,0,0,0|2,0,0]=3 1178 B10R0.98 CC(C)COCC(N)C(N)=O Amb18787974 [0,1,0,0,0,0|3,0,0]=4 1179 B10R0.98 CC(C)COC[C@@H](N)C(=O)O Amb33065410 [0,1,0,0,0,0|2,0,0]=3 1180 B10R0.98 CC(C)COC[C@H](N)C(=O)O Amb32668496 [0,1,0,0,0,0|2,0,0]=3 1181 B10R0.98 CC(C)OCCC(C)C(=O)O Amb18792223 [0,1,0,0,0,0|3,0,0]=4 1182 B10R0.98 CC(C)OCCC(N)C(=O)O Amb18180011 [0,1,0,0,0,0|2,0,0]=3 1183 B10R0.98 CC(C)OCCC(N)C(N)=O Amb18787993 [0,1,0,0,0,0|3,0,0]=4 1184 B10R0.98 CC(C)OCCC(O)C(=O)O Amb33274843 [0,1,0,0,0,0|3,0,0]=4 1185 B10R0.98 CC(C)OCC[C@@H](N)C(=O)O Amb31295667 [0,1,0,0,0,0|2,0,0]=3 1186 B10R0.98 CC(C)OCC[C@H](N)C(=O)O Amb33036708 [0,1,0,0,0,0|2,0,0]=3 1187 B10R0.98 CC(C)SCCC(N)C(=O)O Amb18180682 [0,1,0,0,0,0|2,0,0]=3 1188 B10R0.98 CC(C)SCCC(N)C(N)=O Amb18178327 [0,1,0,0,0,0|3,0,0]=4 1189 B10R0.98 CC(C)SCC[C@@H](N)C(=O)O Amb33069965 [0,1,0,0,0,0|2,0,0]=3 1190 B10R0.98 CC(C)SCC[C@H](N)C(=O)O Amb33065836 [0,1,0,0,0,0|2,0,0]=3 1191 B10R0.98 CC(CCCN(C)C)C(=O)O Amb33359292 [0,1,0,0,0,0|3,0,0]=4 1192 B10R0.98 CC(CCNC(N)=O)C(=O)O Amb27270986 [0,1,0,0,0,0|2,0,1]=4 1193 B10R0.98 CC(N)CCCC(C)C(=O)O Amb19337779 [0,1,0,0,0,0|1,0,0]=2 1194 B10R0.98 CC(N)CCCC(C)C(=O)O Amb22059651 [0,1,0,0,0,0|1,0,0]=2 1195 B10R0.98 CC(N)CSCC(=O)C(=O)O Amb33069822 [0,1,0,0,0,0|2,0,1]=4 1196 B10R0.98 CC(O)CCCC(N)C(=O)O Amb32941153 [0,1,0,0,0,0|1,0,0]=2 1197 B10R0.98 CC(O)CCCC(N)C(N)=O Amb33308669 [0,1,0,0,0,0|2,0,0]=3 1198 B10R0.98 CC(O)CCC[C@@H](N)C(=O)O Amb33066250 [0,1,0,0,0,0|1,0,0]=2 1199 B10R0.98 CC(O)CCC[C@H](N)C(=O)O Amb33127508 [0,1,0,0,0,0|1,0,0]=2 1200 B10R0.98 CN(C)CCCC(N)C(=O)O Amb18199837 [0,1,0,0,0,0|2,0,0]=3 1201 B10R0.98 CN(C)CCCC(N)C(N)=O Amb33065486 [0,1,0,0,0,0|3,0,0]=4 1202 B10R0.98 CN(C)CCCC(O)C(=O)O Amb33272932 [0,1,0,0,0,0|3,0,0]=4 1203 B10R0.98 CN(C)CCC[C@@H](N)C(=O)O Amb31295703 [0,1,0,0,0,0|2,0,0]=3 1204 B10R0.98 CN(C)CCC[C@H](N)C(=O)O Amb33036715 [0,1,0,0,0,0|2,0,0]=3 1205 B10R0.98 C[C@@H](N)CSCC(=O)C(=O)O Amb33069811 [0,1,0,0,0,0|2,0,1]=4 1206 B10R0.98 C[C@H](N)CSCC(=O)C(=O)O Amb33069808 [0,1,0,0,0,0|2,0,1]=4 1207 B10R0.98 N=C(N)NCC[C@@H](N)C(=O)O Amb27266501 [0,1,0,0,0,0|1,0,1]=3 1208 B10R0.98 N=C(N)NCC[C@H](N)C(=O)O Amb20240584 [0,1,0,0,0,0|1,0,1]=3 1209 B10R0.98 NC(=O)C(N)CCCC(F)F Amb33065708 [0,1,0,0,0,0|2,0,0]=3 1210 B10R0.98 NC(=O)NCCC(O)C(=O)O Amb27670719 [0,1,0,0,0,0|2,0,1]=4 1211 B10R0.98 NC(=O)NCC[C@H](O)C(=O)O Amb27670720 [0,1,0,0,0,0|2,0,1]=4 1212 B10R0.98 NC(CCCC(=O)O)C(=O)O Amb22740152 [0,1,0,0,0,0|1,0,1]=3 1213 B10R0.98 NC(CCCC(=O)O)C(=O)O Amb6334822 [0,1,0,0,0,0|1,0,1]=3 1214 B10R0.98 NC(CCCC(F)F)C(=O)O Amb32788578 [0,1,0,0,0,0|1,0,0]=2 1215 B10R0.98 NC(CSCC(=O)O)C(=O)O Amb6740297 [0,1,0,0,0,0|2,0,1]=4 1216 B10R0.98 NC(N)=NCCC(N)C(=O)O Amb22492813 [0,1,0,0,0,0|1,0,1]=3 1217 B10R0.98 NC(N)=NCC[C@H](N)C(=O)O Amb33842525 [0,1,0,0,0,0|1,0,1]=3 1218 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O Amb6600090 [0,1,0,0,0,0|1,0,1]=3 1219 B10R0.98 N[C@@H](CCCC(F)F)C(=O)O Amb33066046 [0,1,0,0,0,0|1,0,0]=2 1220 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O Amb16232500 [0,1,0,0,0,0|2,0,1]=4 1221 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O Amb6336477 [0,1,0,0,0,0|2,0,1]=4 1222 B10R0.98 N[C@H](CCCC(=O)O)C(=O)O Amb8629031 [0,1,0,0,0,0|1,0,1]=3 1223 B10R0.98 N[C@H](CCCC(F)F)C(=O)O Amb33309003 [0,1,0,0,0,0|1,0,0]=2 1224 B10R0.98 O=C(O)CCCC(O)C(=O)O Amb21963897 [0,1,0,0,0,0|2,0,1]=4 1225 B10R1.7 CC1CCCCCCC1=O Amb4020430 [0,0,0,1,0,0|3,0,0]=4 1226 B10R1.7 NC1CCCCCCC1=O Amb28050100 [0,0,0,1,0,0|2,0,0]=3 1227 B10R1.7 NC1CCCCCNC1=O Amb26056483 [0,0,0,1,0,0|2,0,0]=3 1228 B10R1.7 N[C@@H]1CCCCCC[C@@H]1O Amb27881602 [0,0,0,1,0,0|2,0,1]=4 1229 B10R1.7 N[C@@H]1CCCCCC[C@H]1O Amb27881642 [0,0,0,1,0,0|2,0,1]=4 1230 B10R1.7 N[C@@H]1CCCCCNC1=O Amb27210584 [0,0,0,1,0,0|2,0,0]=3 1231 B10R1.7 O=C1C=CCCCCC1Cl Amb27471827 [0,0,0,1,0,0|3,0,0]=4 1232 B10R1.7 O=C1CCCCCCC1Br Amb26871305 [0,0,0,1,0,0|3,0,0]=4 1233 B10R1.7 O=C1CCCCCCC1Cl Amb22228745 [0,0,0,1,0,0|3,0,0]=4 1234 B10R1.7 O=C1CCCCCCC1F Amb27837778 [0,0,0,1,0,0|3,0,0]=4 1235 B10R1.7 O=C1CCCCCCC1O Amb22896567 [0,0,0,1,0,0|3,0,0]=4 1236 B10R1.7 O=C1NCCCCCC1Br Amb27799738 [0,0,0,1,0,0|3,0,0]=4 1237 B10R1.7 O=C1NCCCCCC1Cl Amb25706288 [0,0,0,1,0,0|3,0,0]=4 1238 B10R1.7 O=C1NCCCCCC1S Amb28074060 [0,0,0,1,0,0|3,0,0]=4 1239 B10R1.23 C=C(C(=O)O)C1CCCC1 Amb18124595 [0,0,0,1,0,0|2,0,1]=4 1240 B10R1.23 C=C(C(=O)O)C1CCCO1 Amb33318704 [0,0,0,1,0,0|2,0,1]=4 1241 B10R1.23 C=C(C(=O)O)C1CCCS1 Amb33414834 [0,0,0,1,0,0|2,0,1]=4 1242 B10R1.23 C=C(C)C(F)C1CCCN1 Amb27765559 [0,0,0,1,0,0|3,0,0]=4 1243 B10R1.23 C=C(C)C(N)C1CCCC1 Amb27459600 [0,0,0,1,0,0|3,0,0]=4 1244 B10R1.23 C=C(C)C(O)[C@@H]1CCCN1 Amb29891690 [0,0,0,1,0,0|3,0,0]=4 1245 B10R1.23 C=C(C)C(O)[C@H]1CCCN1 Amb30038986 [0,0,0,1,0,0|3,0,0]=4 1246 B10R1.23 CC(=O)C(=O)C1CCCN1 Amb24470443 [0,0,0,1,0,0|2,0,1]=4 1247 B10R1.23 CC(=O)C(O)C1CCCC1 Amb25129517 [0,0,0,1,0,0|3,0,0]=4 1248 B10R1.23 CC(=O)C(O)C1CCCN1 Amb28239614 [0,0,0,1,0,0|2,0,0]=3 1249 B10R1.23 CC(C(=O)Cl)C1CCCC1 Amb28071401 [0,0,0,1,0,0|3,0,0]=4 1250 B10R1.23 CC(C(=O)O)C1=CCCC1 Amb18643557 [0,0,0,1,0,0|2,0,1]=4 1251 B10R1.23 CC(C(=O)O)C1CCCC1 Amb33531206 [0,0,0,1,0,0|2,0,0]=3 1252 B10R1.23 CC(C(=O)O)C1CCCN1 Amb18202477 [0,0,0,1,0,0|1,0,0]=2 1253 B10R1.23 CC(C(=O)O)C1CCCO1 Amb27253801 [0,0,0,1,0,0|2,0,0]=3 1254 B10R1.23 CC(C(=O)O)C1CCCS1 Amb27186076 [0,0,0,1,0,0|2,0,0]=3 1255 B10R1.23 CC(C(=O)O)C1CCNC1 Amb18831577 [0,0,0,1,0,0|3,0,0]=4 1256 B10R1.23 CC(C(=O)O)C1CCOC1 Amb18831507 [0,0,0,1,0,0|3,0,0]=4 1257 B10R1.23 CC(C(=O)O)C1CCSC1 Amb27850440 [0,0,0,1,0,0|3,0,0]=4 1258 B10R1.23 CC(C(=O)O)N1CCCC1 Amb9783423 [0,0,0,1,0,0|3,0,0]=4 1259 B10R1.23 CC(C(N)=O)C1CCCC1 Amb28388222 [0,0,0,1,0,0|3,0,0]=4 1260 B10R1.23 CC(C(N)=O)C1CCCO1 Amb32685778 [0,0,0,1,0,0|3,0,0]=4 1261 B10R1.23 CC(C1CCCN1)S(C)=O Amb30029017 [0,0,0,1,0,0|3,0,0]=4 1262 B10R1.23 CC(O)C(C)C1CCCN1 Amb33212810 [0,0,0,1,0,0|2,0,1]=4 1263 B10R1.23 C[C@@H](C(=O)O)C1CCCC1 Amb10844017 [0,0,0,1,0,0|2,0,0]=3 1264 B10R1.23 C[C@@H](C(=O)O)C1CCCO1 Amb33726955 [0,0,0,1,0,0|2,0,0]=3 1265 B10R1.23 C[C@@H](C(=O)O)C1CCOC1 Amb33729604 [0,0,0,1,0,0|3,0,0]=4 1266 B10R1.23 C[C@@H](C(=O)O)N1CCCC1 Amb28050114 [0,0,0,1,0,0|3,0,0]=4 1267 B10R1.23 C[C@@H](O)[C@H](N)C1CCCC1 Amb28074379 [0,0,0,1,0,0|2,0,1]=4 1268 B10R1.23 C[C@H](C(=O)O)C1CCCC1 Amb10844018 [0,0,0,1,0,0|2,0,0]=3 1269 B10R1.23 C[C@H](C(=O)O)C1CCCO1 Amb33744367 [0,0,0,1,0,0|2,0,0]=3 1270 B10R1.23 C[C@H](C(=O)O)C1CCOC1 Amb33747705 [0,0,0,1,0,0|3,0,0]=4 1271 B10R1.23 C[C@H](C(=O)O)[C@H]1CCCN1 Amb27630718 [0,0,0,1,0,0|1,0,0]=2 1272 B10R1.23 NC(=O)C(F)C1CCCC1 Amb33611589 [0,0,0,1,0,0|3,0,0]=4 1273 B10R1.23 NC(=O)C(N)C1CCCC1 Amb18958717 [0,0,0,1,0,0|2,0,0]=3 1274 B10R1.23 NC(=O)C(N)C1CCCN1 Amb27959202 [0,0,0,1,0,0|1,0,0]=2 1275 B10R1.23 NC(=O)C(N)C1CCCO1 Amb26620475 [0,0,0,1,0,0|2,0,0]=3 1276 B10R1.23 NC(=O)C(N)C1CCCS1 Amb27959206 [0,0,0,1,0,0|2,0,0]=3 1277 B10R1.23 NC(=O)C(N)C1CCOC1 Amb18950565 [0,0,0,1,0,0|3,0,0]=4 1278 B10R1.23 NC(=O)C(N)C1CCOC1 Amb32708489 [0,0,0,1,0,0|3,0,0]=4 1279 B10R1.23 NC(=O)C(N)C1CCSC1 Amb26340123 [0,0,0,1,0,0|3,0,0]=4 1280 B10R1.23 NC(C(=O)O)C1C=CCO1 Amb27838140 [0,0,0,1,0,0|1,0,2]=4 1281 B10R1.23 NC(C(=O)O)C1CCCC1 Amb19373068 [0,0,0,1,0,0|1,0,0]=2 1282 B10R1.23 NC(C(=O)O)C1CCCC1 Amb9721618 [0,0,0,1,0,0|1,0,0]=2 1283 B10R1.23 NC(C(=O)O)C1CCCO1 Amb18644193 [0,0,0,1,0,0|1,0,0]=2 1284 B10R1.23 NC(C(=O)O)C1CCCS1 Amb26645781 [0,0,0,1,0,0|1,0,0]=2 1285 B10R1.23 NC(C(=O)O)C1CCNC1 Amb2699126 [0,0,0,1,0,0|2,0,0]=3 1286 B10R1.23 NC(C(=O)O)C1CCNC1 Amb33718664 [0,0,0,1,0,0|2,0,0]=3 1287 B10R1.23 NC(C(=O)O)C1CCOC1 Amb9724906 [0,0,0,1,0,0|2,0,0]=3 1288 B10R1.23 NC(C(=O)O)C1CCSC1 Amb25837887 [0,0,0,1,0,0|2,0,0]=3 1289 B10R1.23 N[C@@H](C(=O)O)C1CCCC1 Amb2699119 [0,0,0,1,0,0|1,0,0]=2 1290 B10R1.23 N[C@@H](C(=O)O)C1CCCO1 Amb33066080 [0,0,0,1,0,0|1,0,0]=2 1291 B10R1.23 N[C@@H](C(=O)O)C1CCOC1 Amb24437668 [0,0,0,1,0,0|2,0,0]=3 1292 B10R1.23 N[C@@H](C(=O)O)C1CCSC1 Amb30011061 [0,0,0,1,0,0|2,0,0]=3 1293 B10R1.23 N[C@@H](C(=O)O)[C@@H]1C=CCC1 Amb27975764 [0,0,0,1,0,0|1,0,1]=3 1294 B10R1.23 N[C@@H](C(=O)O)[C@@H]1CCCO1 Amb28366221 [0,0,0,1,0,0|1,0,0]=2 1295 B10R1.23 N[C@H](C(=O)O)C1CCCC1 Amb2699120 [0,0,0,1,0,0|1,0,0]=2 1296 B10R1.23 N[C@H](C(=O)O)C1CCCN1 Amb27823844 [0,0,0,1,0,0|0,0,0]=1 1297 B10R1.23 N[C@H](C(=O)O)C1CCCO1 Amb33309007 [0,0,0,1,0,0|1,0,0]=2 1298 B10R1.23 N[C@H](C(=O)O)C1CCOC1 Amb24353330 [0,0,0,1,0,0|2,0,0]=3 1299 B10R1.23 N[C@H](C(=O)O)C1CCSC1 Amb30013147 [0,0,0,1,0,0|2,0,0]=3 1300 B10R1.23 N[C@H](C(=O)O)C1SCCS1 Amb27753737 [0,0,0,1,0,0|2,0,0]=3 1301 B10R1.23 N[C@H](C(=O)O)[C@@H]1CC=NO1 Amb27222035 [0,0,0,1,0,0|2,0,1]=4 1302 B10R1.23 N[C@H](C(=O)O)[C@@H]1CCCO1 Amb27625760 [0,0,0,1,0,0|1,0,0]=2 1303 B10R1.23 N[C@H](C(=O)O)[C@@H]1CCOC1 Amb24621873 [0,0,0,1,0,0|2,0,0]=3 1304 B10R1.23 N[C@H](C(=O)O)[C@H]1C=CCO1 Amb27473290 [0,0,0,1,0,0|1,0,2]=4 1305 B10R1.23 N[C@H](C(=O)O)[C@H]1CC=NO1 Amb27968338 [0,0,0,1,0,0|2,0,1]=4 1306 B10R1.23 N[C@H](C(=O)O)[C@H]1CCOC1 Amb24621874 [0,0,0,1,0,0|2,0,0]=3 1307 B10R1.23 O=C(Cl)C(Br)C1CCCC1 Amb27947988 [0,0,0,1,0,0|3,0,0]=4 1308 B10R1.23 O=C(O)C(=O)C1CCCC1 Amb18643845 [0,0,0,1,0,0|2,0,1]=4 1309 B10R1.23 O=C(O)C(=O)C1CCCO1 Amb33318753 [0,0,0,1,0,0|2,0,1]=4 1310 B10R1.23 O=C(O)C(=O)C1CCCS1 Amb33416224 [0,0,0,1,0,0|2,0,1]=4 1311 B10R1.23 O=C(O)C(=O)N1CCCN1 Amb28316103 [0,0,0,1,0,0|2,0,1]=4 1312 B10R1.23 O=C(O)C(Br)C1CCCC1 Amb18130988 [0,0,0,1,0,0|2,0,0]=3 1313 B10R1.23 O=C(O)C(F)C1CCCC1 Amb26343220 [0,0,0,1,0,0|2,0,0]=3 1314 B10R1.23 O=C(O)C(F)C1CCOC1 Amb27589906 [0,0,0,1,0,0|3,0,0]=4 1315 B10R1.23 O=C(O)C(F)C1CCSC1 Amb27449563 [0,0,0,1,0,0|3,0,0]=4 1316 B10R1.23 O=C(O)C(O)C1C=CCN1 Amb27466402 [0,0,0,1,0,0|1,0,2]=4 1317 B10R1.23 O=C(O)C(O)C1CCCC1 Amb18958313 [0,0,0,1,0,0|2,0,0]=3 1318 B10R1.23 O=C(O)C(O)C1CCCN1 Amb27447229 [0,0,0,1,0,0|1,0,0]=2 1319 B10R1.23 O=C(O)C(O)C1CCCO1 Amb27596051 [0,0,0,1,0,0|2,0,0]=3 1320 B10R1.23 O=C(O)C(O)C1CCCS1 Amb33416223 [0,0,0,1,0,0|2,0,0]=3 1321 B10R1.23 O=C(O)C(O)C1CCNC1 Amb18124721 [0,0,0,1,0,0|3,0,0]=4 1322 B10R1.23 O=C(O)C(O)C1CCSC1 Amb25788192 [0,0,0,1,0,0|3,0,0]=4 1323 B10R1.23 O=C(O)C(O)[C@@H]1CCCN1 Amb27982415 [0,0,0,1,0,0|1,0,0]=2 1324 B10R1.23 O=C(O)C(S)C1CCCC1 Amb28050893 [0,0,0,1,0,0|2,0,0]=3 1325 B10R1.23 O=C(O)[C@H](O)C1CCCC1 Amb27494022 [0,0,0,1,0,0|2,0,0]=3 1326 B10R1.23 O=C(O)[C@H](O)[C@H]1C=CCC1 Amb27784872 [0,0,0,1,0,0|2,0,1]=4 1327 B10R1.31 C#C[C@@H]1CC[C@@H](C(=O)O)N1 Amb25930020 [0,0,0,1,0,0|1,0,1]=3 1328 B10R1.31 C#C[C@@H]1CC[C@H](C(=O)O)N1 Amb27964144 [0,0,0,1,0,0|1,0,1]=3 1329 B10R1.31 C#C[C@H]1CC[C@@H](C(=O)O)N1 Amb28141834 [0,0,0,1,0,0|1,0,1]=3 1330 B10R1.31 C#C[C@H]1CC[C@H](C(=O)O)N1 Amb27789120 [0,0,0,1,0,0|1,0,1]=3 1331 B10R1.31 C=CC1CCC(C(=O)O)C1 Amb18643554 [0,0,0,1,0,0|2,0,1]=4 1332 B10R1.31 C=C[C@@H]1CC[C@H](C(=O)O)N1 Amb27196476 [0,0,0,1,0,0|1,0,1]=3 1333 B10R1.31 C=C[C@H]1CC[C@@H](C(=O)O)N1 Amb27195910 [0,0,0,1,0,0|1,0,1]=3 1334 B10R1.31 CC(=O)C1CCC(CN)O1 Amb27831696 [0,0,0,1,0,0|2,0,0]=3 1335 B10R1.31 CC(=O)C1CC[C@H](CBr)O1 Amb27772033 [0,0,0,1,0,0|3,0,0]=4 1336 B10R1.31 CC(=O)C1COC(CN)C1 Amb33132393 [0,0,0,1,0,0|3,0,0]=4 1337 B10R1.31 CC(=O)N1CCC(CN)C1 Amb18278707 [0,0,0,1,0,0|3,0,0]=4 1338 B10R1.31 CC(=O)N1CCC(CN)C1 Amb33552523 [0,0,0,1,0,0|3,0,0]=4 1339 B10R1.31 CC(=O)N1CC[C@@H](CN)C1 Amb28282653 [0,0,0,1,0,0|3,0,0]=4 1340 B10R1.31 CC(=O)[C@@H]1CO[C@H](CN)C1 Amb33132409 [0,0,0,1,0,0|3,0,0]=4 1341 B10R1.31 CC(O)C1CCC(CN)O1 Amb35624747 [0,0,0,1,0,0|2,0,1]=4 1342 B10R1.31 CCC1=NC(C(=O)O)CC1 Amb23560251 [0,0,0,1,0,0|1,0,2]=4 1343 B10R1.31 CCC1CCC(C(=O)O)N1 Amb24694112 [0,0,0,1,0,0|1,0,0]=2 1344 B10R1.31 CCC1CCC(C(=O)O)N1 Amb28555622 [0,0,0,1,0,0|1,0,0]=2 1345 B10R1.31 CCC1CCC(C(=O)O)O1 Amb20668759 [0,0,0,1,0,0|2,0,0]=3 1346 B10R1.31 CCC1CCC(C(C)=O)C1 Amb27490849 [0,0,0,1,0,0|3,0,0]=4 1347 B10R1.31 CCC1CNC(C(=O)O)C1 Amb22496300 [0,0,0,1,0,0|3,0,0]=4 1348 B10R1.31 CCC1CN[C@H](C(=O)O)C1 Amb27168235 [0,0,0,1,0,0|3,0,0]=4 1349 B10R1.31 CCC1NC(C(=O)O)CS1 Amb32409625 [0,0,0,1,0,0|2,0,0]=3 1350 B10R1.31 CCC1NC(C(=O)O)CS1 Amb9723340 [0,0,0,1,0,0|2,0,0]=3 1351 B10R1.31 CCC1N[C@@H](C(=O)O)CS1 Amb8515134 [0,0,0,1,0,0|2,0,0]=3 1352 B10R1.31 CCC1N[C@H](C(=O)O)CS1 Amb18792350 [0,0,0,1,0,0|2,0,0]=3 1353 B10R1.31 CCN1CCC(C(=O)O)C1 Amb10607746 [0,0,0,1,0,0|3,0,0]=4 1354 B10R1.31 CCN1CC[C@H](C(=O)O)C1 Amb27406792 [0,0,0,1,0,0|3,0,0]=4 1355 B10R1.31 CC[C@@H]1CC[C@@H](C(=O)O)O1 Amb35750180 [0,0,0,1,0,0|2,0,0]=3 1356 B10R1.31 CC[C@@H]1CC[C@@H](C(N)=O)N1 Amb27782933 [0,0,0,1,0,0|2,0,0]=3 1357 B10R1.31 CC[C@@H]1CN[C@H](C(=O)O)C1 Amb35747486 [0,0,0,1,0,0|3,0,0]=4 1358 B10R1.31 CC[C@@H]1CN[C@H](C(=O)O)C1 Amb35747917 [0,0,0,1,0,0|3,0,0]=4 1359 B10R1.31 CC[C@H]1CC[C@@H](C(=O)O)N1 Amb28053433 [0,0,0,1,0,0|1,0,0]=2 1360 B10R1.31 CNC1CCC(C(=O)O)C1 Amb23454119 [0,0,0,1,0,0|3,0,0]=4 1361 B10R1.31 COC1CCC(C(=O)O)C1 Amb24399167 [0,0,0,1,0,0|3,0,0]=4 1362 B10R1.31 CO[C@H]1CC[C@@H](C(=O)O)C1 Amb26657399 [0,0,0,1,0,0|3,0,0]=4 1363 B10R1.31 N#CC1CCC(C(=O)O)O1 Amb28280556 [0,0,0,1,0,0|1,0,2]=4 1364 B10R1.31 NC(=O)C1CCC(CO)C1 Amb26317542 [0,0,0,1,0,0|3,0,0]=4 1365 B10R1.31 NC(=O)[C@@H]1CC[C@H](CO)C1 Amb25708732 [0,0,0,1,0,0|3,0,0]=4 1366 B10R1.31 NC(=O)[C@@H]1CC[C@H](CO)O1 Amb27643548 [0,0,0,1,0,0|3,0,0]=4 1367 B10R1.31 NCC1CC(C(N)=O)CO1 Amb19373933 [0,0,0,1,0,0|3,0,0]=4 1368 B10R1.31 NCC1CC(C(N)=O)CO1 Amb33276230 [0,0,0,1,0,0|3,0,0]=4 1369 B10R1.31 NCC1CCC(C(=O)O)C1 Amb28202595 [0,0,0,1,0,0|1,0,0]=2 1370 B10R1.31 NCC1CCC(C(=O)O)O1 Amb27451875 [0,0,0,1,0,0|1,0,0]=2 1371 B10R1.31 NCC1CCC(C(N)=O)O1 Amb20669131 [0,0,0,1,0,0|2,0,0]=3 1372 B10R1.31 NCC1CCC(C(N)=O)O1 Amb22157199 [0,0,0,1,0,0|2,0,0]=3 1373 B10R1.31 NCC1CCC([N+](=O)[O-])C1 Amb27634256 [0,0,0,1,0,0|2,0,1]=4 1374 B10R1.31 NCC1CCN(C(N)=O)C1 Amb18279605 [0,0,0,1,0,0|3,0,0]=4 1375 B10R1.31 NCC1CCN(C(N)=O)C1 Amb28555408 [0,0,0,1,0,0|3,0,0]=4 1376 B10R1.31 NC[C@@H]1CC[C@@H](C(=O)O)C1 Amb10066932 [0,0,0,1,0,0|1,0,0]=2 1377 B10R1.31 NC[C@@H]1CC[C@@H](C(=O)O)O1 Amb27420232 [0,0,0,1,0,0|1,0,0]=2 1378 B10R1.31 NC[C@@H]1CC[C@H](C(=O)O)O1 Amb32645997 [0,0,0,1,0,0|1,0,0]=2 1379 B10R1.31 NC[C@@H]1CC[C@H](C(=O)O)O1 Amb33098523 [0,0,0,1,0,0|1,0,0]=2 1380 B10R1.31 NC[C@@H]1CN[C@H](C(=O)O)C1 Amb24117206 [0,0,0,1,0,0|2,0,0]=3 1381 B10R1.31 NC[C@@H]1CN[C@H](C(=O)O)C1 Amb26415233 [0,0,0,1,0,0|2,0,0]=3 1382 B10R1.31 NC[C@H]1CC[C@@H](C(=O)O)O1 Amb27959990 [0,0,0,1,0,0|1,0,0]=2 1383 B10R1.31 NC[C@H]1CN[C@H](C(=O)O)C1 Amb24117205 [0,0,0,1,0,0|2,0,0]=3 1384 B10R1.31 NC[C@H]1CN[C@H](C(=O)O)C1 Amb25912130 [0,0,0,1,0,0|2,0,0]=3 1385 B10R1.31 NO[C@@H]1CN[C@H](C(=O)O)C1 Amb25188204 [0,0,0,1,0,0|3,0,0]=4 1386 B10R1.31 O=C(Cl)C1CCC(CO)C1 Amb27660986 [0,0,0,1,0,0|3,0,0]=4 1387 B10R1.31 O=C(O)C1CCC(CF)N1 Amb27233067 [0,0,0,1,0,0|1,0,0]=2 1388 B10R1.31 O=C(O)C1CCC(CO)N1 Amb24502434 [0,0,0,1,0,0|1,0,0]=2 1389 B10R1.31 O=C(O)C1CSC(CO)N1 Amb27837995 [0,0,0,1,0,0|2,0,0]=3 1390 B10R1.31 O=C(O)[C@@H]1CC(CO)CN1 Amb25917979 [0,0,0,1,0,0|3,0,0]=4 1391 B10R1.31 O=C(O)[C@@H]1CS[C@H](CO)N1 Amb26530942 [0,0,0,1,0,0|2,0,0]=3 1392 B10R1.31 O=C(O)[C@@H]1C[C@@H](CO)CN1 Amb24514873 [0,0,0,1,0,0|3,0,0]=4 1393 B10R1.31 O=C(O)[C@H]1CC[C@@H](CO)O1 Amb25968230 [0,0,0,1,0,0|2,0,0]=3 1394 B10R1.31 O=C(O)[C@H]1CS[C@H](CS)C1 Amb28458525 [0,0,0,1,0,0|3,0,0]=4 1395 B10R1.93 CCCC1C=C(C(=O)O)C1 Amb28347309 [0,0,0,1,0,0|2,0,1]=4 1396 B10R1.93 CCCC1CC(C(=O)O)C1 Amb23537724 [0,0,0,1,0,0|2,0,0]=3 1397 B10R1.93 CCC[C@H]1C[C@@H](C(=O)O)C1 Amb28423037 [0,0,0,1,0,0|2,0,0]=3 1398 B10R1.93 CCNC1CC(C(=O)O)C1 Amb20622657 [0,0,0,1,0,0|3,0,0]=4 1399 B10R1.93 CCN[C@H]1C[C@@H](C(=O)O)C1 Amb32671515 [0,0,0,1,0,0|3,0,0]=4 1400 B10R1.93 CCOC1CC(C(=O)O)C1 Amb23448945 [0,0,0,1,0,0|3,0,0]=4 1401 B10R1.93 COCC1CC(C(=O)O)C1 Amb25835213 [0,0,0,1,0,0|3,0,0]=4 1402 B10R1.93 COC[C@H]1C[C@@H](C(=O)O)C1 Amb28280247 [0,0,0,1,0,0|3,0,0]=4 1403 B10R1.93 N#CCC1CC(C(=O)O)C1 Amb27411212 [0,0,0,1,0,0|1,0,2]=4 1404 B10R1.93 NCCN1CC(C(N)=O)C1 Amb27759947 [0,0,0,1,0,0|3,0,0]=4 1405 B10R1.93 O=C(O)C1CN(CCF)C1 Amb27171702 [0,0,0,1,0,0|3,0,0]=4 1406 B10R1.113 C=C(C)C1CCCC(C)N1 Amb32721884 [0,0,0,1,0,0|3,0,0]=4 1407 B10R1.113 CC(=O)C1CCCC(Br)C1 Amb27827804 [0,0,0,1,0,0|3,0,0]=4 1408 B10R1.113 CC(=O)C1CCCC(Cl)C1 Amb26457716 [0,0,0,1,0,0|3,0,0]=4 1409 B10R1.113 CC(=O)C1CCCC(N)C1 Amb25990513 [0,0,0,1,0,0|2,0,0]=3 1410 B10R1.113 CC(=O)C1CCCC(N)C1 Amb33447093 [0,0,0,1,0,0|2,0,0]=3 1411 B10R1.113 CC(=O)N1CCCC(N)C1 Amb6760480 [0,0,0,1,0,0|3,0,0]=4 1412 B10R1.113 CC(=O)N1CCCC(N)C1 Amb9173596 [0,0,0,1,0,0|3,0,0]=4 1413 B10R1.113 CC(=O)N1CCC[C@@H](N)C1 Amb22227486 [0,0,0,1,0,0|3,0,0]=4 1414 B10R1.113 CC(=O)N1CCC[C@@H](N)C1 Amb35752473 [0,0,0,1,0,0|3,0,0]=4 1415 B10R1.113 CC(=O)N1CCC[C@H](N)C1 Amb22227519 [0,0,0,1,0,0|3,0,0]=4 1416 B10R1.113 CC(=O)[C@@H]1CCC[C@@H](N)C1 Amb33307837 [0,0,0,1,0,0|2,0,0]=3 1417 B10R1.113 CC(=O)[C@@H]1CCC[C@H](Cl)C1 Amb28051845 [0,0,0,1,0,0|3,0,0]=4 1418 B10R1.113 CC(=O)[C@@H]1CCC[C@H](N)C1 Amb33132804 [0,0,0,1,0,0|2,0,0]=3 1419 B10R1.113 CC(=O)[C@@H]1CCC[C@H](O)C1 Amb28457491 [0,0,0,1,0,0|3,0,0]=4 1420 B10R1.113 CC(O)C1CCCC(N)C1 Amb27866998 [0,0,0,1,0,0|2,0,1]=4 1421 B10R1.113 CC1=CC(C(=O)O)CCC1 Amb27252115 [0,0,0,1,0,0|2,0,1]=4 1422 B10R1.113 CC1C=C(C(=O)O)CCC1 Amb24446315 [0,0,0,1,0,0|2,0,1]=4 1423 B10R1.113 CC1CC(C(=O)O)CCN1 Amb18831574 [0,0,0,1,0,0|3,0,0]=4 1424 B10R1.113 CC1CC(C(=O)O)CCN1 Amb28555517 [0,0,0,1,0,0|3,0,0]=4 1425 B10R1.113 CC1CC(C(=O)O)CCO1 Amb33545304 [0,0,0,1,0,0|3,0,0]=4 1426 B10R1.113 CC1CC(C(=O)O)CCS1 Amb26442619 [0,0,0,1,0,0|3,0,0]=4 1427 B10R1.113 CC1CCCC(C(=O)Cl)C1 Amb25715458 [0,0,0,1,0,0|3,0,0]=4 1428 B10R1.113 CC1CCCC(C(=O)O)C1 Amb3939935 [0,0,0,1,0,0|2,0,0]=3 1429 B10R1.113 CC1CCCC(C(=O)O)N1 Amb19959953 [0,0,0,1,0,0|1,0,0]=2 1430 B10R1.113 CC1CCCC(C(=O)O)N1 Amb4314386 [0,0,0,1,0,0|1,0,0]=2 1431 B10R1.113 CC1CCCC(C(=O)O)O1 Amb24529278 [0,0,0,1,0,0|2,0,0]=3 1432 B10R1.113 CC1CCCC(S(=O)O)C1 Amb35683278 [0,0,0,1,0,0|3,0,0]=4 1433 B10R1.113 CC1CCC[C@H](C(=O)O)N1 Amb540211 [0,0,0,1,0,0|1,0,0]=2 1434 B10R1.113 CC1CCNC(C(=O)O)C1 Amb13886199 [0,0,0,1,0,0|3,0,0]=4 1435 B10R1.113 CC1CCNC(C(=O)O)C1 Amb19375550 [0,0,0,1,0,0|3,0,0]=4 1436 B10R1.113 CC1CCNC(C(=O)O)O1 Amb25702339 [0,0,0,1,0,0|3,0,0]=4 1437 B10R1.113 CC1CCOC(C(=O)O)C1 Amb25266110 [0,0,0,1,0,0|3,0,0]=4 1438 B10R1.113 CC1CCOC(C(=O)O)N1 Amb33194311 [0,0,0,1,0,0|2,0,0]=3 1439 B10R1.113 CC1CNCC(C(=O)O)C1 Amb18643998 [0,0,0,1,0,0|3,0,0]=4 1440 B10R1.113 CC1CNCC(C(=O)O)N1 Amb32716215 [0,0,0,1,0,0|2,0,0]=3 1441 B10R1.113 CC1CNCC(C(=O)O)O1 Amb26021863 [0,0,0,1,0,0|3,0,0]=4 1442 B10R1.113 CC1CNCC(C(=O)O)O1 Amb32752555 [0,0,0,1,0,0|3,0,0]=4 1443 B10R1.113 CC1COCC(C(=O)O)N1 Amb23585511 [0,0,0,1,0,0|2,0,0]=3 1444 B10R1.113 CC1COCC(C(=O)O)N1 Amb28555605 [0,0,0,1,0,0|2,0,0]=3 1445 B10R1.113 CC1CSCC(C(=O)O)N1 Amb18645533 [0,0,0,1,0,0|2,0,0]=3 1446 B10R1.113 CC1CSCC(C(=O)O)N1 Amb33456372 [0,0,0,1,0,0|2,0,0]=3 1447 B10R1.113 CC1CSC[C@@H](C(=O)O)N1 Amb27223064 [0,0,0,1,0,0|2,0,0]=3 1448 B10R1.113 CC1NC(C(=O)O)CCS1 Amb18278331 [0,0,0,1,0,0|2,0,0]=3 1449 B10R1.113 CN1CCCC(C(=O)O)C1 Amb2689660 [0,0,0,1,0,0|3,0,0]=4 1450 B10R1.113 CN1CCCC(C(=O)O)C1 Amb9238836 [0,0,0,1,0,0|3,0,0]=4 1451 B10R1.113 CN1CCC[C@@H](C(=O)O)C1 Amb22751960 [0,0,0,1,0,0|3,0,0]=4 1452 B10R1.113 CN1CCC[C@H](C(=O)O)C1 Amb28428437 [0,0,0,1,0,0|3,0,0]=4 1453 B10R1.113 CS(=O)C1CCCC(N)C1 Amb25777618 [0,0,0,1,0,0|3,0,0]=4 1454 B10R1.113 C[C@@H]1CCC[C@@H](C(N)=O)C1 Amb28054502 [0,0,0,1,0,0|3,0,0]=4 1455 B10R1.113 C[C@@H]1CCC[C@H](C(=O)O)N1 Amb25168905 [0,0,0,1,0,0|1,0,0]=2 1456 B10R1.113 C[C@@H]1CCC[C@H](C(=O)O)N1 Amb32666562 [0,0,0,1,0,0|1,0,0]=2 1457 B10R1.113 C[C@@H]1CCN[C@@H](C(=O)O)C1 Amb8393477 [0,0,0,1,0,0|3,0,0]=4 1458 B10R1.113 C[C@@H]1CNC[C@@H](C(=O)O)C1 Amb28198256 [0,0,0,1,0,0|3,0,0]=4 1459 B10R1.113 C[C@@H]1CNC[C@@H](C(=O)O)O1 Amb33804088 [0,0,0,1,0,0|3,0,0]=4 1460 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)C1 Amb28186632 [0,0,0,1,0,0|3,0,0]=4 1461 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)C1 Amb35746974 [0,0,0,1,0,0|3,0,0]=4 1462 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)O1 Amb25378882 [0,0,0,1,0,0|3,0,0]=4 1463 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)O1 Amb32664812 [0,0,0,1,0,0|3,0,0]=4 1464 B10R1.113 C[C@@H]1COC[C@H](C(=O)O)N1 Amb25102766 [0,0,0,1,0,0|2,0,0]=3 1465 B10R1.113 C[C@@H]1COC[C@H](C(=O)O)N1 Amb32796271 [0,0,0,1,0,0|2,0,0]=3 1466 B10R1.113 C[C@@H]1C[C@H](C(=O)O)CCN1 Amb31147397 [0,0,0,1,0,0|3,0,0]=4 1467 B10R1.113 C[C@@H]1C[C@H](C(=O)O)CCN1 Amb32670817 [0,0,0,1,0,0|3,0,0]=4 1468 B10R1.113 C[C@H]1CCC[C@@H](C(=O)O)C1 Amb25919595 [0,0,0,1,0,0|2,0,0]=3 1469 B10R1.113 C[C@H]1CCC[C@@H](C(=O)O)N1 Amb28145011 [0,0,0,1,0,0|1,0,0]=2 1470 B10R1.113 C[C@H]1CCC[C@@H](C(=O)O)N1 Amb35746778 [0,0,0,1,0,0|1,0,0]=2 1471 B10R1.113 C[C@H]1CCN[C@H](C(=O)O)C1 Amb22744764 [0,0,0,1,0,0|3,0,0]=4 1472 B10R1.113 C[C@H]1CCN[C@H](C(=O)O)C1 Amb33330844 [0,0,0,1,0,0|3,0,0]=4 1473 B10R1.113 C[C@H]1CCOC(C(=O)O)C1 Amb26057818 [0,0,0,1,0,0|3,0,0]=4 1474 B10R1.113 C[C@H]1CCO[C@@H](C(=O)O)O1 Amb27815067 [0,0,0,1,0,0|3,0,0]=4 1475 B10R1.113 C[C@H]1CCO[C@H](C(=O)O)C1 Amb26565299 [0,0,0,1,0,0|3,0,0]=4 1476 B10R1.113 C[C@H]1CNC[C@@H](C(=O)O)C1 Amb26968513 [0,0,0,1,0,0|3,0,0]=4 1477 B10R1.113 C[C@H]1COC[C@@H](C(=O)O)N1 Amb26528283 [0,0,0,1,0,0|2,0,0]=3 1478 B10R1.113 C[C@H]1COC[C@@H](C(=O)O)N1 Amb35746779 [0,0,0,1,0,0|2,0,0]=3 1479 B10R1.113 C[C@H]1COC[C@@H](C(N)=O)N1 Amb27867896 [0,0,0,1,0,0|3,0,0]=4 1480 B10R1.113 C[C@H]1C[C@@H](C(=O)O)CCN1 Amb26405288 [0,0,0,1,0,0|3,0,0]=4 1481 B10R1.113 C[C@H]1C[C@@H](C(=O)O)CCN1 Amb33362296 [0,0,0,1,0,0|3,0,0]=4 1482 B10R1.113 C[C@H]1OCC[C@@H](C(=O)O)O1 Amb26918498 [0,0,0,1,0,0|3,0,0]=4 1483 B10R1.113 N=C1NCC[C@H](C(=O)O)N1 Amb27203442 [0,0,0,1,0,0|1,0,2]=4 1484 B10R1.113 NC(=O)C1CCCC(F)C1 Amb32943801 [0,0,0,1,0,0|3,0,0]=4 1485 B10R1.113 NC(=O)C1CCCC(N)C1 Amb20669500 [0,0,0,1,0,0|2,0,0]=3 1486 B10R1.113 NC(=O)C1CCCC(N)C1 Amb9709433 [0,0,0,1,0,0|2,0,0]=3 1487 B10R1.113 NC(=O)C1CCCC(O)C1 Amb25067304 [0,0,0,1,0,0|3,0,0]=4 1488 B10R1.113 NC(=O)C1CCCN(N)C1 Amb19663672 [0,0,0,1,0,0|3,0,0]=4 1489 B10R1.113 NC(=O)N1CCCC(N)C1 Amb18278018 [0,0,0,1,0,0|3,0,0]=4 1490 B10R1.113 NC(=O)N1CCCC(N)C1 Amb19149223 [0,0,0,1,0,0|3,0,0]=4 1491 B10R1.113 NC(=O)N1CCC[C@@H](N)C1 Amb27424872 [0,0,0,1,0,0|3,0,0]=4 1492 B10R1.113 NC(=O)N1CCC[C@H](N)C1 Amb32413880 [0,0,0,1,0,0|3,0,0]=4 1493 B10R1.113 NC(=O)[C@@H]1CCCC(=O)N1 Amb24753146 [0,0,0,1,0,0|2,0,1]=4 1494 B10R1.113 NC(=O)[C@@H]1CCC[C@@H](N)C1 Amb10873178 [0,0,0,1,0,0|2,0,0]=3 1495 B10R1.113 NC(=O)[C@@H]1CCC[C@H](O)C1 Amb27433641 [0,0,0,1,0,0|3,0,0]=4 1496 B10R1.113 NC(=O)[C@H]1CCC[C@@H](N)C1 Amb33457595 [0,0,0,1,0,0|2,0,0]=3 1497 B10R1.113 NC(=O)[C@H]1CCC[C@@H](N)C1 Amb33457596 [0,0,0,1,0,0|2,0,0]=3 1498 B10R1.113 NC1=NC(C(=O)O)CCS1 Amb25756997 [0,0,0,1,0,0|1,0,2]=4 1499 B10R1.113 NC1=NCCC(C(=O)O)C1 Amb28042963 [0,0,0,1,0,0|2,0,1]=4 1500 B10R1.113 NC1=NCCC(C(=O)O)N1 Amb27202937 [0,0,0,1,0,0|1,0,1]=3 1501 B10R1.113 NC1=N[C@H](C(=O)O)CSC1 Amb28384073 [0,0,0,1,0,0|1,0,2]=4 1502 B10R1.113 NC1C=CCC(C(=O)O)C1 Amb27180527 [0,0,0,1,0,0|1,0,2]=4 1503 B10R1.113 NC1C=CCC(C(=O)O)C1 Amb32675210 [0,0,0,1,0,0|1,0,2]=4 1504 B10R1.113 NC1CCCC(C(=O)Cl)C1 Amb27861962 [0,0,0,1,0,0|2,0,0]=3 1505 B10R1.113 NC1CCCC(C(=O)O)C1 Amb32664151 [0,0,0,1,0,0|1,0,0]=2 1506 B10R1.113 NC1CCCC(C(=O)O)C1 Amb33545486 [0,0,0,1,0,0|1,0,0]=2 1507 B10R1.113 NC1CCOC(C(=O)O)C1 Amb26917330 [0,0,0,1,0,0|2,0,0]=3 1508 B10R1.113 NC1CCOC(C(=O)O)C1 Amb33338762 [0,0,0,1,0,0|2,0,0]=3 1509 B10R1.113 NC1COCC(C(=O)O)C1 Amb25088866 [0,0,0,1,0,0|2,0,0]=3 1510 B10R1.113 N[C@@H]1CCC[C@@H](C(=O)O)C1 Amb10873166 [0,0,0,1,0,0|1,0,0]=2 1511 B10R1.113 N[C@@H]1CCC[C@@H](C(=O)O)C1 Amb25989341 [0,0,0,1,0,0|1,0,0]=2 1512 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 Amb20241308 [0,0,0,1,0,0|1,0,0]=2 1513 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 Amb32643943 [0,0,0,1,0,0|1,0,0]=2 1514 B10R1.113 N[C@@H]1CNC[C@@H](C(=O)O)C1 Amb27186917 [0,0,0,1,0,0|2,0,0]=3 1515 B10R1.113 N[C@H]1C=CC[C@@H](C(=O)O)C1 Amb26568665 [0,0,0,1,0,0|1,0,2]=4 1516 B10R1.113 N[C@H]1C=CC[C@@H](C(=O)O)C1 Amb32675220 [0,0,0,1,0,0|1,0,2]=4 1517 B10R1.113 N[C@H]1C=CC[C@H](C(=O)O)C1 Amb26589126 [0,0,0,1,0,0|1,0,2]=4 1518 B10R1.113 N[C@H]1C=CC[C@H](C(=O)O)C1 Amb32679286 [0,0,0,1,0,0|1,0,2]=4 1519 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 Amb20241307 [0,0,0,1,0,0|1,0,0]=2 1520 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 Amb23439976 [0,0,0,1,0,0|1,0,0]=2 1521 B10R1.113 N[C@H]1CCC[C@H](C(=O)O)C1 Amb22746829 [0,0,0,1,0,0|1,0,0]=2 1522 B10R1.113 N[C@H]1CCC[C@H](C(=O)O)C1 Amb23439848 [0,0,0,1,0,0|1,0,0]=2 1523 B10R1.113 N[C@H]1CCO[C@H](C(=O)O)C1 Amb32992741 [0,0,0,1,0,0|2,0,0]=3 1524 B10R1.113 O=C(Cl)C1CCCC(Cl)C1 Amb28322791 [0,0,0,1,0,0|3,0,0]=4 1525 B10R1.113 O=C(O)C1=CC(O)CCC1 Amb25889028 [0,0,0,1,0,0|2,0,1]=4 1526 B10R1.113 O=C(O)C1=C[C@H](O)CCC1 Amb27203167 [0,0,0,1,0,0|2,0,1]=4 1527 B10R1.113 O=C(O)C1CC(F)CCN1 Amb24423965 [0,0,0,1,0,0|3,0,0]=4 1528 B10R1.113 O=C(O)C1CC(O)CCN1 Amb24117443 [0,0,0,1,0,0|3,0,0]=4 1529 B10R1.113 O=C(O)C1CC(O)CCO1 Amb28246597 [0,0,0,1,0,0|3,0,0]=4 1530 B10R1.113 O=C(O)C1CCCC(F)C1 Amb26004039 [0,0,0,1,0,0|2,0,0]=3 1531 B10R1.113 O=C(O)C1CCCC(O)C1 Amb33544783 [0,0,0,1,0,0|2,0,0]=3 1532 B10R1.113 O=C(O)C1CCCC(S)C1 Amb32788453 [0,0,0,1,0,0|2,0,0]=3 1533 B10R1.113 O=C(O)C1CNCC(O)C1 Amb2695137 [0,0,0,1,0,0|3,0,0]=4 1534 B10R1.113 O=C(O)C1CNCC(O)C1 Amb8630089 [0,0,0,1,0,0|3,0,0]=4 1535 B10R1.113 O=C(O)C1COCC(O)C1 Amb27810785 [0,0,0,1,0,0|3,0,0]=4 1536 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](O)C1 Amb22899464 [0,0,0,1,0,0|2,0,0]=3 1537 B10R1.113 O=C(O)[C@@H]1CCC[C@H](Br)C1 Amb28053594 [0,0,0,1,0,0|2,0,0]=3 1538 B10R1.113 O=C(O)[C@@H]1CCC[C@H](O)C1 Amb28059041 [0,0,0,1,0,0|2,0,0]=3 1539 B10R1.113 O=C(O)[C@@H]1CNC[C@@H](O)C1 Amb27186916 [0,0,0,1,0,0|3,0,0]=4 1540 B10R1.113 O=C(O)[C@@H]1CNC[C@H](F)C1 Amb27447199 [0,0,0,1,0,0|3,0,0]=4 1541 B10R1.113 O=C(O)[C@@H]1CNC[C@H](O)C1 Amb27188671 [0,0,0,1,0,0|3,0,0]=4 1542 B10R1.113 O=C(O)[C@@H]1C[C@@H](O)CCN1 Amb22388540 [0,0,0,1,0,0|3,0,0]=4 1543 B10R1.113 O=C(O)[C@@H]1C[C@H](F)CCN1 Amb27786906 [0,0,0,1,0,0|3,0,0]=4 1544 B10R1.113 O=C(O)[C@@H]1C[C@H](O)CCN1 Amb22386828 [0,0,0,1,0,0|3,0,0]=4 1545 B10R1.113 O=C(O)[C@H]1CCC[C@@H](Cl)C1 Amb28436868 [0,0,0,1,0,0|2,0,0]=3 1546 B10R1.113 O=C(O)[C@H]1CCC[C@@H](O)C1 Amb22899465 [0,0,0,1,0,0|2,0,0]=3 1547 B10R1.113 O=C(O)[C@H]1CCC[C@H](Cl)C1 Amb28385610 [0,0,0,1,0,0|2,0,0]=3 1548 B10R1.113 O=C(O)[C@H]1C[C@@H](O)CCN1 Amb20241913 [0,0,0,1,0,0|3,0,0]=4 1549 B10R1.113 O=C(O)[C@H]1C[C@H](O)CCN1 Amb22748263 [0,0,0,1,0,0|3,0,0]=4 1550 B10R1.113 O=C(O)[C@H]1C[C@H](O)CCN1 Amb30982057 [0,0,0,1,0,0|3,0,0]=4 1551 B10R1.113 O=C1CCCC(C(=O)O)C1 Amb6305244 [0,0,0,1,0,0|2,0,1]=4 1552 B10R1.113 O=C1CCCC(C(=O)O)N1 Amb2697230 [0,0,0,1,0,0|1,0,1]=3 1553 B10R1.113 O=C1CCCC(C(=O)O)O1 Amb27969173 [0,0,0,1,0,0|2,0,1]=4 1554 B10R1.113 O=C1CCC[C@@H](C(=O)O)C1 Amb28050152 [0,0,0,1,0,0|2,0,1]=4 1555 B10R1.113 O=C1CCC[C@@H](C(=O)O)N1 Amb10576327 [0,0,0,1,0,0|1,0,1]=3 1556 B10R1.113 O=C1CCC[C@H](C(=O)O)N1 Amb8631220 [0,0,0,1,0,0|1,0,1]=3 1557 B10R1.113 O=C1CNC[C@H](C(=O)O)N1 Amb27398104 [0,0,0,1,0,0|2,0,1]=4 1558 B10R1.113 O=C1COCC(C(=O)O)N1 Amb18862478 [0,0,0,1,0,0|2,0,1]=4 1559 B10R1.113 O=C1COC[C@@H](C(=O)O)N1 Amb27164013 [0,0,0,1,0,0|2,0,1]=4 1560 B10R1.113 O=C1CSCC(C(=O)O)N1 Amb2693036 [0,0,0,1,0,0|2,0,1]=4 1561 B10R1.113 O=C1CSC[C@@H](C(=O)O)N1 Amb26516534 [0,0,0,1,0,0|2,0,1]=4 1562 B10R1.113 O=C1CSC[C@H](C(=O)O)N1 Amb27667984 [0,0,0,1,0,0|2,0,1]=4 1563 B10R1.113 O=C1NC(C(=O)O)CCO1 Amb28121893 [0,0,0,1,0,0|2,0,1]=4 1564 B10R1.113 O=C1NC(C(=O)O)CCS1 Amb28342373 [0,0,0,1,0,0|2,0,1]=4 1565 B10R1.113 O=[PH](O)C1CCCC(Cl)C1 Amb27760848 [0,0,0,1,0,0|3,0,0]=4 1566 B10R1.116 CC1CCC1C(N)C(=O)O Amb35666629 [0,0,0,1,0,0|1,0,0]=2 1567 B10R1.116 CC1CCN1C(C)C(=O)O Amb27785364 [0,0,0,1,0,0|3,0,0]=4 1568 B10R1.116 NC(=O)C(N)C1CCC1O Amb33036780 [0,0,0,1,0,0|2,0,0]=3 1569 B10R1.116 NC(C(=O)O)C1CCC1O Amb33127592 [0,0,0,1,0,0|1,0,0]=2 1570 B10R1.116 N[C@@H](C(=O)O)C1CCC1O Amb33065605 [0,0,0,1,0,0|1,0,0]=2 1571 B10R1.116 N[C@H](C(=O)O)C1CCC1O Amb32788587 [0,0,0,1,0,0|1,0,0]=2 1572 B10R1.116 O=C(O)C(O)C1CCC1=O Amb28349882 [0,0,0,1,0,0|2,0,1]=4 1573 B10R1.131 C=CC[C@H]1C[C@@H](O)C(=O)O1 Amb27423205 [0,0,0,1,0,0|2,0,1]=4 1574 B10R1.131 CC1CC(CCBr)OC1=O Amb27619697 [0,0,0,1,0,0|2,0,0]=3 1575 B10R1.131 CC1CC(CCN)OC1=O Amb27816570 [0,0,0,1,0,0|1,0,0]=2 1576 B10R1.131 CCCC1CC(=O)C(=O)O1 Amb17593586 [0,0,0,1,0,0|2,0,1]=4 1577 B10R1.131 CCCC1CC(C)C(=O)N1 Amb28388420 [0,0,0,1,0,0|3,0,0]=4 1578 B10R1.131 CCCC1OC(=O)C(C)O1 Amb4034550 [0,0,0,1,0,0|3,0,0]=4 1579 B10R1.131 CCCC1OC(=O)C(F)S1 Amb27838868 [0,0,0,1,0,0|3,0,0]=4 1580 B10R1.131 CCC[C@@H]1C[C@H](O)C(=O)O1 Amb27448038 [0,0,0,1,0,0|2,0,0]=3 1581 B10R1.131 CN1CC(CCN)CC1=O Amb25739570 [0,0,0,1,0,0|3,0,0]=4 1582 B10R1.131 CN1CC(CCN)OC1=O Amb18831496 [0,0,0,1,0,0|2,0,0]=3 1583 B10R1.131 CN1CC(CON)OC1=O Amb35684471 [0,0,0,1,0,0|3,0,0]=4 1584 B10R1.131 CSCC1CN(N)C(=O)O1 Amb17594038 [0,0,0,1,0,0|3,0,0]=4 1585 B10R1.131 NCCC1CC(O)C(O)C1 Amb27757233 [0,0,0,1,0,0|2,0,1]=4 1586 B10R1.131 N[C@H]1C[C@@H](CCCl)OC1=O Amb27629568 [0,0,0,1,0,0|1,0,0]=2 1587 B10R1.131 N[C@H]1C[C@@H](CCO)OC1=O Amb27629757 [0,0,0,1,0,0|1,0,0]=2 1588 B10R1.144 CC(=O)[C@H]1O[C@@H]1CCCO Amb28349303 [0,0,0,1,0,0|3,0,0]=4 1589 B10R1.144 CCCCC1=C[C@@H]1C(=O)O Amb27258425 [0,0,0,1,0,0|2,0,1]=4 1590 B10R1.144 CCCCC1CC1C(=O)O Amb10608641 [0,0,0,1,0,0|2,0,0]=3 1591 B10R1.144 CCCCC1OC1C(C)=O Amb27750786 [0,0,0,1,0,0|3,0,0]=4 1592 B10R1.144 CCCC[C@@H]1C[C@@H]1C(C)=O Amb27619227 [0,0,0,1,0,0|3,0,0]=4 1593 B10R1.144 CCCC[C@@H]1C[C@H]1C(=O)O Amb25960764 [0,0,0,1,0,0|2,0,0]=3 1594 B10R1.144 CCCC[C@@H]1O[C@H]1C(=O)O Amb24585157 [0,0,0,1,0,0|2,0,0]=3 1595 B10R1.144 CCCC[C@@H]1O[C@H]1C(C)=O Amb28244724 [0,0,0,1,0,0|3,0,0]=4 1596 B10R1.144 CCOCC1CC1C(=O)O Amb28071192 [0,0,0,1,0,0|3,0,0]=4 1597 B10R1.144 CCOC[C@@H]1C[C@H]1C(=O)O Amb26947700 [0,0,0,1,0,0|3,0,0]=4 1598 B10R1.144 CCSCC1CC1C(=O)O Amb33324041 [0,0,0,1,0,0|3,0,0]=4 1599 B10R1.144 CCSC[C@@H]1C[C@H]1C(=O)O Amb33324038 [0,0,0,1,0,0|3,0,0]=4 1600 B10R1.144 COCCC1CC1C(=O)O Amb33377829 [0,0,0,1,0,0|3,0,0]=4 1601 B10R1.144 COCC[C@@H]1C[C@H]1C(=O)O Amb33377827 [0,0,0,1,0,0|3,0,0]=4 1602 B10R1.144 CSCCC1CC1C(=O)O Amb33198761 [0,0,0,1,0,0|3,0,0]=4 1603 B10R1.144 CSCC[C@@H]1C[C@H]1C(=O)O Amb33198757 [0,0,0,1,0,0|3,0,0]=4 1604 B10R1.144 NC\C=C\[C@@H]1C[C@@H]1C(=O)O Amb27858384 [0,0,0,1,0,0|1,0,2]=4 1605 B10R1.155 C=C(C)C(N)C1CC1CC Amb27880430 [0,0,0,1,0,0|3,0,0]=4 1606 B10R1.155 C=C(C)C(N)[C@@H]1C[C@H]1CC Amb27803096 [0,0,0,1,0,0|3,0,0]=4 1607 B10R1.155 CCC1CC1C(C)C(=O)O Amb28130000 [0,0,0,1,0,0|2,0,0]=3 1608 B10R1.155 CCC1CC1C(N)C(=O)O Amb27639984 [0,0,0,1,0,0|1,0,0]=2 1609 B10R1.155 NC(C(=O)O)C1CC1CO Amb28076860 [0,0,0,1,0,0|1,0,0]=2 1610 B10R1.176 CC1CCC(C=O)OC1=O Amb26474867 [0,0,0,1,0,0|2,0,1]=4 1611 B10R1.176 CC1CCC(CCl)NC1=O Amb27481484 [0,0,0,1,0,0|3,0,0]=4 1612 B10R1.176 CC1CCC(CO)CC1=O Amb27433532 [0,0,0,1,0,0|3,0,0]=4 1613 B10R1.176 CC1CCC(CO)NC1=O Amb27828134 [0,0,0,1,0,0|3,0,0]=4 1614 B10R1.176 CC1CCC(CO)OC1=O Amb27772597 [0,0,0,1,0,0|2,0,0]=3 1615 B10R1.176 CC1OC(CO)CCC1N Amb27620448 [0,0,0,1,0,0|2,0,1]=4 1616 B10R1.176 CC[C@@H]1CC[C@@H](C)C(=O)C1 Amb28351646 [0,0,0,1,0,0|3,0,0]=4 1617 B10R1.176 CN1CCC(CN)CC1=O Amb18908367 [0,0,0,1,0,0|3,0,0]=4 1618 B10R1.176 CN1CCC(CN)CC1=O Amb23439152 [0,0,0,1,0,0|3,0,0]=4 1619 B10R1.176 CN1CCC(CN)CC1=O Amb28555569 [0,0,0,1,0,0|3,0,0]=4 1620 B10R1.176 CN1CCC(CO)OC1=O Amb8388589 [0,0,0,1,0,0|3,0,0]=4 1621 B10R1.176 CN1CC[C@@H](CN)OC1=O Amb27390402 [0,0,0,1,0,0|2,0,0]=3 1622 B10R1.176 CN1CC[C@@H](CO)OC1=O Amb27472723 [0,0,0,1,0,0|3,0,0]=4 1623 B10R1.176 NCC1CCC(N)C(O)O1 Amb27837977 [0,0,0,1,0,0|0,0,2]=3 1624 B10R1.176 NC[C@@H]1CC[C@@H](N)[C@@H](O)O1 Amb25929919 [0,0,0,1,0,0|0,0,2]=3 1625 B10R1.176 N[C@H]1CC[C@@H](CF)NC1=O Amb25989934 [0,0,0,1,0,0|2,0,0]=3 1626 B10R1.190 C=C1CC1CC(N)C(=O)O Amb24117524 [0,0,0,1,0,0|1,0,1]=3 1627 B10R1.190 C=C1CC1C[C@@H](N)C(=O)O Amb24640688 [0,0,0,1,0,0|1,0,1]=3 1628 B10R1.190 C=C1C[C@@H]1C[C@H](N)C(=O)O Amb17615983 [0,0,0,1,0,0|1,0,1]=3 1629 B10R1.190 CC(CC1CC1C)C(=O)O Amb33448930 [0,0,0,1,0,0|2,0,0]=3 1630 B10R1.190 CC1CC1CC(=O)C(=O)O Amb32954470 [0,0,0,1,0,0|2,0,1]=4 1631 B10R1.190 CC1CC1CC(N)C(=O)O Amb25147396 [0,0,0,1,0,0|1,0,0]=2 1632 B10R1.190 CC1CC1CC(N)C(N)=O Amb33308625 [0,0,0,1,0,0|2,0,0]=3 1633 B10R1.190 CC1CC1CC(O)C(=O)O Amb33353335 [0,0,0,1,0,0|2,0,0]=3 1634 B10R1.190 CC1CC1C[C@@H](N)C(=O)O Amb33036595 [0,0,0,1,0,0|1,0,0]=2 1635 B10R1.190 CC1CC1C[C@H](N)C(=O)O Amb25305763 [0,0,0,1,0,0|1,0,0]=2 1636 B10R1.190 CC1SC1CC(N)C(=O)O Amb28143562 [0,0,0,1,0,0|2,0,0]=3 1637 B10R1.190 C[C@@H]1O[C@H]1C[C@H](N)C(=O)O Amb27421923 [0,0,0,1,0,0|2,0,0]=3 1638 B10R1.190 C[C@H]1O[C@H]1C[C@H](N)C(=O)O Amb27254136 [0,0,0,1,0,0|2,0,0]=3 1639 B10R1.190 NC(C[C@@H]1C[C@H]1N)C(=O)O Amb27783818 [0,0,0,1,0,0|0,0,0]=1 1640 B10R1.190 NC1CC1NC(=O)C(=O)O Amb28285321 [0,0,0,1,0,0|2,0,1]=4 1641 B10R1.190 N[C@@H](CC1CC1=O)C(=O)O Amb28315789 [0,0,0,1,0,0|1,0,1]=3 1642 B10R1.190 N[C@H](C[C@@H]1C[C@H]1N)C(=O)O Amb27194166 [0,0,0,1,0,0|0,0,0]=1 1643 B10R1.204 CC(=O)N(C)CC1CCN1 Amb27665911 [0,0,0,1,0,0|3,0,0]=4 1644 B10R1.204 CC(=O)N(N)CC1CCC1 Amb33191665 [0,0,0,1,0,0|3,0,0]=4 1645 B10R1.204 CC(CC1CCC1)C(=O)O Amb27812387 [0,0,0,1,0,0|2,0,0]=3 1646 B10R1.204 CC(CC1CCO1)C(=O)O Amb33727407 [0,0,0,1,0,0|2,0,0]=3 1647 B10R1.204 CC(CN1CCC1)C(=O)O Amb28049704 [0,0,0,1,0,0|3,0,0]=4 1648 B10R1.204 CC(NC1CCC1)C(=O)O Amb18989323 [0,0,0,1,0,0|3,0,0]=4 1649 B10R1.204 CC(OC1CCC1)C(=O)O Amb18977476 [0,0,0,1,0,0|3,0,0]=4 1650 B10R1.204 CN(CC1CCN1)C(N)=O Amb28052841 [0,0,0,1,0,0|3,0,0]=4 1651 B10R1.204 C[C@@H](CC1CCC1)C(=O)O Amb33749526 [0,0,0,1,0,0|2,0,0]=3 1652 B10R1.204 C[C@@H](CC1CCO1)C(=O)O Amb33728832 [0,0,0,1,0,0|2,0,0]=3 1653 B10R1.204 C[C@H](CC1CCC1)C(=O)O Amb33738108 [0,0,0,1,0,0|2,0,0]=3 1654 B10R1.204 C[C@H](CC1CCO1)C(=O)O Amb33729204 [0,0,0,1,0,0|2,0,0]=3 1655 B10R1.204 NC(=O)C(F)CC1CCC1 Amb33611588 [0,0,0,1,0,0|3,0,0]=4 1656 B10R1.204 NC(=O)C(N)CC1CCC1 Amb26618159 [0,0,0,1,0,0|2,0,0]=3 1657 B10R1.204 NC(=O)C(N)CC1CNC1 Amb27959203 [0,0,0,1,0,0|3,0,0]=4 1658 B10R1.204 NC(CC1=CCC1)C(=O)O Amb28239360 [0,0,0,1,0,0|1,0,1]=3 1659 B10R1.204 NC(CC1CCC1)C(=O)O Amb21963935 [0,0,0,1,0,0|1,0,0]=2 1660 B10R1.204 NC(CC1CCC1)C(=O)O Amb28896003 [0,0,0,1,0,0|1,0,0]=2 1661 B10R1.204 NC(CN1CCC1)C(=O)O Amb27402247 [0,0,0,1,0,0|2,0,0]=3 1662 B10R1.204 N[C@@H](CC1CCC1)C(=O)O Amb22641837 [0,0,0,1,0,0|1,0,0]=2 1663 B10R1.204 N[C@H](CC1CCC1)C(=O)O Amb19889667 [0,0,0,1,0,0|1,0,0]=2 1664 B10R1.204 O=C(O)C(=O)CC1CCC1 Amb26501402 [0,0,0,1,0,0|2,0,1]=4 1665 B10R1.204 O=C(O)C(F)CC1CCC1 Amb26324472 [0,0,0,1,0,0|2,0,0]=3 1666 B10R1.204 O=C(O)C(F)CN1CCC1 Amb27209852 [0,0,0,1,0,0|3,0,0]=4 1667 B10R1.204 O=C(O)C(F)OC1CCC1 Amb28410162 [0,0,0,1,0,0|3,0,0]=4 1668 B10R1.204 O=C(O)C(O)CC1CCC1 Amb25701846 [0,0,0,1,0,0|2,0,0]=3 1669 B10R1.204 O=C(O)C(O)CN1CCC1 Amb28049703 [0,0,0,1,0,0|3,0,0]=4 1670 B10R1.204 O=C(O)[C@@H](O)CC1CCC1 Amb27655656 [0,0,0,1,0,0|2,0,0]=3 1671 B10R1.204 O=C(O)[C@H](O)CC1CCC1 Amb27216981 [0,0,0,1,0,0|2,0,0]=3 1672 B10R1.205 CC(=O)C(C)CCC1CC1 Amb27494349 [0,0,0,1,0,0|3,0,0]=4 1673 B10R1.205 CC(CCC1CC1)C(=O)O Amb28042040 [0,0,0,1,0,0|2,0,0]=3 1674 B10R1.205 CC(CNC1CC1)C(=O)O Amb9400282 [0,0,0,1,0,0|3,0,0]=4 1675 B10R1.205 CC(CSC1CC1)C(=O)O Amb27228111 [0,0,0,1,0,0|3,0,0]=4 1676 B10R1.205 CC(OCC1CC1)C(=O)O Amb6680906 [0,0,0,1,0,0|3,0,0]=4 1677 B10R1.205 C[C@@H](CCC1CC1)C(=O)O Amb33744645 [0,0,0,1,0,0|2,0,0]=3 1678 B10R1.205 C[C@H](CCC1CC1)C(=O)O Amb33738116 [0,0,0,1,0,0|2,0,0]=3 1679 B10R1.205 NC(=O)C(Cl)CCC1CC1 Amb27434724 [0,0,0,1,0,0|3,0,0]=4 1680 B10R1.205 NC(=O)C(N)CCC1CC1 Amb25284806 [0,0,0,1,0,0|2,0,0]=3 1681 B10R1.205 NC(CCC1CC1)C(=O)O Amb18831582 [0,0,0,1,0,0|1,0,0]=2 1682 B10R1.205 NC(CNC1CC1)C(=O)O Amb27668994 [0,0,0,1,0,0|2,0,0]=3 1683 B10R1.205 N[C@@H](CCC1CC1)C(=O)O Amb25236249 [0,0,0,1,0,0|1,0,0]=2 1684 B10R1.205 N[C@H](CCC1CC1)C(=O)O Amb27801629 [0,0,0,1,0,0|1,0,0]=2 1685 B10R1.205 O=C(O)C(=O)CCC1CC1 Amb26540532 [0,0,0,1,0,0|2,0,1]=4 1686 B10R1.205 O=C(O)C(O)CCC1CC1 Amb25187335 [0,0,0,1,0,0|2,0,0]=3 1687 B10R1.217 CCCCC1NC(=O)C1Br Amb28118443 [0,0,0,1,0,0|3,0,0]=4 1688 B10R1.217 CCCCC1NC(=O)C1C Amb28397328 [0,0,0,1,0,0|3,0,0]=4 1689 B10R1.217 CCCCC1NC(=O)C1O Amb27837929 [0,0,0,1,0,0|3,0,0]=4 1690 B10R1.277 CC1CCCC(C)C(=O)N1 Amb19335341 [0,0,0,1,0,0|3,0,0]=4 1691 B10R1.277 CC1CCCC(N)C(=O)N1 Amb32455738 [0,0,0,1,0,0|2,0,0]=3 1692 B10R1.277 C[C@H]1CCC[C@@H](C)C(=O)N1 Amb27860437 [0,0,0,1,0,0|3,0,0]=4 1693 B10R1.291 CC(=O)C1(C)CCCC1N Amb27859716 [0,0,0,1,0,0|2,0,0]=3 1694 B10R1.291 CC(=O)C1(C)COCC1N Amb24586865 [0,0,0,1,0,0|3,0,0]=4 1695 B10R1.291 CC(O)C1(C)CCCC1N Amb35621031 [0,0,0,1,0,0|2,0,1]=4 1696 B10R1.291 CC1(C(=O)O)CCCC1=O Amb33249720 [0,0,0,1,0,0|2,0,1]=4 1697 B10R1.291 CC1(C(=O)O)CCCC1N Amb18643994 [0,0,0,1,0,0|1,0,0]=2 1698 B10R1.291 CC1(C(=O)O)CCCC1N Amb32693462 [0,0,0,1,0,0|1,0,0]=2 1699 B10R1.291 CC1(C(=O)O)CCCC1O Amb18644145 [0,0,0,1,0,0|2,0,0]=3 1700 B10R1.291 CC1(C(=O)O)CCCN1O Amb27858287 [0,0,0,1,0,0|3,0,0]=4 1701 B10R1.291 CC1(C(=O)O)NCCC1O Amb28455757 [0,0,0,1,0,0|3,0,0]=4 1702 B10R1.291 CC1CCCC1(C)C(=O)O Amb33545081 [0,0,0,1,0,0|2,0,0]=3 1703 B10R1.291 CC1CCCC1(C)C(N)=O Amb26588946 [0,0,0,1,0,0|3,0,0]=4 1704 B10R1.291 CC1CCCC1(N)C(=O)O Amb2695736 [0,0,0,1,0,0|1,0,0]=2 1705 B10R1.291 CC1CCCC1(N)C(=O)O Amb31156300 [0,0,0,1,0,0|1,0,0]=2 1706 B10R1.291 CC1CCCC1(N)C(N)=O Amb33547798 [0,0,0,1,0,0|2,0,0]=3 1707 B10R1.291 CC1COCC1(N)C(=O)O Amb35646804 [0,0,0,1,0,0|2,0,0]=3 1708 B10R1.291 CC1COCC1(N)C(N)=O Amb35635778 [0,0,0,1,0,0|3,0,0]=4 1709 B10R1.291 CC1COCC1(O)C(=O)O Amb35632025 [0,0,0,1,0,0|3,0,0]=4 1710 B10R1.291 CC1OCCC1(C)C(=O)O Amb26591045 [0,0,0,1,0,0|3,0,0]=4 1711 B10R1.291 CC1OCCC1(F)C(=O)O Amb33078512 [0,0,0,1,0,0|3,0,0]=4 1712 B10R1.291 CC1OCCC1(O)C(=O)O Amb27606899 [0,0,0,1,0,0|3,0,0]=4 1713 B10R1.291 CN1CCC[C@@]1(C)C(=O)O Amb25068442 [0,0,0,1,0,0|3,0,0]=4 1714 B10R1.291 CN1CCC[C@@]1(O)C(=O)O Amb28061304 [0,0,0,1,0,0|3,0,0]=4 1715 B10R1.291 CN1CCC[C@]1(C)C(=O)O Amb26930260 [0,0,0,1,0,0|3,0,0]=4 1716 B10R1.291 C[C@@H]1CCC[C@@]1(N)C(=O)O Amb26580738 [0,0,0,1,0,0|1,0,0]=2 1717 B10R1.291 C[C@@H]1CCC[C@@]1(N)C(N)=O Amb27420226 [0,0,0,1,0,0|2,0,0]=3 1718 B10R1.291 C[C@@H]1CCC[C@]1(C)C(N)=O Amb27261999 [0,0,0,1,0,0|3,0,0]=4 1719 B10R1.291 C[C@@H]1CCC[C@]1(N)C(=O)O Amb24562232 [0,0,0,1,0,0|1,0,0]=2 1720 B10R1.291 C[C@@H]1CNC[C@@]1(C)C(=O)O Amb28287365 [0,0,0,1,0,0|3,0,0]=4 1721 B10R1.291 C[C@@H]1CNC[C@@]1(C)C(=O)O Amb31156310 [0,0,0,1,0,0|3,0,0]=4 1722 B10R1.291 C[C@@]1(C(=O)O)CCC[C@@H]1N Amb22504290 [0,0,0,1,0,0|1,0,0]=2 1723 B10R1.291 C[C@H]1CCC[C@@]1(N)C(=O)O Amb27786907 [0,0,0,1,0,0|1,0,0]=2 1724 B10R1.291 C[C@H]1CCC[C@@]1(N)C(N)=O Amb27960295 [0,0,0,1,0,0|2,0,0]=3 1725 B10R1.291 C[C@H]1CCC[C@]1(N)C(N)=O Amb27420225 [0,0,0,1,0,0|2,0,0]=3 1726 B10R1.291 C[C@H]1CSC[C@@]1(N)C(=O)O Amb27202538 [0,0,0,1,0,0|2,0,0]=3 1727 B10R1.291 C[C@]1(C(=O)O)CCC[C@@H]1N Amb24580091 [0,0,0,1,0,0|1,0,0]=2 1728 B10R1.291 C[C@]1(C(=O)O)CCC[C@@H]1O Amb28058141 [0,0,0,1,0,0|2,0,0]=3 1729 B10R1.291 C[C@]1(C(=O)O)CCC[C@H]1N Amb27767841 [0,0,0,1,0,0|1,0,0]=2 1730 B10R1.291 NC1(C(=O)O)CCCC1Cl Amb2695624 [0,0,0,1,0,0|1,0,0]=2 1731 B10R1.291 NC1(C(=O)O)CCCC1F Amb27841625 [0,0,0,1,0,0|1,0,0]=2 1732 B10R1.291 NC1CCCC1(N)C(=O)O Amb27817777 [0,0,0,1,0,0|0,0,0]=1 1733 B10R1.291 O=C(O)C1(O)CCCC1F Amb27461367 [0,0,0,1,0,0|2,0,0]=3 1734 B10R1.291 O=C(O)C1(O)COCC1O Amb28126796 [0,0,0,1,0,0|3,0,0]=4 1735 B10R1.291 O=C(O)[C@@]1(O)CCC[C@H]1F Amb27767897 [0,0,0,1,0,0|2,0,0]=3 1736 B10R1.291 O=C(O)[C@@]1(O)COC[C@H]1O Amb27472429 [0,0,0,1,0,0|3,0,0]=4 1737 B10R1.319 CCCC1CC1(N)C(=O)O Amb24391690 [0,0,0,1,0,0|1,0,0]=2 1738 B10R1.319 CCCC1OC1(C)C(=O)O Amb28325821 [0,0,0,1,0,0|3,0,0]=4 1739 B10R1.319 COC[C@@H]1C[C@@]1(C)C(=O)O Amb33098406 [0,0,0,1,0,0|3,0,0]=4 1740 B10R1.319 COC[C@H]1C[C@@]1(C)C(=O)O Amb33098401 [0,0,0,1,0,0|3,0,0]=4 1741 B10R1.319 CSCC1CC1(N)C(=O)O Amb27838049 [0,0,0,1,0,0|2,0,0]=3 1742 B10R1.319 CSC[C@H]1C[C@@]1(N)C(=O)O Amb28365949 [0,0,0,1,0,0|2,0,0]=3 1743 B10R1.319 CSC[C@H]1C[C@]1(N)C(=O)O Amb27780183 [0,0,0,1,0,0|2,0,0]=3 1744 B10R1.319 NC1(C(=O)O)CC1CCO Amb28290452 [0,0,0,1,0,0|1,0,0]=2 1745 B10R1.348 CC(=O)C1CCCCCC1 Amb24407172 [0,0,0,1,0,0|3,0,0]=4 1746 B10R1.348 CC(=O)C1CCCCCN1 Amb25169359 [0,0,0,1,0,0|2,0,0]=3 1747 B10R1.348 CC(=O)C1CNCCOC1 Amb33132256 [0,0,0,1,0,0|3,0,0]=4 1748 B10R1.348 NC(=O)C1CCCCCC1 Amb24182051 [0,0,0,1,0,0|3,0,0]=4 1749 B10R1.348 NC(=O)C1CCCCCN1 Amb23596651 [0,0,0,1,0,0|2,0,0]=3 1750 B10R1.348 NC(=O)C1CCCCNC1 Amb27483476 [0,0,0,1,0,0|2,0,0]=3 1751 B10R1.348 NC(=O)C1CNCCNC1 Amb27475768 [0,0,0,1,0,0|3,0,0]=4 1752 B10R1.348 NC(=O)C1CNCCOC1 Amb20062256 [0,0,0,1,0,0|3,0,0]=4 1753 B10R1.348 O=C(Cl)C1CCCCCC1 Amb18797932 [0,0,0,1,0,0|3,0,0]=4 1754 B10R1.348 O=C(O)C1=CCCCCC1 Amb26605756 [0,0,0,1,0,0|2,0,1]=4 1755 B10R1.348 O=C(O)C1=NCCCCN1 Amb27975697 [0,0,0,1,0,0|2,0,1]=4 1756 B10R1.348 O=C(O)C1CCCCCC1 Amb2721236 [0,0,0,1,0,0|2,0,0]=3 1757 B10R1.348 O=C(O)C1CCCCCN1 Amb542684 [0,0,0,1,0,0|1,0,0]=2 1758 B10R1.348 O=C(O)C1CCCCCN1 Amb8504180 [0,0,0,1,0,0|1,0,0]=2 1759 B10R1.348 O=C(O)C1CCCCCO1 Amb28294213 [0,0,0,1,0,0|2,0,0]=3 1760 B10R1.348 O=C(O)C1CCCCNC1 Amb30586509 [0,0,0,1,0,0|1,0,0]=2 1761 B10R1.348 O=C(O)C1CCCCNC1 Amb8630383 [0,0,0,1,0,0|1,0,0]=2 1762 B10R1.348 O=C(O)C1CCCCNN1 Amb28287718 [0,0,0,1,0,0|0,0,0]=1 1763 B10R1.348 O=C(O)C1CCCNCC1 Amb18831588 [0,0,0,1,0,0|3,0,0]=4 1764 B10R1.348 O=C(O)C1CCCNCC1 Amb33189342 [0,0,0,1,0,0|3,0,0]=4 1765 B10R1.348 O=C(O)C1CCCOCC1 Amb18831505 [0,0,0,1,0,0|3,0,0]=4 1766 B10R1.348 O=C(O)C1CCCSCC1 Amb18199262 [0,0,0,1,0,0|3,0,0]=4 1767 B10R1.348 O=C(O)C1CCNCCO1 Amb27632727 [0,0,0,1,0,0|3,0,0]=4 1768 B10R1.348 O=C(O)C1CNCCCN1 Amb25890339 [0,0,0,1,0,0|2,0,0]=3 1769 B10R1.348 O=C(O)C1CNCCCN1 Amb28896027 [0,0,0,1,0,0|2,0,0]=3 1770 B10R1.348 O=C(O)C1CNCCCO1 Amb17739810 [0,0,0,1,0,0|2,0,0]=3 1771 B10R1.348 O=C(O)C1CNCCOC1 Amb27600407 [0,0,0,1,0,0|2,0,0]=3 1772 B10R1.348 O=C(O)C1CNCCOC1 Amb32664315 [0,0,0,1,0,0|2,0,0]=3 1773 B10R1.348 O=C(O)C1CNCCSC1 Amb27813931 [0,0,0,1,0,0|2,0,0]=3 1774 B10R1.348 O=C(O)C1COCCOC1 Amb26443379 [0,0,0,1,0,0|3,0,0]=4 1775 B10R1.348 O=C(O)[C@@H]1CC=CCCN1 Amb27440042 [0,0,0,1,0,0|1,0,2]=4 1776 B10R1.348 O=C(O)[C@@H]1CCCCCN1 Amb2699229 [0,0,0,1,0,0|1,0,0]=2 1777 B10R1.348 O=C(O)[C@@H]1CCCCCN1 Amb8630384 [0,0,0,1,0,0|1,0,0]=2 1778 B10R1.348 O=C(O)[C@@H]1CCCNCC1 Amb27411309 [0,0,0,1,0,0|3,0,0]=4 1779 B10R1.348 O=C(O)[C@@H]1CCCOCC1 Amb27839414 [0,0,0,1,0,0|3,0,0]=4 1780 B10R1.348 O=C(O)[C@@H]1CSCCCN1 Amb28121128 [0,0,0,1,0,0|2,0,0]=3 1781 B10R1.348 O=C(O)[C@H]1CCCCCN1 Amb27770395 [0,0,0,1,0,0|1,0,0]=2 1782 B10R1.348 O=C(O)[C@H]1CCCCCN1 Amb33299452 [0,0,0,1,0,0|1,0,0]=2 1783 B10R1.348 O=C(O)[C@H]1CCCNCC1 Amb24479341 [0,0,0,1,0,0|3,0,0]=4 1784 B10R1.348 O=C(O)[C@H]1CCCOCC1 Amb27604305 [0,0,0,1,0,0|3,0,0]=4 1785 B10R1.363 C=C(C)C1(N)CCCCC1 Amb33201889 [0,0,0,1,0,0|3,0,0]=4 1786 B10R1.363 CC(=O)C1(C)CCCCC1 Amb25825155 [0,0,0,1,0,0|3,0,0]=4 1787 B10R1.363 CC(=O)C1(C)CCCCN1 Amb27173872 [0,0,0,1,0,0|2,0,0]=3 1788 B10R1.363 CC(=O)C1(N)CCCCC1 Amb1091885 [0,0,0,1,0,0|2,0,0]=3 1789 B10R1.363 CC(=O)C1(N)CCCCC1 Amb22283957 [0,0,0,1,0,0|2,0,0]=3 1790 B10R1.363 CC(=O)C1(N)CCOCC1 Amb26381759 [0,0,0,1,0,0|3,0,0]=4 1791 B10R1.363 CC(=O)C1(O)CCCCC1 Amb4017468 [0,0,0,1,0,0|3,0,0]=4 1792 B10R1.363 CC(=O)C1(S)CCCCC1 Amb25130567 [0,0,0,1,0,0|3,0,0]=4 1793 B10R1.363 CC(O)C1(C)CCCCN1 Amb35586964 [0,0,0,1,0,0|2,0,1]=4 1794 B10R1.363 CC(O)C1(N)CCCCC1 Amb18202452 [0,0,0,1,0,0|2,0,1]=4 1795 B10R1.363 CC1(C(=O)Cl)CCCCC1 Amb3939513 [0,0,0,1,0,0|3,0,0]=4 1796 B10R1.363 CC1(C(=O)Cl)CCCCO1 Amb25047171 [0,0,0,1,0,0|3,0,0]=4 1797 B10R1.363 CC1(C(=O)O)C=CCCC1 Amb4021852 [0,0,0,1,0,0|2,0,1]=4 1798 B10R1.363 CC1(C(=O)O)CCCCC1 Amb2388313 [0,0,0,1,0,0|2,0,0]=3 1799 B10R1.363 CC1(C(=O)O)CCCCN1 Amb21959568 [0,0,0,1,0,0|1,0,0]=2 1800 B10R1.363 CC1(C(=O)O)CCCCN1 Amb2694988 [0,0,0,1,0,0|1,0,0]=2 1801 B10R1.363 CC1(C(=O)O)CCCCO1 Amb33542722 [0,0,0,1,0,0|2,0,0]=3 1802 B10R1.363 CC1(C(=O)O)CCCCS1 Amb28323348 [0,0,0,1,0,0|2,0,0]=3 1803 B10R1.363 CC1(C(=O)O)CCCNC1 Amb17622036 [0,0,0,1,0,0|3,0,0]=4 1804 B10R1.363 CC1(C(=O)O)CCCNC1 Amb19148847 [0,0,0,1,0,0|3,0,0]=4 1805 B10R1.363 CC1(C(=O)O)CCCOC1 Amb33532255 [0,0,0,1,0,0|3,0,0]=4 1806 B10R1.363 CC1(C(=O)O)CCNCC1 Amb15701613 [0,0,0,1,0,0|3,0,0]=4 1807 B10R1.363 CC1(C(=O)O)CCNCC1 Amb33549108 [0,0,0,1,0,0|3,0,0]=4 1808 B10R1.363 CC1(C(=O)O)CCOCC1 Amb10843981 [0,0,0,1,0,0|3,0,0]=4 1809 B10R1.363 CC1(C(=O)O)CCOCO1 Amb24648903 [0,0,0,1,0,0|3,0,0]=4 1810 B10R1.363 CC1(C(=O)O)CCSCC1 Amb10843982 [0,0,0,1,0,0|3,0,0]=4 1811 B10R1.363 CC1(C(=O)O)CNCCN1 Amb27830098 [0,0,0,1,0,0|2,0,0]=3 1812 B10R1.363 CC1(C(=O)O)CNCCO1 Amb32656211 [0,0,0,1,0,0|3,0,0]=4 1813 B10R1.363 CC1(C(=O)O)CNCCO1 Amb32988610 [0,0,0,1,0,0|3,0,0]=4 1814 B10R1.363 CC1(C(=O)O)COCCN1 Amb26021643 [0,0,0,1,0,0|2,0,0]=3 1815 B10R1.363 CC1(C(=O)O)COCCN1 Amb31291275 [0,0,0,1,0,0|2,0,0]=3 1816 B10R1.363 CC1(C(=O)O)COCCO1 Amb26485107 [0,0,0,1,0,0|3,0,0]=4 1817 B10R1.363 CC1(C(N)=O)CCCCC1 Amb17674284 [0,0,0,1,0,0|3,0,0]=4 1818 B10R1.363 CC1(C(N)=O)CCCCN1 Amb26003815 [0,0,0,1,0,0|2,0,0]=3 1819 B10R1.363 CC1(C(N)=O)CCCCN1 Amb28896018 [0,0,0,1,0,0|2,0,0]=3 1820 B10R1.363 C[C@@]1(C(=O)O)C=CCCC1 Amb24505174 [0,0,0,1,0,0|2,0,1]=4 1821 B10R1.363 C[C@@]1(C(=O)O)CCCCN1 Amb22262937 [0,0,0,1,0,0|1,0,0]=2 1822 B10R1.363 C[C@@]1(C(=O)O)CCCNC1 Amb30594012 [0,0,0,1,0,0|3,0,0]=4 1823 B10R1.363 C[C@@]1(C(N)=O)CCCCN1 Amb27168600 [0,0,0,1,0,0|2,0,0]=3 1824 B10R1.363 C[C@]1(C(=O)O)CCCCN1 Amb22262934 [0,0,0,1,0,0|1,0,0]=2 1825 B10R1.363 C[C@]1(C(=O)O)CCCCN1 Amb33715562 [0,0,0,1,0,0|1,0,0]=2 1826 B10R1.363 C[C@]1(C(=O)O)CCCCO1 Amb24659158 [0,0,0,1,0,0|2,0,0]=3 1827 B10R1.363 C[C@]1(C(=O)O)COCCN1 Amb27857000 [0,0,0,1,0,0|2,0,0]=3 1828 B10R1.363 C[C@]1(C(N)=O)CCCCN1 Amb25147419 [0,0,0,1,0,0|2,0,0]=3 1829 B10R1.363 N=C(N)C1(N)CCCCC1 Amb27196371 [0,0,0,1,0,0|3,0,0]=4 1830 B10R1.363 NC(=O)C1(Br)CCCCC1 Amb27849949 [0,0,0,1,0,0|3,0,0]=4 1831 B10R1.363 NC(=O)C1(N)CCCCC1 Amb6259495 [0,0,0,1,0,0|2,0,0]=3 1832 B10R1.363 NC(=O)C1(N)CCCCC1 Amb9178008 [0,0,0,1,0,0|2,0,0]=3 1833 B10R1.363 NC(=O)C1(N)CCCNC1 Amb26038224 [0,0,0,1,0,0|3,0,0]=4 1834 B10R1.363 NC(=O)C1(N)CCCNC1 Amb33328788 [0,0,0,1,0,0|3,0,0]=4 1835 B10R1.363 NC(=O)C1(N)CCCOC1 Amb22059476 [0,0,0,1,0,0|3,0,0]=4 1836 B10R1.363 NC(=O)C1(N)CCCOC1 Amb32693416 [0,0,0,1,0,0|3,0,0]=4 1837 B10R1.363 NC(=O)C1(N)CCNCC1 Amb18278418 [0,0,0,1,0,0|3,0,0]=4 1838 B10R1.363 NC(=O)C1(N)CCNCC1 Amb33483967 [0,0,0,1,0,0|3,0,0]=4 1839 B10R1.363 NC(=O)C1(N)CCOCC1 Amb18278286 [0,0,0,1,0,0|3,0,0]=4 1840 B10R1.363 NC(=O)C1(N)CCOCC1 Amb32667049 [0,0,0,1,0,0|3,0,0]=4 1841 B10R1.363 NC(=O)C1(N)CCSCC1 Amb18278809 [0,0,0,1,0,0|3,0,0]=4 1842 B10R1.363 NC(=O)C1(O)CCCCC1 Amb24116820 [0,0,0,1,0,0|3,0,0]=4 1843 B10R1.363 NC(=S)C1(N)CCCCC1 Amb27389992 [0,0,0,1,0,0|2,1,0]=4 1844 B10R1.363 NC1(C(=O)O)CC=CCC1 Amb27816089 [0,0,0,1,0,0|1,0,2]=4 1845 B10R1.363 NC1(C(=O)O)CCCCC1 Amb1153058 [0,0,0,1,0,0|1,0,0]=2 1846 B10R1.363 NC1(C(=O)O)CCCCC1 Amb2720183 [0,0,0,1,0,0|1,0,0]=2 1847 B10R1.363 NC1(C(=O)O)CCCNC1 Amb20242317 [0,0,0,1,0,0|2,0,0]=3 1848 B10R1.363 NC1(C(=O)O)CCCNC1 Amb22756826 [0,0,0,1,0,0|2,0,0]=3 1849 B10R1.363 NC1(C(=O)O)CCCNC1 Amb28555533 [0,0,0,1,0,0|2,0,0]=3 1850 B10R1.363 NC1(C(=O)O)CCCOC1 Amb19958927 [0,0,0,1,0,0|2,0,0]=3 1851 B10R1.363 NC1(C(=O)O)CCCOC1 Amb22270206 [0,0,0,1,0,0|2,0,0]=3 1852 B10R1.363 NC1(C(=O)O)CCCSC1 Amb18948549 [0,0,0,1,0,0|2,0,0]=3 1853 B10R1.363 NC1(C(=O)O)CCNCC1 Amb16230706 [0,0,0,1,0,0|2,0,0]=3 1854 B10R1.363 NC1(C(=O)O)CCNCC1 Amb2695575 [0,0,0,1,0,0|2,0,0]=3 1855 B10R1.363 NC1(C(=O)O)CCNCC1 Amb2698793 [0,0,0,1,0,0|2,0,0]=3 1856 B10R1.363 NC1(C(=O)O)CCNCC1 Amb33549791 [0,0,0,1,0,0|2,0,0]=3 1857 B10R1.363 NC1(C(=O)O)CCOCC1 Amb2699136 [0,0,0,1,0,0|2,0,0]=3 1858 B10R1.363 NC1(C(=O)O)CCOCC1 Amb2699208 [0,0,0,1,0,0|2,0,0]=3 1859 B10R1.363 NC1(C(=O)O)CCSCC1 Amb17943831 [0,0,0,1,0,0|2,0,0]=3 1860 B10R1.363 NC1(P(O)O)CCCCC1 Amb27394628 [0,0,0,1,0,0|2,0,1]=4 1861 B10R1.363 O=C(Cl)C1(Cl)CCCCC1 Amb8427958 [0,0,0,1,0,0|3,0,0]=4 1862 B10R1.363 O=C(O)C1(Br)CCCCC1 Amb18130989 [0,0,0,1,0,0|2,0,0]=3 1863 B10R1.363 O=C(O)C1(Br)CCOCC1 Amb25828678 [0,0,0,1,0,0|3,0,0]=4 1864 B10R1.363 O=C(O)C1(Cl)CCCCC1 Amb8427953 [0,0,0,1,0,0|2,0,0]=3 1865 B10R1.363 O=C(O)C1(Cl)CCCOC1 Amb33127968 [0,0,0,1,0,0|3,0,0]=4 1866 B10R1.363 O=C(O)C1(Cl)CCOCC1 Amb18646184 [0,0,0,1,0,0|3,0,0]=4 1867 B10R1.363 O=C(O)C1(Cl)CCSCC1 Amb33127953 [0,0,0,1,0,0|3,0,0]=4 1868 B10R1.363 O=C(O)C1(F)CCCCC1 Amb10603425 [0,0,0,1,0,0|2,0,0]=3 1869 B10R1.363 O=C(O)C1(F)CCCNC1 Amb24062229 [0,0,0,1,0,0|3,0,0]=4 1870 B10R1.363 O=C(O)C1(F)CCCOC1 Amb25178890 [0,0,0,1,0,0|3,0,0]=4 1871 B10R1.363 O=C(O)C1(F)CCCSC1 Amb27441996 [0,0,0,1,0,0|3,0,0]=4 1872 B10R1.363 O=C(O)C1(F)CCNCC1 Amb17739849 [0,0,0,1,0,0|3,0,0]=4 1873 B10R1.363 O=C(O)C1(F)CCNCC1 Amb19374711 [0,0,0,1,0,0|3,0,0]=4 1874 B10R1.363 O=C(O)C1(F)CCOCC1 Amb16233480 [0,0,0,1,0,0|3,0,0]=4 1875 B10R1.363 O=C(O)C1(O)CCCCC1 Amb1159102 [0,0,0,1,0,0|2,0,0]=3 1876 B10R1.363 O=C(O)C1(O)CCCNC1 Amb18202374 [0,0,0,1,0,0|3,0,0]=4 1877 B10R1.363 O=C(O)C1(O)CCCNC1 Amb32671229 [0,0,0,1,0,0|3,0,0]=4 1878 B10R1.363 O=C(O)C1(O)CCNCC1 Amb10552861 [0,0,0,1,0,0|3,0,0]=4 1879 B10R1.363 O=C(O)C1(O)CCNCC1 Amb21961528 [0,0,0,1,0,0|3,0,0]=4 1880 B10R1.363 O=C(O)C1(O)CCOCC1 Amb18944710 [0,0,0,1,0,0|3,0,0]=4 1881 B10R1.363 O=C(O)C1(O)CCSCC1 Amb18945166 [0,0,0,1,0,0|3,0,0]=4 1882 B10R1.363 O=C(O)[C@@]1(F)CCCNC1 Amb24502317 [0,0,0,1,0,0|3,0,0]=4 1883 B10R1.363 [NH3+]C1(C(=O)O)CCCCC1 Amb4239236 [0,0,0,1,0,0|1,0,1]=3 1884 B10R1.451 NC1(C(=O)O)CCC1CO Amb27838150 [0,0,0,1,0,0|1,0,0]=2 1885 B10R1.451 N[C@@]1(C(=O)O)CC[C@@H]1CO Amb28456568 [0,0,0,1,0,0|1,0,0]=2 1886 B10R1.451 N[C@@]1(C(=O)O)CC[C@H]1CO Amb28057731 [0,0,0,1,0,0|1,0,0]=2 1887 B10R1.451 N[C@]1(C(=O)O)CC[C@@H]1CO Amb26017390 [0,0,0,1,0,0|1,0,0]=2 1888 B10R1.451 N[C@]1(C(=O)O)CC[C@H]1CO Amb24629045 [0,0,0,1,0,0|1,0,0]=2 1889 B10R0.6 CCCCCC(C)CC(=O)O Amb19375410 [0,0,0,0,0,1|2,0,0]=3 1890 B10R0.6 CCCCCC(N)CC(=O)O Amb21857987 [0,0,0,0,0,1|1,0,0]=2 1891 B10R0.6 CCCCCC(N)CC(=O)O Amb31307614 [0,0,0,0,0,1|1,0,0]=2 1892 B10R0.6 CCCCCC(N)CC(N)=O Amb33255748 [0,0,0,0,0,1|2,0,0]=3 1893 B10R0.6 CCCCCC(O)CC(=O)O Amb18797787 [0,0,0,0,0,1|2,0,0]=3 1894 B10R0.6 CCCCC[C@@H](O)CC(=O)O Amb31308365 [0,0,0,0,0,1|2,0,0]=3 1895 B10R0.6 CCCCC[C@H](O)CC(=O)O Amb33872470 [0,0,0,0,0,1|2,0,0]=3 1896 B10R0.6 CCCSCC(N)CC(=O)O Amb32687888 [0,0,0,0,0,1|2,0,0]=3 1897 B10R0.6 CCC\C=C\C(N)CC(=O)O Amb33429157 [0,0,0,0,0,1|1,0,2]=4 1898 B10R0.6 CCSCCC(N)CC(=O)O Amb33254745 [0,0,0,0,0,1|2,0,0]=3 1899 B10R0.6 CCSCCC(N)CC(N)=O Amb33308127 [0,0,0,0,0,1|3,0,0]=4 1900 B10R0.6 CSCCCC(N)CC(=O)O Amb33308380 [0,0,0,0,0,1|2,0,0]=3 1901 B10R0.6 CSCCCC(N)CC(N)=O Amb32787351 [0,0,0,0,0,1|3,0,0]=4 1902 B10R0.6 NCCCCC(=O)NC(N)=O Amb27271665 [0,0,0,0,0,1|2,0,1]=4 1903 B10R0.6 NCCCC[C@@H](N)CC(=O)O Amb22746256 [0,0,0,0,0,1|0,0,0]=1 1904 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb16184018 [0,0,0,0,0,1|0,0,0]=1 1905 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb22369388 [0,0,0,0,0,1|0,0,0]=1 1906 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb33929234 [0,0,0,0,0,1|0,0,0]=1 1907 B10R0.6 NCCCC[C@H](N)CC(N)=O Amb32650909 [0,0,0,0,0,1|1,0,0]=2 1908 B10R0.6 NCCCC[C@H](N)CC(N)=S Amb32650910 [0,0,0,0,0,1|1,1,0]=3 1909 B7R0.1 C#CCCCCCN Amb33544857 [2,0,0,0,0,0|1,0,1]=4 1910 B7R0.1 C=CCCCCC=O Amb9785164 [2,0,0,0,0,0|1,0,1]=4 1911 B7R0.1 C=CCCCCCBr Amb16234121 [2,0,0,0,0,0|2,0,0]=4 1912 B7R0.1 C=CCCCCCC Amb3940500 [2,0,0,0,0,0|2,0,0]=4 1913 B7R0.1 C=CCCCCCCl Amb6298878 [2,0,0,0,0,0|2,0,0]=4 1914 B7R0.1 C=CCCCCCI Amb24483139 [2,0,0,0,0,0|2,0,0]=4 1915 B7R0.1 C=CCCCCCN Amb18641754 [2,0,0,0,0,0|1,0,0]=3 1916 B7R0.1 C=CCCCCCO Amb4017321 [2,0,0,0,0,0|2,0,0]=4 1917 B7R0.1 C=CCCOCCN Amb22059113 [2,0,0,0,0,0|2,0,0]=4 1918 B7R0.1 C=CCCSCCN Amb25889820 [2,0,0,0,0,0|2,0,0]=4 1919 B7R0.1 C=CCNCCCN Amb17315274 [2,0,0,0,0,0|2,0,0]=4 1920 B7R0.1 C=CCOCCCN Amb25190295 [2,0,0,0,0,0|2,0,0]=4 1921 B7R0.1 C=CCSCCCN Amb17500693 [2,0,0,0,0,0|2,0,0]=4 1922 B7R0.1 CCCCCCC=O Amb3939948 [2,0,0,0,0,0|1,0,0]=3 1923 B7R0.1 CCCCCCCN Amb3940125 [2,0,0,0,0,0|1,0,1]=4 1924 B7R0.1 CCCCCCCO Amb6608791 [2,0,0,0,0,0|1,0,1]=4 1925 B7R0.1 CCCCCCNO Amb24591654 [2,0,0,0,0,0|2,0,0]=4 1926 B7R0.1 CCCCCCNO Amb32687464 [2,0,0,0,0,0|2,0,0]=4 1927 B7R0.1 CCCCOCC=O Amb26515709 [2,0,0,0,0,0|2,0,0]=4 1928 B7R0.1 CCCCSCC=O Amb28189740 [2,0,0,0,0,0|2,0,0]=4 1929 B7R0.1 CCCNCCC=O Amb27838403 [2,0,0,0,0,0|2,0,0]=4 1930 B7R0.1 CCOCCCC=O Amb27236777 [2,0,0,0,0,0|2,0,0]=4 1931 B7R0.1 CCSCCCC=O Amb33323662 [2,0,0,0,0,0|2,0,0]=4 1932 B7R0.1 CNCCCCCN Amb23448496 [2,0,0,0,0,0|2,0,0]=4 1933 B7R0.1 COCCCCC=O Amb27410175 [2,0,0,0,0,0|2,0,0]=4 1934 B7R0.1 COCCCCCN Amb13951647 [2,0,0,0,0,0|2,0,0]=4 1935 B7R0.1 CSCCCCC=O Amb25760866 [2,0,0,0,0,0|2,0,0]=4 1936 B7R0.1 CSCCCCCN Amb24271082 [2,0,0,0,0,0|2,0,0]=4 1937 B7R0.1 C\C=C\CCCCN Amb27209196 [2,0,0,0,0,0|1,0,1]=4 1938 B7R0.1 C\C=N/CCCCN Amb27838890 [2,0,0,0,0,0|2,0,0]=4 1939 B7R0.1 N#CCCCCC=O Amb17593149 [2,0,0,0,0,0|0,0,2]=4 1940 B7R0.1 N#CCCCCCN Amb2721249 [2,0,0,0,0,0|1,0,1]=4 1941 B7R0.1 N#CCCCCCN Amb31031060 [2,0,0,0,0,0|1,0,1]=4 1942 B7R0.1 NCCCCCCBr Amb18648322 [2,0,0,0,0,0|1,0,1]=4 1943 B7R0.1 NCCCCCCCl Amb31030966 [2,0,0,0,0,0|1,0,1]=4 1944 B7R0.1 NCCCCCCF Amb28314228 [2,0,0,0,0,0|1,0,1]=4 1945 B7R0.1 NCCCCCCN Amb2573303 [2,0,0,0,0,0|1,0,1]=4 1946 B7R0.1 NCCCCCCN Amb8516658 [2,0,0,0,0,0|1,0,1]=4 1947 B7R0.1 NCCCCCCO Amb2720515 [2,0,0,0,0,0|0,0,1]=3 1948 B7R0.1 NCCCCCCS Amb18642745 [2,0,0,0,0,0|0,1,1]=4 1949 B7R0.1 NCCCCCCS Amb24099361 [2,0,0,0,0,0|0,1,1]=4 1950 B7R0.1 NCCCCCNO Amb24381036 [2,0,0,0,0,0|1,0,0]=3 1951 B7R0.1 NCCCCCNO Amb33483225 [2,0,0,0,0,0|1,0,0]=3 1952 B7R0.1 NCCCCNC=O Amb18641902 [2,0,0,0,0,0|1,0,0]=3 1953 B7R0.1 NCCCNCCO Amb4035734 [2,0,0,0,0,0|1,0,1]=4 1954 B7R0.1 NCCCOCCO Amb33534338 [2,0,0,0,0,0|1,0,1]=4 1955 B7R0.1 NCCCSCCO Amb9481738 [2,0,0,0,0,0|1,0,1]=4 1956 B7R0.1 NCCNCCCO Amb22732348 [2,0,0,0,0,0|1,0,1]=4 1957 B7R0.1 NCCOCCCO Amb33551903 [2,0,0,0,0,0|1,0,1]=4 1958 B7R0.1 NCCOCCCO Amb9392883 [2,0,0,0,0,0|1,0,1]=4 1959 B7R0.1 NCCSCCCO Amb8876329 [2,0,0,0,0,0|1,0,1]=4 1960 B7R0.1 O=CCCCCC=O Amb17593185 [2,0,0,0,0,0|1,0,1]=4 1961 B7R0.1 O=CCCCCCBr Amb18127461 [2,0,0,0,0,0|1,0,0]=3 1962 B7R0.1 O=CCCCCCCl Amb16185781 [2,0,0,0,0,0|1,0,0]=3 1963 B7R0.1 O=CCCCCCF Amb24533888 [2,0,0,0,0,0|1,0,0]=3 1964 B7R0.1 O=CCCCCCO Amb18641885 [2,0,0,0,0,0|1,0,0]=3 1965 B7R0.1 O=CCCOCCO Amb18641946 [2,0,0,0,0,0|2,0,0]=4 1966 B7R0.1 O=CCSCCCO Amb27871143 [2,0,0,0,0,0|2,0,0]=4 1967 B7R0.1 O=CNCCCCF Amb27168251 [2,0,0,0,0,0|2,0,0]=4 1968 B7R0.1 O=CNCCCCO Amb28187191 [2,0,0,0,0,0|2,0,0]=4 1969 B7R0.1 OCCCCCCBr Amb24063183 [2,0,0,0,0,0|1,0,1]=4 1970 B7R0.1 OCCCCCCBr Amb8514955 [2,0,0,0,0,0|1,0,1]=4 1971 B7R0.1 OCCCCCCCl Amb2686112 [2,0,0,0,0,0|1,0,1]=4 1972 B7R0.1 OCCCCCCF Amb24428671 [2,0,0,0,0,0|1,0,1]=4 1973 B7R0.1 OCCCCCCI Amb28048917 [2,0,0,0,0,0|1,0,1]=4 1974 B7R0.1 OCCCCCCO Amb6869970 [2,0,0,0,0,0|1,0,1]=4 1975 B7R0.1 OCCCCCCS Amb9786744 [2,0,0,0,0,0|1,0,1]=4 1976 B7R0.3 C#CC(N)CCCC Amb25798992 [2,0,0,0,0,0|1,0,1]=4 1977 B7R0.3 C#C[C@@H](N)CCCN Amb27169320 [2,0,0,0,0,0|1,0,1]=4 1978 B7R0.3 C#C[C@H](N)CCCC Amb27797061 [2,0,0,0,0,0|1,0,1]=4 1979 B7R0.3 C=C(C=O)CCCC Amb4025817 [2,0,0,0,0,0|1,0,1]=4 1980 B7R0.3 C=CC(Br)CCCC Amb25758328 [2,0,0,0,0,0|2,0,0]=4 1981 B7R0.3 C=CC(C)CCCC Amb22641469 [2,0,0,0,0,0|2,0,0]=4 1982 B7R0.3 C=CC(N)CCSC Amb28316202 [2,0,0,0,0,0|2,0,0]=4 1983 B7R0.3 C=CC(N)COCC Amb27248147 [2,0,0,0,0,0|2,0,0]=4 1984 B7R0.3 C=CC(N)CSCC Amb27648478 [2,0,0,0,0,0|2,0,0]=4 1985 B7R0.3 C=C[C@@H](Cl)CCCC Amb27954902 [2,0,0,0,0,0|2,0,0]=4 1986 B7R0.3 C=C[C@@H](N)CCCC Amb27477524 [2,0,0,0,0,0|1,0,0]=3 1987 B7R0.3 C=C[C@H](Cl)CCCC Amb27590978 [2,0,0,0,0,0|2,0,0]=4 1988 B7R0.3 CC(C=N)CCCN Amb27640100 [2,0,0,0,0,0|2,0,0]=4 1989 B7R0.3 CC(C=O)CCCBr Amb26526795 [2,0,0,0,0,0|2,0,0]=4 1990 B7R0.3 CC(CO)CCCN Amb17569904 [2,0,0,0,0,0|1,0,1]=4 1991 B7R0.3 CC(CO)CCCN Amb32686956 [2,0,0,0,0,0|1,0,1]=4 1992 B7R0.3 CCC(N)CCCN Amb27392660 [2,0,0,0,0,0|1,0,1]=4 1993 B7R0.3 CCCCC(Br)C=O Amb17594581 [2,0,0,0,0,0|1,0,0]=3 1994 B7R0.3 CCCCC(C)C=O Amb17593191 [2,0,0,0,0,0|1,0,0]=3 1995 B7R0.3 CCCCC(C)CO Amb17593205 [2,0,0,0,0,0|1,0,1]=4 1996 B7R0.3 CCCCC(F)C=O Amb27838938 [2,0,0,0,0,0|1,0,0]=3 1997 B7R0.3 CCCCC(N)C#N Amb18975861 [2,0,0,0,0,0|1,0,1]=4 1998 B7R0.3 CCCCC(N)C=O Amb28422291 [2,0,0,0,0,0|0,0,0]=2 1999 B7R0.3 CCCCC(N)CC Amb33527796 [2,0,0,0,0,0|1,0,1]=4 2000 B7R0.3 CCCCC(N)CC Amb9031866 [2,0,0,0,0,0|1,0,1]=4 2001 B7R0.3 CCCCC(N)CN Amb19009750 [2,0,0,0,0,0|1,0,1]=4 2002 B7R0.3 CCCCC(N)CO Amb3939373 [2,0,0,0,0,0|0,0,1]=3 2003 B7R0.3 CCCCC(N)CS Amb27961155 [2,0,0,0,0,0|0,1,1]=4 2004 B7R0.3 CCCCC(O)CO Amb8390318 [2,0,0,0,0,0|1,0,1]=4 2005 B7R0.3 CCCCN(C)C=O Amb26967032 [2,0,0,0,0,0|2,0,0]=4 2006 B7R0.3 CCCC[C@@H](Br)CO Amb27658529 [2,0,0,0,0,0|1,0,1]=4 2007 B7R0.3 CCCC[C@@H](C)CO Amb27481144 [2,0,0,0,0,0|1,0,1]=4 2008 B7R0.3 CCCC[C@@H](F)CO Amb27593926 [2,0,0,0,0,0|1,0,1]=4 2009 B7R0.3 CCCC[C@@H](N)CC Amb28461624 [2,0,0,0,0,0|1,0,1]=4 2010 B7R0.3 CCCC[C@@H](N)CO Amb8517438 [2,0,0,0,0,0|0,0,1]=3 2011 B7R0.3 CCCC[C@H](C)C=O Amb26587628 [2,0,0,0,0,0|1,0,0]=3 2012 B7R0.3 CCCC[C@H](C)CO Amb26370424 [2,0,0,0,0,0|1,0,1]=4 2013 B7R0.3 CCCC[C@H](F)CO Amb28315208 [2,0,0,0,0,0|1,0,1]=4 2014 B7R0.3 CCCC[C@H](N)CO Amb3941478 [2,0,0,0,0,0|0,0,1]=3 2015 B7R0.3 CCCC[C@H](S)CO Amb27804425 [2,0,0,0,0,0|1,0,1]=4 2016 B7R0.3 CCCC\C(N)=N/O Amb2696577 [2,0,0,0,0,0|1,0,1]=4 2017 B7R0.3 CCCC\C(N)=N\O Amb8391665 [2,0,0,0,0,0|1,0,1]=4 2018 B7R0.3 CCCSC(C)C=O Amb18124367 [2,0,0,0,0,0|2,0,0]=4 2019 B7R0.3 CCOCC(N)CO Amb25890491 [2,0,0,0,0,0|1,0,1]=4 2020 B7R0.3 CCOCC(N)CO Amb32666301 [2,0,0,0,0,0|1,0,1]=4 2021 B7R0.3 CCOCC(O)C=O Amb27883256 [2,0,0,0,0,0|2,0,0]=4 2022 B7R0.3 CCOC[C@@H](N)CO Amb27838360 [2,0,0,0,0,0|1,0,1]=4 2023 B7R0.3 CCOC[C@@H](N)CO Amb32653631 [2,0,0,0,0,0|1,0,1]=4 2024 B7R0.3 CCSCC(C)C=O Amb27592961 [2,0,0,0,0,0|2,0,0]=4 2025 B7R0.3 CCSCC(N)CO Amb18643038 [2,0,0,0,0,0|1,0,1]=4 2026 B7R0.3 CCSC[C@@H](N)CO Amb26504944 [2,0,0,0,0,0|1,0,1]=4 2027 B7R0.3 CCSC[C@H](N)CO Amb26564857 [2,0,0,0,0,0|1,0,1]=4 2028 B7R0.3 COCCC(C)C=O Amb26896518 [2,0,0,0,0,0|2,0,0]=4 2029 B7R0.3 COCCC(N)C=O Amb28397866 [2,0,0,0,0,0|1,0,0]=3 2030 B7R0.3 COCCC(N)CO Amb32952892 [2,0,0,0,0,0|1,0,1]=4 2031 B7R0.3 COCCC(N)CO Amb33532817 [2,0,0,0,0,0|1,0,1]=4 2032 B7R0.3 COCC[C@@H](C)C=O Amb28351588 [2,0,0,0,0,0|2,0,0]=4 2033 B7R0.3 COCC[C@@H](N)CO Amb33377807 [2,0,0,0,0,0|1,0,1]=4 2034 B7R0.3 COCC[C@H](N)CO Amb25937729 [2,0,0,0,0,0|1,0,1]=4 2035 B7R0.3 COCC\C(N)=C\O Amb28364926 [2,0,0,0,0,0|1,0,1]=4 2036 B7R0.3 CSCCC(C)C=O Amb26624792 [2,0,0,0,0,0|2,0,0]=4 2037 B7R0.3 CSCCC(N)CO Amb4036829 [2,0,0,0,0,0|1,0,1]=4 2038 B7R0.3 CSCC[C@@H](N)CO Amb8516106 [2,0,0,0,0,0|1,0,1]=4 2039 B7R0.3 CSCC[C@H](N)CO Amb2720562 [2,0,0,0,0,0|1,0,1]=4 2040 B7R0.3 NC(CO)CCCF Amb28069002 [2,0,0,0,0,0|1,0,1]=4 2041 B7R0.3 NC(CO)CCCO Amb18641979 [2,0,0,0,0,0|1,0,1]=4 2042 B7R0.3 NCCCC(N)CF Amb28410605 [2,0,0,0,0,0|1,0,1]=4 2043 B7R0.3 NCCCC(N)CN Amb26640553 [2,0,0,0,0,0|1,0,1]=4 2044 B7R0.3 NCCCC(N)CO Amb27665423 [2,0,0,0,0,0|0,0,1]=3 2045 B7R0.3 NCCCC(O)CO Amb27759884 [2,0,0,0,0,0|1,0,1]=4 2046 B7R0.3 NCCC[C@H](N)C=O Amb27838296 [2,0,0,0,0,0|0,0,0]=2 2047 B7R0.3 NCCC\C(N)=N\O Amb25889843 [2,0,0,0,0,0|1,0,1]=4 2048 B7R0.3 NOCC[C@H](N)CO Amb27430113 [2,0,0,0,0,0|1,0,1]=4 2049 B7R0.3 N[C@@H](CO)CCCO Amb28254525 [2,0,0,0,0,0|1,0,1]=4 2050 B7R0.3 N[C@H](CO)CCCO Amb24117047 [2,0,0,0,0,0|1,0,1]=4 2051 B7R0.3 O=CC(Cl)CCCO Amb27831369 [2,0,0,0,0,0|2,0,0]=4 2052 B7R0.3 O=C[C@H](O)CCCO Amb27164637 [2,0,0,0,0,0|2,0,0]=4 2053 B7R0.4 C#CCCCC(=O)O Amb2721705 [2,0,0,0,0,0|0,0,2]=4 2054 B7R0.4 C=C(C)CCCCC Amb6298938 [2,0,0,0,0,0|2,0,0]=4 2055 B7R0.4 C=CCCCC(=O)O Amb3941675 [2,0,0,0,0,0|0,0,2]=4 2056 B7R0.4 CC#CCCC(=O)O Amb3987196 [2,0,0,0,0,0|0,0,2]=4 2057 B7R0.4 CC(=O)CCCCBr Amb16234126 [2,0,0,0,0,0|2,0,0]=4 2058 B7R0.4 CC(=O)CCCCCl Amb3941549 [2,0,0,0,0,0|2,0,0]=4 2059 B7R0.4 CC(=O)CCCCF Amb27490855 [2,0,0,0,0,0|2,0,0]=4 2060 B7R0.4 CC(=O)CCCCN Amb27401218 [2,0,0,0,0,0|1,0,0]=3 2061 B7R0.4 CC(=O)CCCCO Amb10603864 [2,0,0,0,0,0|2,0,0]=4 2062 B7R0.4 CC(=O)CSCCN Amb17500454 [2,0,0,0,0,0|2,0,0]=4 2063 B7R0.4 CC(=O)NCCCN Amb10610286 [2,0,0,0,0,0|2,0,0]=4 2064 B7R0.4 CC(=O)NCCCN Amb6664982 [2,0,0,0,0,0|2,0,0]=4 2065 B7R0.4 CC(C)CCCCN Amb33548422 [2,0,0,0,0,0|1,0,1]=4 2066 B7R0.4 CC(C)CCCCN Amb9304907 [2,0,0,0,0,0|1,0,1]=4 2067 B7R0.4 CC(N)CCCCBr Amb27814547 [2,0,0,0,0,0|1,0,1]=4 2068 B7R0.4 CC(N)CCCCCl Amb27867737 [2,0,0,0,0,0|1,0,1]=4 2069 B7R0.4 CC(N)CCCCF Amb25954668 [2,0,0,0,0,0|1,0,1]=4 2070 B7R0.4 CC(N)CCCCN Amb25214697 [2,0,0,0,0,0|0,0,1]=3 2071 B7R0.4 CC(N)CCCCN Amb33551364 [2,0,0,0,0,0|0,0,1]=3 2072 B7R0.4 CC(N)CCCCO Amb17569907 [2,0,0,0,0,0|1,0,1]=4 2073 B7R0.4 CC(N)CCCCO Amb28934868 [2,0,0,0,0,0|1,0,1]=4 2074 B7R0.4 CC(N)CNCCN Amb28198270 [2,0,0,0,0,0|1,0,1]=4 2075 B7R0.4 CC(O)CCCCF Amb27486303 [2,0,0,0,0,0|2,0,0]=4 2076 B7R0.4 CC(O)CCCCN Amb17569903 [2,0,0,0,0,0|1,0,0]=3 2077 B7R0.4 CC(O)CCCCO Amb22227757 [2,0,0,0,0,0|2,0,0]=4 2078 B7R0.4 CC(O)CCCC[SiH3] Amb28322353 [2,0,0,0,0,0|2,0,0]=4 2079 B7R0.4 CC(O)CNCCN Amb4034606 [2,0,0,0,0,0|2,0,0]=4 2080 B7R0.4 CC(O)COCCN Amb27404532 [2,0,0,0,0,0|2,0,0]=4 2081 B7R0.4 CC(S)CCCCN Amb32788406 [2,0,0,0,0,0|1,0,1]=4 2082 B7R0.4 CCC#CCC(=O)O Amb26515701 [2,0,0,0,0,0|0,0,2]=4 2083 B7R0.4 CCCC#CC(=O)O Amb2721706 [2,0,0,0,0,0|0,0,2]=4 2084 B7R0.4 CCCCCB(O)O Amb2447470 [2,0,0,0,0,0|1,0,1]=4 2085 B7R0.4 CCCCCC(=N)N Amb19890171 [2,0,0,0,0,0|2,0,0]=4 2086 B7R0.4 CCCCCC(=N)N Amb2696574 [2,0,0,0,0,0|2,0,0]=4 2087 B7R0.4 CCCCCC(=N)N Amb35747068 [2,0,0,0,0,0|2,0,0]=4 2088 B7R0.4 CCCCCC(=O)F Amb26061517 [2,0,0,0,0,0|1,0,0]=3 2089 B7R0.4 CCCCCC(=O)O Amb3939846 [2,0,0,0,0,0|0,0,0]=2 2090 B7R0.4 CCCCCC(=O)[O-] Amb22337624 [2,0,0,0,0,0|0,0,1]=3 2091 B7R0.4 CCCCCC(C)=O Amb6608885 [2,0,0,0,0,0|1,0,0]=3 2092 B7R0.4 CCCCCC(C)N Amb21962698 [2,0,0,0,0,0|1,0,1]=4 2093 B7R0.4 CCCCCC(C)N Amb3939364 [2,0,0,0,0,0|1,0,1]=4 2094 B7R0.4 CCCCCC(C)O Amb8383668 [2,0,0,0,0,0|1,0,1]=4 2095 B7R0.4 CCCCCC(N)=S Amb6246072 [2,0,0,0,0,0|1,1,0]=4 2096 B7R0.4 CCCCCC(O)Cl Amb27232933 [2,0,0,0,0,0|1,0,1]=4 2097 B7R0.4 CCCCCC(O)O Amb25921998 [2,0,0,0,0,0|0,0,2]=4 2098 B7R0.4 CCCCCN(C)O Amb33428427 [2,0,0,0,0,0|2,0,0]=4 2099 B7R0.4 CCCCCS(=O)Cl Amb32720370 [2,0,0,0,0,0|2,0,0]=4 2100 B7R0.4 CCCCCS(=O)[O-] Amb32754032 [2,0,0,0,0,0|1,0,1]=4 2101 B7R0.4 CCCCCS(C)=O Amb27457494 [2,0,0,0,0,0|2,0,0]=4 2102 B7R0.4 CCCCCS(N)=O Amb32720371 [2,0,0,0,0,0|2,0,0]=4 2103 B7R0.4 CCCCC[C@@H](C)N Amb3941400 [2,0,0,0,0,0|1,0,1]=4 2104 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [2,0,0,0,0,0|1,0,1]=4 2105 B7R0.4 CCCCC[C@H](C)N Amb8516349 [2,0,0,0,0,0|1,0,1]=4 2106 B7R0.4 CCCCC[C@H](C)O Amb8395591 [2,0,0,0,0,0|1,0,1]=4 2107 B7R0.4 CCCCC[N+](=O)[O-] Amb22227991 [2,0,0,0,0,0|1,0,1]=4 2108 B7R0.4 CCCCNC(=O)Cl Amb24574309 [2,0,0,0,0,0|2,0,0]=4 2109 B7R0.4 CCCCNC(C)=O Amb5835711 [2,0,0,0,0,0|2,0,0]=4 2110 B7R0.4 CCCCNC(N)=O Amb6663202 [2,0,0,0,0,0|2,0,0]=4 2111 B7R0.4 CCCCOC(=O)Cl Amb6608833 [2,0,0,0,0,0|2,0,0]=4 2112 B7R0.4 CCCCOC(C)=O Amb6608782 [2,0,0,0,0,0|2,0,0]=4 2113 B7R0.4 CCCCOC(N)=O Amb4136361 [2,0,0,0,0,0|2,0,0]=4 2114 B7R0.4 CCCCO[PH](=O)O Amb26035392 [2,0,0,0,0,0|2,0,0]=4 2115 B7R0.4 CCCCSC(=O)Cl Amb22352826 [2,0,0,0,0,0|2,0,0]=4 2116 B7R0.4 CCCNCC(=O)O Amb10609640 [2,0,0,0,0,0|1,0,0]=3 2117 B7R0.4 CCCNCC(=O)O Amb1110628 [2,0,0,0,0,0|1,0,0]=3 2118 B7R0.4 CCCNCC(C)=O Amb26954588 [2,0,0,0,0,0|2,0,0]=4 2119 B7R0.4 CCCNCC(N)=O Amb1124632 [2,0,0,0,0,0|2,0,0]=4 2120 B7R0.4 CCCNCC(N)=O Amb28934788 [2,0,0,0,0,0|2,0,0]=4 2121 B7R0.4 CCCOCC(=O)Cl Amb27260778 [2,0,0,0,0,0|2,0,0]=4 2122 B7R0.4 CCCOCC(=O)O Amb8874504 [2,0,0,0,0,0|1,0,0]=3 2123 B7R0.4 CCCOCC(N)=O Amb27844884 [2,0,0,0,0,0|2,0,0]=4 2124 B7R0.4 CCCSCC(=O)O Amb1137113 [2,0,0,0,0,0|1,0,0]=3 2125 B7R0.4 CCCSCC(C)=O Amb9668676 [2,0,0,0,0,0|2,0,0]=4 2126 B7R0.4 CCCSCC(N)=O Amb27424658 [2,0,0,0,0,0|2,0,0]=4 2127 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [2,0,0,0,0,0|0,0,2]=4 2128 B7R0.4 CCNCCC(=O)O Amb28934794 [2,0,0,0,0,0|1,0,0]=3 2129 B7R0.4 CCNCCC(=O)O Amb7766402 [2,0,0,0,0,0|1,0,0]=3 2130 B7R0.4 CCNCCC(C)=O Amb18641851 [2,0,0,0,0,0|2,0,0]=4 2131 B7R0.4 CCNCCC(N)=O Amb33533384 [2,0,0,0,0,0|2,0,0]=4 2132 B7R0.4 CCNCCC(N)=O Amb35749820 [2,0,0,0,0,0|2,0,0]=4 2133 B7R0.4 CCNNCC(=O)O Amb28326075 [2,0,0,0,0,0|2,0,0]=4 2134 B7R0.4 CCOCCC(=O)Cl Amb20672027 [2,0,0,0,0,0|2,0,0]=4 2135 B7R0.4 CCOCCC(=O)O Amb3939859 [2,0,0,0,0,0|1,0,0]=3 2136 B7R0.4 CCOCCC(C)=O Amb7764636 [2,0,0,0,0,0|2,0,0]=4 2137 B7R0.4 CCSCCC(=O)O Amb6273140 [2,0,0,0,0,0|1,0,0]=3 2138 B7R0.4 CCSCCC(C)=O Amb9655821 [2,0,0,0,0,0|2,0,0]=4 2139 B7R0.4 CCSCCC(N)=O Amb27258252 [2,0,0,0,0,0|2,0,0]=4 2140 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [2,0,0,0,0,0|0,0,2]=4 2141 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [2,0,0,0,0,0|0,0,2]=4 2142 B7R0.4 CNCCCC(=O)O Amb1153115 [2,0,0,0,0,0|1,0,0]=3 2143 B7R0.4 CNCCCC(=O)O Amb4521435 [2,0,0,0,0,0|1,0,0]=3 2144 B7R0.4 CNCCCC(C)=O Amb27838406 [2,0,0,0,0,0|2,0,0]=4 2145 B7R0.4 CNCCCC(N)=O Amb18303611 [2,0,0,0,0,0|2,0,0]=4 2146 B7R0.4 CNCCCC(N)=O Amb31307731 [2,0,0,0,0,0|2,0,0]=4 2147 B7R0.4 COCCCC(=O)O Amb6275629 [2,0,0,0,0,0|1,0,0]=3 2148 B7R0.4 COCCCC(C)=O Amb9031556 [2,0,0,0,0,0|2,0,0]=4 2149 B7R0.4 COCOCC(=O)O Amb28059312 [2,0,0,0,0,0|2,0,0]=4 2150 B7R0.4 COCSCC(=O)O Amb27466837 [2,0,0,0,0,0|2,0,0]=4 2151 B7R0.4 CS(=O)CCCCN Amb17617794 [2,0,0,0,0,0|2,0,0]=4 2152 B7R0.4 CSCCCC(=O)O Amb17503622 [2,0,0,0,0,0|1,0,0]=3 2153 B7R0.4 CSCCCC(C)=O Amb25122381 [2,0,0,0,0,0|2,0,0]=4 2154 B7R0.4 CSCSCC(=O)O Amb27858824 [2,0,0,0,0,0|2,0,0]=4 2155 B7R0.4 CSSCCC(=O)O Amb26848465 [2,0,0,0,0,0|2,0,0]=4 2156 B7R0.4 C[C@@H](N)CCCCF Amb33196127 [2,0,0,0,0,0|1,0,1]=4 2157 B7R0.4 C[C@@H](O)CCCCBr Amb28343132 [2,0,0,0,0,0|2,0,0]=4 2158 B7R0.4 C[C@@H](O)CCCCCl Amb8517538 [2,0,0,0,0,0|2,0,0]=4 2159 B7R0.4 C[C@@H](O)CCCCF Amb33196128 [2,0,0,0,0,0|2,0,0]=4 2160 B7R0.4 C[C@@H](O)CCCCN Amb27789987 [2,0,0,0,0,0|1,0,0]=3 2161 B7R0.4 C[C@H](N)CCCCF Amb33480694 [2,0,0,0,0,0|1,0,1]=4 2162 B7R0.4 C[C@H](O)CCCCF Amb33196129 [2,0,0,0,0,0|2,0,0]=4 2163 B7R0.4 C[C@H](O)CCCCO Amb28381637 [2,0,0,0,0,0|2,0,0]=4 2164 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [2,0,0,0,0,0|0,0,2]=4 2165 B7R0.4 N#CCCCC(=O)O Amb33542831 [2,0,0,0,0,0|0,0,2]=4 2166 B7R0.4 N=C(N)CCCCN Amb25714813 [2,0,0,0,0,0|1,0,1]=4 2167 B7R0.4 N=C(N)CCCCN Amb33299438 [2,0,0,0,0,0|1,0,1]=4 2168 B7R0.4 NC(=O)CCCCBr Amb27875083 [2,0,0,0,0,0|1,0,1]=4 2169 B7R0.4 NC(=O)CCCCCl Amb7782532 [2,0,0,0,0,0|1,0,1]=4 2170 B7R0.4 NC(=O)CCCCO Amb3939470 [2,0,0,0,0,0|1,0,1]=4 2171 B7R0.4 NC(=O)CCCCS Amb27839239 [2,0,0,0,0,0|1,0,1]=4 2172 B7R0.4 NCC#CCC(=O)O Amb27976019 [2,0,0,0,0,0|0,0,2]=4 2173 B7R0.4 NCCC#CC(=O)O Amb32656225 [2,0,0,0,0,0|0,0,2]=4 2174 B7R0.4 NCCCCB(O)O Amb27436221 [2,0,0,0,0,0|1,0,1]=4 2175 B7R0.4 NCCCCC(=O)Cl Amb26599615 [2,0,0,0,0,0|1,0,0]=3 2176 B7R0.4 NCCCCC(=O)O Amb2780021 [2,0,0,0,0,0|0,0,0]=2 2177 B7R0.4 NCCCCC(=O)O Amb3941646 [2,0,0,0,0,0|0,0,0]=2 2178 B7R0.4 NCCCCC(=O)O Amb9825855 [2,0,0,0,0,0|0,0,0]=2 2179 B7R0.4 NCCCCC(F)F Amb32812804 [2,0,0,0,0,0|2,0,0]=4 2180 B7R0.4 NCCCCC(N)=O Amb18641897 [2,0,0,0,0,0|0,0,1]=3 2181 B7R0.4 NCCCCC(N)=O Amb33552086 [2,0,0,0,0,0|0,0,1]=3 2182 B7R0.4 NCCCCS(=O)O Amb27882127 [2,0,0,0,0,0|1,0,0]=3 2183 B7R0.4 NCCCNC(=O)O Amb24093884 [2,0,0,0,0,0|1,0,0]=3 2184 B7R0.4 NCCCNC(=O)S Amb27839485 [2,0,0,0,0,0|1,1,0]=4 2185 B7R0.4 NCCCNC(N)=O Amb18296186 [2,0,0,0,0,0|1,0,1]=4 2186 B7R0.4 NCCCNC(N)=O Amb20622408 [2,0,0,0,0,0|1,0,1]=4 2187 B7R0.4 NCCCOC(N)=O Amb26334419 [2,0,0,0,0,0|1,0,1]=4 2188 B7R0.4 NCCCOC(N)=O Amb33299259 [2,0,0,0,0,0|1,0,1]=4 2189 B7R0.4 NCCCOS(=O)O Amb26007874 [2,0,0,0,0,0|2,0,0]=4 2190 B7R0.4 NCCNCC(=O)O Amb17608063 [2,0,0,0,0,0|1,0,0]=3 2191 B7R0.4 NCCNCC(=O)O Amb33339058 [2,0,0,0,0,0|1,0,0]=3 2192 B7R0.4 NCCNCC(N)=O Amb28388338 [2,0,0,0,0,0|1,0,1]=4 2193 B7R0.4 NCCOCC(=O)O Amb18630146 [2,0,0,0,0,0|1,0,0]=3 2194 B7R0.4 NCCOCC(=O)O Amb33550947 [2,0,0,0,0,0|1,0,0]=3 2195 B7R0.4 NCCOCC(N)=O Amb18523830 [2,0,0,0,0,0|1,0,1]=4 2196 B7R0.4 NCCOCC(N)=O Amb33549549 [2,0,0,0,0,0|1,0,1]=4 2197 B7R0.4 NCCSCC(=O)O Amb17500446 [2,0,0,0,0,0|1,0,0]=3 2198 B7R0.4 NCCSCC(=O)O Amb20622325 [2,0,0,0,0,0|1,0,0]=3 2199 B7R0.4 NCCSCC(N)=O Amb6266329 [2,0,0,0,0,0|1,0,1]=4 2200 B7R0.4 NCC\C=C/C(=O)O Amb27201417 [2,0,0,0,0,0|0,0,2]=4 2201 B7R0.4 NOCCCC(=O)O Amb10975956 [2,0,0,0,0,0|1,0,0]=3 2202 B7R0.4 NOCCCC(=O)O Amb22011795 [2,0,0,0,0,0|1,0,0]=3 2203 B7R0.4 NOCCCC(=O)O Amb31283653 [2,0,0,0,0,0|1,0,0]=3 2204 B7R0.4 NS(=O)CCCCCl Amb32720307 [2,0,0,0,0,0|2,0,0]=4 2205 B7R0.4 NS(=O)CCCCF Amb32720393 [2,0,0,0,0,0|2,0,0]=4 2206 B7R0.4 O=C(Cl)CCCCBr Amb2685557 [2,0,0,0,0,0|2,0,0]=4 2207 B7R0.4 O=C(Cl)CCCCCl Amb6296596 [2,0,0,0,0,0|2,0,0]=4 2208 B7R0.4 O=C(O)CCCCBr Amb6608763 [2,0,0,0,0,0|1,0,0]=3 2209 B7R0.4 O=C(O)CCCCCl Amb3940369 [2,0,0,0,0,0|1,0,0]=3 2210 B7R0.4 O=C(O)CCCCF Amb26639920 [2,0,0,0,0,0|1,0,0]=3 2211 B7R0.4 O=C(O)CCCCO Amb9214971 [2,0,0,0,0,0|1,0,0]=3 2212 B7R0.4 O=C(O)CCCCS Amb17503767 [2,0,0,0,0,0|1,0,0]=3 2213 B7R0.4 O=C(O)CCCNCl Amb27173950 [2,0,0,0,0,0|2,0,0]=4 2214 B7R0.4 O=C(O)CNCCF Amb28076282 [2,0,0,0,0,0|2,0,0]=4 2215 B7R0.4 O=C(O)CNCCO Amb9325653 [2,0,0,0,0,0|2,0,0]=4 2216 B7R0.4 O=C(O)COCCCl Amb21857870 [2,0,0,0,0,0|2,0,0]=4 2217 B7R0.4 O=C(O)COCCF Amb27866609 [2,0,0,0,0,0|2,0,0]=4 2218 B7R0.4 O=C(O)COCCO Amb6680914 [2,0,0,0,0,0|2,0,0]=4 2219 B7R0.4 O=C(O)CSCCCl Amb18644703 [2,0,0,0,0,0|2,0,0]=4 2220 B7R0.4 O=C([O-])CCCCF Amb33527827 [2,0,0,0,0,0|1,0,1]=4 2221 B7R0.4 O=C([O-])CCCCO Amb13952763 [2,0,0,0,0,0|1,0,1]=4 2222 B7R0.4 O=C([O-])CCCCO Amb22749314 [2,0,0,0,0,0|1,0,1]=4 2223 B7R0.4 O=CCCCC(=O)O Amb17593198 [2,0,0,0,0,0|1,0,1]=4 2224 B7R0.4 OC(Cl)CCCCCl Amb27410884 [2,0,0,0,0,0|2,0,0]=4 2225 B7R0.5 C#CCC(N)C(=O)O Amb19944472 [2,0,0,0,0,0|0,0,2]=4 2226 B7R0.5 C#CCC(N)C(=O)O Amb9721758 [2,0,0,0,0,0|0,0,2]=4 2227 B7R0.5 C#CC[C@@H](N)C(=O)O Amb16183954 [2,0,0,0,0,0|0,0,2]=4 2228 B7R0.5 C#CC[C@@H](N)C(=O)O Amb22748688 [2,0,0,0,0,0|0,0,2]=4 2229 B7R0.5 C#CC[C@H](N)C(=O)O Amb8396606 [2,0,0,0,0,0|0,0,2]=4 2230 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [2,0,0,0,0,0|1,0,1]=4 2231 B7R0.5 C=C(CCN)C(=O)O Amb27267272 [2,0,0,0,0,0|1,0,1]=4 2232 B7R0.5 C=CCC(N)C(=O)O Amb21856826 [2,0,0,0,0,0|0,0,2]=4 2233 B7R0.5 C=CCC(N)C(=O)O Amb9729145 [2,0,0,0,0,0|0,0,2]=4 2234 B7R0.5 C=CC[C@@H](N)C(=O)O Amb22745310 [2,0,0,0,0,0|0,0,2]=4 2235 B7R0.5 C=CC[C@@H](N)C(=O)O Amb8389451 [2,0,0,0,0,0|0,0,2]=4 2236 B7R0.5 C=CC[C@H](N)C(=O)O Amb10982568 [2,0,0,0,0,0|0,0,2]=4 2237 B7R0.5 C=CC[C@H](N)C(=O)O Amb2699115 [2,0,0,0,0,0|0,0,2]=4 2238 B7R0.5 CC(=O)C(N)CCO Amb25087112 [2,0,0,0,0,0|2,0,0]=4 2239 B7R0.5 CC(=O)[C@@H](N)CCO Amb28410323 [2,0,0,0,0,0|2,0,0]=4 2240 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [2,0,0,0,0,0|2,0,0]=4 2241 B7R0.5 CC(CCF)C(=O)O Amb24678386 [2,0,0,0,0,0|2,0,0]=4 2242 B7R0.5 CC(CCN)C(=O)O Amb20667970 [2,0,0,0,0,0|1,0,0]=3 2243 B7R0.5 CC(CCN)C(=O)O Amb538221 [2,0,0,0,0,0|1,0,0]=3 2244 B7R0.5 CC(CCO)C(=O)O Amb18641949 [2,0,0,0,0,0|2,0,0]=4 2245 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [2,0,0,0,0,0|1,0,1]=4 2246 B7R0.5 CCCC(Br)C(=O)Cl Amb17569837 [2,0,0,0,0,0|2,0,0]=4 2247 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [2,0,0,0,0,0|1,0,0]=3 2248 B7R0.5 CCCC(Br)C(C)=O Amb26870127 [2,0,0,0,0,0|2,0,0]=4 2249 B7R0.5 CCCC(C)C(=O)Cl Amb2689582 [2,0,0,0,0,0|2,0,0]=4 2250 B7R0.5 CCCC(C)C(=O)O Amb3938958 [2,0,0,0,0,0|1,0,0]=3 2251 B7R0.5 CCCC(C)C(C)=O Amb4034597 [2,0,0,0,0,0|2,0,0]=4 2252 B7R0.5 CCCC(C)C(N)=O Amb3886535 [2,0,0,0,0,0|2,0,0]=4 2253 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [2,0,0,0,0,0|1,0,0]=3 2254 B7R0.5 CCCC(F)C(=O)O Amb25842008 [2,0,0,0,0,0|1,0,0]=3 2255 B7R0.5 CCCC(F)C(C)=O Amb28316211 [2,0,0,0,0,0|2,0,0]=4 2256 B7R0.5 CCCC(F)C(N)=O Amb28127390 [2,0,0,0,0,0|2,0,0]=4 2257 B7R0.5 CCCC(N)C(=N)N Amb27222841 [2,0,0,0,0,0|2,0,0]=4 2258 B7R0.5 CCCC(N)C(=O)O Amb6262055 [2,0,0,0,0,0|0,0,0]=2 2259 B7R0.5 CCCC(N)C(C)=O Amb27838289 [2,0,0,0,0,0|1,0,0]=3 2260 B7R0.5 CCCC(N)C(N)=O Amb22284825 [2,0,0,0,0,0|1,0,0]=3 2261 B7R0.5 CCCC(N)C(N)=O Amb9514970 [2,0,0,0,0,0|1,0,0]=3 2262 B7R0.5 CCCC(N)C(N)=S Amb28121515 [2,0,0,0,0,0|1,1,0]=4 2263 B7R0.5 CCCC(O)C(=O)O Amb2818222 [2,0,0,0,0,0|1,0,0]=3 2264 B7R0.5 CCCC(O)C(C)=O Amb22495823 [2,0,0,0,0,0|2,0,0]=4 2265 B7R0.5 CCCC(O)C(N)=O Amb24116553 [2,0,0,0,0,0|2,0,0]=4 2266 B7R0.5 CCCC(S)C(=O)O Amb18124440 [2,0,0,0,0,0|1,0,0]=3 2267 B7R0.5 CCCN(N)C(C)=O Amb18641903 [2,0,0,0,0,0|2,0,0]=4 2268 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [2,0,0,0,0,0|1,0,0]=3 2269 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [2,0,0,0,0,0|1,0,0]=3 2270 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [2,0,0,0,0,0|0,0,0]=2 2271 B7R0.5 CCC[C@@H](N)C(C)=O Amb35659946 [2,0,0,0,0,0|1,0,0]=3 2272 B7R0.5 CCC[C@@H](N)C(C)O Amb29849610 [2,0,0,0,0,0|1,0,1]=4 2273 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [2,0,0,0,0,0|1,0,0]=3 2274 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [2,0,0,0,0,0|1,0,0]=3 2275 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [2,0,0,0,0,0|1,0,0]=3 2276 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [2,0,0,0,0,0|1,0,0]=3 2277 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [2,0,0,0,0,0|1,0,0]=3 2278 B7R0.5 CCC[C@H](C)C(C)=O Amb27463637 [2,0,0,0,0,0|2,0,0]=4 2279 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [2,0,0,0,0,0|1,0,0]=3 2280 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [2,0,0,0,0,0|0,0,0]=2 2281 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [2,0,0,0,0,0|0,0,0]=2 2282 B7R0.5 CCC[C@H](N)C(C)=O Amb35662324 [2,0,0,0,0,0|1,0,0]=3 2283 B7R0.5 CCC[C@H](N)C(C)O Amb35664016 [2,0,0,0,0,0|1,0,1]=4 2284 B7R0.5 CCC[C@H](N)C(N)=O Amb26916392 [2,0,0,0,0,0|1,0,0]=3 2285 B7R0.5 CCC[C@H](N)C(N)=O Amb33813498 [2,0,0,0,0,0|1,0,0]=3 2286 B7R0.5 CCC[C@H](N)[C@H](C)O Amb27883481 [2,0,0,0,0,0|1,0,1]=4 2287 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [2,0,0,0,0,0|1,0,0]=3 2288 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [2,0,0,0,0,0|2,0,0]=4 2289 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [2,0,0,0,0,0|1,0,0]=3 2290 B7R0.5 CCNC(C)C(=O)O Amb33527634 [2,0,0,0,0,0|2,0,0]=4 2291 B7R0.5 CCNC(C)C(=O)O Amb9326962 [2,0,0,0,0,0|2,0,0]=4 2292 B7R0.5 CCNC(O)C(=O)O Amb27259098 [2,0,0,0,0,0|2,0,0]=4 2293 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [2,0,0,0,0,0|2,0,0]=4 2294 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [2,0,0,0,0,0|2,0,0]=4 2295 B7R0.5 CCOC(C)C(=O)O Amb9725271 [2,0,0,0,0,0|2,0,0]=4 2296 B7R0.5 CCOC(F)C(=O)O Amb27210743 [2,0,0,0,0,0|2,0,0]=4 2297 B7R0.5 CCSC(C)C(=O)O Amb9721554 [2,0,0,0,0,0|2,0,0]=4 2298 B7R0.5 CNCC(C)C(=O)O Amb13952364 [2,0,0,0,0,0|2,0,0]=4 2299 B7R0.5 CNCC(C)C(=O)O Amb9400281 [2,0,0,0,0,0|2,0,0]=4 2300 B7R0.5 CNCC(N)C(=O)O Amb10845350 [2,0,0,0,0,0|1,0,0]=3 2301 B7R0.5 CNCC(O)C(=O)O Amb26894610 [2,0,0,0,0,0|2,0,0]=4 2302 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [2,0,0,0,0,0|1,0,0]=3 2303 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [2,0,0,0,0,0|1,0,0]=3 2304 B7R0.5 COCC(Br)C(=O)O Amb17594709 [2,0,0,0,0,0|2,0,0]=4 2305 B7R0.5 COCC(C)C(=O)O Amb33545090 [2,0,0,0,0,0|2,0,0]=4 2306 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [2,0,0,0,0,0|2,0,0]=4 2307 B7R0.5 COCC(N)C(=O)O Amb33551350 [2,0,0,0,0,0|1,0,0]=3 2308 B7R0.5 COCC(N)C(=O)O Amb6752055 [2,0,0,0,0,0|1,0,0]=3 2309 B7R0.5 COCC(N)C(C)=O Amb27468401 [2,0,0,0,0,0|2,0,0]=4 2310 B7R0.5 COCC(N)C(N)=O Amb18984372 [2,0,0,0,0,0|2,0,0]=4 2311 B7R0.5 COCC(N)C(N)=O Amb32693410 [2,0,0,0,0,0|2,0,0]=4 2312 B7R0.5 COCC(O)C(=O)O Amb18124273 [2,0,0,0,0,0|2,0,0]=4 2313 B7R0.5 COCC(S)C(=O)O Amb27763656 [2,0,0,0,0,0|2,0,0]=4 2314 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [2,0,0,0,0,0|2,0,0]=4 2315 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [2,0,0,0,0,0|1,0,0]=3 2316 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [2,0,0,0,0,0|1,0,0]=3 2317 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [2,0,0,0,0,0|2,0,0]=4 2318 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [2,0,0,0,0,0|1,0,0]=3 2319 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [2,0,0,0,0,0|1,0,0]=3 2320 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [2,0,0,0,0,0|2,0,0]=4 2321 B7R0.5 CSCC(C)C(=O)O Amb18967825 [2,0,0,0,0,0|2,0,0]=4 2322 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [2,0,0,0,0,0|2,0,0]=4 2323 B7R0.5 CSCC(N)C(=O)O Amb33804791 [2,0,0,0,0,0|1,0,0]=3 2324 B7R0.5 CSCC(N)C(=O)O Amb6280829 [2,0,0,0,0,0|1,0,0]=3 2325 B7R0.5 CSCC(O)C(=O)O Amb25131873 [2,0,0,0,0,0|2,0,0]=4 2326 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [2,0,0,0,0,0|2,0,0]=4 2327 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [2,0,0,0,0,0|1,0,0]=3 2328 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [2,0,0,0,0,0|1,0,0]=3 2329 B7R0.5 CSC[C@H](N)C(N)=O Amb27607700 [2,0,0,0,0,0|2,0,0]=4 2330 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [2,0,0,0,0,0|2,0,0]=4 2331 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [2,0,0,0,0,0|1,0,0]=3 2332 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [2,0,0,0,0,0|2,0,0]=4 2333 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [2,0,0,0,0,0|1,0,0]=3 2334 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [2,0,0,0,0,0|1,0,0]=3 2335 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [2,0,0,0,0,0|0,0,2]=4 2336 B7R0.5 N#CCC(N)C(=O)O Amb18641766 [2,0,0,0,0,0|0,0,2]=4 2337 B7R0.5 N#CC[C@@H](N)C(=O)O Amb26397494 [2,0,0,0,0,0|0,0,2]=4 2338 B7R0.5 N#CC[C@H](N)C(=O)O Amb16183916 [2,0,0,0,0,0|0,0,2]=4 2339 B7R0.5 NC(=O)C(N)CCF Amb24391278 [2,0,0,0,0,0|2,0,0]=4 2340 B7R0.5 NC(=O)C(N)CCO Amb24481392 [2,0,0,0,0,0|2,0,0]=4 2341 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [2,0,0,0,0,0|1,0,0]=3 2342 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [2,0,0,0,0,0|1,0,0]=3 2343 B7R0.5 NC(CCF)C(=O)O Amb25889337 [2,0,0,0,0,0|1,0,0]=3 2344 B7R0.5 NC(CCF)C(=O)O Amb28934889 [2,0,0,0,0,0|1,0,0]=3 2345 B7R0.5 NC(CCO)C(=O)O Amb8514287 [2,0,0,0,0,0|1,0,0]=3 2346 B7R0.5 NC(CCS)C(=O)O Amb19267093 [2,0,0,0,0,0|1,0,0]=3 2347 B7R0.5 NC(CCS)C(=O)O Amb3499433 [2,0,0,0,0,0|1,0,0]=3 2348 B7R0.5 NC(CCS)[PH](=O)O Amb27409002 [2,0,0,0,0,0|2,0,0]=4 2349 B7R0.5 NC(CNO)C(=O)O Amb4092732 [2,0,0,0,0,0|2,0,0]=4 2350 B7R0.5 NC(CO[SiH3])C(=O)O Amb27461306 [2,0,0,0,0,0|1,1,0]=4 2351 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [2,0,0,0,0,0|1,0,0]=3 2352 B7R0.5 NCCC(F)C(=O)O Amb10838221 [2,0,0,0,0,0|1,0,0]=3 2353 B7R0.5 NCCC(F)C(=O)O Amb22229524 [2,0,0,0,0,0|1,0,0]=3 2354 B7R0.5 NCCC(F)[PH](=O)O Amb27639139 [2,0,0,0,0,0|2,0,0]=4 2355 B7R0.5 NCCC(N)C(=O)O Amb2697841 [2,0,0,0,0,0|0,0,0]=2 2356 B7R0.5 NCCC(N)C(=O)O Amb8514694 [2,0,0,0,0,0|0,0,0]=2 2357 B7R0.5 NCCC(O)C(=O)O Amb16232090 [2,0,0,0,0,0|1,0,0]=3 2358 B7R0.5 NCCC(O)C(N)=O Amb28121985 [2,0,0,0,0,0|2,0,0]=4 2359 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [2,0,0,0,0,0|1,0,0]=3 2360 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [2,0,0,0,0,0|0,0,0]=2 2361 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [2,0,0,0,0,0|0,0,0]=2 2362 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [2,0,0,0,0,0|0,0,0]=2 2363 B7R0.5 NCC[C@@H](N)C(N)=O Amb31031077 [2,0,0,0,0,0|1,0,0]=3 2364 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [2,0,0,0,0,0|1,0,0]=3 2365 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [2,0,0,0,0,0|1,0,0]=3 2366 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [2,0,0,0,0,0|0,0,0]=2 2367 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [2,0,0,0,0,0|0,0,0]=2 2368 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [2,0,0,0,0,0|0,0,0]=2 2369 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [2,0,0,0,0,0|0,0,0]=2 2370 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [2,0,0,0,0,0|1,0,0]=3 2371 B7R0.5 NCC[C@H](O)C(N)=O Amb27390493 [2,0,0,0,0,0|2,0,0]=4 2372 B7R0.5 NOCC(N)C(=O)O Amb24184086 [2,0,0,0,0,0|1,0,0]=3 2373 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [2,0,0,0,0,0|1,0,0]=3 2374 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [2,0,0,0,0,0|1,0,0]=3 2375 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [2,0,0,0,0,0|1,0,0]=3 2376 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [2,0,0,0,0,0|1,0,0]=3 2377 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [2,0,0,0,0,0|1,0,0]=3 2378 B7R0.5 N[C@@H](OCS)C(=O)O Amb27591629 [2,0,0,0,0,0|2,0,0]=4 2379 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [2,0,0,0,0,0|1,0,1]=4 2380 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [2,0,0,0,0,0|1,0,0]=3 2381 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [2,0,0,0,0,0|1,0,0]=3 2382 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [2,0,0,0,0,0|1,0,0]=3 2383 B7R0.5 N[C@H](C[SH]=O)C(=O)O Amb27596028 [2,0,0,0,0,0|2,0,0]=4 2384 B7R0.5 O=C(O)C(Br)CCBr Amb19889695 [2,0,0,0,0,0|2,0,0]=4 2385 B7R0.5 O=C(O)C(Br)CCO Amb28325416 [2,0,0,0,0,0|2,0,0]=4 2386 B7R0.5 O=C(O)C(Cl)CCCl Amb18126030 [2,0,0,0,0,0|2,0,0]=4 2387 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [2,0,0,0,0,0|2,0,0]=4 2388 B7R0.5 O=C(O)C(O)CCF Amb28071189 [2,0,0,0,0,0|2,0,0]=4 2389 B7R0.5 O=C(O)C(O)CCO Amb24689942 [2,0,0,0,0,0|2,0,0]=4 2390 B7R0.5 O=C(O)C(S)CCS Amb27634893 [2,0,0,0,0,0|2,0,0]=4 2391 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [2,0,0,0,0,0|2,0,0]=4 2392 B9R0.1 CC(C)CCCC(N)CO Amb27233021 [1,1,0,0,0,0|1,0,1]=4 2393 B9R0.1 CC(N)CCCC(C)CO Amb27226928 [1,1,0,0,0,0|1,0,1]=4 2394 B9R0.5 C=CCC(N)CCCCF Amb28139176 [1,1,0,0,0,0|2,0,0]=4 2395 B9R0.5 CCCCCC(C)CC=O Amb21953169 [1,1,0,0,0,0|2,0,0]=4 2396 B9R0.5 CCCCCC(C)NC=O Amb27615073 [1,1,0,0,0,0|2,0,0]=4 2397 B9R0.5 CCCCCC(N)COC Amb27206898 [1,1,0,0,0,0|1,0,1]=4 2398 B9R0.5 CCCCCC(S)CC=O Amb27424790 [1,1,0,0,0,0|2,0,0]=4 2399 B9R0.8 CCCCC(O)C(N)CO Amb27862099 [1,1,0,0,0,0|1,0,1]=4 2400 B9R0.8 CCCC[C@@H](O)[C@@H](N)CO Amb28313946 [1,1,0,0,0,0|1,0,1]=4 2401 B9R0.8 CCCC[C@H](O)[C@@H](C)C=O Amb27770429 [1,1,0,0,0,0|2,0,0]=4 2402 B9R0.20 CC(C)(C=O)CCCCO Amb27650761 [1,1,0,0,0,0|2,0,0]=4 2403 B9R0.20 CC(C)(CO)CCCCN Amb28398641 [1,1,0,0,0,0|1,0,1]=4 2404 B9R0.20 CCCCCC(C)(N)CO Amb28049699 [1,1,0,0,0,0|1,0,1]=4 2405 B9R0.20 CCCCCC(Cl)(Cl)C=O Amb27838067 [1,1,0,0,0,0|2,0,0]=4 2406 B9R0.20 O=CC(Cl)(Cl)CCCCCl Amb27881492 [1,1,0,0,0,0|2,0,0]=4 2407 B9R0.24 C=CC(N)CCC(N)CF Amb27167624 [1,1,0,0,0,0|2,0,0]=4 2408 B9R0.34 CC(C=O)CC(C)CCO Amb27750291 [1,1,0,0,0,0|2,0,0]=4 2409 B9R0.34 CCCC(C)CC(N)CO Amb27770369 [1,1,0,0,0,0|1,0,1]=4 2410 B9R0.46 C=CC(N)CCCOCC Amb27654779 [1,1,0,0,0,0|2,0,0]=4 2411 B9R0.46 C=CC(N)CCOCCC Amb28050316 [1,1,0,0,0,0|2,0,0]=4 2412 B9R0.46 C=CCCCCC(Cl)C=O Amb27636303 [1,1,0,0,0,0|2,0,0]=4 2413 B9R0.46 CC(C=O)CCCCC=O Amb27614225 [1,1,0,0,0,0|2,0,0]=4 2414 B9R0.46 CCCCCCC(Cl)C=O Amb26493540 [1,1,0,0,0,0|2,0,0]=4 2415 B9R0.46 CCCCCCC(N)CO Amb27770563 [1,1,0,0,0,0|1,0,1]=4 2416 B9R0.46 CCCCCC[C@@H](Cl)C=O Amb27477830 [1,1,0,0,0,0|2,0,0]=4 2417 B9R0.46 CCCCCC[C@@H](N)CO Amb27812823 [1,1,0,0,0,0|1,0,1]=4 2418 B9R0.46 CCCCCC[C@H](N)CO Amb28126944 [1,1,0,0,0,0|1,0,1]=4 2419 B9R0.46 CCCCOCC(N)CO Amb27839156 [1,1,0,0,0,0|1,0,1]=4 2420 B9R0.46 CCCCOCC(O)C=O Amb27646119 [1,1,0,0,0,0|2,0,0]=4 2421 B9R0.46 CCCCOC[C@H](N)CO Amb28130815 [1,1,0,0,0,0|1,0,1]=4 2422 B9R0.46 CCCCSCC(C)C=O Amb27837938 [1,1,0,0,0,0|2,0,0]=4 2423 B9R0.46 CCCCSCC(N)CO Amb24480393 [1,1,0,0,0,0|1,0,1]=4 2424 B9R0.46 CCCSCCC(N)CO Amb27839116 [1,1,0,0,0,0|1,0,1]=4 2425 B9R0.46 CCOCCC[C@H](N)CO Amb27175345 [1,1,0,0,0,0|1,0,1]=4 2426 B9R0.46 CCSCCCC(N)CO Amb27779485 [1,1,0,0,0,0|1,0,1]=4 2427 B9R0.46 CNCCCCN(C)C=O Amb27813564 [1,1,0,0,0,0|2,0,0]=4 2428 B9R0.46 CNCCCC\C(N)=N\O Amb27442257 [1,1,0,0,0,0|1,0,1]=4 2429 B9R0.46 NC(CO)COCCCO Amb28410875 [1,1,0,0,0,0|1,0,1]=4 2430 B9R0.46 NCCCCCC(N)CN Amb27210080 [1,1,0,0,0,0|1,0,1]=4 2431 B9R0.46 NCCCCC\C(N)=N\O Amb28199763 [1,1,0,0,0,0|1,0,1]=4 2432 B9R0.46 NCCCNCC(N)CO Amb27815029 [1,1,0,0,0,0|0,0,1]=3 2433 B9R0.46 NCCCNC[C@H](O)CO Amb27779433 [1,1,0,0,0,0|1,0,1]=4 2434 B9R0.46 NCCCOCC(O)CO Amb24654813 [1,1,0,0,0,0|1,0,1]=4 2435 B9R0.46 NCCCSCC(O)CO Amb27486689 [1,1,0,0,0,0|1,0,1]=4 2436 B9R0.46 NCCOCC\C(N)=N\O Amb27861977 [1,1,0,0,0,0|1,0,1]=4 2437 B9R0.46 N[C@@H](CO)COCCCF Amb27755335 [1,1,0,0,0,0|1,0,1]=4 2438 B9R0.50 C=CC(CCCCC)NC Amb27652218 [1,1,0,0,0,0|2,0,0]=4 2439 B9R0.50 C=CC(CCCCC)NN Amb27952275 [1,1,0,0,0,0|2,0,0]=4 2440 B9R0.50 CCCCCC(C=O)CC Amb25883306 [1,1,0,0,0,0|2,0,0]=4 2441 B9R0.50 CCCCCC(C=O)SC Amb27841692 [1,1,0,0,0,0|2,0,0]=4 2442 B9R0.50 CCCCCC(CN)CO Amb27465223 [1,1,0,0,0,0|1,0,1]=4 2443 B9R0.50 CCCCC[C@@H](C=O)CC Amb27792864 [1,1,0,0,0,0|2,0,0]=4 2444 B9R0.50 CCCCC\C(C=O)=C/N Amb27591489 [1,1,0,0,0,0|1,0,1]=4 2445 B9R0.2 C#CCCCCCC(=O)O Amb22232010 [1,1,0,0,0,0|1,0,0]=3 2446 B9R0.2 C#CCCCCCC(C)=O Amb28053988 [1,1,0,0,0,0|2,0,0]=4 2447 B9R0.2 C#CCCCCCC(N)=O Amb27596626 [1,1,0,0,0,0|2,0,0]=4 2448 B9R0.2 C#CCCCSCC(=O)O Amb27984745 [1,1,0,0,0,0|1,0,1]=4 2449 B9R0.2 C#CCCNCCC(=O)O Amb9326411 [1,1,0,0,0,0|1,0,1]=4 2450 B9R0.2 C#CCCOCCC(=O)O Amb27406242 [1,1,0,0,0,0|1,0,1]=4 2451 B9R0.2 C#CCOCCCC(=O)O Amb9208659 [1,1,0,0,0,0|1,0,1]=4 2452 B9R0.2 C#CCSCCCC(=O)O Amb17503626 [1,1,0,0,0,0|1,0,1]=4 2453 B9R0.2 C=C(C)CCCCCNC Amb27489967 [1,1,0,0,0,0|2,0,0]=4 2454 B9R0.2 C=C(C)CCNCCCN Amb27863043 [1,1,0,0,0,0|2,0,0]=4 2455 B9R0.2 C=C(C)CCOCCCN Amb27615177 [1,1,0,0,0,0|2,0,0]=4 2456 B9R0.2 C=C(C)CCSCCCN Amb27615176 [1,1,0,0,0,0|2,0,0]=4 2457 B9R0.2 C=C(C)CSCCCCN Amb17500961 [1,1,0,0,0,0|2,0,0]=4 2458 B9R0.2 C=CCCCCCC(=O)O Amb6299579 [1,1,0,0,0,0|1,0,0]=3 2459 B9R0.2 C=CCCCCCC(C)=O Amb33544200 [1,1,0,0,0,0|2,0,0]=4 2460 B9R0.2 C=CCCCNCC(=O)O Amb28119977 [1,1,0,0,0,0|1,0,1]=4 2461 B9R0.2 C=CCCCOCC(=O)O Amb27217276 [1,1,0,0,0,0|1,0,1]=4 2462 B9R0.2 C=CCCCSCC(=O)O Amb27838988 [1,1,0,0,0,0|1,0,1]=4 2463 B9R0.2 C=CCCNCCC(=O)O Amb27839020 [1,1,0,0,0,0|1,0,1]=4 2464 B9R0.2 C=CCCSCCC(=O)O Amb28201215 [1,1,0,0,0,0|1,0,1]=4 2465 B9R0.2 C=CCOCCCC(=O)O Amb33531507 [1,1,0,0,0,0|1,0,1]=4 2466 B9R0.2 C=CCSCCCC(=O)O Amb27392354 [1,1,0,0,0,0|1,0,1]=4 2467 B9R0.2 CC(=O)CCCCCCN Amb25147578 [1,1,0,0,0,0|1,0,0]=3 2468 B9R0.2 CC(=O)CCCCCCN Amb32663700 [1,1,0,0,0,0|1,0,0]=3 2469 B9R0.2 CC(=O)CCCSCCO Amb9660259 [1,1,0,0,0,0|2,0,0]=4 2470 B9R0.2 CC(=O)CNCCCCN Amb33483477 [1,1,0,0,0,0|1,0,0]=3 2471 B9R0.2 CC(=O)CNCCCCN Amb33483478 [1,1,0,0,0,0|1,0,0]=3 2472 B9R0.2 CC(=O)CSCCCCF Amb27952719 [1,1,0,0,0,0|2,0,0]=4 2473 B9R0.2 CC(=O)CSCCCCN Amb17500952 [1,1,0,0,0,0|1,0,0]=3 2474 B9R0.2 CC(=O)NCCCCCCl Amb25709577 [1,1,0,0,0,0|2,0,0]=4 2475 B9R0.2 CC(=O)NCCCCCN Amb18102716 [1,1,0,0,0,0|1,0,0]=3 2476 B9R0.2 CC(=O)NCCNCCN Amb27596069 [1,1,0,0,0,0|2,0,0]=4 2477 B9R0.2 CC(=O)NCCOCCN Amb16233780 [1,1,0,0,0,0|2,0,0]=4 2478 B9R0.2 CC(=O)NCCSCCN Amb8876526 [1,1,0,0,0,0|2,0,0]=4 2479 B9R0.2 CC(=O)OCCCCCBr Amb8516155 [1,1,0,0,0,0|2,0,0]=4 2480 B9R0.2 CC(=O)OCCCCCCl Amb2778974 [1,1,0,0,0,0|2,0,0]=4 2481 B9R0.2 CC(O)CCCNCCN Amb27253160 [1,1,0,0,0,0|1,0,1]=4 2482 B9R0.2 CC(O)COCCCCN Amb28246831 [1,1,0,0,0,0|1,0,1]=4 2483 B9R0.2 CCC#CCCCC(=O)O Amb27628844 [1,1,0,0,0,0|1,0,1]=4 2484 B9R0.2 CCCC#CCCC(=O)O Amb27663886 [1,1,0,0,0,0|1,0,1]=4 2485 B9R0.2 CCCCC#CCC(=O)O Amb26327934 [1,1,0,0,0,0|1,0,1]=4 2486 B9R0.2 CCCCCC#CC(=O)O Amb2778506 [1,1,0,0,0,0|1,0,1]=4 2487 B9R0.2 CCCCCCCC(=O)Cl Amb3940245 [1,1,0,0,0,0|2,0,0]=4 2488 B9R0.2 CCCCCCCC(=O)O Amb3940371 [1,1,0,0,0,0|1,0,0]=3 2489 B9R0.2 CCCCCCCC(=O)S Amb10561702 [1,1,0,0,0,0|1,1,0]=4 2490 B9R0.2 CCCCCCCC(=O)[O-] Amb33756883 [1,1,0,0,0,0|1,0,1]=4 2491 B9R0.2 CCCCCCCC(=O)[O-] Amb8515835 [1,1,0,0,0,0|1,0,1]=4 2492 B9R0.2 CCCCCCCC(C)=O Amb6891951 [1,1,0,0,0,0|2,0,0]=4 2493 B9R0.2 CCCCCCCC(N)=O Amb8999028 [1,1,0,0,0,0|2,0,0]=4 2494 B9R0.2 CCCCCCNC(C)=O Amb3368460 [1,1,0,0,0,0|2,0,0]=4 2495 B9R0.2 CCCCCCNC(N)=O Amb23569596 [1,1,0,0,0,0|2,0,0]=4 2496 B9R0.2 CCCCCCOC(=O)Cl Amb10070637 [1,1,0,0,0,0|2,0,0]=4 2497 B9R0.2 CCCCCCOC(C)=O Amb8513414 [1,1,0,0,0,0|2,0,0]=4 2498 B9R0.2 CCCCCCOC(N)=O Amb22495526 [1,1,0,0,0,0|2,0,0]=4 2499 B9R0.2 CCCCCCSC(=O)Cl Amb28421765 [1,1,0,0,0,0|2,0,0]=4 2500 B9R0.2 CCCCCCSC(C)=O Amb27837874 [1,1,0,0,0,0|2,0,0]=4 2501 B9R0.2 CCCCCNCC(N)=O Amb6708061 [1,1,0,0,0,0|2,0,0]=4 2502 B9R0.2 CCCCCOCC(=O)O Amb8902706 [1,1,0,0,0,0|1,0,0]=3 2503 B9R0.2 CCCCCSCC(=O)O Amb6249571 [1,1,0,0,0,0|1,0,0]=3 2504 B9R0.2 CCCCNCCC(=O)O Amb7755713 [1,1,0,0,0,0|1,0,0]=3 2505 B9R0.2 CCCCNCCC(C)=O Amb26381876 [1,1,0,0,0,0|2,0,0]=4 2506 B9R0.2 CCCCNCCC(N)=O Amb8841106 [1,1,0,0,0,0|2,0,0]=4 2507 B9R0.2 CCCCOCCC(N)=O Amb27480748 [1,1,0,0,0,0|2,0,0]=4 2508 B9R0.2 CCCCSCCC(=O)O Amb1032992 [1,1,0,0,0,0|1,0,0]=3 2509 B9R0.2 CCCC\C=C\CC(=O)O Amb6297257 [1,1,0,0,0,0|1,0,1]=4 2510 B9R0.2 CCCNCCCC(=O)O Amb1109953 [1,1,0,0,0,0|1,0,0]=3 2511 B9R0.2 CCCOCCCC(=O)O Amb8874517 [1,1,0,0,0,0|1,0,0]=3 2512 B9R0.2 CCCONCCC(=O)O Amb27233908 [1,1,0,0,0,0|2,0,0]=4 2513 B9R0.2 CCCSCCCC(=O)O Amb6680215 [1,1,0,0,0,0|1,0,0]=3 2514 B9R0.2 CCCSCCCC(C)=O Amb9660304 [1,1,0,0,0,0|2,0,0]=4 2515 B9R0.2 CCC\C=C/CCC(=O)O Amb26566880 [1,1,0,0,0,0|1,0,1]=4 2516 B9R0.2 CCC\C=C\CCC(=O)O Amb25378821 [1,1,0,0,0,0|1,0,1]=4 2517 B9R0.2 CCNCCCCC(=O)O Amb24385094 [1,1,0,0,0,0|1,0,0]=3 2518 B9R0.2 CCNCCCCC(=O)O Amb32686610 [1,1,0,0,0,0|1,0,0]=3 2519 B9R0.2 CCNCCCCC(C)=O Amb27951143 [1,1,0,0,0,0|2,0,0]=4 2520 B9R0.2 CCNCCCCC(N)=O Amb27964384 [1,1,0,0,0,0|2,0,0]=4 2521 B9R0.2 CCOCCCCC(=O)O Amb9207786 [1,1,0,0,0,0|1,0,0]=3 2522 B9R0.2 CCOCCCCC(C)=O Amb9659807 [1,1,0,0,0,0|2,0,0]=4 2523 B9R0.2 CCOCCOCC(=O)O Amb6258165 [1,1,0,0,0,0|2,0,0]=4 2524 B9R0.2 CCOCSCCC(=O)O Amb27447358 [1,1,0,0,0,0|2,0,0]=4 2525 B9R0.2 CCONCCCC(=O)O Amb27839067 [1,1,0,0,0,0|2,0,0]=4 2526 B9R0.2 CCSCCCCC(=O)O Amb7782874 [1,1,0,0,0,0|1,0,0]=3 2527 B9R0.2 CCSCCSCC(=O)O Amb28126747 [1,1,0,0,0,0|2,0,0]=4 2528 B9R0.2 CNCCCCCC(C)=O Amb25728176 [1,1,0,0,0,0|1,0,0]=3 2529 B9R0.2 CNCCCCCC(N)=O Amb27625362 [1,1,0,0,0,0|1,0,0]=3 2530 B9R0.2 CNCCOCCC(=O)O Amb18111840 [1,1,0,0,0,0|1,0,0]=3 2531 B9R0.2 CNCCOCCC(C)=O Amb18630756 [1,1,0,0,0,0|2,0,0]=4 2532 B9R0.2 CNCCOCCC(N)=O Amb28122222 [1,1,0,0,0,0|2,0,0]=4 2533 B9R0.2 CNCCSCCC(=O)O Amb27442544 [1,1,0,0,0,0|1,0,0]=3 2534 B9R0.2 COCCCCCC(=O)O Amb10607872 [1,1,0,0,0,0|1,0,0]=3 2535 B9R0.2 COCCCCCC(C)=O Amb27227265 [1,1,0,0,0,0|2,0,0]=4 2536 B9R0.2 COCCCOCC(=O)O Amb25304314 [1,1,0,0,0,0|2,0,0]=4 2537 B9R0.2 COCCNCCC(=O)O Amb33527038 [1,1,0,0,0,0|2,0,0]=4 2538 B9R0.2 COCCNCCC(=O)O Amb7755691 [1,1,0,0,0,0|2,0,0]=4 2539 B9R0.2 COCCOCCC(=O)O Amb6268336 [1,1,0,0,0,0|2,0,0]=4 2540 B9R0.2 CSCCCCCC(=O)O Amb27444761 [1,1,0,0,0,0|1,0,0]=3 2541 B9R0.2 CSCCCNCC(=O)O Amb8827601 [1,1,0,0,0,0|2,0,0]=4 2542 B9R0.2 CSCCCOCC(=O)O Amb28042679 [1,1,0,0,0,0|2,0,0]=4 2543 B9R0.2 CSCCNCCC(=O)O Amb25055507 [1,1,0,0,0,0|2,0,0]=4 2544 B9R0.2 C[NH2+]CCCCCC(=O)O Amb9791271 [1,1,0,0,0,0|0,0,1]=3 2545 B9R0.2 C\C=C\CCCCC(=O)O Amb18643887 [1,1,0,0,0,0|1,0,1]=4 2546 B9R0.2 N#CCCCCCC(=O)O Amb18643705 [1,1,0,0,0,0|0,0,1]=3 2547 B9R0.2 N#CCCCSCC(=O)O Amb1109771 [1,1,0,0,0,0|0,0,2]=4 2548 B9R0.2 N#CCCNCCC(=O)O Amb17315318 [1,1,0,0,0,0|0,0,2]=4 2549 B9R0.2 N#CCCSCCC(=O)O Amb18927741 [1,1,0,0,0,0|0,0,2]=4 2550 B9R0.2 N#CCSCCCC(=O)O Amb17501766 [1,1,0,0,0,0|0,0,2]=4 2551 B9R0.2 N=C(N)NCCCCCN Amb25889016 [1,1,0,0,0,0|2,0,0]=4 2552 B9R0.2 N=C(N)OCCCCCN Amb27875240 [1,1,0,0,0,0|2,0,0]=4 2553 B9R0.2 NC(=O)CCCCCCBr Amb27654995 [1,1,0,0,0,0|2,0,0]=4 2554 B9R0.2 NC(=O)CCCCCCCl Amb27254212 [1,1,0,0,0,0|2,0,0]=4 2555 B9R0.2 NC(=O)CCNCCCO Amb19959936 [1,1,0,0,0,0|2,0,0]=4 2556 B9R0.2 NC(=O)CCNCCCO Amb9243308 [1,1,0,0,0,0|2,0,0]=4 2557 B9R0.2 NC(=O)CCSCCCCl Amb27217057 [1,1,0,0,0,0|2,0,0]=4 2558 B9R0.2 NC(=O)CCSCCCF Amb27756832 [1,1,0,0,0,0|2,0,0]=4 2559 B9R0.2 NC(=O)CCSCCCO Amb27615089 [1,1,0,0,0,0|2,0,0]=4 2560 B9R0.2 NC(=O)CCSCCCS Amb27779781 [1,1,0,0,0,0|2,0,0]=4 2561 B9R0.2 NC(=O)COCCCCO Amb27195620 [1,1,0,0,0,0|2,0,0]=4 2562 B9R0.2 NC(=O)CSCCCCCl Amb27806823 [1,1,0,0,0,0|2,0,0]=4 2563 B9R0.2 NC(=O)CSCCCCS Amb27776386 [1,1,0,0,0,0|2,0,0]=4 2564 B9R0.2 NCCCCCCB(O)O Amb28401029 [1,1,0,0,0,0|1,0,1]=4 2565 B9R0.2 NCCCCCCC(=O)O Amb1151254 [1,1,0,0,0,0|0,0,0]=2 2566 B9R0.2 NCCCCCCC(=O)O Amb16232099 [1,1,0,0,0,0|0,0,0]=2 2567 B9R0.2 NCCCCCCC(=O)[O-] Amb32663972 [1,1,0,0,0,0|0,0,1]=3 2568 B9R0.2 NCCCCCNC(=S)S Amb28076658 [1,1,0,0,0,0|0,2,0]=4 2569 B9R0.2 NCCCCCNC(N)=O Amb28120485 [1,1,0,0,0,0|1,0,0]=3 2570 B9R0.2 NCCCCNCC(=O)O Amb27800960 [1,1,0,0,0,0|0,0,0]=2 2571 B9R0.2 NCCCCSCC(=O)O Amb17500919 [1,1,0,0,0,0|0,0,0]=2 2572 B9R0.2 NCCCCSCC(N)=O Amb17500917 [1,1,0,0,0,0|1,0,0]=3 2573 B9R0.2 NCCCNCCC(=O)O Amb27959846 [1,1,0,0,0,0|0,0,0]=2 2574 B9R0.2 NCCCOCCC(=O)O Amb18111494 [1,1,0,0,0,0|0,0,0]=2 2575 B9R0.2 NCCCOCCC(N)=O Amb27412120 [1,1,0,0,0,0|1,0,0]=3 2576 B9R0.2 NCCCSCCC(=O)O Amb24496605 [1,1,0,0,0,0|0,0,0]=2 2577 B9R0.2 NCCCSCCC(N)=O Amb28077685 [1,1,0,0,0,0|1,0,0]=3 2578 B9R0.2 NCCCS\C=C\C(=O)O Amb27837837 [1,1,0,0,0,0|0,0,2]=4 2579 B9R0.2 NCCNCCNC(=O)O Amb24069145 [1,1,0,0,0,0|1,0,0]=3 2580 B9R0.2 NCCNCCNC(N)=O Amb28122121 [1,1,0,0,0,0|2,0,0]=4 2581 B9R0.2 NCCOCCCC(=O)O Amb18111467 [1,1,0,0,0,0|0,0,0]=2 2582 B9R0.2 NCCOCCNC(N)=O Amb27758878 [1,1,0,0,0,0|2,0,0]=4 2583 B9R0.2 NCCSCCCC(=O)O Amb17500468 [1,1,0,0,0,0|0,0,0]=2 2584 B9R0.2 NCCSSCCC(=O)O Amb17608062 [1,1,0,0,0,0|1,0,0]=3 2585 B9R0.2 NOCCCCCC(=O)O Amb32708458 [1,1,0,0,0,0|0,0,0]=2 2586 B9R0.2 NOCCSCCC(N)=O Amb27475291 [1,1,0,0,0,0|2,0,0]=4 2587 B9R0.2 O=C(Cl)CCCSCCCl Amb27644536 [1,1,0,0,0,0|2,0,0]=4 2588 B9R0.2 O=C(F)OCCCCCCl Amb27391688 [1,1,0,0,0,0|2,0,0]=4 2589 B9R0.2 O=C(O)C#CCCCCO Amb28050129 [1,1,0,0,0,0|1,0,1]=4 2590 B9R0.2 O=C(O)CCCC#CCO Amb27391720 [1,1,0,0,0,0|1,0,1]=4 2591 B9R0.2 O=C(O)CCCCCCBr Amb10071514 [1,1,0,0,0,0|1,0,0]=3 2592 B9R0.2 O=C(O)CCCCCCCl Amb17594087 [1,1,0,0,0,0|1,0,0]=3 2593 B9R0.2 O=C(O)CCCCCCF Amb25132501 [1,1,0,0,0,0|1,0,0]=3 2594 B9R0.2 O=C(O)CCCCCCO Amb9787028 [1,1,0,0,0,0|1,0,0]=3 2595 B9R0.2 O=C(O)CCCCCCS Amb24710334 [1,1,0,0,0,0|1,0,0]=3 2596 B9R0.2 O=C(O)CCCCCNBr Amb28054088 [1,1,0,0,0,0|0,0,0]=2 2597 B9R0.2 O=C(O)CCCCN=C=S Amb25685363 [1,1,0,0,0,0|1,0,1]=4 2598 B9R0.2 O=C(O)CCCC\C=C\Br Amb26542054 [1,1,0,0,0,0|1,0,1]=4 2599 B9R0.2 O=C(O)CCCNCCO Amb9333522 [1,1,0,0,0,0|1,0,0]=3 2600 B9R0.2 O=C(O)CCCOCCO Amb6680919 [1,1,0,0,0,0|1,0,0]=3 2601 B9R0.2 O=C(O)CCCSCCF Amb27614997 [1,1,0,0,0,0|1,0,0]=3 2602 B9R0.2 O=C(O)CCCSCCO Amb9481728 [1,1,0,0,0,0|1,0,0]=3 2603 B9R0.2 O=C(O)CCC\C=C/CO Amb27425001 [1,1,0,0,0,0|1,0,1]=4 2604 B9R0.2 O=C(O)CCNCCCF Amb28049536 [1,1,0,0,0,0|1,0,0]=3 2605 B9R0.2 O=C(O)CCNCCCO Amb9239888 [1,1,0,0,0,0|1,0,0]=3 2606 B9R0.2 O=C(O)CCOCCCO Amb24476864 [1,1,0,0,0,0|1,0,0]=3 2607 B9R0.2 O=C(O)CCSCCCCl Amb26421708 [1,1,0,0,0,0|1,0,0]=3 2608 B9R0.2 O=C(O)CCSCCCF Amb27251653 [1,1,0,0,0,0|1,0,0]=3 2609 B9R0.2 O=C(O)CCSSCCO Amb17615366 [1,1,0,0,0,0|2,0,0]=4 2610 B9R0.2 O=C(O)CNCCCCO Amb28063278 [1,1,0,0,0,0|1,0,0]=3 2611 B9R0.2 O=C(O)COCCCCF Amb27770553 [1,1,0,0,0,0|1,0,0]=3 2612 B9R0.2 O=C(O)COCCCCO Amb27465121 [1,1,0,0,0,0|1,0,0]=3 2613 B9R0.2 O=C(O)CSCCCCCl Amb27165750 [1,1,0,0,0,0|1,0,0]=3 2614 B9R0.2 O=C(O)CSCCCCF Amb28062594 [1,1,0,0,0,0|1,0,0]=3 2615 B9R0.2 O=C(O)\C=C\CCCCCl Amb18645743 [1,1,0,0,0,0|1,0,1]=4 2616 B9R0.2 O=C=NCCCCC(=O)O Amb24505309 [1,1,0,0,0,0|1,0,1]=4 2617 B9R0.2 O=CCCCCCC(=O)O Amb26548890 [1,1,0,0,0,0|1,0,0]=3 2618 B9R0.2 [N-]=[N+]=NCCCCC(=O)O Amb19516609 [1,1,0,0,0,0|1,0,1]=4 2619 B9R0.4 C=C(CCCC)CC(=O)O Amb18643896 [1,1,0,0,0,0|1,0,1]=4 2620 B9R0.4 C=CCCC(N)CC(=O)O Amb22641959 [1,1,0,0,0,0|1,0,1]=4 2621 B9R0.4 C=CCCC(N)CC(=O)O Amb31307612 [1,1,0,0,0,0|1,0,1]=4 2622 B9R0.4 C=CCC[C@@H](C)CC(=O)O Amb27390713 [1,1,0,0,0,0|1,0,1]=4 2623 B9R0.4 C=CCC[C@H](N)CC(=O)O Amb10066917 [1,1,0,0,0,0|1,0,1]=4 2624 B9R0.4 CC(CC(=O)O)NCCF Amb28144859 [1,1,0,0,0,0|2,0,0]=4 2625 B9R0.4 CC(CC(=O)O)NCCO Amb9398895 [1,1,0,0,0,0|2,0,0]=4 2626 B9R0.4 CC(CC(=O)O)SCCN Amb18788220 [1,1,0,0,0,0|1,0,0]=3 2627 B9R0.4 CC(CC(=O)O)SCCO Amb9481722 [1,1,0,0,0,0|2,0,0]=4 2628 B9R0.4 CC(CCC=O)CC(=O)O Amb28251065 [1,1,0,0,0,0|1,0,1]=4 2629 B9R0.4 CC(CCCCl)CC(=O)O Amb18646190 [1,1,0,0,0,0|1,0,0]=3 2630 B9R0.4 CC(CCCO)CC(=O)O Amb28050163 [1,1,0,0,0,0|1,0,0]=3 2631 B9R0.4 CC(CCCS)CC(=O)O Amb27443015 [1,1,0,0,0,0|1,0,0]=3 2632 B9R0.4 CCCCC(C)CC(=O)O Amb6740296 [1,1,0,0,0,0|1,0,0]=3 2633 B9R0.4 CCCCC(C)CC(N)=O Amb24761512 [1,1,0,0,0,0|2,0,0]=4 2634 B9R0.4 CCCCC(N)CC(=O)O Amb1993866 [1,1,0,0,0,0|1,0,0]=3 2635 B9R0.4 CCCCC(N)CC(=O)O Amb31307613 [1,1,0,0,0,0|1,0,0]=3 2636 B9R0.4 CCCCC(N)CC(N)=O Amb24638916 [1,1,0,0,0,0|2,0,0]=4 2637 B9R0.4 CCCCC(O)CC(=O)O Amb22388888 [1,1,0,0,0,0|1,0,0]=3 2638 B9R0.4 CCCCC(O)CC(C)=O Amb28325992 [1,1,0,0,0,0|2,0,0]=4 2639 B9R0.4 CCCCN(C)CC(=O)O Amb5774355 [1,1,0,0,0,0|2,0,0]=4 2640 B9R0.4 CCCCS(=O)CC(=O)O Amb18792577 [1,1,0,0,0,0|2,0,0]=4 2641 B9R0.4 CCCC[C@@H](C)CC(=O)O Amb25887593 [1,1,0,0,0,0|1,0,0]=3 2642 B9R0.4 CCCC[C@@H](C)CC(C)=O Amb27589814 [1,1,0,0,0,0|2,0,0]=4 2643 B9R0.4 CCCC[C@@H](N)CC(=O)O Amb26612752 [1,1,0,0,0,0|1,0,0]=3 2644 B9R0.4 CCCC[C@@H](N)CC(=O)O Amb32663769 [1,1,0,0,0,0|1,0,0]=3 2645 B9R0.4 CCCC[C@@H](O)CC(=O)O Amb24350627 [1,1,0,0,0,0|1,0,0]=3 2646 B9R0.4 CCCC[C@H](C)CC(=O)O Amb27424971 [1,1,0,0,0,0|1,0,0]=3 2647 B9R0.4 CCCC[C@H](C)CC(C)=O Amb28253626 [1,1,0,0,0,0|2,0,0]=4 2648 B9R0.4 CCCC[C@H](C)CC(N)=O Amb28461273 [1,1,0,0,0,0|2,0,0]=4 2649 B9R0.4 CCCC[C@H](N)CC(=O)O Amb27154618 [1,1,0,0,0,0|1,0,0]=3 2650 B9R0.4 CCNCC(C)CC(=O)O Amb27602707 [1,1,0,0,0,0|2,0,0]=4 2651 B9R0.4 CCOCC(O)CC(=O)O Amb28340917 [1,1,0,0,0,0|2,0,0]=4 2652 B9R0.4 CCSCC(C)CC(=O)O Amb33324046 [1,1,0,0,0,0|2,0,0]=4 2653 B9R0.4 CCSCC(N)CC(=O)O Amb27233388 [1,1,0,0,0,0|2,0,0]=4 2654 B9R0.4 CCSCC(O)CC(=O)O Amb26062529 [1,1,0,0,0,0|2,0,0]=4 2655 B9R0.4 CCSC[C@@H](O)CC(=O)O Amb33324012 [1,1,0,0,0,0|2,0,0]=4 2656 B9R0.4 CCSC[C@H](O)CC(=O)O Amb33324011 [1,1,0,0,0,0|2,0,0]=4 2657 B9R0.4 CNCC[C@@H](N)CC(=O)O Amb24117036 [1,1,0,0,0,0|2,0,0]=4 2658 B9R0.4 COCCC(C)CC(=O)O Amb27973352 [1,1,0,0,0,0|2,0,0]=4 2659 B9R0.4 COCCC(N)CC(=O)O Amb32687893 [1,1,0,0,0,0|2,0,0]=4 2660 B9R0.4 COCCC(O)CC(=O)O Amb33377806 [1,1,0,0,0,0|2,0,0]=4 2661 B9R0.4 COCC[C@@H](O)CC(=O)O Amb33377805 [1,1,0,0,0,0|2,0,0]=4 2662 B9R0.4 COCC[C@H](O)CC(=O)O Amb33377804 [1,1,0,0,0,0|2,0,0]=4 2663 B9R0.4 CSCCC(C)CC(=O)O Amb26651819 [1,1,0,0,0,0|2,0,0]=4 2664 B9R0.4 CSCCC(N)CC(=O)O Amb22353181 [1,1,0,0,0,0|2,0,0]=4 2665 B9R0.4 CSCCC(N)CC(=O)O Amb30666600 [1,1,0,0,0,0|2,0,0]=4 2666 B9R0.4 CSCCC(O)CC(=O)O Amb18798349 [1,1,0,0,0,0|2,0,0]=4 2667 B9R0.4 CSCC[C@@H](N)CC(=O)O Amb26930581 [1,1,0,0,0,0|2,0,0]=4 2668 B9R0.4 CSCC[C@@H](O)CC(=O)O Amb33198734 [1,1,0,0,0,0|2,0,0]=4 2669 B9R0.4 CSCC[C@H](N)CC(=O)O Amb16184019 [1,1,0,0,0,0|2,0,0]=4 2670 B9R0.4 CSCC[C@H](O)CC(=O)O Amb33198733 [1,1,0,0,0,0|2,0,0]=4 2671 B9R0.4 C[C@@H](CCC=O)CC(=O)O Amb27614920 [1,1,0,0,0,0|1,0,1]=4 2672 B9R0.4 NCCCC(N)CC(=O)O Amb18644278 [1,1,0,0,0,0|0,0,0]=2 2673 B9R0.4 NCCCC(N)CC(=O)O Amb32753541 [1,1,0,0,0,0|0,0,0]=2 2674 B9R0.4 NCCCS(=O)CC(=O)O Amb27965039 [1,1,0,0,0,0|1,0,0]=3 2675 B9R0.4 NCCCS(=O)CC(N)=O Amb28133954 [1,1,0,0,0,0|2,0,0]=4 2676 B9R0.4 NCCC[C@@H](N)CC(=O)O Amb24117039 [1,1,0,0,0,0|0,0,0]=2 2677 B9R0.4 NCCC[C@@H](N)CC(=O)O Amb24117927 [1,1,0,0,0,0|0,0,0]=2 2678 B9R0.4 NCCC[C@H](N)CC(=O)O Amb25757485 [1,1,0,0,0,0|0,0,0]=2 2679 B9R0.4 NCCC[C@H](N)CC(=O)O Amb32684506 [1,1,0,0,0,0|0,0,0]=2 2680 B9R0.4 NCCNC(=O)CC(=O)O Amb27190857 [1,1,0,0,0,0|1,0,1]=4 2681 B9R0.38 CC(C)(O)CCCCCN Amb27593876 [1,1,0,0,0,0|1,0,1]=4 2682 B9R0.38 CCCCCCP(=O)(O)O Amb3371952 [1,1,0,0,0,0|2,0,0]=4 2683 B9R0.38 CCCCCCS(=O)(=O)O Amb25138206 [1,1,0,0,0,0|2,0,0]=4 2684 B9R0.38 CS(=O)(=O)CCCCCN Amb28895974 [1,1,0,0,0,0|1,0,1]=4 2685 B9R0.38 NCCCCCS(=O)(=O)F Amb33463767 [1,1,0,0,0,0|1,0,1]=4 2686 B9R0.38 NCCCCCS(=O)(=O)O Amb28325598 [1,1,0,0,0,0|1,0,0]=3 2687 B9R0.38 NCCCCOP(=O)(O)O Amb27984989 [1,1,0,0,0,0|2,0,0]=4 2688 B9R0.38 NCCCCOS(=O)(=O)O Amb27975375 [1,1,0,0,0,0|2,0,0]=4 2689 B9R0.48 C=C(CCC)CCC(=O)O Amb27475552 [1,1,0,0,0,0|1,0,1]=4 2690 B9R0.48 C=CCC(C)CCC(=O)O Amb27605823 [1,1,0,0,0,0|1,0,1]=4 2691 B9R0.48 CC(=O)CCC(C)CCN Amb27426882 [1,1,0,0,0,0|1,0,0]=3 2692 B9R0.48 CC(=O)CC[C@@H](C)CCO Amb27944575 [1,1,0,0,0,0|2,0,0]=4 2693 B9R0.48 CC(CC=O)CCC(=O)O Amb27439382 [1,1,0,0,0,0|1,0,1]=4 2694 B9R0.48 CC(CCCl)CCC(=O)O Amb27834348 [1,1,0,0,0,0|1,0,0]=3 2695 B9R0.48 CC(CCN)CCC(=O)O Amb18124749 [1,1,0,0,0,0|0,0,0]=2 2696 B9R0.48 CC(CCN)CCC(N)=O Amb19515543 [1,1,0,0,0,0|1,0,0]=3 2697 B9R0.48 CC(CCN)CNC(N)=O Amb27455693 [1,1,0,0,0,0|2,0,0]=4 2698 B9R0.48 CC(CCN)SCC(=O)O Amb27244497 [1,1,0,0,0,0|1,0,0]=3 2699 B9R0.48 CC(CCN)SCC(N)=O Amb27234451 [1,1,0,0,0,0|2,0,0]=4 2700 B9R0.48 CC(CCO)NCC(=O)O Amb27174877 [1,1,0,0,0,0|2,0,0]=4 2701 B9R0.48 CC(CCS)CCC(=O)O Amb28291582 [1,1,0,0,0,0|1,0,0]=3 2702 B9R0.48 CCCC(C)CCC(=O)O Amb28193257 [1,1,0,0,0,0|1,0,0]=3 2703 B9R0.48 CCCC(C)CCC(C)=O Amb10807385 [1,1,0,0,0,0|2,0,0]=4 2704 B9R0.48 CCCC(C)OCC(=O)O Amb18124782 [1,1,0,0,0,0|2,0,0]=4 2705 B9R0.48 CCCC(Cl)CCC(=O)Cl Amb27831367 [1,1,0,0,0,0|2,0,0]=4 2706 B9R0.48 CCCC(N)CCC(=O)O Amb1014101 [1,1,0,0,0,0|1,0,0]=3 2707 B9R0.48 CCCC(O)CCC(=O)O Amb17689110 [1,1,0,0,0,0|1,0,0]=3 2708 B9R0.48 CCCC(O)CCC(=O)[O-] Amb17778117 [1,1,0,0,0,0|1,0,1]=4 2709 B9R0.48 CCCC(O)CCC(=O)[O-] Amb2386295 [1,1,0,0,0,0|1,0,1]=4 2710 B9R0.48 CCCN(C)CCC(=O)O Amb33546079 [1,1,0,0,0,0|2,0,0]=4 2711 B9R0.48 CCCN(C)CCC(=O)O Amb8899165 [1,1,0,0,0,0|2,0,0]=4 2712 B9R0.48 CCCN(O)CCC(=O)O Amb27196070 [1,1,0,0,0,0|2,0,0]=4 2713 B9R0.48 CCCS(=O)CCC(=O)O Amb18792575 [1,1,0,0,0,0|2,0,0]=4 2714 B9R0.48 CCC[C@@H](O)CCC(=O)O Amb28050107 [1,1,0,0,0,0|1,0,0]=3 2715 B9R0.48 CCC[C@H](C)CCC(=O)O Amb24446759 [1,1,0,0,0,0|1,0,0]=3 2716 B9R0.48 CCC[C@H](O)CCC(=O)O Amb27618330 [1,1,0,0,0,0|1,0,0]=3 2717 B9R0.48 CCC[C@H](O)CCC(N)=O Amb27765010 [1,1,0,0,0,0|2,0,0]=4 2718 B9R0.48 CCOC(C)CCC(=O)O Amb24690847 [1,1,0,0,0,0|2,0,0]=4 2719 B9R0.48 CN(CCCl)CCC(=O)O Amb27949173 [1,1,0,0,0,0|2,0,0]=4 2720 B9R0.48 CN(CCN)CCC(=O)O Amb28382339 [1,1,0,0,0,0|1,0,0]=3 2721 B9R0.48 CN(CCO)CCC(=O)O Amb5774461 [1,1,0,0,0,0|2,0,0]=4 2722 B9R0.48 COCC(Cl)CCC(=O)O Amb27456486 [1,1,0,0,0,0|2,0,0]=4 2723 B9R0.48 COCC(N)CCC(=O)O Amb33036364 [1,1,0,0,0,0|2,0,0]=4 2724 B9R0.48 COCC(O)CCC(=O)O Amb33036250 [1,1,0,0,0,0|2,0,0]=4 2725 B9R0.48 CSCC(N)CCC(=O)O Amb33272065 [1,1,0,0,0,0|2,0,0]=4 2726 B9R0.48 CSCC(O)CCC(=O)O Amb27490998 [1,1,0,0,0,0|2,0,0]=4 2727 B9R0.48 C[C@@H](CC#N)CCC(=O)O Amb27950078 [1,1,0,0,0,0|0,0,2]=4 2728 B9R0.48 C[C@@H](CCO)CCC(=O)O Amb28250798 [1,1,0,0,0,0|1,0,0]=3 2729 B9R0.48 NC(CCF)CCC(=O)O Amb33480872 [1,1,0,0,0,0|1,0,0]=3 2730 B9R0.48 NCCC(=O)NCC(=O)O Amb28555431 [1,1,0,0,0,0|1,0,1]=4 2731 B9R0.48 NCCC(=O)NCC(=O)O Amb4035945 [1,1,0,0,0,0|1,0,1]=4 2732 B9R0.48 NCCC(N)CCC(=O)O Amb27390542 [1,1,0,0,0,0|0,0,0]=2 2733 B9R0.48 NCNC(=O)CCC(=O)O Amb27753445 [1,1,0,0,0,0|1,0,1]=4 2734 B9R0.48 N[C@H](CCS)CCC(=O)O Amb27857300 [1,1,0,0,0,0|1,0,0]=3 2735 B9R0.48 O=C(O)CCC(O)CCO Amb28121295 [1,1,0,0,0,0|1,0,0]=3 2736 B9R0.55 C=C(F)CCCCC(=O)O Amb27949889 [1,1,0,0,0,0|1,0,1]=4 2737 B9R0.55 CC(=O)CCCCC(=O)O Amb3939946 [1,1,0,0,0,0|1,0,1]=4 2738 B9R0.55 CC(=O)CCCCC(C)O Amb27838002 [1,1,0,0,0,0|2,0,0]=4 2739 B9R0.55 CC(=O)CCCCC(Cl)Cl Amb27392324 [1,1,0,0,0,0|2,0,0]=4 2740 B9R0.55 CC(Br)COCCC(=O)O Amb28255646 [1,1,0,0,0,0|2,0,0]=4 2741 B9R0.55 CC(C)CCCCC(=O)Cl Amb25067489 [1,1,0,0,0,0|2,0,0]=4 2742 B9R0.55 CC(C)CCCCC(=O)O Amb10576144 [1,1,0,0,0,0|1,0,0]=3 2743 B9R0.55 CC(C)CCCCC(N)=O Amb2613088 [1,1,0,0,0,0|2,0,0]=4 2744 B9R0.55 CC(C)CCNCC(=O)O Amb1111021 [1,1,0,0,0,0|2,0,0]=4 2745 B9R0.55 CC(C)CCOCC(=O)O Amb6268007 [1,1,0,0,0,0|2,0,0]=4 2746 B9R0.55 CC(C)CCSCC(=O)O Amb1137397 [1,1,0,0,0,0|2,0,0]=4 2747 B9R0.55 CC(C)CNCCC(=O)O Amb10609230 [1,1,0,0,0,0|2,0,0]=4 2748 B9R0.55 CC(C)CNCCC(=O)O Amb2372367 [1,1,0,0,0,0|2,0,0]=4 2749 B9R0.55 CC(C)COCCC(=O)O Amb6280020 [1,1,0,0,0,0|2,0,0]=4 2750 B9R0.55 CC(C)CSCCC(=O)O Amb6278798 [1,1,0,0,0,0|2,0,0]=4 2751 B9R0.55 CC(C)NCCCC(=O)O Amb1111231 [1,1,0,0,0,0|2,0,0]=4 2752 B9R0.55 CC(C)NCCCC(=O)O Amb528115 [1,1,0,0,0,0|2,0,0]=4 2753 B9R0.55 CC(C)OCCCC(=O)O Amb6274334 [1,1,0,0,0,0|2,0,0]=4 2754 B9R0.55 CC(C)SCCCC(=O)O Amb17503621 [1,1,0,0,0,0|2,0,0]=4 2755 B9R0.55 CC(F)CCOCC(=O)O Amb27613091 [1,1,0,0,0,0|2,0,0]=4 2756 B9R0.55 CC(F)CCSCC(=O)O Amb27777659 [1,1,0,0,0,0|2,0,0]=4 2757 B9R0.55 CC(N)CCC#CC(=O)O Amb33169012 [1,1,0,0,0,0|0,0,2]=4 2758 B9R0.55 CC(N)CCCCC(=O)O Amb18644199 [1,1,0,0,0,0|0,0,0]=2 2759 B9R0.55 CC(N)CCCCC(=O)O Amb19515386 [1,1,0,0,0,0|0,0,0]=2 2760 B9R0.55 CC(N)CCCCC(N)=O Amb19515544 [1,1,0,0,0,0|1,0,0]=3 2761 B9R0.55 CC(N)CCSCC(=O)O Amb27436369 [1,1,0,0,0,0|1,0,0]=3 2762 B9R0.55 CC(O)CSCCC(=O)O Amb18792572 [1,1,0,0,0,0|2,0,0]=4 2763 B9R0.55 CN(C)CCCCC(=O)O Amb19275569 [1,1,0,0,0,0|2,0,0]=4 2764 B9R0.55 CN(C)CCCCC(=O)O Amb7783201 [1,1,0,0,0,0|2,0,0]=4 2765 B9R0.55 CS(=O)CCCCC(=O)O Amb18788305 [1,1,0,0,0,0|2,0,0]=4 2766 B9R0.55 C[C@@H](N)CCCCC(=O)O Amb25877255 [1,1,0,0,0,0|0,0,0]=2 2767 B9R0.55 C[C@H](N)CSCCC(N)=O Amb28367266 [1,1,0,0,0,0|2,0,0]=4 2768 B9R0.55 N=C(N)NCCCC(=O)O Amb9813713 [1,1,0,0,0,0|1,0,1]=4 2769 B9R0.55 NC(=O)CCCCC(=O)O Amb9391119 [1,1,0,0,0,0|0,0,1]=3 2770 B9R0.55 NC(=O)CCCCC(N)=O Amb2793081 [1,1,0,0,0,0|1,0,1]=4 2771 B9R0.55 NC(=O)CSCCC(=O)O Amb6664956 [1,1,0,0,0,0|1,0,1]=4 2772 B9R0.55 NC(=O)NCCCC(=O)O Amb1104859 [1,1,0,0,0,0|1,0,1]=4 2773 B9R0.55 NC(=S)NCCCC(=O)O Amb27649643 [1,1,0,0,0,0|1,0,1]=4 2774 B9R0.55 O=C(O)CCCCC(=O)Cl Amb27614847 [1,1,0,0,0,0|1,0,1]=4 2775 B9R0.55 O=C(O)CCCCC(=O)O Amb22167453 [1,1,0,0,0,0|1,0,1]=4 2776 B9R0.55 O=C(O)CCCCC(=O)O Amb22336279 [1,1,0,0,0,0|1,0,1]=4 2777 B9R0.55 O=C(O)CCCCC(=O)O Amb2793031 [1,1,0,0,0,0|1,0,1]=4 2778 B9R0.55 O=C(O)CCCCC(O)O Amb28143854 [1,1,0,0,0,0|1,0,0]=3 2779 B9R0.55 O=C(O)CCCCN(F)F Amb27985922 [1,1,0,0,0,0|2,0,0]=4 2780 B9R0.55 O=C(O)CCCOC(F)F Amb27861059 [1,1,0,0,0,0|2,0,0]=4 2781 B9R0.55 O=C(O)CCOCC(F)F Amb26539468 [1,1,0,0,0,0|2,0,0]=4 2782 B9R0.55 O=C(O)COCCC(F)F Amb27848670 [1,1,0,0,0,0|2,0,0]=4 2783 B9R0.3 CCCCC(N)C(C)(C)O Amb33214880 [1,1,0,0,0,0|1,0,1]=4 2784 B9R0.3 CCCCC(N)P(C)(=O)O Amb27863006 [1,1,0,0,0,0|1,0,0]=3 2785 B9R0.3 CCCCC(N)S(=O)(=O)O Amb27229977 [1,1,0,0,0,0|1,0,0]=3 2786 B9R0.3 CCCCC(O)P(=O)(O)O Amb25356317 [1,1,0,0,0,0|2,0,0]=4 2787 B9R0.3 CSCCC(N)P(=O)(O)O Amb26427856 [1,1,0,0,0,0|2,0,0]=4 2788 B9R0.3 CSCCC(N)S(=O)(=O)O Amb28142834 [1,1,0,0,0,0|2,0,0]=4 2789 B9R0.3 CSCC[C@@H](N)P(=O)(O)O Amb28457689 [1,1,0,0,0,0|2,0,0]=4 2790 B9R0.3 CSCC[C@H](N)P(=O)(O)O Amb28396596 [1,1,0,0,0,0|2,0,0]=4 2791 B9R0.6 C=C(C(=O)O)C(C)CCC Amb33321132 [1,1,0,0,0,0|1,0,1]=4 2792 B9R0.6 C=C(CCC)[C@H](N)C(=O)O Amb27404609 [1,1,0,0,0,0|0,0,1]=3 2793 B9R0.6 C=CCC(C)C(N)C(=O)O Amb26381874 [1,1,0,0,0,0|0,0,2]=4 2794 B9R0.6 C=CCC(C)[C@@H](N)C(=O)O Amb33037030 [1,1,0,0,0,0|0,0,2]=4 2795 B9R0.6 C=CCC(C)[C@H](N)C(=O)O Amb32865926 [1,1,0,0,0,0|0,0,2]=4 2796 B9R0.6 CC(C(=O)O)N(C)CCN Amb19028451 [1,1,0,0,0,0|2,0,0]=4 2797 B9R0.6 CC(CC#N)C(N)C(=O)O Amb33066130 [1,1,0,0,0,0|0,0,2]=4 2798 B9R0.6 CC(CC#N)[C@@H](N)C(=O)O Amb33308829 [1,1,0,0,0,0|0,0,2]=4 2799 B9R0.6 CC(CC#N)[C@H](N)C(=O)O Amb32865927 [1,1,0,0,0,0|0,0,2]=4 2800 B9R0.6 CCCC(C)C(=O)C(=O)O Amb24747027 [1,1,0,0,0,0|1,0,1]=4 2801 B9R0.6 CCCC(C)C(C)C(=O)O Amb28050123 [1,1,0,0,0,0|1,0,0]=3 2802 B9R0.6 CCCC(C)C(Cl)C(N)=O Amb18800738 [1,1,0,0,0,0|2,0,0]=4 2803 B9R0.6 CCCC(C)C(N)C(=O)O Amb20622789 [1,1,0,0,0,0|0,0,0]=2 2804 B9R0.6 CCCC(C)C(N)C(N)=O Amb27809015 [1,1,0,0,0,0|1,0,0]=3 2805 B9R0.6 CCCC(C)C(O)C(=O)O Amb27809670 [1,1,0,0,0,0|1,0,0]=3 2806 B9R0.6 CCCC(C)C(O)C(C)=O Amb27645205 [1,1,0,0,0,0|2,0,0]=4 2807 B9R0.6 CCCC(C)C(O)C(N)=O Amb27407802 [1,1,0,0,0,0|2,0,0]=4 2808 B9R0.6 CCCC(C)[C@@H](C)C(=O)O Amb33727115 [1,1,0,0,0,0|1,0,0]=3 2809 B9R0.6 CCCC(C)[C@@H](N)C(=O)O Amb26624121 [1,1,0,0,0,0|0,0,0]=2 2810 B9R0.6 CCCC(C)[C@H](C)C(=O)O Amb33749068 [1,1,0,0,0,0|1,0,0]=3 2811 B9R0.6 CCCC(C)[C@H](N)C(=O)O Amb26512364 [1,1,0,0,0,0|0,0,0]=2 2812 B9R0.6 CCCC(Cl)C(O)C(C)=O Amb25943692 [1,1,0,0,0,0|2,0,0]=4 2813 B9R0.6 CCCC(F)C(Br)C(=O)O Amb27623862 [1,1,0,0,0,0|1,0,0]=3 2814 B9R0.6 CCCC(F)C(N)C(=O)O Amb10839857 [1,1,0,0,0,0|0,0,0]=2 2815 B9R0.6 CCCC(N)C(C)C(=O)O Amb24763852 [1,1,0,0,0,0|1,0,0]=3 2816 B9R0.6 CCCC(N)C(F)C(=O)O Amb33036385 [1,1,0,0,0,0|1,0,0]=3 2817 B9R0.6 CCCC(N)C(O)C(N)=O Amb8391315 [1,1,0,0,0,0|2,0,0]=4 2818 B9R0.6 CCCC(O)C(C)C(=O)O Amb18310700 [1,1,0,0,0,0|1,0,0]=3 2819 B9R0.6 CCCC(O)C(C)C(N)=O Amb27816041 [1,1,0,0,0,0|2,0,0]=4 2820 B9R0.6 CCCC(O)C(Cl)C(=O)O Amb28120934 [1,1,0,0,0,0|1,0,0]=3 2821 B9R0.6 CCCC(O)C(Cl)C(C)=O Amb26066170 [1,1,0,0,0,0|2,0,0]=4 2822 B9R0.6 CCCC(O)C(F)C(=O)O Amb33036248 [1,1,0,0,0,0|1,0,0]=3 2823 B9R0.6 CCCC(O)C(N)C(=O)O Amb18124815 [1,1,0,0,0,0|0,0,0]=2 2824 B9R0.6 CCCC(O)C(O)C(=O)O Amb27772742 [1,1,0,0,0,0|1,0,0]=3 2825 B9R0.6 CCCC(O)C(O)C(C)=O Amb28122464 [1,1,0,0,0,0|2,0,0]=4 2826 B9R0.6 CCCC(O)[C@@H](O)C(=O)O Amb27256644 [1,1,0,0,0,0|1,0,0]=3 2827 B9R0.6 CCCC(O)[C@H](N)C(=O)O Amb26635079 [1,1,0,0,0,0|0,0,0]=2 2828 B9R0.6 CCCC(S)C(N)C(=O)O Amb27860699 [1,1,0,0,0,0|0,0,0]=2 2829 B9R0.6 CCCC(S)[C@@H](N)C(=O)O Amb27759942 [1,1,0,0,0,0|0,0,0]=2 2830 B9R0.6 CCC[C@@H](C)[C@@H](C)C(=O)O Amb27961440 [1,1,0,0,0,0|1,0,0]=3 2831 B9R0.6 CCC[C@@H](N)C(O)C(N)=O Amb33716855 [1,1,0,0,0,0|2,0,0]=4 2832 B9R0.6 CCC[C@@H](N)[C@@H](C)C(=O)O Amb27784849 [1,1,0,0,0,0|1,0,0]=3 2833 B9R0.6 CCC[C@@H](N)[C@@H](O)C(=O)O Amb22747816 [1,1,0,0,0,0|1,0,0]=3 2834 B9R0.6 CCC[C@@H](N)[C@H](O)C(=O)O Amb22747809 [1,1,0,0,0,0|1,0,0]=3 2835 B9R0.6 CCC[C@@H](O)[C@@H](N)C(=O)O Amb25367288 [1,1,0,0,0,0|0,0,0]=2 2836 B9R0.6 CCC[C@@H](O)[C@H](N)C(=O)O Amb24715802 [1,1,0,0,0,0|0,0,0]=2 2837 B9R0.6 CCC[C@H](C)[C@@H](N)C(=O)O Amb27801051 [1,1,0,0,0,0|0,0,0]=2 2838 B9R0.6 CCC[C@H](C)[C@@H](O)C(=O)O Amb28050149 [1,1,0,0,0,0|1,0,0]=3 2839 B9R0.6 CCC[C@H](C)[C@H](N)C(=O)O Amb29838293 [1,1,0,0,0,0|0,0,0]=2 2840 B9R0.6 CCC[C@H](N)C(O)C(=O)O Amb27229636 [1,1,0,0,0,0|1,0,0]=3 2841 B9R0.6 CCC[C@H](N)[C@@H](C)C(=O)O Amb27618082 [1,1,0,0,0,0|1,0,0]=3 2842 B9R0.6 CCC[C@H](N)[C@@H](O)C(=O)O Amb26344900 [1,1,0,0,0,0|1,0,0]=3 2843 B9R0.6 CCC[C@H](N)[C@H](O)C(=O)O Amb25084552 [1,1,0,0,0,0|1,0,0]=3 2844 B9R0.6 CCC[C@H](O)[C@@H](N)C(=O)O Amb26415873 [1,1,0,0,0,0|0,0,0]=2 2845 B9R0.6 CCC[C@H](O)[C@H](N)C(=O)O Amb25113866 [1,1,0,0,0,0|0,0,0]=2 2846 B9R0.6 CCOC(C)C(C)C(=O)O Amb33427356 [1,1,0,0,0,0|2,0,0]=4 2847 B9R0.6 CCOC(C)C(N)C(=O)O Amb25887694 [1,1,0,0,0,0|1,0,0]=3 2848 B9R0.6 CCOC(C)C(N)C(N)=O Amb33037044 [1,1,0,0,0,0|2,0,0]=4 2849 B9R0.6 CCOC(C)C(O)C(=O)O Amb33425709 [1,1,0,0,0,0|2,0,0]=4 2850 B9R0.6 CCOC(C)[C@@H](N)C(=O)O Amb33065865 [1,1,0,0,0,0|1,0,0]=3 2851 B9R0.6 CCOC(C)[C@H](N)C(=O)O Amb33065957 [1,1,0,0,0,0|1,0,0]=3 2852 B9R0.6 CCO[C@H](C)[C@@H](N)C(=O)O Amb22747686 [1,1,0,0,0,0|1,0,0]=3 2853 B9R0.6 CCSC(C)C(C)C(=O)O Amb27753248 [1,1,0,0,0,0|2,0,0]=4 2854 B9R0.6 CCSC(C)C(N)C(=O)O Amb26359481 [1,1,0,0,0,0|1,0,0]=3 2855 B9R0.6 COCC(C)C(C)C(=O)O Amb26369700 [1,1,0,0,0,0|2,0,0]=4 2856 B9R0.6 COCC(C)C(N)C(=O)O Amb24116980 [1,1,0,0,0,0|1,0,0]=3 2857 B9R0.6 COCC(C)C(N)C(N)=O Amb24468545 [1,1,0,0,0,0|2,0,0]=4 2858 B9R0.6 COCC(C)C(O)C(=O)O Amb27596283 [1,1,0,0,0,0|2,0,0]=4 2859 B9R0.6 COCC(C)[C@@H](N)C(=O)O Amb26467489 [1,1,0,0,0,0|1,0,0]=3 2860 B9R0.6 COCC(C)[C@H](N)C(=O)O Amb25729786 [1,1,0,0,0,0|1,0,0]=3 2861 B9R0.6 COCC(O)C(N)C(=O)O Amb25147551 [1,1,0,0,0,0|1,0,0]=3 2862 B9R0.6 CSCC(C)C(N)C(=O)O Amb27161222 [1,1,0,0,0,0|1,0,0]=3 2863 B9R0.6 CSCC(C)[C@H](N)C(=O)O Amb28137881 [1,1,0,0,0,0|1,0,0]=3 2864 B9R0.6 CSCC(O)C(N)C(=O)O Amb18646340 [1,1,0,0,0,0|1,0,0]=3 2865 B9R0.6 CSC[C@@H](C)C(N)C(=O)O Amb27629392 [1,1,0,0,0,0|1,0,0]=3 2866 B9R0.6 CSC[C@H](O)[C@@H](N)C(=O)O Amb28320767 [1,1,0,0,0,0|1,0,0]=3 2867 B9R0.6 C[C@@H](CCCl)[C@H](N)C(=O)O Amb28203940 [1,1,0,0,0,0|1,0,0]=3 2868 B9R0.6 NC(C(=O)O)C(O)CCF Amb33196437 [1,1,0,0,0,0|1,0,0]=3 2869 B9R0.6 NCCC(F)C(N)C(=O)O Amb28204060 [1,1,0,0,0,0|0,0,0]=2 2870 B9R0.6 NCCC(N)C(N)C(=O)O Amb27759858 [1,1,0,0,0,0|0,0,0]=2 2871 B9R0.6 NCC[C@@H](F)[C@H](N)C(=O)O Amb27818085 [1,1,0,0,0,0|0,0,0]=2 2872 B9R0.6 NCC[C@@H](O)[C@H](N)C(=O)O Amb27800764 [1,1,0,0,0,0|0,0,0]=2 2873 B9R0.6 NCC[C@H](O)[C@H](N)C(=O)O Amb27263062 [1,1,0,0,0,0|0,0,0]=2 2874 B9R0.7 C=C(C)CCC(C)C(=O)O Amb25809141 [1,1,0,0,0,0|1,0,1]=4 2875 B9R0.7 C=C(C)CCC(N)C(=O)O Amb28121242 [1,1,0,0,0,0|0,0,1]=3 2876 B9R0.7 C=C(C)CCC(N)C(N)=O Amb27188568 [1,1,0,0,0,0|1,0,1]=4 2877 B9R0.7 C=C(C)CCC(O)C(=O)O Amb27436256 [1,1,0,0,0,0|1,0,1]=4 2878 B9R0.7 C=C(C)CC[C@@H](N)C(=O)O Amb25775219 [1,1,0,0,0,0|0,0,1]=3 2879 B9R0.7 C=C(C)CC[C@H](N)C(=O)O Amb25948355 [1,1,0,0,0,0|0,0,1]=3 2880 B9R0.7 C=C(Cl)CCC(N)C(=O)O Amb27424777 [1,1,0,0,0,0|0,0,2]=4 2881 B9R0.7 CC(=O)C(C)CCC(C)O Amb27823560 [1,1,0,0,0,0|2,0,0]=4 2882 B9R0.7 CC(=O)CCC(N)C(=O)O Amb20669473 [1,1,0,0,0,0|0,0,1]=3 2883 B9R0.7 CC(=O)CCC(N)C(=O)O Amb22157242 [1,1,0,0,0,0|0,0,1]=3 2884 B9R0.7 CC(=O)CCC(N)C(N)=O Amb26649117 [1,1,0,0,0,0|1,0,1]=4 2885 B9R0.7 CC(=O)CC[C@@H](N)C(=O)O Amb26516732 [1,1,0,0,0,0|0,0,1]=3 2886 B9R0.7 CC(=O)CC[C@H](N)C(=O)O Amb25147501 [1,1,0,0,0,0|0,0,1]=3 2887 B9R0.7 CC(=O)NCC(N)C(=O)O Amb26046380 [1,1,0,0,0,0|1,0,1]=4 2888 B9R0.7 CC(=O)OCC(N)C(=O)O Amb17593668 [1,1,0,0,0,0|1,0,1]=4 2889 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O Amb2699176 [1,1,0,0,0,0|1,0,1]=4 2890 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb2778750 [1,1,0,0,0,0|1,0,1]=4 2891 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb33757552 [1,1,0,0,0,0|1,0,1]=4 2892 B9R0.7 CC(=O)SCC(N)C(=O)O Amb22490452 [1,1,0,0,0,0|1,0,1]=4 2893 B9R0.7 CC(C)=CCC(N)C(=O)O Amb6276273 [1,1,0,0,0,0|0,0,2]=4 2894 B9R0.7 CC(C)=CC[C@@H](N)C(=O)O Amb27254062 [1,1,0,0,0,0|0,0,2]=4 2895 B9R0.7 CC(C)=CC[C@H](N)C(=O)O Amb25836895 [1,1,0,0,0,0|0,0,2]=4 2896 B9R0.7 CC(C)CCC(=O)C(=O)O Amb26508699 [1,1,0,0,0,0|1,0,1]=4 2897 B9R0.7 CC(C)CCC(Br)C(=O)O Amb18131059 [1,1,0,0,0,0|1,0,0]=3 2898 B9R0.7 CC(C)CCC(C)C(=O)O Amb19033547 [1,1,0,0,0,0|1,0,0]=3 2899 B9R0.7 CC(C)CCC(F)C(=O)O Amb26612835 [1,1,0,0,0,0|1,0,0]=3 2900 B9R0.7 CC(C)CCC(N)C(=O)Cl Amb27396445 [1,1,0,0,0,0|1,0,0]=3 2901 B9R0.7 CC(C)CCC(N)C(=O)O Amb19269152 [1,1,0,0,0,0|0,0,0]=2 2902 B9R0.7 CC(C)CCC(N)C(=O)O Amb6269218 [1,1,0,0,0,0|0,0,0]=2 2903 B9R0.7 CC(C)CCC(N)C(N)=O Amb27424766 [1,1,0,0,0,0|1,0,0]=3 2904 B9R0.7 CC(C)CCC(O)C(=O)O Amb27788603 [1,1,0,0,0,0|1,0,0]=3 2905 B9R0.7 CC(C)CC[C@@H](C)C(=O)O Amb26983027 [1,1,0,0,0,0|1,0,0]=3 2906 B9R0.7 CC(C)CC[C@@H](Cl)C(=O)Cl Amb27164122 [1,1,0,0,0,0|2,0,0]=4 2907 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb19133196 [1,1,0,0,0,0|0,0,0]=2 2908 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb22899130 [1,1,0,0,0,0|0,0,0]=2 2909 B9R0.7 CC(C)CC[C@@H](O)C(=O)[O-] Amb27218868 [1,1,0,0,0,0|1,0,1]=4 2910 B9R0.7 CC(C)CC[C@H](C)C(=O)O Amb27227250 [1,1,0,0,0,0|1,0,0]=3 2911 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb16183866 [1,1,0,0,0,0|0,0,0]=2 2912 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb33339290 [1,1,0,0,0,0|0,0,0]=2 2913 B9R0.7 CC(C)CC[C@H](N)[C@H](C)O Amb28119956 [1,1,0,0,0,0|1,0,1]=4 2914 B9R0.7 CC(C)CNC(C)C(=O)O Amb9326958 [1,1,0,0,0,0|2,0,0]=4 2915 B9R0.7 CC(C)CN[C@@H](C)C(=O)O Amb27872965 [1,1,0,0,0,0|2,0,0]=4 2916 B9R0.7 CC(C)COC(C)C(=O)O Amb6258223 [1,1,0,0,0,0|2,0,0]=4 2917 B9R0.7 CC(C)COC(F)C(=O)O Amb27825878 [1,1,0,0,0,0|2,0,0]=4 2918 B9R0.7 CC(C)CSC(C)C(=O)O Amb6270237 [1,1,0,0,0,0|2,0,0]=4 2919 B9R0.7 CC(C)NCC(C)C(=O)O Amb9400283 [1,1,0,0,0,0|2,0,0]=4 2920 B9R0.7 CC(C)NCC(N)C(N)=O Amb27812569 [1,1,0,0,0,0|2,0,0]=4 2921 B9R0.7 CC(C)OCC(C)C(=O)O Amb26037515 [1,1,0,0,0,0|2,0,0]=4 2922 B9R0.7 CC(C)OCC(Cl)C(=O)O Amb27770474 [1,1,0,0,0,0|2,0,0]=4 2923 B9R0.7 CC(C)OCC(N)C(=O)O Amb25956723 [1,1,0,0,0,0|1,0,0]=3 2924 B9R0.7 CC(C)OCC(N)C(=O)O Amb32665467 [1,1,0,0,0,0|1,0,0]=3 2925 B9R0.7 CC(C)OCC(N)C(N)=O Amb25104507 [1,1,0,0,0,0|2,0,0]=4 2926 B9R0.7 CC(C)OCC(O)C(=O)O Amb24583914 [1,1,0,0,0,0|2,0,0]=4 2927 B9R0.7 CC(C)OC[C@@H](N)C(=O)O Amb24479342 [1,1,0,0,0,0|1,0,0]=3 2928 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb26960408 [1,1,0,0,0,0|1,0,0]=3 2929 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb32664966 [1,1,0,0,0,0|1,0,0]=3 2930 B9R0.7 CC(C)OC[C@H](N)C(N)=O Amb27184033 [1,1,0,0,0,0|2,0,0]=4 2931 B9R0.7 CC(C)SCC(N)C(=O)O Amb6273927 [1,1,0,0,0,0|1,0,0]=3 2932 B9R0.7 CC(CCC(F)F)C(=O)O Amb32672190 [1,1,0,0,0,0|2,0,0]=4 2933 B9R0.7 CC(CCN(C)C)C(=O)O Amb26502003 [1,1,0,0,0,0|2,0,0]=4 2934 B9R0.7 CC(CCN(C)C)C(=O)O Amb32675008 [1,1,0,0,0,0|2,0,0]=4 2935 B9R0.7 CC(CCS(C)=O)C(=O)O Amb27237254 [1,1,0,0,0,0|2,0,0]=4 2936 B9R0.7 CC(N)CCC(O)C(=O)O Amb28436655 [1,1,0,0,0,0|1,0,0]=3 2937 B9R0.7 CC(NC[C@@H](C)O)C(=O)O Amb27617222 [1,1,0,0,0,0|2,0,0]=4 2938 B9R0.7 CC(NC[C@H](C)O)C(=O)O Amb27248684 [1,1,0,0,0,0|2,0,0]=4 2939 B9R0.7 CC(O)CCC(=O)C(=O)O Amb27799217 [1,1,0,0,0,0|1,0,1]=4 2940 B9R0.7 CC(O)CCC(N)C(=O)O Amb26598749 [1,1,0,0,0,0|0,0,0]=2 2941 B9R0.7 CC(O)CCC(N)C(N)=O Amb33036759 [1,1,0,0,0,0|1,0,0]=3 2942 B9R0.7 CC(O)CC[C@@H](N)C(=O)O Amb28126862 [1,1,0,0,0,0|0,0,0]=2 2943 B9R0.7 CC(O)CC[C@H](N)C(=O)O Amb26346481 [1,1,0,0,0,0|0,0,0]=2 2944 B9R0.7 CC(O)CNC(C)C(=O)O Amb18523859 [1,1,0,0,0,0|2,0,0]=4 2945 B9R0.7 CC(O)CN[C@H](C)C(=O)O Amb28246243 [1,1,0,0,0,0|2,0,0]=4 2946 B9R0.7 CC(O)CO[C@@H](C)C(=O)O Amb27273395 [1,1,0,0,0,0|2,0,0]=4 2947 B9R0.7 CC(O)NC[C@H](N)C(=O)O Amb24575047 [1,1,0,0,0,0|1,0,0]=3 2948 B9R0.7 CC(O)OC[C@@H](N)C(=O)O Amb28348403 [1,1,0,0,0,0|1,0,0]=3 2949 B9R0.7 CN(C)CCC(F)C(=O)O Amb27959150 [1,1,0,0,0,0|2,0,0]=4 2950 B9R0.7 CN(C)CCC(N)C(=O)O Amb32661000 [1,1,0,0,0,0|1,0,0]=3 2951 B9R0.7 CN(C)CCC(N)C(=O)O Amb6259376 [1,1,0,0,0,0|1,0,0]=3 2952 B9R0.7 CN(C)CCC(N)C(N)=O Amb19036813 [1,1,0,0,0,0|2,0,0]=4 2953 B9R0.7 CN(C)CCC(O)C(=O)O Amb26847402 [1,1,0,0,0,0|2,0,0]=4 2954 B9R0.7 CN(C)CC[C@@H](N)C(=O)O Amb26453522 [1,1,0,0,0,0|1,0,0]=3 2955 B9R0.7 CN(C)CC[C@H](N)C(=O)O Amb25108550 [1,1,0,0,0,0|1,0,0]=3 2956 B9R0.7 CN(C)CC[C@H](N)C(N)=O Amb28364893 [1,1,0,0,0,0|2,0,0]=4 2957 B9R0.7 CN(C)NCC(N)C(=O)O Amb28045970 [1,1,0,0,0,0|2,0,0]=4 2958 B9R0.7 CN(O)CC[C@H](N)C(=O)O Amb27640254 [1,1,0,0,0,0|1,0,0]=3 2959 B9R0.7 CS(=N)CCC(N)C(=O)O Amb25243030 [1,1,0,0,0,0|1,0,0]=3 2960 B9R0.7 CS(=O)CCC(N)C(=O)O Amb6336322 [1,1,0,0,0,0|1,0,0]=3 2961 B9R0.7 CS(=O)CCC(N)C(N)=O Amb25869966 [1,1,0,0,0,0|2,0,0]=4 2962 B9R0.7 CS(=O)CCC(O)C(=O)O Amb28118981 [1,1,0,0,0,0|2,0,0]=4 2963 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O Amb19133021 [1,1,0,0,0,0|1,0,0]=3 2964 B9R0.7 CS(=O)CC[C@H](N)C(=O)O Amb6600089 [1,1,0,0,0,0|1,0,0]=3 2965 B9R0.7 CS(=O)NCC(N)C(=O)O Amb28122995 [1,1,0,0,0,0|2,0,0]=4 2966 B9R0.7 C[C@@H](N)CC[C@@H](O)C(=O)O Amb27815031 [1,1,0,0,0,0|1,0,0]=3 2967 B9R0.7 C[C@@H](N)CN[C@H](C)C(=O)O Amb27646700 [1,1,0,0,0,0|2,0,0]=4 2968 B9R0.7 C[C@H](N)CN[C@H](C)C(=O)O Amb27445282 [1,1,0,0,0,0|2,0,0]=4 2969 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4006595 [1,1,0,0,0,0|1,0,0]=3 2970 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4006626 [1,1,0,0,0,0|1,0,0]=3 2971 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4007490 [1,1,0,0,0,0|1,0,0]=3 2972 B9R0.7 C[S+](C)CCC(O)C(=O)O Amb33482959 [1,1,0,0,0,0|2,0,0]=4 2973 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O Amb35781977 [1,1,0,0,0,0|1,0,0]=3 2974 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O Amb6336613 [1,1,0,0,0,0|1,0,0]=3 2975 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O Amb10601599 [1,1,0,0,0,0|1,0,0]=3 2976 B9R0.7 C[SH](C)CC[C@H](N)C(=O)O Amb24440849 [1,1,0,0,0,0|1,0,0]=3 2977 B9R0.7 C\C(F)=C/C[C@H](N)C(=O)O Amb27205690 [1,1,0,0,0,0|0,0,2]=4 2978 B9R0.7 N=C(N)CCC(N)C(=O)O Amb28185146 [1,1,0,0,0,0|0,0,1]=3 2979 B9R0.7 N=C(N)NCC(N)C(=O)O Amb22169574 [1,1,0,0,0,0|1,0,1]=4 2980 B9R0.7 N=C(N)NCC(N)C(=O)O Amb9871390 [1,1,0,0,0,0|1,0,1]=4 2981 B9R0.7 N=C(N)NC[C@@H](N)C(=O)O Amb28058768 [1,1,0,0,0,0|1,0,1]=4 2982 B9R0.7 N=C(N)NC[C@@H](N)C(=O)O Amb31292962 [1,1,0,0,0,0|1,0,1]=4 2983 B9R0.7 N=C(N)NC[C@H](N)C(=O)O Amb27230623 [1,1,0,0,0,0|1,0,1]=4 2984 B9R0.7 NC(=O)CCC(Br)C(=O)O Amb27828829 [1,1,0,0,0,0|1,0,1]=4 2985 B9R0.7 NC(=O)CCC(N)C(=O)Cl Amb27793490 [1,1,0,0,0,0|1,0,1]=4 2986 B9R0.7 NC(=O)CCC(N)C(=O)O Amb9702792 [1,1,0,0,0,0|0,0,1]=3 2987 B9R0.7 NC(=O)CCC(N)C(N)=O Amb27175153 [1,1,0,0,0,0|1,0,1]=4 2988 B9R0.7 NC(=O)CC[C@@H](Br)C(=O)O Amb28049993 [1,1,0,0,0,0|1,0,1]=4 2989 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O Amb2688618 [1,1,0,0,0,0|0,0,1]=3 2990 B9R0.7 NC(=O)CC[C@@H](N)C(N)=O Amb22748708 [1,1,0,0,0,0|1,0,1]=4 2991 B9R0.7 NC(=O)CC[C@@H](N)C(N)=O Amb25996678 [1,1,0,0,0,0|1,0,1]=4 2992 B9R0.7 NC(=O)CC[C@H](N)C(=O)O Amb6600045 [1,1,0,0,0,0|0,0,1]=3 2993 B9R0.7 NC(=O)CC[C@H](N)C(N)=O Amb24426852 [1,1,0,0,0,0|1,0,1]=4 2994 B9R0.7 NC(=O)CC[C@H](N)C(N)=O Amb33774694 [1,1,0,0,0,0|1,0,1]=4 2995 B9R0.7 NC(=O)NCC(N)C(=O)O Amb4037018 [1,1,0,0,0,0|1,0,1]=4 2996 B9R0.7 NC(=O)NC[C@@H](N)C(=O)O Amb10068479 [1,1,0,0,0,0|1,0,1]=4 2997 B9R0.7 NC(=O)NC[C@H](N)C(=O)O Amb6298794 [1,1,0,0,0,0|1,0,1]=4 2998 B9R0.7 NC(=O)OCC(N)C(=O)O Amb26968173 [1,1,0,0,0,0|1,0,1]=4 2999 B9R0.7 NC(=O)OC[C@H](N)C(=O)O Amb28126945 [1,1,0,0,0,0|1,0,1]=4 3000 B9R0.7 NC(=O)SCC(N)C(=O)O Amb3993051 [1,1,0,0,0,0|1,0,1]=4 3001 B9R0.7 NC(=O)SC[C@@H](N)C(=O)O Amb10072293 [1,1,0,0,0,0|1,0,1]=4 3002 B9R0.7 NC(=O)SC[C@H](N)C(=O)O Amb22735296 [1,1,0,0,0,0|1,0,1]=4 3003 B9R0.7 NC(=S)CCC(N)C(=O)O Amb27448533 [1,1,0,0,0,0|0,0,1]=3 3004 B9R0.7 NC(=S)CC[C@H](N)C(=O)O Amb27640783 [1,1,0,0,0,0|0,0,1]=3 3005 B9R0.7 NC(CCB(O)O)C(=O)O Amb22497480 [1,1,0,0,0,0|2,0,0]=4 3006 B9R0.7 NC(CCC(=O)Cl)C(=O)O Amb27816376 [1,1,0,0,0,0|1,0,1]=4 3007 B9R0.7 NC(CCC(=O)O)C(=O)O Amb8395158 [1,1,0,0,0,0|1,0,1]=4 3008 B9R0.7 NC(CCC(=O)O)C(=O)O Amb9703098 [1,1,0,0,0,0|1,0,1]=4 3009 B9R0.7 NC(CC[N+](=O)[O-])C(=O)O Amb27221965 [1,1,0,0,0,0|2,0,0]=4 3010 B9R0.7 NC(COC(F)F)C(=O)O Amb27849786 [1,1,0,0,0,0|2,0,0]=4 3011 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb34915082 [1,1,0,0,0,0|1,0,1]=4 3012 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb3940322 [1,1,0,0,0,0|1,0,1]=4 3013 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb8513626 [1,1,0,0,0,0|1,0,1]=4 3014 B9R0.7 N[C@@H](CCC(O)=S)C(=O)O Amb24480492 [1,1,0,0,0,0|1,0,1]=4 3015 B9R0.7 N[C@@H](CCS(=O)O)C(=O)O Amb25972325 [1,1,0,0,0,0|2,0,0]=4 3016 B9R0.7 N[C@@H](CC[PH](=O)O)C(=O)O Amb22904307 [1,1,0,0,0,0|2,0,0]=4 3017 B9R0.7 N[C@H](CCC(=O)O)C(=O)O Amb2720565 [1,1,0,0,0,0|1,0,1]=4 3018 B9R0.7 N[C@H](COC(F)F)C(=O)O Amb27637675 [1,1,0,0,0,0|2,0,0]=4 3019 B9R0.7 N[C@H](CSC(F)F)C(=O)O Amb28290955 [1,1,0,0,0,0|2,0,0]=4 3020 B9R0.13 C=C(C)C(CCCC)NC Amb28319659 [1,1,0,0,0,0|2,0,0]=4 3021 B9R0.13 C=C=C(CCCC)C(=O)O Amb27489813 [1,1,0,0,0,0|1,0,1]=4 3022 B9R0.13 C=CC(CCCC)C(=O)O Amb27759693 [1,1,0,0,0,0|1,0,0]=3 3023 B9R0.13 C=CC(CCCCl)C(=O)O Amb28072929 [1,1,0,0,0,0|2,0,0]=4 3024 B9R0.13 C=CC(NCCC)C(=O)O Amb28454234 [1,1,0,0,0,0|2,0,0]=4 3025 B9R0.13 C=CC(NCCN)C(=O)O Amb27197767 [1,1,0,0,0,0|2,0,0]=4 3026 B9R0.13 C=CC(SCCC)C(=O)O Amb27207894 [1,1,0,0,0,0|2,0,0]=4 3027 B9R0.13 C=C[C@@H](CCCC)C(=O)O Amb28050245 [1,1,0,0,0,0|1,0,0]=3 3028 B9R0.13 C=C[C@H](CCCC)C(=O)O Amb27838910 [1,1,0,0,0,0|1,0,0]=3 3029 B9R0.13 CCC(CCOC)C(=O)O Amb25289946 [1,1,0,0,0,0|2,0,0]=4 3030 B9R0.13 CCC(CCSC)C(=O)O Amb24373794 [1,1,0,0,0,0|2,0,0]=4 3031 B9R0.13 CCC(NCCN)C(=O)O Amb28061779 [1,1,0,0,0,0|2,0,0]=4 3032 B9R0.13 CCC(OCCN)C(=O)O Amb18111197 [1,1,0,0,0,0|2,0,0]=4 3033 B9R0.13 CCC(SCCN)C(=O)O Amb18788222 [1,1,0,0,0,0|2,0,0]=4 3034 B9R0.13 CCCCC(C#N)C(=O)O Amb27202774 [1,1,0,0,0,0|0,0,1]=3 3035 B9R0.13 CCCCC(C#N)C(C)=O Amb24647883 [1,1,0,0,0,0|1,0,1]=4 3036 B9R0.13 CCCCC(C#N)C(N)=O Amb27403940 [1,1,0,0,0,0|1,0,1]=4 3037 B9R0.13 CCCCC(CBr)C(=O)O Amb27799965 [1,1,0,0,0,0|1,0,0]=3 3038 B9R0.13 CCCCC(CC)C(=O)Cl Amb3939067 [1,1,0,0,0,0|2,0,0]=4 3039 B9R0.13 CCCCC(CC)C(=O)O Amb3939821 [1,1,0,0,0,0|1,0,0]=3 3040 B9R0.13 CCCCC(CC)C(=O)[O-] Amb22043361 [1,1,0,0,0,0|1,0,1]=4 3041 B9R0.13 CCCCC(CC)C(=O)[O-] Amb22053863 [1,1,0,0,0,0|1,0,1]=4 3042 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8387188 [1,1,0,0,0,0|1,0,1]=4 3043 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8387190 [1,1,0,0,0,0|1,0,1]=4 3044 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8515519 [1,1,0,0,0,0|1,0,1]=4 3045 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8516528 [1,1,0,0,0,0|1,0,1]=4 3046 B9R0.13 CCCCC(CC)C(N)=O Amb3886579 [1,1,0,0,0,0|2,0,0]=4 3047 B9R0.13 CCCCC(CN)C(=O)O Amb26978768 [1,1,0,0,0,0|0,0,0]=2 3048 B9R0.13 CCCCC(CO)C(=O)O Amb27834958 [1,1,0,0,0,0|1,0,0]=3 3049 B9R0.13 CCCCC(NC)C(=O)O Amb24116642 [1,1,0,0,0,0|0,0,0]=2 3050 B9R0.13 CCCCC(NC)C(N)=O Amb24116641 [1,1,0,0,0,0|1,0,0]=3 3051 B9R0.13 CCCCC(NCl)C(=O)O Amb27863591 [1,1,0,0,0,0|0,0,0]=2 3052 B9R0.13 CCCCC(NN)C(=O)O Amb18644274 [1,1,0,0,0,0|0,0,0]=2 3053 B9R0.13 CCCCC(NO)C(=O)O Amb27619251 [1,1,0,0,0,0|0,0,0]=2 3054 B9R0.13 CCCCC(OC)C(=O)O Amb25889001 [1,1,0,0,0,0|1,0,0]=3 3055 B9R0.13 CCCCC(OC)C(C)=O Amb27465061 [1,1,0,0,0,0|2,0,0]=4 3056 B9R0.13 CCCC[C@@H](CC)C(=O)O Amb28398235 [1,1,0,0,0,0|1,0,0]=3 3057 B9R0.13 CCCC[C@@H](CC)C(C)=O Amb27973070 [1,1,0,0,0,0|2,0,0]=4 3058 B9R0.13 CCCC[C@@H](CN)C(=O)O Amb27812140 [1,1,0,0,0,0|0,0,0]=2 3059 B9R0.13 CCCC[C@@H](NC)C(=O)O Amb22799980 [1,1,0,0,0,0|0,0,0]=2 3060 B9R0.13 CCCC[C@@H](NO)C(=O)O Amb27162541 [1,1,0,0,0,0|0,0,0]=2 3061 B9R0.13 CCCC[C@H](CC)C(=O)O Amb24671282 [1,1,0,0,0,0|1,0,0]=3 3062 B9R0.13 CCCC[C@H](CO)C(=O)O Amb16232529 [1,1,0,0,0,0|1,0,0]=3 3063 B9R0.13 CCCC[C@H](NC)C(=O)O Amb25887554 [1,1,0,0,0,0|0,0,0]=2 3064 B9R0.13 CCCC[C@H](NC)C(N)=O Amb27264530 [1,1,0,0,0,0|1,0,0]=3 3065 B9R0.13 CCCC\C(=N/O)C(=O)O Amb28347572 [1,1,0,0,0,0|0,0,2]=4 3066 B9R0.13 CCCN[C@@H](CS)C(=O)O Amb27645159 [1,1,0,0,0,0|2,0,0]=4 3067 B9R0.13 CCCN[C@H](CO)C(=O)O Amb28125350 [1,1,0,0,0,0|2,0,0]=4 3068 B9R0.13 CCCOC(CC)C(=O)O Amb9675479 [1,1,0,0,0,0|2,0,0]=4 3069 B9R0.13 CCCSC(CC)C(=O)O Amb9675504 [1,1,0,0,0,0|2,0,0]=4 3070 B9R0.13 CCCSC(CN)C(=O)O Amb27233967 [1,1,0,0,0,0|1,0,0]=3 3071 B9R0.13 CCCSC(CO)C(=O)O Amb27629095 [1,1,0,0,0,0|2,0,0]=4 3072 B9R0.13 CCOC[C@H](NC)C(=O)O Amb33347475 [1,1,0,0,0,0|1,0,0]=3 3073 B9R0.13 CCSCC(CC)C(=O)O Amb24482439 [1,1,0,0,0,0|2,0,0]=4 3074 B9R0.13 CCSCC(CN)C(=O)O Amb33324076 [1,1,0,0,0,0|1,0,0]=3 3075 B9R0.13 CC\C=C\C(CN)C(=O)O Amb33268709 [1,1,0,0,0,0|0,0,2]=4 3076 B9R0.13 CNC(CCCN)C(=O)O Amb18644280 [1,1,0,0,0,0|0,0,0]=2 3077 B9R0.13 CNC(CCSC)C(=O)O Amb18792506 [1,1,0,0,0,0|1,0,0]=3 3078 B9R0.13 CNC(CCSC)C(N)=O Amb18792442 [1,1,0,0,0,0|2,0,0]=4 3079 B9R0.13 CN[C@@H](CCOC)C(N)=O Amb27175032 [1,1,0,0,0,0|2,0,0]=4 3080 B9R0.13 CN[C@@H](CCSC)C(=O)O Amb26844419 [1,1,0,0,0,0|1,0,0]=3 3081 B9R0.13 CN[C@H](CCCN)C(=O)O Amb28060751 [1,1,0,0,0,0|0,0,0]=2 3082 B9R0.13 CN[C@H](CCSC)C(=O)O Amb27974159 [1,1,0,0,0,0|1,0,0]=3 3083 B9R0.13 COC(CCCF)C(=O)O Amb33196102 [1,1,0,0,0,0|2,0,0]=4 3084 B9R0.13 COC(CCSC)C(=O)O Amb28288804 [1,1,0,0,0,0|2,0,0]=4 3085 B9R0.13 COCCC(CN)C(=O)O Amb24697893 [1,1,0,0,0,0|1,0,0]=3 3086 B9R0.13 COCCC(OC)C(=O)O Amb33428673 [1,1,0,0,0,0|2,0,0]=4 3087 B9R0.13 CSCCC(CN)C(=O)O Amb24618199 [1,1,0,0,0,0|1,0,0]=3 3088 B9R0.13 CSCCC(NCl)C(=O)O Amb27635192 [1,1,0,0,0,0|1,0,0]=3 3089 B9R0.13 CSCCC(NF)C(=O)O Amb27233599 [1,1,0,0,0,0|1,0,0]=3 3090 B9R0.13 CSCC[C@@H](CN)C(=O)O Amb28458297 [1,1,0,0,0,0|1,0,0]=3 3091 B9R0.13 NCC(NCCF)C(=O)O Amb27246937 [1,1,0,0,0,0|2,0,0]=4 3092 B9R0.13 NCC(SCCO)C(=O)O Amb27233935 [1,1,0,0,0,0|2,0,0]=4 3093 B9R0.13 NCCCC(CS)C(=O)O Amb28458435 [1,1,0,0,0,0|1,0,0]=3 3094 B9R0.13 NCCC[C@@H](NN)C(=O)O Amb27768758 [1,1,0,0,0,0|0,0,0]=2 3095 B9R0.13 NCCNC(CN)C(=O)O Amb28454232 [1,1,0,0,0,0|1,0,0]=3 3096 B9R0.13 NCCN[C@@H](CS)C(=O)O Amb27407766 [1,1,0,0,0,0|2,0,0]=4 3097 B9R0.42 C#C[C@@H](O)C[C@@H](N)C(=O)O Amb28321822 [1,1,0,0,0,0|0,0,2]=4 3098 B9R0.42 C=C(C)C(N)CC(C)CC Amb28064517 [1,1,0,0,0,0|2,0,0]=4 3099 B9R0.42 C=C(CC(C)CC)C(=O)O Amb27794839 [1,1,0,0,0,0|1,0,1]=4 3100 B9R0.42 C=C(CC(O)CC)C(=O)O Amb27427164 [1,1,0,0,0,0|1,0,1]=4 3101 B9R0.42 C=C(CC)CC(N)C(=O)O Amb28064280 [1,1,0,0,0,0|0,0,1]=3 3102 B9R0.42 C=C(CC)CC(N)C(N)=O Amb24429018 [1,1,0,0,0,0|1,0,1]=4 3103 B9R0.42 C=C(CC)C[C@@H](N)C(=O)O Amb26340266 [1,1,0,0,0,0|0,0,1]=3 3104 B9R0.42 C=C(CC)C[C@H](N)C(=O)O Amb25694434 [1,1,0,0,0,0|0,0,1]=3 3105 B9R0.42 CC(C#N)CC(N)C(=O)O Amb25262927 [1,1,0,0,0,0|0,0,2]=4 3106 B9R0.42 CC(C#N)C[C@@H](N)C(=O)O Amb33127539 [1,1,0,0,0,0|0,0,2]=4 3107 B9R0.42 CC(C#N)C[C@H](N)C(=O)O Amb33036873 [1,1,0,0,0,0|0,0,2]=4 3108 B9R0.42 CC(CF)CC(N)C(=O)O Amb27838056 [1,1,0,0,0,0|1,0,0]=3 3109 B9R0.42 CC(CO)CC(C)C(=O)O Amb27838009 [1,1,0,0,0,0|2,0,0]=4 3110 B9R0.42 CC(CO)CC(N)C(=O)O Amb25147300 [1,1,0,0,0,0|1,0,0]=3 3111 B9R0.42 CC(CO)CC(N)C(N)=O Amb32787927 [1,1,0,0,0,0|2,0,0]=4 3112 B9R0.42 CC(CO)C[C@@H](N)C(=O)O Amb33036727 [1,1,0,0,0,0|1,0,0]=3 3113 B9R0.42 CC(CO)C[C@H](N)C(=O)O Amb32865934 [1,1,0,0,0,0|1,0,0]=3 3114 B9R0.42 CC(C[C@H](N)CS)C(=O)O Amb27981242 [1,1,0,0,0,0|2,0,0]=4 3115 B9R0.42 CCC(=O)CC(N)C(=O)O Amb22546324 [1,1,0,0,0,0|0,0,1]=3 3116 B9R0.42 CCC(=O)CC(N)C(=O)O Amb24479073 [1,1,0,0,0,0|0,0,1]=3 3117 B9R0.42 CCC(=O)CC(N)C(N)=O Amb25129863 [1,1,0,0,0,0|1,0,1]=4 3118 B9R0.42 CCC(=O)CC(O)C(=O)O Amb27655574 [1,1,0,0,0,0|1,0,1]=4 3119 B9R0.42 CCC(=O)C[C@@H](N)C(=O)O Amb26061186 [1,1,0,0,0,0|0,0,1]=3 3120 B9R0.42 CCC(=O)C[C@H](N)C(=O)O Amb24479266 [1,1,0,0,0,0|0,0,1]=3 3121 B9R0.42 CCC(C)CC(=O)C(=O)O Amb27600368 [1,1,0,0,0,0|1,0,1]=4 3122 B9R0.42 CCC(C)CC(Br)C(C)=O Amb27224857 [1,1,0,0,0,0|2,0,0]=4 3123 B9R0.42 CCC(C)CC(C)C(=O)O Amb22228338 [1,1,0,0,0,0|1,0,0]=3 3124 B9R0.42 CCC(C)CC(Cl)C(=O)O Amb28050903 [1,1,0,0,0,0|1,0,0]=3 3125 B9R0.42 CCC(C)CC(Cl)C(N)=O Amb27669368 [1,1,0,0,0,0|2,0,0]=4 3126 B9R0.42 CCC(C)CC(N)C(=O)O Amb18313985 [1,1,0,0,0,0|0,0,0]=2 3127 B9R0.42 CCC(C)CC(N)C(=O)O Amb20667726 [1,1,0,0,0,0|0,0,0]=2 3128 B9R0.42 CCC(C)CC(N)C(N)=O Amb26989566 [1,1,0,0,0,0|1,0,0]=3 3129 B9R0.42 CCC(C)CC(O)C(=O)O Amb25849308 [1,1,0,0,0,0|1,0,0]=3 3130 B9R0.42 CCC(C)CC(S)C(=O)O Amb18798152 [1,1,0,0,0,0|1,0,0]=3 3131 B9R0.42 CCC(C)C[C@@H](C)C(=O)O Amb33727258 [1,1,0,0,0,0|1,0,0]=3 3132 B9R0.42 CCC(C)C[C@@H](N)C(=O)O Amb25127143 [1,1,0,0,0,0|0,0,0]=2 3133 B9R0.42 CCC(C)C[C@H](C)C(=O)O Amb33743264 [1,1,0,0,0,0|1,0,0]=3 3134 B9R0.42 CCC(C)C[C@H](N)C(=O)O Amb27471067 [1,1,0,0,0,0|0,0,0]=2 3135 B9R0.42 CCC(C)C[C@H](N)C(N)=O Amb27429524 [1,1,0,0,0,0|1,0,0]=3 3136 B9R0.42 CCC(C)N[C@@H](C)C(=O)O Amb25691180 [1,1,0,0,0,0|2,0,0]=4 3137 B9R0.42 CCC(C)O[C@@H](C)C(=O)O Amb27395318 [1,1,0,0,0,0|2,0,0]=4 3138 B9R0.42 CCC(C)O[C@H](C)C(=O)O Amb27495202 [1,1,0,0,0,0|2,0,0]=4 3139 B9R0.42 CCC(C)SC(F)C(=O)O Amb27272834 [1,1,0,0,0,0|2,0,0]=4 3140 B9R0.42 CCC(N)CC(N)C(=O)O Amb27205091 [1,1,0,0,0,0|0,0,0]=2 3141 B9R0.42 CCC(O)CC(C)C(=O)O Amb28348984 [1,1,0,0,0,0|1,0,0]=3 3142 B9R0.42 CCC(O)CC(Cl)C(=O)O Amb28244776 [1,1,0,0,0,0|1,0,0]=3 3143 B9R0.42 CCC(O)CC(N)C(=O)O Amb24117068 [1,1,0,0,0,0|0,0,0]=2 3144 B9R0.42 CCC(O)CC(N)C(N)=O Amb33308821 [1,1,0,0,0,0|1,0,0]=3 3145 B9R0.42 CCC(O)CC(O)C(=O)O Amb28050169 [1,1,0,0,0,0|1,0,0]=3 3146 B9R0.42 CCC(O)C[C@@H](N)C(=O)O Amb33065603 [1,1,0,0,0,0|0,0,0]=2 3147 B9R0.42 CCC(O)C[C@H](N)C(=O)O Amb24759913 [1,1,0,0,0,0|0,0,0]=2 3148 B9R0.42 CCN(C)CC(C)C(=O)O Amb8428202 [1,1,0,0,0,0|2,0,0]=4 3149 B9R0.42 CCN(C)CC(C)C(=O)O Amb9173364 [1,1,0,0,0,0|2,0,0]=4 3150 B9R0.42 CCN(C)CC(N)C(=O)O Amb27478110 [1,1,0,0,0,0|1,0,0]=3 3151 B9R0.42 CCN(C)CC(N)C(N)=O Amb27768725 [1,1,0,0,0,0|2,0,0]=4 3152 B9R0.42 CCS(=O)CC(C)C(=O)O Amb19012076 [1,1,0,0,0,0|2,0,0]=4 3153 B9R0.42 CCS(=O)CC(O)C(=O)O Amb28342085 [1,1,0,0,0,0|2,0,0]=4 3154 B9R0.42 CCS(=O)C[C@H](N)C(=O)O Amb28118843 [1,1,0,0,0,0|1,0,0]=3 3155 B9R0.42 CC[C@@H](C)C[C@@H](C)C(=O)O Amb28248596 [1,1,0,0,0,0|1,0,0]=3 3156 B9R0.42 CC[C@@H](C)C[C@H](O)C(=O)O Amb27770344 [1,1,0,0,0,0|1,0,0]=3 3157 B9R0.42 CC[C@H](C)CC(=O)C(=O)O Amb27473360 [1,1,0,0,0,0|1,0,1]=4 3158 B9R0.42 CC[C@H](C)CC(C)C(=O)O Amb27770364 [1,1,0,0,0,0|1,0,0]=3 3159 B9R0.42 CC[C@H](C)CC(N)C(=O)O Amb28364291 [1,1,0,0,0,0|0,0,0]=2 3160 B9R0.42 CC[C@H](C)C[C@H](C)C(=O)O Amb27472997 [1,1,0,0,0,0|1,0,0]=3 3161 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb25662528 [1,1,0,0,0,0|0,0,0]=2 3162 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb33620552 [1,1,0,0,0,0|0,0,0]=2 3163 B9R0.42 CNC(=O)CC(N)C(=O)O Amb27839034 [1,1,0,0,0,0|1,0,1]=4 3164 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O Amb20240891 [1,1,0,0,0,0|1,0,1]=4 3165 B9R0.42 COC(=O)CC(N)C(=O)O Amb22489498 [1,1,0,0,0,0|1,0,1]=4 3166 B9R0.42 COC(=O)CC(N)C(=O)O Amb7172558 [1,1,0,0,0,0|1,0,1]=4 3167 B9R0.42 COC(=O)CC(N)C(=O)O Amb8390391 [1,1,0,0,0,0|1,0,1]=4 3168 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb22745861 [1,1,0,0,0,0|1,0,1]=4 3169 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb8385327 [1,1,0,0,0,0|1,0,1]=4 3170 B9R0.42 COC(=O)C[C@H](N)C(=O)O Amb8629121 [1,1,0,0,0,0|1,0,1]=4 3171 B9R0.42 COC(C)CC(N)C(=O)O Amb25147752 [1,1,0,0,0,0|1,0,0]=3 3172 B9R0.42 COC(C)CC(N)C(N)=O Amb25349298 [1,1,0,0,0,0|2,0,0]=4 3173 B9R0.42 COC(C)CC(O)C(=O)O Amb33353368 [1,1,0,0,0,0|2,0,0]=4 3174 B9R0.42 COC(C)C[C@@H](N)C(=O)O Amb24412403 [1,1,0,0,0,0|1,0,0]=3 3175 B9R0.42 COC(C)C[C@H](N)C(=O)O Amb27801695 [1,1,0,0,0,0|1,0,0]=3 3176 B9R0.42 CSC(C)C[C@H](N)C(=O)O Amb28208334 [1,1,0,0,0,0|1,0,0]=3 3177 B9R0.42 CS[C@@H](C)C[C@@H](N)C(=O)O Amb27755570 [1,1,0,0,0,0|1,0,0]=3 3178 B9R0.42 C[C@@H](CO)C[C@@H](N)C(=O)O Amb27398331 [1,1,0,0,0,0|1,0,0]=3 3179 B9R0.42 C[C@@H](C[C@@H](O)CN)C(=O)O Amb27768864 [1,1,0,0,0,0|1,0,0]=3 3180 B9R0.42 C[C@H](CO)C[C@H](N)C(=O)O Amb27625117 [1,1,0,0,0,0|1,0,0]=3 3181 B9R0.42 C[C@H](C[C@@H](O)CN)C(=O)O Amb27169198 [1,1,0,0,0,0|1,0,0]=3 3182 B9R0.42 C\C=C(/C)C[C@H](N)C(=O)O Amb27827659 [1,1,0,0,0,0|0,0,2]=4 3183 B9R0.42 NC(=O)C(N)CC(O)CF Amb33308795 [1,1,0,0,0,0|2,0,0]=4 3184 B9R0.42 NC(=O)C(N)CC(O)CO Amb33066193 [1,1,0,0,0,0|2,0,0]=4 3185 B9R0.42 NC(CC(=O)CI)C(=O)O Amb27803464 [1,1,0,0,0,0|1,0,1]=4 3186 B9R0.42 NC(CC(=O)CO)C(=O)O Amb18644310 [1,1,0,0,0,0|1,0,1]=4 3187 B9R0.42 NC(CC(F)CO)C(=O)O Amb27632459 [1,1,0,0,0,0|1,0,0]=3 3188 B9R0.42 NC(CC(O)C=O)C(=O)O Amb28126784 [1,1,0,0,0,0|1,0,1]=4 3189 B9R0.42 NC(CC(O)CF)C(=O)O Amb33065776 [1,1,0,0,0,0|1,0,0]=3 3190 B9R0.42 NC(CC(O)CO)C(=O)O Amb18644388 [1,1,0,0,0,0|1,0,0]=3 3191 B9R0.42 NC(CC(O)CO)C(=O)O Amb24117285 [1,1,0,0,0,0|1,0,0]=3 3192 B9R0.42 NCC(F)C[C@H](N)C(=O)O Amb28126719 [1,1,0,0,0,0|0,0,0]=2 3193 B9R0.42 NCC(O)CC(N)C(=O)O Amb30988061 [1,1,0,0,0,0|0,0,0]=2 3194 B9R0.42 NCC(O)CC(O)C(=O)O Amb27170737 [1,1,0,0,0,0|1,0,0]=3 3195 B9R0.42 NC[C@H](O)CC(O)C(=O)O Amb27590744 [1,1,0,0,0,0|1,0,0]=3 3196 B9R0.42 NNC(=O)C[C@H](N)C(=O)O Amb24680907 [1,1,0,0,0,0|1,0,1]=4 3197 B9R0.42 N[C@@H](CC(=O)CCl)C(=O)O Amb27168692 [1,1,0,0,0,0|1,0,1]=4 3198 B9R0.42 N[C@@H](CC(=O)CI)C(=O)O Amb27248631 [1,1,0,0,0,0|1,0,1]=4 3199 B9R0.42 N[C@@H](CC(=O)CO)C(=O)O Amb28050099 [1,1,0,0,0,0|1,0,1]=4 3200 B9R0.42 N[C@@H](CC(O)CCl)C(=O)O Amb27837835 [1,1,0,0,0,0|1,0,0]=3 3201 B9R0.42 N[C@@H](CC(O)CF)C(=O)O Amb33036578 [1,1,0,0,0,0|1,0,0]=3 3202 B9R0.42 N[C@@H](CC(O)CO)C(=O)O Amb25870815 [1,1,0,0,0,0|1,0,0]=3 3203 B9R0.42 N[C@H](CC(O)CF)C(=O)O Amb32796094 [1,1,0,0,0,0|1,0,0]=3 3204 B9R0.42 N[C@H](CC(O)CO)C(=O)O Amb33036156 [1,1,0,0,0,0|1,0,0]=3 3205 B9R0.42 N\C=C(/N)CC(N)C(=O)O Amb28250396 [1,1,0,0,0,0|0,0,2]=4 3206 B9R0.42 O=C(O)C(Br)CC(Br)CCl Amb28315583 [1,1,0,0,0,0|2,0,0]=4 3207 B9R0.42 O=C(O)C(O)C[C@H](O)CO Amb27984868 [1,1,0,0,0,0|2,0,0]=4 3208 B9R0.51 C=CCCC(C)(N)C(=O)O Amb24524526 [1,1,0,0,0,0|0,0,2]=4 3209 B9R0.51 C=CCC[C@](C)(N)C(=O)O Amb24478852 [1,1,0,0,0,0|0,0,2]=4 3210 B9R0.51 CC(C)(CCCCl)C(=O)O Amb27601953 [1,1,0,0,0,0|2,0,0]=4 3211 B9R0.51 CC(C)(CCCF)C(=O)O Amb28049560 [1,1,0,0,0,0|2,0,0]=4 3212 B9R0.51 CC(C)(CCCN)C(=O)O Amb26855022 [1,1,0,0,0,0|1,0,0]=3 3213 B9R0.51 CC(C)(CCCN)C(=O)O Amb27601033 [1,1,0,0,0,0|1,0,0]=3 3214 B9R0.51 CC(C)(CCCO)C(=O)O Amb28410873 [1,1,0,0,0,0|2,0,0]=4 3215 B9R0.51 CC(C)(CCON)C(=O)O Amb28254746 [1,1,0,0,0,0|2,0,0]=4 3216 B9R0.51 CC(C)(OCCN)C(=O)O Amb18110232 [1,1,0,0,0,0|2,0,0]=4 3217 B9R0.51 CC(C)(SCCN)C(=O)O Amb17500467 [1,1,0,0,0,0|2,0,0]=4 3218 B9R0.51 CC(N)(CCCF)C(=O)O Amb32670154 [1,1,0,0,0,0|1,0,0]=3 3219 B9R0.51 CC(N)(CCCN)C(=O)O Amb18644277 [1,1,0,0,0,0|0,0,0]=2 3220 B9R0.51 CC(N)(CCCN)C(=O)O Amb2697838 [1,1,0,0,0,0|0,0,0]=2 3221 B9R0.51 CC(O)(CCCF)C(=O)O Amb33196095 [1,1,0,0,0,0|2,0,0]=4 3222 B9R0.51 CCCCC(C)(Br)C(=O)O Amb28198025 [1,1,0,0,0,0|1,0,0]=3 3223 B9R0.51 CCCCC(C)(C)C(=O)Cl Amb24705541 [1,1,0,0,0,0|2,0,0]=4 3224 B9R0.51 CCCCC(C)(C)C(=O)O Amb2687527 [1,1,0,0,0,0|1,0,0]=3 3225 B9R0.51 CCCCC(C)(F)C(=O)O Amb24444856 [1,1,0,0,0,0|1,0,0]=3 3226 B9R0.51 CCCCC(C)(N)C(=O)O Amb33743440 [1,1,0,0,0,0|0,0,0]=2 3227 B9R0.51 CCCCC(C)(N)C(=O)O Amb4134834 [1,1,0,0,0,0|0,0,0]=2 3228 B9R0.51 CCCCC(C)(O)C(=O)O Amb17593657 [1,1,0,0,0,0|1,0,0]=3 3229 B9R0.51 CCCCC(C)(O)C(C)=O Amb27621354 [1,1,0,0,0,0|2,0,0]=4 3230 B9R0.51 CCCCC(Cl)(Cl)C(=O)O Amb2720177 [1,1,0,0,0,0|1,0,0]=3 3231 B9R0.51 CCCCC(F)(F)C(=O)O Amb19929267 [1,1,0,0,0,0|1,0,0]=3 3232 B9R0.51 CCCCC(O)(O)C(=O)O Amb28059576 [1,1,0,0,0,0|1,0,0]=3 3233 B9R0.51 CCCC[C@@](C)(N)C(=O)O Amb26346904 [1,1,0,0,0,0|0,0,0]=2 3234 B9R0.51 CCCC[C@@](C)(O)C(=O)O Amb27221053 [1,1,0,0,0,0|1,0,0]=3 3235 B9R0.51 CCCC[C@](C)(N)C(=O)O Amb25961122 [1,1,0,0,0,0|0,0,0]=2 3236 B9R0.51 CCCC[C@](C)(O)C(=O)O Amb27615053 [1,1,0,0,0,0|1,0,0]=3 3237 B9R0.51 CCCNC(C)(C)C(=O)O Amb9620095 [1,1,0,0,0,0|2,0,0]=4 3238 B9R0.51 CCCSC(C)(C)C(=O)O Amb17501481 [1,1,0,0,0,0|2,0,0]=4 3239 B9R0.51 CCCSC(F)(F)C(=O)O Amb27483837 [1,1,0,0,0,0|2,0,0]=4 3240 B9R0.51 CCNCC(F)(F)C(=O)O Amb33170567 [1,1,0,0,0,0|2,0,0]=4 3241 B9R0.51 CCOCC(C)(C)C(=O)O Amb27810825 [1,1,0,0,0,0|2,0,0]=4 3242 B9R0.51 CCOCC(C)(N)C(=O)O Amb27404396 [1,1,0,0,0,0|1,0,0]=3 3243 B9R0.51 CCOCC(C)(N)C(N)=O Amb27253744 [1,1,0,0,0,0|2,0,0]=4 3244 B9R0.51 CCOCC(C)(O)C(=O)O Amb27949919 [1,1,0,0,0,0|2,0,0]=4 3245 B9R0.51 CCOCC(F)(F)C(=O)O Amb33171237 [1,1,0,0,0,0|2,0,0]=4 3246 B9R0.51 CCSCC(C)(C)C(=O)O Amb26439975 [1,1,0,0,0,0|2,0,0]=4 3247 B9R0.51 CCSCC(C)(N)C(=O)O Amb18788224 [1,1,0,0,0,0|1,0,0]=3 3248 B9R0.51 CCSCC(F)(F)C(=O)O Amb33171137 [1,1,0,0,0,0|2,0,0]=4 3249 B9R0.51 COCCC(C)(C)C(=O)O Amb19029437 [1,1,0,0,0,0|2,0,0]=4 3250 B9R0.51 COCCC(C)(Cl)C(=O)O Amb27878699 [1,1,0,0,0,0|2,0,0]=4 3251 B9R0.51 COCCC(C)(O)C(=O)O Amb23454643 [1,1,0,0,0,0|2,0,0]=4 3252 B9R0.51 COCCC(F)(F)C(=O)O Amb33476906 [1,1,0,0,0,0|2,0,0]=4 3253 B9R0.51 COCC[C@](C)(N)C(=O)O Amb27425033 [1,1,0,0,0,0|1,0,0]=3 3254 B9R0.51 CSCCC(C)(C)C(=O)O Amb10844081 [1,1,0,0,0,0|2,0,0]=4 3255 B9R0.51 CSCCC(C)(N)[PH](=O)O Amb27394208 [1,1,0,0,0,0|2,0,0]=4 3256 B9R0.51 CSCCC(C)(O)C(=O)O Amb33271718 [1,1,0,0,0,0|2,0,0]=4 3257 B9R0.51 CSCCC(F)(F)C(=O)O Amb33010112 [1,1,0,0,0,0|2,0,0]=4 3258 B9R0.51 CSCC[C@@](C)(N)C(=O)O Amb24482190 [1,1,0,0,0,0|1,0,0]=3 3259 B9R0.51 C[C@@](N)(CCCN)C(=O)O Amb27468967 [1,1,0,0,0,0|0,0,0]=2 3260 B9R0.51 C[C@](O)(CCCO)C(=O)O Amb27252130 [1,1,0,0,0,0|2,0,0]=4 3261 B9R0.51 C\C=C\CC(C)(N)C(=O)O Amb27591750 [1,1,0,0,0,0|0,0,2]=4 3262 B9R0.51 NCCCC(Cl)(Cl)C(=O)O Amb17594797 [1,1,0,0,0,0|1,0,0]=3 3263 B9R0.51 O=C(O)C(F)(F)CCCF Amb33482365 [1,1,0,0,0,0|2,0,0]=4 3264 B9R0.51 O=C(O)C(F)(F)CCCO Amb24652882 [1,1,0,0,0,0|2,0,0]=4 3265 B11R0.1 CCCC(N)CC(C)CC(=O)O Amb32669799 [0,1,0,0,0,1|2,0,0]=4 3266 B11R0.2 CCCCCCC(C)CC(=O)O Amb4001745 [0,1,0,0,0,1|2,0,0]=4 3267 B11R0.2 CCCCCCC(N)CC(=O)O Amb2229636 [0,1,0,0,0,1|1,0,0]=3 3268 B11R0.2 CCCCCCC(N)CC(=O)O Amb31307615 [0,1,0,0,0,1|1,0,0]=3 3269 B11R0.2 CCCCCCC(N)CC(N)=O Amb32787662 [0,1,0,0,0,1|2,0,0]=4 3270 B11R0.2 CCCCCCC(O)CC(=O)O Amb18803982 [0,1,0,0,0,1|2,0,0]=4 3271 B11R0.2 COCCOCC(N)CC(=O)O Amb33255511 [0,1,0,0,0,1|2,0,0]=4 3272 B11R0.6 CC(C)CCCC(C)CC(=O)O Amb32412878 [0,1,0,0,0,1|2,0,0]=4 3273 B11R0.6 CC(C)CCCC(N)CC(N)=O Amb33254017 [0,1,0,0,0,1|2,0,0]=4 3274 B11R0.107 CCC(C)CCC(O)CC(=O)O Amb33362284 [0,1,0,0,0,1|2,0,0]=4 3275 B11R0.154 CCCCCC(N)CC(=O)OC Amb33254856 [0,1,0,0,0,1|1,0,0]=3 3276 B11R0.154 CCCCCC(O)CC(=O)OC Amb21928835 [0,1,0,0,0,1|2,0,0]=4 3277 B11R0.154 CCCCC[C@@H](O)CC(=O)OC Amb31308366 [0,1,0,0,0,1|2,0,0]=4 3278 B11R0.154 CCCCC[C@H](O)CC(=O)OC Amb33872469 [0,1,0,0,0,1|2,0,0]=4 3279 B11R0.154 CCSCCC(N)CC(=O)OC Amb33254198 [0,1,0,0,0,1|2,0,0]=4 3280 B11R0.154 COC(=O)CC(N)CCCSC Amb33255461 [0,1,0,0,0,1|2,0,0]=4 3281 B11R0.324 CCCCCC(C)(N)CC(=O)O Amb33308272 [0,1,0,0,0,1|1,0,0]=3 3282 B11R0.324 CCCCCC(C)(N)CC(N)=O Amb33254907 [0,1,0,0,0,1|2,0,0]=4 3283 B11R0.324 CCCSCC(C)(N)CC(=O)O Amb32787897 [0,1,0,0,0,1|2,0,0]=4 3284 B11R0.324 COCCCC(C)(N)CC(=O)O Amb33254714 [0,1,0,0,0,1|2,0,0]=4 3285 B11R0.324 NCCCCS(=O)(=O)CC(=O)O Amb17501019 [0,1,0,0,0,1|2,0,0]=4 3286 B11R0.10 CCCC(C)CC(C)(C)C(=O)O Amb18803021 [0,2,0,0,0,0|2,0,0]=4 3287 B11R0.10 CCCC(C)CC(C)(O)C(=O)O Amb33321117 [0,2,0,0,0,0|2,0,0]=4 3288 B11R0.33 CC(C)CC(C)CC(N)C(=O)O Amb33065868 [0,2,0,0,0,0|1,0,0]=3 3289 B11R0.33 CC(C)CC(C)CC(N)C(N)=O Amb33308637 [0,2,0,0,0,0|2,0,0]=4 3290 B11R0.33 CC(C)CC(C)CC(O)C(=O)O Amb33353462 [0,2,0,0,0,0|2,0,0]=4 3291 B11R0.33 CC(C)CC(C)C[C@@H](N)C(=O)O Amb33127555 [0,2,0,0,0,0|1,0,0]=3 3292 B11R0.33 CC(C)CC(C)C[C@H](N)C(=O)O Amb32867928 [0,2,0,0,0,0|1,0,0]=3 3293 B11R0.33 CC(CC(F)F)CC(N)C(=O)O Amb33036938 [0,2,0,0,0,0|1,0,0]=3 3294 B11R0.33 CC(CC(F)F)CC(N)C(N)=O Amb33066293 [0,2,0,0,0,0|2,0,0]=4 3295 B11R0.33 CC(CC(F)F)C[C@@H](N)C(=O)O Amb32865933 [0,2,0,0,0,0|1,0,0]=3 3296 B11R0.33 CC(CC(F)F)C[C@H](N)C(=O)O Amb33308997 [0,2,0,0,0,0|1,0,0]=3 3297 B11R0.33 CN(C)CC(O)CC(N)C(=O)O Amb33066325 [0,2,0,0,0,0|2,0,0]=4 3298 B11R0.33 CN(C)CC(O)C[C@@H](N)C(=O)O Amb33036676 [0,2,0,0,0,0|2,0,0]=4 3299 B11R0.33 CN(C)CC(O)C[C@H](N)C(=O)O Amb33036691 [0,2,0,0,0,0|2,0,0]=4 3300 B11R0.37 CCCC(CC(O)C(=O)O)OC Amb33353375 [0,2,0,0,0,0|2,0,0]=4 3301 B11R0.37 COCC(CC(N)C(=O)O)OC Amb33036475 [0,2,0,0,0,0|2,0,0]=4 3302 B11R0.37 COCC(C[C@@H](N)C(=O)O)OC Amb33036443 [0,2,0,0,0,0|2,0,0]=4 3303 B11R0.37 COCC(C[C@H](N)C(=O)O)OC Amb33036611 [0,2,0,0,0,0|2,0,0]=4 3304 B11R0.55 CCCC(C)CC(OC)C(=O)O Amb33321120 [0,2,0,0,0,0|2,0,0]=4 3305 B11R0.55 COCC(C)CC(CN)C(=O)O Amb32664169 [0,2,0,0,0,0|2,0,0]=4 3306 B11R0.55 COCC(C)CC(CN)C(=O)O Amb32664170 [0,2,0,0,0,0|2,0,0]=4 3307 B11R0.58 CCCC(C)C(O)C(N)C(=O)O Amb33172519 [0,2,0,0,0,0|1,0,0]=3 3308 B11R0.58 CCOC(C)C(O)C(N)C(=O)O Amb33425391 [0,2,0,0,0,0|2,0,0]=4 3309 B11R0.117 CCC(C)C(=O)CC(N)C(=O)O Amb33309180 [0,2,0,0,0,0|1,0,1]=4 3310 B11R0.117 CCC(C)C(=O)C[C@@H](N)C(=O)O Amb33066098 [0,2,0,0,0,0|1,0,1]=4 3311 B11R0.117 CCC(C)C(=O)C[C@H](N)C(=O)O Amb33036762 [0,2,0,0,0,0|1,0,1]=4 3312 B11R0.163 CCOCC(O)CC(N)C(=O)O Amb33036905 [0,2,0,0,0,0|1,0,0]=3 3313 B11R0.163 CCOCC(O)CC(N)C(N)=O Amb33036533 [0,2,0,0,0,0|2,0,0]=4 3314 B11R0.163 CCOCC(O)C[C@@H](N)C(=O)O Amb33065818 [0,2,0,0,0,0|1,0,0]=3 3315 B11R0.163 CCOCC(O)C[C@H](N)C(=O)O Amb33065801 [0,2,0,0,0,0|1,0,0]=3 3316 B11R0.163 NCCCS(=O)CC(=O)C(=O)O Amb33069858 [0,2,0,0,0,0|1,0,1]=4 3317 B11R0.184 CCOC(C)(C)CC(N)C(=O)O Amb33065622 [0,2,0,0,0,0|2,0,0]=4 3318 B11R0.184 CCOC(C)(C)C[C@@H](N)C(=O)O Amb33309220 [0,2,0,0,0,0|2,0,0]=4 3319 B11R0.184 CCOC(C)(C)C[C@H](N)C(=O)O Amb33036871 [0,2,0,0,0,0|2,0,0]=4 3320 B11R0.184 COCC(C)(C)CC(N)C(=O)O Amb33308604 [0,2,0,0,0,0|2,0,0]=4 3321 B11R0.184 COCC(C)(C)C[C@@H](N)C(=O)O Amb33036848 [0,2,0,0,0,0|2,0,0]=4 3322 B11R0.184 COCC(C)(C)C[C@H](N)C(=O)O Amb33127520 [0,2,0,0,0,0|2,0,0]=4 3323 B11R0.187 CCCC(=O)CC(N)C(=O)OC Amb33308785 [0,2,0,0,0,0|1,0,1]=4 3324 B11R0.187 CCCC(C)CC(N)C(=O)OC Amb33066050 [0,2,0,0,0,0|1,0,0]=3 3325 B11R0.187 CCCC(C)CC(O)C(=O)OC Amb33358460 [0,2,0,0,0,0|2,0,0]=4 3326 B11R0.187 COCC(O)CC(N)C(=O)OC Amb33309192 [0,2,0,0,0,0|2,0,0]=4 3327 B11R0.125 CC(C)(SCCCCN)C(=O)O Amb17500971 [0,2,0,0,0,0|1,0,0]=3 3328 B11R0.125 CCCCCCC(C)(N)C(=O)O Amb7795642 [0,2,0,0,0,0|1,0,0]=3 3329 B11R0.125 CCCCNCC(F)(F)C(=O)O Amb33170599 [0,2,0,0,0,0|2,0,0]=4 3330 B11R0.125 CCCCOCC(F)(F)C(=O)O Amb33169238 [0,2,0,0,0,0|2,0,0]=4 3331 B11R0.125 CCCCSCC(F)(F)C(=O)O Amb33171148 [0,2,0,0,0,0|2,0,0]=4 3332 B11R0.125 CNCCSCC(F)(F)C(=O)O Amb33169291 [0,2,0,0,0,0|2,0,0]=4 3333 B11R0.125 NCCCNCC(F)(F)C(=O)O Amb33170602 [0,2,0,0,0,0|1,0,0]=3 3334 B11R0.125 NCCCSCC(F)(F)C(=O)O Amb33171153 [0,2,0,0,0,0|1,0,0]=3 3335 B11R0.125 O=C(O)C(F)(F)CNCCCF Amb33170608 [0,2,0,0,0,0|2,0,0]=4 3336 B11R0.125 O=C(O)C(F)(F)CNCCCO Amb33170603 [0,2,0,0,0,0|2,0,0]=4 3337 B11R0.125 O=C(O)C(F)(F)CSCCCO Amb33171158 [0,2,0,0,0,0|2,0,0]=4 3338 B11R0.201 CC(CN)SCC(F)(F)C(=O)O Amb33171154 [0,2,0,0,0,0|2,0,0]=4 3339 B11R0.202 CC(N)CSCC(F)(F)C(=O)O Amb33171152 [0,2,0,0,0,0|2,0,0]=4 3340 B11R0.202 CN(C)CCCC(C)(N)C(=O)O Amb18790367 [0,2,0,0,0,0|2,0,0]=4 3341 B11R0.202 CN(C)CCCC(C)(N)C(=O)O Amb28555719 [0,2,0,0,0,0|2,0,0]=4 3342 B11R0.329 CCCCCC(C)(CC)C(=O)O Amb18803025 [0,2,0,0,0,0|2,0,0]=4 3343 B11R0.29 CC(=O)CCCCC(N)C(=O)O Amb33065945 [0,2,0,0,0,0|1,0,0]=3 3344 B11R0.29 CC(=O)CCCCC(N)C(N)=O Amb33308578 [0,2,0,0,0,0|2,0,0]=4 3345 B11R0.29 CC(=O)CCCC[C@@H](N)C(=O)O Amb33066091 [0,2,0,0,0,0|1,0,0]=3 3346 B11R0.29 CC(=O)CCCC[C@H](N)C(=O)O Amb33037049 [0,2,0,0,0,0|1,0,0]=3 3347 B11R0.29 CC(C)COCCC(N)C(=O)O Amb18790631 [0,2,0,0,0,0|1,0,0]=3 3348 B11R0.29 CC(C)COCCC(N)C(N)=O Amb18790432 [0,2,0,0,0,0|2,0,0]=4 3349 B11R0.29 CC(C)COCC[C@@H](N)C(=O)O Amb32867930 [0,2,0,0,0,0|1,0,0]=3 3350 B11R0.29 CC(C)COCC[C@H](N)C(=O)O Amb33308723 [0,2,0,0,0,0|1,0,0]=3 3351 B11R0.29 CC(C)OCCCC(C)C(=O)O Amb33447417 [0,2,0,0,0,0|2,0,0]=4 3352 B11R0.29 CC(C)OCCCC(N)C(=O)O Amb33036640 [0,2,0,0,0,0|1,0,0]=3 3353 B11R0.29 CC(C)OCCCC(N)C(N)=O Amb33036888 [0,2,0,0,0,0|2,0,0]=4 3354 B11R0.29 CC(C)OCCC[C@@H](N)C(=O)O Amb33308958 [0,2,0,0,0,0|1,0,0]=3 3355 B11R0.29 CC(C)OCCC[C@H](N)C(=O)O Amb33127511 [0,2,0,0,0,0|1,0,0]=3 3356 B11R0.29 CC(CCCCN(C)C)C(=O)O Amb33271940 [0,2,0,0,0,0|1,0,0]=3 3357 B11R0.29 CC(N)CCSCC(=O)C(=O)O Amb33069817 [0,2,0,0,0,0|1,0,1]=4 3358 B11R0.29 CN(C)CC#CCC(N)C(=O)O Amb27233413 [0,2,0,0,0,0|0,0,2]=4 3359 B11R0.29 CN(C)CC#CC[C@H](N)C(=O)O Amb27592021 [0,2,0,0,0,0|0,0,2]=4 3360 B11R0.29 CN(C)CCCCC(N)C(=O)O Amb32796898 [0,2,0,0,0,0|0,0,0]=2 3361 B11R0.29 CN(C)CCCCC(N)C(N)=O Amb32796904 [0,2,0,0,0,0|1,0,0]=3 3362 B11R0.29 CN(C)CCCC[C@@H](N)C(=O)O Amb33065657 [0,2,0,0,0,0|0,0,0]=2 3363 B11R0.29 CN(C)CCCC[C@H](N)C(=O)O Amb33309085 [0,2,0,0,0,0|0,0,0]=2 3364 B11R0.29 CN(C)CCCC[C@H](N)C(=O)O Amb33778932 [0,2,0,0,0,0|0,0,0]=2 3365 B11R0.29 N=C(N)NCCCC(N)C(=O)O Amb1151252 [0,2,0,0,0,0|0,0,1]=3 3366 B11R0.29 N=C(N)NCCCC(N)C(=O)O Amb32644498 [0,2,0,0,0,0|0,0,1]=3 3367 B11R0.29 N=C(N)NCCCC(N)C(=O)O Amb32664990 [0,2,0,0,0,0|0,0,1]=3 3368 B11R0.29 N=C(N)NCCCC(N)C(=O)O Amb6609047 [0,2,0,0,0,0|0,0,1]=3 3369 B11R0.29 N=C(N)NCCCC(N)C(=O)O Amb8387122 [0,2,0,0,0,0|0,0,1]=3 3370 B11R0.29 N=C(N)NCCCC(O)C(=O)O Amb22730085 [0,2,0,0,0,0|1,0,1]=4 3371 B11R0.29 N=C(N)NCCC[C@@H](N)C(=O)O Amb22745064 [0,2,0,0,0,0|0,0,1]=3 3372 B11R0.29 N=C(N)NCCC[C@@H](N)C(=O)O Amb22745189 [0,2,0,0,0,0|0,0,1]=3 3373 B11R0.29 N=C(N)NCCC[C@@H](N)C(=O)O Amb22745210 [0,2,0,0,0,0|0,0,1]=3 3374 B11R0.29 N=C(N)NCCC[C@@H](N)C(=O)O Amb22745921 [0,2,0,0,0,0|0,0,1]=3 3375 B11R0.29 N=C(N)NCCC[C@@H](N)C(=O)O Amb22801409 [0,2,0,0,0,0|0,0,1]=3 3376 B11R0.29 N=C(N)NCCC[C@@H](N)C(=O)O Amb2718762 [0,2,0,0,0,0|0,0,1]=3 3377 B11R0.29 N=C(N)NCCC[C@@H](N)C(=O)O Amb2720084 [0,2,0,0,0,0|0,0,1]=3 3378 B11R0.29 N=C(N)NCCC[C@@H](N)C(=O)O Amb32411788 [0,2,0,0,0,0|0,0,1]=3 3379 B11R0.29 N=C(N)NCCC[C@@H](N)C(N)=O Amb8390378 [0,2,0,0,0,0|1,0,1]=4 3380 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O Amb16232497 [0,2,0,0,0,0|0,0,1]=3 3381 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O Amb17942891 [0,2,0,0,0,0|0,0,1]=3 3382 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O Amb2698266 [0,2,0,0,0,0|0,0,1]=3 3383 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O Amb2759781 [0,2,0,0,0,0|0,0,1]=3 3384 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O Amb32644822 [0,2,0,0,0,0|0,0,1]=3 3385 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O Amb3940700 [0,2,0,0,0,0|0,0,1]=3 3386 B11R0.29 N=C(N)NCCC[C@H](N)C(N)=O Amb16232536 [0,2,0,0,0,0|1,0,1]=4 3387 B11R0.29 N=C(N)NOCCC(N)C(=O)O Amb22261558 [0,2,0,0,0,0|1,0,1]=4 3388 B11R0.29 NC(=O)NCCCC(N)C(=O)O Amb3499394 [0,2,0,0,0,0|0,0,1]=3 3389 B11R0.29 NC(=O)NCCC[C@@H](N)C(=O)O Amb8629519 [0,2,0,0,0,0|0,0,1]=3 3390 B11R0.29 NC(=O)NCCC[C@H](N)C(=O)O Amb22169596 [0,2,0,0,0,0|0,0,1]=3 3391 B11R0.29 NC(=O)NCCC[C@H](N)C(=O)O Amb2718751 [0,2,0,0,0,0|0,0,1]=3 3392 B11R0.29 NC(CCCCC(=O)O)C(=O)O Amb2760482 [0,2,0,0,0,0|1,0,0]=3 3393 B11R0.29 NC(CCSCC(=O)O)C(=O)O Amb32660941 [0,2,0,0,0,0|1,0,1]=4 3394 B11R0.29 NC(CCSCC(=O)O)C(=O)O Amb33552542 [0,2,0,0,0,0|1,0,1]=4 3395 B11R0.29 NC(N)=NCCCC(N)C(=O)O Amb19866551 [0,2,0,0,0,0|0,0,1]=3 3396 B11R0.29 N[C@@H](CCCCC(=O)O)C(=O)O Amb22746360 [0,2,0,0,0,0|1,0,0]=3 3397 B11R0.42 C#CCCCCCC(N)C(=O)O Amb33065497 [0,2,0,0,0,0|1,0,0]=3 3398 B11R0.42 C#CCCCCCC(N)C(N)=O Amb33308952 [0,2,0,0,0,0|2,0,0]=4 3399 B11R0.42 C#CCCCCC[C@@H](N)C(=O)O Amb33069966 [0,2,0,0,0,0|1,0,0]=3 3400 B11R0.42 C#CCCCCC[C@H](N)C(=O)O Amb33034711 [0,2,0,0,0,0|1,0,0]=3 3401 B11R0.42 C=CCCCCCC(N)C(=O)O Amb21936740 [0,2,0,0,0,0|1,0,0]=3 3402 B11R0.42 C=CCCCCCC(N)C(N)=O Amb32867920 [0,2,0,0,0,0|2,0,0]=4 3403 B11R0.42 C=CCCCCC[C@@H](N)C(=O)O Amb22745701 [0,2,0,0,0,0|1,0,0]=3 3404 B11R0.42 C=CCCCCC[C@H](N)C(=O)O Amb33037010 [0,2,0,0,0,0|1,0,0]=3 3405 B11R0.42 C=CCCCCO[C@H](C)C(=O)O Amb22225166 [0,2,0,0,0,0|2,0,0]=4 3406 B11R0.42 CCCCCCCC(N)C(=O)O Amb2229635 [0,2,0,0,0,0|1,0,0]=3 3407 B11R0.42 CCCCCCCC(N)C(N)=O Amb18794469 [0,2,0,0,0,0|2,0,0]=4 3408 B11R0.42 CCCCCCC[C@@H](N)C(=O)O Amb22747720 [0,2,0,0,0,0|1,0,0]=3 3409 B11R0.42 CCCCCCC[C@H](N)C(=O)O Amb33308889 [0,2,0,0,0,0|1,0,0]=3 3410 B11R0.42 CCCCCCOC(C)C(=O)O Amb7790036 [0,2,0,0,0,0|2,0,0]=4 3411 B11R0.42 CCCCOCCC(N)C(=O)O Amb18795636 [0,2,0,0,0,0|1,0,0]=3 3412 B11R0.42 CCCCOCCC(N)C(N)=O Amb18178142 [0,2,0,0,0,0|2,0,0]=4 3413 B11R0.42 CCCCOCC[C@@H](N)C(=O)O Amb33065700 [0,2,0,0,0,0|1,0,0]=3 3414 B11R0.42 CCCCOCC[C@H](N)C(=O)O Amb32789517 [0,2,0,0,0,0|1,0,0]=3 3415 B11R0.42 CCC\C=C\CCC(C)C(=O)O Amb33373744 [0,2,0,0,0,0|2,0,0]=4 3416 B11R0.42 CCOCCNCC(C)C(=O)O Amb13952381 [0,2,0,0,0,0|2,0,0]=4 3417 B11R0.42 CCOCCNCC(C)C(=O)O Amb9454345 [0,2,0,0,0,0|2,0,0]=4 3418 B11R0.42 CNCCCSCC(=O)C(=O)O Amb33069830 [0,2,0,0,0,0|1,0,1]=4 3419 B11R0.42 COCCOCCC(N)C(=O)O Amb18790828 [0,2,0,0,0,0|1,0,0]=3 3420 B11R0.42 COCCOCCC(N)C(N)=O Amb18790751 [0,2,0,0,0,0|2,0,0]=4 3421 B11R0.42 COCCOCC[C@@H](N)C(=O)O Amb33065896 [0,2,0,0,0,0|1,0,0]=3 3422 B11R0.42 COCCOCC[C@H](N)C(=O)O Amb32864933 [0,2,0,0,0,0|1,0,0]=3 3423 B11R0.42 N#CCCCCCC(N)C(=O)O Amb33309071 [0,2,0,0,0,0|0,0,1]=3 3424 B11R0.42 N#CCCCCCC(N)C(N)=O Amb32789448 [0,2,0,0,0,0|1,0,1]=4 3425 B11R0.42 N#CCCCCC[C@@H](N)C(=O)O Amb33308705 [0,2,0,0,0,0|0,0,1]=3 3426 B11R0.42 N#CCCCCC[C@H](N)C(=O)O Amb32789469 [0,2,0,0,0,0|0,0,1]=3 3427 B11R0.42 N#CCCOCCC(N)C(=O)O Amb33036696 [0,2,0,0,0,0|0,0,1]=3 3428 B11R0.42 N#CCCOCCC(N)C(N)=O Amb33036588 [0,2,0,0,0,0|1,0,1]=4 3429 B11R0.42 N#CCCOCC[C@@H](N)C(=O)O Amb33065553 [0,2,0,0,0,0|0,0,1]=3 3430 B11R0.42 N#CCCOCC[C@H](N)C(=O)O Amb33308660 [0,2,0,0,0,0|0,0,1]=3 3431 B11R0.42 NC(=O)C(N)CCCCCCO Amb33036551 [0,2,0,0,0,0|2,0,0]=4 3432 B11R0.42 NC(CCCCCCO)C(=O)O Amb32937041 [0,2,0,0,0,0|1,0,0]=3 3433 B11R0.42 NC(CCCCNC=O)C(=O)O Amb22362874 [0,2,0,0,0,0|0,0,0]=2 3434 B11R0.42 NCCCCSCC(=O)C(=O)O Amb33069798 [0,2,0,0,0,0|1,0,1]=4 3435 B11R0.42 NOCCCSCC(=O)C(=O)O Amb33070047 [0,2,0,0,0,0|1,0,1]=4 3436 B11R0.42 N[C@@H](CCCCCCO)C(=O)O Amb33033601 [0,2,0,0,0,0|1,0,0]=3 3437 B11R0.42 N[C@H](CCCCCCO)C(=O)O Amb33069952 [0,2,0,0,0,0|1,0,0]=3 3438 B11R0.42 N\N=C\NCCC[C@@H](N)C(N)=O Amb34915138 [0,2,0,0,0,0|1,0,1]=4 3439 B11R0.42 [N-]=[N+]=NCCCC[C@H](N)C(=O)O Amb30586486 [0,2,0,0,0,0|0,0,1]=3 3440 B11R0.42 [N-]=[N+]=NCCCC[C@H](N)C(=O)O Amb31031221 [0,2,0,0,0,0|0,0,1]=3 3441 B11R0.76 CCCCCCC(CC)C(=O)O Amb18794406 [0,2,0,0,0,0|2,0,0]=4 3442 B11R0.76 CCCCCCC(NC)C(=O)O Amb9619840 [0,2,0,0,0,0|1,0,0]=3 3443 B11R0.109 CC(C#N)OCCC(N)C(=O)O Amb33308663 [0,2,0,0,0,0|0,0,2]=4 3444 B11R0.109 CC(C#N)OCC[C@@H](N)C(=O)O Amb33066273 [0,2,0,0,0,0|0,0,2]=4 3445 B11R0.109 CC(C#N)OCC[C@H](N)C(=O)O Amb33065809 [0,2,0,0,0,0|0,0,2]=4 3446 B11R0.109 CC(CN)CSCC(=O)C(=O)O Amb33069800 [0,2,0,0,0,0|1,0,1]=4 3447 B11R0.109 CCC(=O)CCCC(N)C(=O)O Amb33036923 [0,2,0,0,0,0|1,0,0]=3 3448 B11R0.109 CCC(=O)CCCC(N)C(N)=O Amb33308786 [0,2,0,0,0,0|2,0,0]=4 3449 B11R0.109 CCC(=O)CCC[C@@H](N)C(=O)O Amb32864919 [0,2,0,0,0,0|1,0,0]=3 3450 B11R0.109 CCC(=O)CCC[C@H](N)C(=O)O Amb33309055 [0,2,0,0,0,0|1,0,0]=3 3451 B11R0.109 COC(=O)CCC[C@H](N)C(=O)O Amb13884888 [0,2,0,0,0,0|1,0,1]=4 3452 B11R0.109 NCC(O)CSCC(=O)C(=O)O Amb33069805 [0,2,0,0,0,0|1,0,1]=4 3453 B11R0.109 NC[C@@H](O)CSCC(=O)C(=O)O Amb33069803 [0,2,0,0,0,0|1,0,1]=4 3454 B11R0.109 NC[C@H](O)CSCC(=O)C(=O)O Amb33069804 [0,2,0,0,0,0|1,0,1]=4 3455 B11R0.141 CC(CCN)SCC(=O)C(=O)O Amb33069801 [0,2,0,0,0,0|1,0,1]=4 3456 B11R0.141 CCCC(C)CCC(C)C(=O)O Amb33079033 [0,2,0,0,0,0|2,0,0]=4 3457 B11R0.141 CCCN(C)CC[C@@H](N)C(=O)O Amb32698169 [0,2,0,0,0,0|1,0,0]=3 3458 B11R0.141 CCNC(=O)CC[C@@H](N)C(=O)O Amb19134042 [0,2,0,0,0,0|1,0,1]=4 3459 B11R0.141 CCNC(=O)CC[C@H](N)C(=O)O Amb8390594 [0,2,0,0,0,0|1,0,1]=4 3460 B11R0.141 CCOC(=O)CCC(N)C(=O)O Amb6740305 [0,2,0,0,0,0|1,0,1]=4 3461 B11R0.141 CCOC(=O)CC[C@@H](N)C(=O)O Amb22745269 [0,2,0,0,0,0|1,0,1]=4 3462 B11R0.141 CCOC(=O)CC[C@H](N)C(=O)O Amb8385328 [0,2,0,0,0,0|1,0,1]=4 3463 B11R0.141 CCOC(C)CCC(C)C(=O)O Amb33424999 [0,2,0,0,0,0|2,0,0]=4 3464 B11R0.142 C=CCOCCC(N)C(=O)OC Amb33036567 [0,2,0,0,0,0|1,0,1]=4 3465 B11R0.142 CCCCCCC(N)C(=O)OC Amb18794902 [0,2,0,0,0,0|1,0,0]=3 3466 B11R0.142 CCCCCC[C@H](N)C(=O)OC Amb34157713 [0,2,0,0,0,0|1,0,0]=3 3467 B11R0.142 CCCCNCC(C)C(=O)OC Amb9253097 [0,2,0,0,0,0|2,0,0]=4 3468 B11R0.142 CCCNCCC(N)C(=O)OC Amb32993445 [0,2,0,0,0,0|1,0,0]=3 3469 B11R0.142 CCCOCCC(N)C(=O)OC Amb18790642 [0,2,0,0,0,0|1,0,0]=3 3470 B11R0.142 CCOCCCC(N)C(=O)OC Amb33308774 [0,2,0,0,0,0|1,0,0]=3 3471 B11R0.142 CCSCCCC(N)C(=O)OC Amb33065453 [0,2,0,0,0,0|1,0,0]=3 3472 B11R0.142 COC(=O)C(N)CCCCC#N Amb31296515 [0,2,0,0,0,0|0,0,1]=3 3473 B11R0.142 COC(=O)C(N)CCCCCF Amb33308580 [0,2,0,0,0,0|1,0,0]=3 3474 B11R0.142 COC(=O)C(N)CCCCCO Amb33065778 [0,2,0,0,0,0|1,0,0]=3 3475 B11R0.142 COC(=O)C(N)CCOCCO Amb33066165 [0,2,0,0,0,0|1,0,0]=3 3476 B11R0.142 COCCCCC(N)C(=O)OC Amb33309184 [0,2,0,0,0,0|1,0,0]=3 3477 B11R0.142 COCCOCC(N)C(=O)OC Amb18790826 [0,2,0,0,0,0|2,0,0]=4 3478 B11R0.73 COC(=O)C(N)C(C)CCC#N Amb33308675 [0,2,0,0,0,0|0,0,2]=4 3479 B11R0.73 COCCC(C)C(N)C(=O)OC Amb33036662 [0,2,0,0,0,0|2,0,0]=4 3480 B11R0.173 CC(C)OCC(O)C(N)C(=O)O Amb33274508 [0,2,0,0,0,0|2,0,0]=4 3481 B11R0.173 CN(C)CCC(O)C(N)C(=O)O Amb33272273 [0,2,0,0,0,0|2,0,0]=4 3482 B11R0.218 CC(C(=O)O)S(=O)(=O)CCCN Amb17500781 [0,2,0,0,0,0|2,0,0]=4 3483 B11R0.218 CCCCC(C)(C)C(N)C(=O)O Amb33428424 [0,2,0,0,0,0|1,0,0]=3 3484 B11R0.218 CCCCC(C)(C)C(O)C(=O)O Amb33080254 [0,2,0,0,0,0|2,0,0]=4 3485 B11R0.218 CCSCC(C)(C)C(N)C(=O)O Amb33324030 [0,2,0,0,0,0|2,0,0]=4 3486 B11R0.218 COCCC(C)(C)C(N)C(=O)O Amb33377821 [0,2,0,0,0,0|2,0,0]=4 3487 B11R0.218 CSCCC(C)(C)C(N)C(=O)O Amb33198745 [0,2,0,0,0,0|2,0,0]=4 3488 B11R0.21 CCC(CC)CCC(C)C(=O)O Amb33449849 [0,2,0,0,0,0|2,0,0]=4 3489 B11R0.21 CCC(CC)OCC(N)C(=O)O Amb33309179 [0,2,0,0,0,0|2,0,0]=4 3490 B11R0.21 CCC(CC)OC[C@@H](N)C(=O)O Amb33066197 [0,2,0,0,0,0|2,0,0]=4 3491 B11R0.21 CCC(CC)OC[C@H](N)C(=O)O Amb32937016 [0,2,0,0,0,0|2,0,0]=4 3492 B11R0.21 CCC(CCC(C)C(=O)O)OC Amb33325431 [0,2,0,0,0,0|2,0,0]=4 3493 B11R0.21 CCN(CC)CCC(N)C(=O)O Amb6256222 [0,2,0,0,0,0|2,0,0]=4 3494 B11R0.21 CCN(CC)CC[C@@H](N)C(=O)O Amb32698153 [0,2,0,0,0,0|2,0,0]=4 3495 B11R0.21 CCN(CC)CC[C@H](N)C(=O)O Amb33065981 [0,2,0,0,0,0|2,0,0]=4 3496 B11R0.120 CCC(C)OCC(N)C(=O)OC Amb18790607 [0,2,0,0,0,0|2,0,0]=4 3497 B11R0.150 CC(C)N(C)CC[C@@H](N)C(=O)O Amb32698158 [0,2,0,0,0,0|2,0,0]=4 3498 B11R0.150 NC(CCC(N)C(=O)O)C(=O)O Amb10602546 [0,2,0,0,0,0|1,0,1]=4 3499 B11R0.150 NC(CCC(O)C(F)F)C(=O)O Amb6893781 [0,2,0,0,0,0|1,0,0]=3 3500 B11R0.302 CC(C)(C#N)CCC(N)C(=O)O Amb33065988 [0,2,0,0,0,0|0,0,2]=4 3501 B11R0.302 CC(C)(C#N)CC[C@@H](N)C(=O)O Amb33308727 [0,2,0,0,0,0|0,0,2]=4 3502 B11R0.302 CC(C)(C#N)CC[C@H](N)C(=O)O Amb33308565 [0,2,0,0,0,0|0,0,2]=4 3503 B11R0.302 CC(CCC(C)(C)CO)C(=O)O Amb33197661 [0,2,0,0,0,0|2,0,0]=4 3504 B11R0.302 CCC(C)(C)CCC(C)C(=O)O Amb33266966 [0,2,0,0,0,0|2,0,0]=4 3505 B11R0.302 CCC(C)(C)CCC(N)C(=O)O Amb33065904 [0,2,0,0,0,0|1,0,0]=3 3506 B11R0.302 CCC(C)(C)CCC(N)C(N)=O Amb33308806 [0,2,0,0,0,0|2,0,0]=4 3507 B11R0.302 CCC(C)(C)CC[C@@H](C)C(=O)O Amb33749396 [0,2,0,0,0,0|2,0,0]=4 3508 B11R0.302 CCC(C)(C)CC[C@@H](N)C(=O)O Amb33127583 [0,2,0,0,0,0|1,0,0]=3 3509 B11R0.302 CCC(C)(C)CC[C@H](C)C(=O)O Amb33749520 [0,2,0,0,0,0|2,0,0]=4 3510 B11R0.302 CCC(C)(C)CC[C@H](N)C(=O)O Amb33065488 [0,2,0,0,0,0|1,0,0]=3 3511 B11R0.302 CCS(=O)(=O)CCC(N)C(=O)O Amb4018747 [0,2,0,0,0,0|2,0,0]=4 3512 B11R0.302 CCS(=O)(=O)CC[C@@H](N)C(=O)O Amb32789514 [0,2,0,0,0,0|2,0,0]=4 3513 B11R0.302 CCS(=O)(=O)CC[C@H](N)C(=O)O Amb32788585 [0,2,0,0,0,0|2,0,0]=4 3514 B11R0.302 COC(C)(C)CCC(N)C(=O)O Amb33036609 [0,2,0,0,0,0|2,0,0]=4 3515 B11R0.302 COC(C)(C)CC[C@@H](N)C(=O)O Amb33065527 [0,2,0,0,0,0|2,0,0]=4 3516 B11R0.302 COC(C)(C)CC[C@H](N)C(=O)O Amb33066246 [0,2,0,0,0,0|2,0,0]=4 3517 B11R0.145 COC(=O)C(N)CCCC(C)=O Amb33065910 [0,2,0,0,0,0|1,0,1]=4 3518 B11R0.145 COC(=O)C(N)CCCC(C)C Amb33066270 [0,2,0,0,0,0|1,0,0]=3 3519 B11R0.145 COC(=O)C(N)CCCC(C)O Amb33308532 [0,2,0,0,0,0|1,0,0]=3 3520 B11R0.145 COC(=O)C(N)CCCC(F)F Amb33036492 [0,2,0,0,0,0|1,0,0]=3 3521 B11R0.145 COC(=O)C(N)CCCN(C)C Amb33065892 [0,2,0,0,0,0|2,0,0]=4 3522 B11R0.145 COC(=O)C(N)CCNC(C)C Amb32993432 [0,2,0,0,0,0|2,0,0]=4 3523 B11R0.145 COC(=O)C(N)CCOC(C)C Amb18790633 [0,2,0,0,0,0|2,0,0]=4 3524 B11R0.145 COC(=O)C(N)CCSC(C)C Amb19041438 [0,2,0,0,0,0|2,0,0]=4 3525 B11R0.145 COC(=O)C(N)CCSC(F)F Amb32681168 [0,2,0,0,0,0|2,0,0]=4 3526 B11R0.145 COC(=O)C(N)COCC(C)C Amb18790571 [0,2,0,0,0,0|2,0,0]=4 3527 B11R0.155 C#CCCCC(N)C(=O)OCC Amb33065960 [0,2,0,0,0,0|1,0,1]=4 3528 B11R0.155 C=CCCCC(N)C(=O)OCC Amb32697565 [0,2,0,0,0,0|1,0,1]=4 3529 B11R0.155 CCCCCC(Br)C(=O)OCC Amb22500132 [0,2,0,0,0,0|2,0,0]=4 3530 B11R0.155 CCCCCC(N)C(=O)OCC Amb18794904 [0,2,0,0,0,0|1,0,0]=3 3531 B11R0.155 CCCOCC(N)C(=O)OCC Amb18790599 [0,2,0,0,0,0|2,0,0]=4 3532 B11R0.155 CCOC(=O)C(Br)CCCCCl Amb24066456 [0,2,0,0,0,0|2,0,0]=4 3533 B11R0.155 CCOC(=O)C(N)CCCC#N Amb33127568 [0,2,0,0,0,0|0,0,2]=4 3534 B11R0.155 CCOC(=O)C(N)CCCCF Amb33036985 [0,2,0,0,0,0|1,0,0]=3 3535 B11R0.155 CCOC(=O)C(N)CCCCN Amb2725538 [0,2,0,0,0,0|0,0,0]=2 3536 B11R0.155 CCOC(=O)C(N)CCCCN Amb32438753 [0,2,0,0,0,0|0,0,0]=2 3537 B11R0.155 CCOC(=O)C(N)CCCCO Amb32789425 [0,2,0,0,0,0|1,0,0]=3 3538 B11R0.155 CCOC(=O)C(N)CCCOC Amb33308559 [0,2,0,0,0,0|2,0,0]=4 3539 B11R0.155 CCOC(=O)C(N)CCCSC Amb33308878 [0,2,0,0,0,0|2,0,0]=4 3540 B11R0.155 CCOC(=O)C(N)CCSCC Amb19041433 [0,2,0,0,0,0|2,0,0]=4 3541 B11R0.155 CCOC(=O)[C@@H](N)CCCCN Amb33813305 [0,2,0,0,0,0|0,0,0]=2 3542 B11R0.155 CCOC(=O)[C@@H](N)CCCCN Amb8390411 [0,2,0,0,0,0|0,0,0]=2 3543 B11R0.155 CCOCCC(N)C(=O)OCC Amb18790640 [0,2,0,0,0,0|2,0,0]=4 3544 B11R0.78 C#CCCCC(NC=O)C(=O)O Amb33308688 [0,2,0,0,0,0|1,0,1]=4 3545 B11R0.78 C=CCCCC(NC=O)C(=O)O Amb33036670 [0,2,0,0,0,0|1,0,1]=4 3546 B11R0.78 CCCC(CCCCN)C(=O)O Amb28653062 [0,2,0,0,0,0|1,0,0]=3 3547 B11R0.78 CCCC(CCCCN)C(=O)O Amb8506428 [0,2,0,0,0,0|1,0,0]=3 3548 B11R0.78 CCCCCC(CCC)C(=O)O Amb18794407 [0,2,0,0,0,0|2,0,0]=4 3549 B11R0.78 CCCCCC(NC=O)C(=O)O Amb33065973 [0,2,0,0,0,0|1,0,0]=3 3550 B11R0.78 CCCOCC(NC=O)C(=O)O Amb33066142 [0,2,0,0,0,0|2,0,0]=4 3551 B11R0.78 CCOCCC(NC=O)C(=O)O Amb33065796 [0,2,0,0,0,0|2,0,0]=4 3552 B11R0.78 CCSCCC(NC=O)C(=O)O Amb24325309 [0,2,0,0,0,0|2,0,0]=4 3553 B11R0.78 COCCCC(NC=O)C(=O)O Amb32788600 [0,2,0,0,0,0|2,0,0]=4 3554 B11R0.78 CSCCCC(NC=O)C(=O)O Amb33066297 [0,2,0,0,0,0|2,0,0]=4 3555 B11R0.78 N#CCCCC(NC=O)C(=O)O Amb33036142 [0,2,0,0,0,0|0,0,2]=4 3556 B11R0.78 O=CNC(CCCCF)C(=O)O Amb33065800 [0,2,0,0,0,0|1,0,0]=3 3557 B11R0.78 O=CNC(CCCCO)C(=O)O Amb33036711 [0,2,0,0,0,0|1,0,0]=3 3558 B11R0.153 CCCCCC(C(=O)O)C(=O)O Amb9786433 [0,2,0,0,0,0|2,0,0]=4 3559 B11R0.153 CCCCCC(C(=O)O)C(C)C Amb18794409 [0,2,0,0,0,0|2,0,0]=4 3560 B11R0.318 CC(C)(C)CCCC(N)C(=O)O Amb33065415 [0,2,0,0,0,0|1,0,0]=3 3561 B11R0.318 CC(C)(C)CCCC(N)C(N)=O Amb33065926 [0,2,0,0,0,0|2,0,0]=4 3562 B11R0.318 CC(C)(C)CCC[C@@H](N)C(=O)O Amb33035589 [0,2,0,0,0,0|1,0,0]=3 3563 B11R0.318 CC(C)(C)CCC[C@H](N)C(=O)O Amb33036857 [0,2,0,0,0,0|1,0,0]=3 3564 B11R0.318 CC(C)(C)OCCC(N)C(=O)O Amb18790630 [0,2,0,0,0,0|2,0,0]=4 3565 B11R0.318 CC(C)(C)OCC[C@@H](N)C(=O)O Amb33066288 [0,2,0,0,0,0|2,0,0]=4 3566 B11R0.318 CC(C)(C)OCC[C@H](N)C(=O)O Amb33037006 [0,2,0,0,0,0|2,0,0]=4 3567 B11R0.318 CC(C)(C)SCCC(N)C(=O)O Amb19041434 [0,2,0,0,0,0|2,0,0]=4 3568 B11R0.318 CC(C)(C)SCC[C@@H](N)C(=O)O Amb33127576 [0,2,0,0,0,0|2,0,0]=4 3569 B11R0.318 CC(C)(C)SCC[C@H](N)C(=O)O Amb33309056 [0,2,0,0,0,0|2,0,0]=4 3570 B11R0.318 CC(CCCC(C)(C)C)C(=O)O Amb32954469 [0,2,0,0,0,0|2,0,0]=4 3571 B11R0.318 CC(CCCC(F)(F)F)C(=O)O Amb33727290 [0,2,0,0,0,0|2,0,0]=4 3572 B11R0.318 CC(F)(F)CCCC(N)C(=O)O Amb33066247 [0,2,0,0,0,0|1,0,0]=3 3573 B11R0.318 CC(F)(F)CCCC(N)C(N)=O Amb33308797 [0,2,0,0,0,0|2,0,0]=4 3574 B11R0.318 CC(F)(F)CCC[C@@H](N)C(=O)O Amb33036484 [0,2,0,0,0,0|1,0,0]=3 3575 B11R0.318 CC(F)(F)CCC[C@H](N)C(=O)O Amb33308847 [0,2,0,0,0,0|1,0,0]=3 3576 B11R0.318 CS(=O)(=O)CCCC(N)C(=O)O Amb18189488 [0,2,0,0,0,0|2,0,0]=4 3577 B11R0.318 CS(=O)(=O)CCC[C@@H](N)C(=O)O Amb32789421 [0,2,0,0,0,0|2,0,0]=4 3578 B11R0.318 CS(=O)(=O)CCC[C@H](N)C(=O)O Amb33308913 [0,2,0,0,0,0|2,0,0]=4 3579 B11R0.318 C[C@@H](CCCC(C)(C)C)C(=O)O Amb33749519 [0,2,0,0,0,0|2,0,0]=4 3580 B11R0.318 C[C@@H](CCCC(F)(F)F)C(=O)O Amb33749521 [0,2,0,0,0,0|2,0,0]=4 3581 B11R0.318 C[C@H](CCCC(C)(C)C)C(=O)O Amb33749395 [0,2,0,0,0,0|2,0,0]=4 3582 B11R0.318 C[C@H](CCCC(F)(F)F)C(=O)O Amb33749840 [0,2,0,0,0,0|2,0,0]=4 3583 B11R0.318 NC(=O)C(N)CCCC(F)(F)F Amb33036876 [0,2,0,0,0,0|2,0,0]=4 3584 B11R0.318 NC(CCCC(F)(F)F)C(=O)O Amb2691072 [0,2,0,0,0,0|1,0,0]=3 3585 B11R0.318 NC(CCCP(=O)(O)O)C(=O)O Amb5722335 [0,2,0,0,0,0|2,0,0]=4 3586 B11R0.318 NC(CCCS(=O)(=O)O)C(=O)O Amb33066081 [0,2,0,0,0,0|2,0,0]=4 3587 B11R0.318 NC(CCOC(F)(F)F)C(=O)O Amb33140953 [0,2,0,0,0,0|2,0,0]=4 3588 B11R0.318 NC(CCOC(F)(F)F)C(=O)O Amb33140954 [0,2,0,0,0,0|2,0,0]=4 3589 B11R0.318 NC(CCSC(F)(F)F)C(=O)O Amb33065484 [0,2,0,0,0,0|2,0,0]=4 3590 B11R0.318 NC(COCC(F)(F)F)C(=O)O Amb19046372 [0,2,0,0,0,0|2,0,0]=4 3591 B11R0.318 N[C@@H](CCCC(F)(F)F)C(=O)O Amb33065499 [0,2,0,0,0,0|1,0,0]=3 3592 B11R0.318 N[C@@H](CCCS(=O)(=O)O)C(=O)O Amb33066176 [0,2,0,0,0,0|2,0,0]=4 3593 B11R0.318 N[C@@H](CCOC(F)(F)F)C(=O)O Amb33065506 [0,2,0,0,0,0|2,0,0]=4 3594 B11R0.318 N[C@@H](CCOC(F)(F)F)C(=O)O Amb35788282 [0,2,0,0,0,0|2,0,0]=4 3595 B11R0.318 N[C@@H](CCSC(F)(F)F)C(=O)O Amb31289219 [0,2,0,0,0,0|2,0,0]=4 3596 B11R0.318 N[C@@H](CCSC(F)(F)F)C(=O)O Amb32992814 [0,2,0,0,0,0|2,0,0]=4 3597 B11R0.318 N[C@@H](COCC(F)(F)F)C(=O)O Amb33065437 [0,2,0,0,0,0|2,0,0]=4 3598 B11R0.318 N[C@H](CCCC(F)(F)F)C(=O)O Amb19889293 [0,2,0,0,0,0|1,0,0]=3 3599 B11R0.318 N[C@H](CCCS(=O)(=O)O)C(=O)O Amb33065642 [0,2,0,0,0,0|2,0,0]=4 3600 B11R0.318 N[C@H](CCOC(F)(F)F)C(=O)O Amb33065847 [0,2,0,0,0,0|2,0,0]=4 3601 B11R0.318 N[C@H](CCSC(F)(F)F)C(=O)O Amb32651796 [0,2,0,0,0,0|2,0,0]=4 3602 B11R0.318 N[C@H](CCSC(F)(F)F)C(=O)O Amb33620582 [0,2,0,0,0,0|2,0,0]=4 3603 B11R0.318 N[C@H](COCC(F)(F)F)C(=O)O Amb33036833 [0,2,0,0,0,0|2,0,0]=4 3604 B9R1.1 C[C@@H]1CC[C@@H](CN)OC1 Amb35788826 [1,0,0,1,0,0|1,0,1]=4 3605 B9R1.1 C[C@@H]1CC[C@@H](CN)OC1 Amb35789057 [1,0,0,1,0,0|1,0,1]=4 3606 B9R1.1 NCC1CCC(N)CC1 Amb16233730 [1,0,0,1,0,0|1,0,1]=4 3607 B9R1.1 NCC1CCC(N)CC1 Amb22491656 [1,0,0,1,0,0|1,0,1]=4 3608 B9R1.1 NCC1CCC(O)CO1 Amb32640405 [1,0,0,1,0,0|1,0,1]=4 3609 B9R1.1 N[C@@H]1C=C[C@H](CO)CC1 Amb24649717 [1,0,0,1,0,0|2,0,0]=4 3610 B9R1.1 N[C@@H]1CC[C@@H](CO)OC1 Amb28204004 [1,0,0,1,0,0|1,0,1]=4 3611 B9R1.1 N[C@H]1C=C[C@@H](CO)CC1 Amb24443345 [1,0,0,1,0,0|2,0,0]=4 3612 B9R1.2 C=CC1CCCC(C)N1 Amb27630668 [1,0,0,1,0,0|2,0,0]=4 3613 B9R1.2 C=CC1CCCC(N)C1 Amb26996279 [1,0,0,1,0,0|2,0,0]=4 3614 B9R1.2 C=C[C@@H]1CCC[C@@H](N)C1 Amb27220130 [1,0,0,1,0,0|2,0,0]=4 3615 B9R1.2 C=C[C@@H]1CCC[C@@H](N)C1 Amb31251611 [1,0,0,1,0,0|2,0,0]=4 3616 B9R1.2 C=C[C@H]1CCC[C@H](C)N1 Amb26419074 [1,0,0,1,0,0|2,0,0]=4 3617 B9R1.2 CC1CCCC(C=O)C1 Amb22059519 [1,0,0,1,0,0|2,0,0]=4 3618 B9R1.2 CC1CCCC(C=O)O1 Amb27956485 [1,0,0,1,0,0|2,0,0]=4 3619 B9R1.2 CC1CCCC(CO)N1 Amb20090381 [1,0,0,1,0,0|1,0,1]=4 3620 B9R1.2 C[C@@H]1CCCC(CO)N1 Amb27413400 [1,0,0,1,0,0|1,0,1]=4 3621 B9R1.2 C[C@@H]1CCC[C@H](CO)N1 Amb24647659 [1,0,0,1,0,0|1,0,1]=4 3622 B9R1.2 C[C@H]1CCC[C@@H](C=O)N1 Amb27866254 [1,0,0,1,0,0|1,0,0]=3 3623 B9R1.2 NC1CCCC(CO)C1 Amb33532803 [1,0,0,1,0,0|1,0,1]=4 3624 B9R1.2 NC1CCCC(NO)C1 Amb28046309 [1,0,0,1,0,0|2,0,0]=4 3625 B9R1.2 N[C@@H]1CCC[C@@H](CO)C1 Amb25973785 [1,0,0,1,0,0|1,0,1]=4 3626 B9R1.2 N[C@@H]1CCC[C@H](CO)C1 Amb27791190 [1,0,0,1,0,0|1,0,1]=4 3627 B9R1.2 N[C@H]1CCC[C@@H](CO)C1 Amb23385323 [1,0,0,1,0,0|1,0,1]=4 3628 B9R1.2 N[C@H]1CCC[C@@H](CO)C1 Amb30526953 [1,0,0,1,0,0|1,0,1]=4 3629 B9R1.2 N[C@H]1CCC[C@H](CO)C1 Amb28399575 [1,0,0,1,0,0|1,0,1]=4 3630 B9R1.2 O=CC1CCCC(Cl)C1 Amb28456028 [1,0,0,1,0,0|2,0,0]=4 3631 B9R1.2 O=CC1CCCC(F)C1 Amb24541768 [1,0,0,1,0,0|2,0,0]=4 3632 B9R1.3 CC1C(N)CCCC1N Amb27180055 [1,0,0,1,0,0|1,0,1]=4 3633 B9R1.3 CC1CCCC(C)C1=O Amb9702826 [1,0,0,1,0,0|2,0,0]=4 3634 B9R1.3 CC1CCCC(F)C1=O Amb24400707 [1,0,0,1,0,0|2,0,0]=4 3635 B9R1.3 CC1CCC[C@@H](C)C1=O Amb27262957 [1,0,0,1,0,0|2,0,0]=4 3636 B9R1.3 CC1CCC[C@H](Cl)C1=O Amb28388615 [1,0,0,1,0,0|2,0,0]=4 3637 B9R1.3 CN1CCCC(N)C1=O Amb23440176 [1,0,0,1,0,0|2,0,0]=4 3638 B9R1.3 CN1CCCC(N)C1=O Amb33536522 [1,0,0,1,0,0|2,0,0]=4 3639 B9R1.3 CN1CCC[C@@H](N)C1=O Amb22745485 [1,0,0,1,0,0|2,0,0]=4 3640 B9R1.3 CN1CCC[C@@H](N)C1=O Amb25709654 [1,0,0,1,0,0|2,0,0]=4 3641 B9R1.3 CN1CCC[C@H](N)C1=O Amb26503808 [1,0,0,1,0,0|2,0,0]=4 3642 B9R1.3 CN1CCC[C@H](N)C1=O Amb33801269 [1,0,0,1,0,0|2,0,0]=4 3643 B9R1.3 C[C@H]1CCC[C@@H](Br)C1=O Amb28132271 [1,0,0,1,0,0|2,0,0]=4 3644 B9R1.3 C[C@H]1CCC[C@@H](N)[C@@H]1O Amb28252463 [1,0,0,1,0,0|1,0,1]=4 3645 B9R1.3 C[C@H]1CCC[C@H](F)C1=O Amb28202070 [1,0,0,1,0,0|2,0,0]=4 3646 B9R1.3 NC1CCCC(=O)C1=O Amb28042602 [1,0,0,1,0,0|1,0,1]=4 3647 B9R1.3 NC1CCCN(O)C1=O Amb25062670 [1,0,0,1,0,0|2,0,0]=4 3648 B9R1.3 NC1CCNC(N)C1=O Amb27644630 [1,0,0,1,0,0|1,0,0]=3 3649 B9R1.3 N[C@@H]1CCCN(O)C1=O Amb28254924 [1,0,0,1,0,0|2,0,0]=4 3650 B9R1.3 N[C@@H]1CCC[C@@H](N)C1O Amb28429791 [1,0,0,1,0,0|0,0,1]=3 3651 B9R1.3 N[C@@H]1CCC[C@@H](O)[C@H]1O Amb24117833 [1,0,0,1,0,0|1,0,1]=4 3652 B9R1.3 N[C@@H]1CCC[C@H](O)[C@@H]1O Amb27777923 [1,0,0,1,0,0|1,0,1]=4 3653 B9R1.3 N[C@@H]1CCC[C@H](O)[C@H]1O Amb27467411 [1,0,0,1,0,0|1,0,1]=4 3654 B9R1.3 N[C@H]1CCCN(O)C1=O Amb27759969 [1,0,0,1,0,0|2,0,0]=4 3655 B9R1.3 N[C@H]1CCC[C@H](O)[C@@H]1O Amb27787410 [1,0,0,1,0,0|1,0,1]=4 3656 B9R1.3 O=C1C(Cl)CCCC1Cl Amb24480185 [1,0,0,1,0,0|2,0,0]=4 3657 B9R1.3 O=C1C(F)CCCC1Cl Amb28285276 [1,0,0,1,0,0|2,0,0]=4 3658 B9R1.3 O=C1C(O)CCCC1Br Amb27483787 [1,0,0,1,0,0|2,0,0]=4 3659 B9R1.3 O=C1[C@@H](Cl)CCC[C@H]1Cl Amb27771094 [1,0,0,1,0,0|2,0,0]=4 3660 B9R1.3 O=C1[C@@H](F)CCC[C@H]1Br Amb27253622 [1,0,0,1,0,0|2,0,0]=4 3661 B9R1.3 O=C1[C@@H](F)CCC[C@H]1F Amb27836851 [1,0,0,1,0,0|2,0,0]=4 3662 B9R1.3 O=C1[C@H](Cl)CCC[C@H]1Br Amb27630665 [1,0,0,1,0,0|2,0,0]=4 3663 B9R1.3 O=C1[C@H](F)CCC[C@H]1F Amb27489318 [1,0,0,1,0,0|2,0,0]=4 3664 B9R1.3 O=C1[C@H](O)CCC[C@H]1O Amb28052305 [1,0,0,1,0,0|2,0,0]=4 3665 B9R1.5 CC1CCCCCC1=O Amb26348270 [1,0,0,1,0,0|2,0,0]=4 3666 B9R1.5 CC1CNCCNC1=O Amb27228560 [1,0,0,1,0,0|2,0,0]=4 3667 B9R1.5 CC1NCCCNC1=O Amb33545017 [1,0,0,1,0,0|2,0,0]=4 3668 B9R1.5 C[C@@H]1CCCCNC1=O Amb28072473 [1,0,0,1,0,0|1,0,0]=3 3669 B9R1.5 C[C@@H]1NCCCNC1=O Amb25733316 [1,0,0,1,0,0|2,0,0]=4 3670 B9R1.5 C[C@H]1NCCCNC1=O Amb25146171 [1,0,0,1,0,0|2,0,0]=4 3671 B9R1.5 NC1CCCCC=C1Br Amb27747172 [1,0,0,1,0,0|2,0,0]=4 3672 B9R1.5 NC1CCCCCC1=O Amb18276126 [1,0,0,1,0,0|1,0,0]=3 3673 B9R1.5 NC1CCCCCC1=O Amb28934932 [1,0,0,1,0,0|1,0,0]=3 3674 B9R1.5 NC1CCCCCC1O Amb8855257 [1,0,0,1,0,0|1,0,1]=4 3675 B9R1.5 NC1CCCCNC1=O Amb19958477 [1,0,0,1,0,0|0,0,0]=2 3676 B9R1.5 NC1CCCCNC1=O Amb9721937 [1,0,0,1,0,0|0,0,0]=2 3677 B9R1.5 NC1CSCCNC1=O Amb25336468 [1,0,0,1,0,0|1,0,0]=3 3678 B9R1.5 NC1CSCCNC1=O Amb32412582 [1,0,0,1,0,0|1,0,0]=3 3679 B9R1.5 NN1CCCCCC1=O Amb22495331 [1,0,0,1,0,0|2,0,0]=4 3680 B9R1.5 N[C@@H]1CCCCC[C@@H]1O Amb1994010 [1,0,0,1,0,0|1,0,1]=4 3681 B9R1.5 N[C@@H]1CCCCC[C@H]1O Amb1994009 [1,0,0,1,0,0|1,0,1]=4 3682 B9R1.5 N[C@@H]1CCCCNC1=O Amb10608775 [1,0,0,1,0,0|0,0,0]=2 3683 B9R1.5 N[C@@H]1CCCCNC1=O Amb20670688 [1,0,0,1,0,0|0,0,0]=2 3684 B9R1.5 N[C@@H]1CSCCNC1=O Amb19374458 [1,0,0,1,0,0|1,0,0]=3 3685 B9R1.5 N[C@@H]1CSCCNC1=O Amb32414615 [1,0,0,1,0,0|1,0,0]=3 3686 B9R1.5 N[C@H]1CCCCC[C@@H]1O Amb26551623 [1,0,0,1,0,0|1,0,1]=4 3687 B9R1.5 N[C@H]1CCCCNC1=O Amb19929579 [1,0,0,1,0,0|0,0,0]=2 3688 B9R1.5 N[C@H]1CCCCNC1=O Amb532926 [1,0,0,1,0,0|0,0,0]=2 3689 B9R1.5 N[C@H]1COCCNC1=O Amb27234381 [1,0,0,1,0,0|1,0,0]=3 3690 B9R1.5 N[C@H]1CSCCNC1=O Amb10067826 [1,0,0,1,0,0|1,0,0]=3 3691 B9R1.5 O=C1CCCCCC1Br Amb18325296 [1,0,0,1,0,0|2,0,0]=4 3692 B9R1.5 O=C1CCCCCC1Cl Amb6892055 [1,0,0,1,0,0|2,0,0]=4 3693 B9R1.5 O=C1CCCCCC1F Amb21965071 [1,0,0,1,0,0|2,0,0]=4 3694 B9R1.5 O=C1CCCCCC1O Amb25284997 [1,0,0,1,0,0|2,0,0]=4 3695 B9R1.5 O=C1CCCCCC1S Amb28199868 [1,0,0,1,0,0|2,0,0]=4 3696 B9R1.5 O=C1NCCCCC1Br Amb9781677 [1,0,0,1,0,0|1,0,0]=3 3697 B9R1.5 O=C1NCCCCC1Cl Amb27815034 [1,0,0,1,0,0|1,0,0]=3 3698 B9R1.5 O=C1NCCCCC1I Amb35751097 [1,0,0,1,0,0|1,0,0]=3 3699 B9R1.7 CCCC1CC(N)CO1 Amb35584876 [1,0,0,1,0,0|1,0,1]=4 3700 B9R1.7 N[C@H]1C=C[C@H](CCO)C1 Amb27204910 [1,0,0,1,0,0|2,0,0]=4 3701 B9R1.11 C=CC(N)C1CCCS1 Amb27424734 [1,0,0,1,0,0|2,0,0]=4 3702 B9R1.11 C=CC(O)[C@H]1CCCN1 Amb30039307 [1,0,0,1,0,0|2,0,0]=4 3703 B9R1.11 CC(C=O)C1CCCC1 Amb20668888 [1,0,0,1,0,0|2,0,0]=4 3704 B9R1.11 CC(C=O)C1CCCO1 Amb18642610 [1,0,0,1,0,0|2,0,0]=4 3705 B9R1.11 CC(C=O)C1CCCS1 Amb33415663 [1,0,0,1,0,0|2,0,0]=4 3706 B9R1.11 CC(NO)C1CCCN1 Amb27626918 [1,0,0,1,0,0|2,0,0]=4 3707 B9R1.11 CCC(N)C1CCCN1 Amb26918433 [1,0,0,1,0,0|1,0,1]=4 3708 B9R1.11 NC(CO)C1CCCC1 Amb18958311 [1,0,0,1,0,0|1,0,1]=4 3709 B9R1.11 NC(CO)C1CCCN1 Amb27631593 [1,0,0,1,0,0|0,0,1]=3 3710 B9R1.11 NC(CO)C1CCCO1 Amb24480307 [1,0,0,1,0,0|1,0,1]=4 3711 B9R1.11 NC(CO)C1CCCS1 Amb27185967 [1,0,0,1,0,0|1,0,1]=4 3712 B9R1.11 N[C@@H](CO)C1CCCC1 Amb25757877 [1,0,0,1,0,0|1,0,1]=4 3713 B9R1.11 N[C@@H](CO)C1CCCO1 Amb33318723 [1,0,0,1,0,0|1,0,1]=4 3714 B9R1.11 N[C@@H](CO)C1CCCS1 Amb33416835 [1,0,0,1,0,0|1,0,1]=4 3715 B9R1.11 N[C@H](CO)C1CCCC1 Amb25324301 [1,0,0,1,0,0|1,0,1]=4 3716 B9R1.11 N[C@H](CO)C1CCCC1 Amb33872225 [1,0,0,1,0,0|1,0,1]=4 3717 B9R1.11 N[C@H](CO)C1CCCO1 Amb33318724 [1,0,0,1,0,0|1,0,1]=4 3718 B9R1.11 N[C@H](CO)C1CCCS1 Amb33416836 [1,0,0,1,0,0|1,0,1]=4 3719 B9R1.11 N\C(=N/O)C1CCCN1 Amb24749080 [1,0,0,1,0,0|1,0,1]=4 3720 B9R1.20 CCCCC1OC1C=O Amb26852359 [1,0,0,1,0,0|2,0,0]=4 3721 B9R1.20 CCCC[C@@H]1C[C@H]1C=O Amb27971394 [1,0,0,1,0,0|2,0,0]=4 3722 B9R1.20 O=C[C@@H]1O[C@H]1CCCBr Amb28320749 [1,0,0,1,0,0|2,0,0]=4 3723 B9R1.20 O=C[C@H]1C[C@H]1CCCBr Amb27202574 [1,0,0,1,0,0|2,0,0]=4 3724 B9R1.21 C=CC1CCC(CC)N1 Amb27953583 [1,0,0,1,0,0|2,0,0]=4 3725 B9R1.21 C=C[C@@H]1CC[C@H](CC)N1 Amb27852500 [1,0,0,1,0,0|2,0,0]=4 3726 B9R1.21 C=C[C@H]1CC[C@@H](CO)N1 Amb27464653 [1,0,0,1,0,0|2,0,0]=4 3727 B9R1.21 CCC1CCC(C=O)C1 Amb25312233 [1,0,0,1,0,0|2,0,0]=4 3728 B9R1.21 CC[C@@H]1CC[C@H](CO)N1 Amb27641256 [1,0,0,1,0,0|1,0,1]=4 3729 B9R1.21 NCC1CCC(CO)C1 Amb27859685 [1,0,0,1,0,0|1,0,1]=4 3730 B9R1.21 NCC1CCC(CO)O1 Amb27796782 [1,0,0,1,0,0|1,0,1]=4 3731 B9R1.21 NC[C@@H]1CC[C@H](CO)O1 Amb26065766 [1,0,0,1,0,0|1,0,1]=4 3732 B9R1.21 NC[C@H]1CC[C@@H](CO)C1 Amb27631261 [1,0,0,1,0,0|1,0,1]=4 3733 B9R1.21 NC[C@H]1CC[C@@H](CO)O1 Amb25367672 [1,0,0,1,0,0|1,0,1]=4 3734 B9R1.21 O=CC1CCC(CO)C1 Amb26516032 [1,0,0,1,0,0|2,0,0]=4 3735 B9R1.21 O=CC1CCC(CO)O1 Amb18642773 [1,0,0,1,0,0|2,0,0]=4 3736 B9R1.21 OCC1CCC(CO)N1 Amb22728597 [1,0,0,1,0,0|1,0,1]=4 3737 B9R1.21 OCC1CCC(CO)N1 Amb32665489 [1,0,0,1,0,0|1,0,1]=4 3738 B9R1.21 OC[C@@H]1CC[C@@H](CO)N1 Amb24375528 [1,0,0,1,0,0|1,0,1]=4 3739 B9R1.21 OC[C@@H]1CC[C@@H](CO)N1 Amb32652831 [1,0,0,1,0,0|1,0,1]=4 3740 B9R1.21 OC[C@@H]1CC[C@H](CO)N1 Amb24117031 [1,0,0,1,0,0|1,0,1]=4 3741 B9R1.21 OC[C@H]1CC[C@H](CO)N1 Amb24539840 [1,0,0,1,0,0|1,0,1]=4 3742 B9R1.21 OC[C@H]1CC[C@H](CO)N1 Amb28877924 [1,0,0,1,0,0|1,0,1]=4 3743 B9R1.50 NC1C=CCCCCC1 Amb22410845 [1,0,0,1,0,0|2,0,0]=4 3744 B9R1.50 NC1C=CCCCCC1 Amb32652668 [1,0,0,1,0,0|2,0,0]=4 3745 B9R1.50 N[C@@H]1C=CCCCCC1 Amb27423065 [1,0,0,1,0,0|2,0,0]=4 3746 B9R1.78 CC1CC1CC(N)CO Amb33144903 [1,0,0,1,0,0|1,0,1]=4 3747 B9R1.79 C=CC(N)CC1CCC1 Amb28046589 [1,0,0,1,0,0|2,0,0]=4 3748 B9R1.79 CC(C=O)CC1CCC1 Amb27600503 [1,0,0,1,0,0|2,0,0]=4 3749 B9R1.79 NC(CO)CC1CCC1 Amb32660961 [1,0,0,1,0,0|1,0,1]=4 3750 B9R1.79 NC(CO)CC1CCC1 Amb33548648 [1,0,0,1,0,0|1,0,1]=4 3751 B9R1.79 N[C@@H](CO)CC1CCC1 Amb28199933 [1,0,0,1,0,0|1,0,1]=4 3752 B9R1.79 N[C@H](CO)CC1CCC1 Amb26547301 [1,0,0,1,0,0|1,0,1]=4 3753 B9R1.80 NC(CO)CCC1CC1 Amb24715971 [1,0,0,1,0,0|1,0,1]=4 3754 B9R1.88 C=CC(N)C1CC1CO Amb28140754 [1,0,0,1,0,0|2,0,0]=4 3755 B9R1.89 O=CC1CCCCCC1 Amb9786985 [1,0,0,1,0,0|2,0,0]=4 3756 B9R1.89 OCC1CCCCCN1 Amb33551226 [1,0,0,1,0,0|1,0,1]=4 3757 B9R1.89 OCC1CCCCCN1 Amb8009310 [1,0,0,1,0,0|1,0,1]=4 3758 B9R1.89 OCC1CCCCNC1 Amb19149352 [1,0,0,1,0,0|1,0,1]=4 3759 B9R1.89 OCC1CCCCNC1 Amb8630389 [1,0,0,1,0,0|1,0,1]=4 3760 B9R1.89 OC[C@@H]1CCCCCN1 Amb24117101 [1,0,0,1,0,0|1,0,1]=4 3761 B9R1.89 OC[C@@H]1CCCCNC1 Amb28315456 [1,0,0,1,0,0|1,0,1]=4 3762 B9R1.118 C=CC1(N)CCCCC1 Amb18642344 [1,0,0,1,0,0|2,0,0]=4 3763 B9R1.118 CC1(C=O)CCCCC1 Amb10070781 [1,0,0,1,0,0|2,0,0]=4 3764 B9R1.118 CC1(C=O)CCCCO1 Amb24627620 [1,0,0,1,0,0|2,0,0]=4 3765 B9R1.118 CC1(CO)CCCCN1 Amb19516855 [1,0,0,1,0,0|1,0,1]=4 3766 B9R1.118 CC1(CO)CCCCN1 Amb22587374 [1,0,0,1,0,0|1,0,1]=4 3767 B9R1.118 NC1(C=O)CCOCC1 Amb35735160 [1,0,0,1,0,0|2,0,0]=4 3768 B9R1.118 NC1(CO)CCCCC1 Amb10608249 [1,0,0,1,0,0|1,0,1]=4 3769 B9R1.118 NC1(CO)CCCCC1 Amb8631827 [1,0,0,1,0,0|1,0,1]=4 3770 B9R1.118 O=CC1(Br)CCCCC1 Amb17594982 [1,0,0,1,0,0|2,0,0]=4 3771 B9R1.118 O=CC1(Cl)CCCCC1 Amb17593665 [1,0,0,1,0,0|2,0,0]=4 3772 B9R1.132 CC1CCC(CO)C1=O Amb27486136 [1,0,0,1,0,0|2,0,0]=4 3773 B9R1.132 CCN1CCC(N)C1=O Amb18945418 [1,0,0,1,0,0|2,0,0]=4 3774 B9R1.132 CCN1CCC(N)C1=O Amb32655994 [1,0,0,1,0,0|2,0,0]=4 3775 B9R1.132 CC[C@@H]1CC[C@H](C)C1=O Amb28052450 [1,0,0,1,0,0|2,0,0]=4 3776 B9R1.132 CN1CCC(CN)C1=O Amb30982588 [1,0,0,1,0,0|2,0,0]=4 3777 B9R1.132 CN1CCC(CN)C1=O Amb33550142 [1,0,0,1,0,0|2,0,0]=4 3778 B9R1.135 NC1CN(CCO)C1=O Amb27180505 [1,0,0,1,0,0|2,0,0]=4 3779 B9R1.202 CC1(CO)CCCC1N Amb19337610 [1,0,0,1,0,0|1,0,1]=4 3780 B9R1.202 CC1CCCC1(C)C=O Amb25860085 [1,0,0,1,0,0|2,0,0]=4 3781 B9R1.202 C[C@@]1(CO)CCC[C@H]1N Amb33483675 [1,0,0,1,0,0|1,0,1]=4 3782 B9R1.6 C=C(C)C1CCCCN1 Amb23536631 [1,0,0,1,0,0|2,0,0]=4 3783 B9R1.6 C=C(O)C1CNCCN1 Amb28286928 [1,0,0,1,0,0|2,0,0]=4 3784 B9R1.6 C=C(O)C1CNCCN1 Amb30594212 [1,0,0,1,0,0|2,0,0]=4 3785 B9R1.6 CC(=O)C1CCCCC1 Amb4037310 [1,0,0,1,0,0|2,0,0]=4 3786 B9R1.6 CC(=O)C1CCCCN1 Amb21962174 [1,0,0,1,0,0|1,0,0]=3 3787 B9R1.6 CC(=O)C1CCCCN1 Amb2700057 [1,0,0,1,0,0|1,0,0]=3 3788 B9R1.6 CC(=O)C1CCCCO1 Amb23585662 [1,0,0,1,0,0|2,0,0]=4 3789 B9R1.6 CC(=O)C1CCCCS1 Amb23568664 [1,0,0,1,0,0|2,0,0]=4 3790 B9R1.6 CC(=O)C1COCCN1 Amb24761214 [1,0,0,1,0,0|2,0,0]=4 3791 B9R1.6 CC(=O)C1CSCCN1 Amb25305093 [1,0,0,1,0,0|2,0,0]=4 3792 B9R1.6 CC(=O)[C@@H]1CCCCN1 Amb26891406 [1,0,0,1,0,0|1,0,0]=3 3793 B9R1.6 CC(=O)[C@@H]1CCCCN1 Amb28555630 [1,0,0,1,0,0|1,0,0]=3 3794 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb25072730 [1,0,0,1,0,0|1,0,0]=3 3795 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb28935031 [1,0,0,1,0,0|1,0,0]=3 3796 B9R1.6 CC(O)C1CCCCN1 Amb18642713 [1,0,0,1,0,0|1,0,1]=4 3797 B9R1.6 CC(O)[C@@H]1CCCCN1 Amb35737461 [1,0,0,1,0,0|1,0,1]=4 3798 B9R1.6 CC(O)[C@H]1CCCCN1 Amb35617462 [1,0,0,1,0,0|1,0,1]=4 3799 B9R1.6 N=C(N)C1CCCCN1 Amb24659758 [1,0,0,1,0,0|2,0,0]=4 3800 B9R1.6 N=C(N)C1CCCCN1 Amb8630661 [1,0,0,1,0,0|2,0,0]=4 3801 B9R1.6 NC(=O)C1CCCCC1 Amb6335833 [1,0,0,1,0,0|2,0,0]=4 3802 B9R1.6 NC(=O)C1CCCCN1 Amb2370929 [1,0,0,1,0,0|1,0,0]=3 3803 B9R1.6 NC(=O)C1CCCCN1 Amb433771 [1,0,0,1,0,0|1,0,0]=3 3804 B9R1.6 NC(=O)C1CCCCS1 Amb26316109 [1,0,0,1,0,0|2,0,0]=4 3805 B9R1.6 NC(=O)C1CNCCN1 Amb1158016 [1,0,0,1,0,0|2,0,0]=4 3806 B9R1.6 NC(=O)C1COCCN1 Amb22059486 [1,0,0,1,0,0|2,0,0]=4 3807 B9R1.6 NC(=O)C1COCCN1 Amb31308018 [1,0,0,1,0,0|2,0,0]=4 3808 B9R1.6 NC(=O)C1CSCCN1 Amb4004499 [1,0,0,1,0,0|2,0,0]=4 3809 B9R1.6 NC(=O)[C@@H]1CCCCN1 Amb25315367 [1,0,0,1,0,0|1,0,0]=3 3810 B9R1.6 NC(=O)[C@@H]1CNCCN1 Amb24183728 [1,0,0,1,0,0|2,0,0]=4 3811 B9R1.6 NC(=O)[C@@H]1CSCCN1 Amb27950510 [1,0,0,1,0,0|2,0,0]=4 3812 B9R1.6 NC(=O)[C@H]1CCCCN1 Amb27490731 [1,0,0,1,0,0|1,0,0]=3 3813 B9R1.6 NC(=O)[C@H]1CCSCN1 Amb27613173 [1,0,0,1,0,0|2,0,0]=4 3814 B9R1.6 NC(=O)[C@H]1CNCCN1 Amb27355135 [1,0,0,1,0,0|2,0,0]=4 3815 B9R1.6 NC(=O)[C@H]1CNCCN1 Amb8420820 [1,0,0,1,0,0|2,0,0]=4 3816 B9R1.6 NC(=O)[C@H]1COCCN1 Amb27591943 [1,0,0,1,0,0|2,0,0]=4 3817 B9R1.6 NC(=O)[C@H]1COCCN1 Amb27838503 [1,0,0,1,0,0|2,0,0]=4 3818 B9R1.6 NC(=S)C1CCCCN1 Amb19148045 [1,0,0,1,0,0|1,1,0]=4 3819 B9R1.6 O=C(Cl)C1CCCCC1 Amb2792904 [1,0,0,1,0,0|2,0,0]=4 3820 B9R1.6 O=C(Cl)C1CCCCO1 Amb2723690 [1,0,0,1,0,0|2,0,0]=4 3821 B9R1.6 O=C(Cl)C1CCCCS1 Amb27658766 [1,0,0,1,0,0|2,0,0]=4 3822 B9R1.6 O=C(Cl)[C@H]1CCCCO1 Amb24478586 [1,0,0,1,0,0|2,0,0]=4 3823 B9R1.6 O=C(O)C1=CCCCC1 Amb2720517 [1,0,0,1,0,0|1,0,1]=4 3824 B9R1.6 O=C(O)C1=CCCCN1 Amb23585365 [1,0,0,1,0,0|0,0,2]=4 3825 B9R1.6 O=C(O)C1=NCCCC1 Amb24597785 [1,0,0,1,0,0|0,0,2]=4 3826 B9R1.6 O=C(O)C1=NCCCN1 Amb25379456 [1,0,0,1,0,0|1,0,1]=4 3827 B9R1.6 O=C(O)C1C=CCCC1 Amb18642396 [1,0,0,1,0,0|1,0,1]=4 3828 B9R1.6 O=C(O)C1C=CCCN1 Amb25145978 [1,0,0,1,0,0|0,0,2]=4 3829 B9R1.6 O=C(O)C1C=CCCN1 Amb35750834 [1,0,0,1,0,0|0,0,2]=4 3830 B9R1.6 O=C(O)C1CC=CCN1 Amb2698158 [1,0,0,1,0,0|0,0,2]=4 3831 B9R1.6 O=C(O)C1CCCCC1 Amb2721294 [1,0,0,1,0,0|1,0,0]=3 3832 B9R1.6 O=C(O)C1CCCCN1 Amb6754083 [1,0,0,1,0,0|0,0,0]=2 3833 B9R1.6 O=C(O)C1CCCCN1 Amb9703161 [1,0,0,1,0,0|0,0,0]=2 3834 B9R1.6 O=C(O)C1CCCCO1 Amb2723689 [1,0,0,1,0,0|1,0,0]=3 3835 B9R1.6 O=C(O)C1CCCCS1 Amb18202314 [1,0,0,1,0,0|1,0,0]=3 3836 B9R1.6 O=C(O)C1CCCNC1 Amb6239367 [1,0,0,1,0,0|2,0,0]=4 3837 B9R1.6 O=C(O)C1CCCNC1 Amb9703145 [1,0,0,1,0,0|2,0,0]=4 3838 B9R1.6 O=C(O)C1CCCOC1 Amb1102367 [1,0,0,1,0,0|2,0,0]=4 3839 B9R1.6 O=C(O)C1CCCSC1 Amb33545067 [1,0,0,1,0,0|2,0,0]=4 3840 B9R1.6 O=C(O)C1CCCSS1 Amb24480090 [1,0,0,1,0,0|2,0,0]=4 3841 B9R1.6 O=C(O)C1CCNCC1 Amb2720245 [1,0,0,1,0,0|2,0,0]=4 3842 B9R1.6 O=C(O)C1CCNCC1 Amb932842 [1,0,0,1,0,0|2,0,0]=4 3843 B9R1.6 O=C(O)C1CCOCC1 Amb426862 [1,0,0,1,0,0|2,0,0]=4 3844 B9R1.6 O=C(O)C1CCOCN1 Amb28042897 [1,0,0,1,0,0|1,0,0]=3 3845 B9R1.6 O=C(O)C1CCSCC1 Amb6572253 [1,0,0,1,0,0|2,0,0]=4 3846 B9R1.6 O=C(O)C1CCSCN1 Amb1102215 [1,0,0,1,0,0|1,0,0]=3 3847 B9R1.6 O=C(O)C1CCSCN1 Amb22284134 [1,0,0,1,0,0|1,0,0]=3 3848 B9R1.6 O=C(O)C1CNCCN1 Amb22490977 [1,0,0,1,0,0|1,0,0]=3 3849 B9R1.6 O=C(O)C1CNCCN1 Amb2690349 [1,0,0,1,0,0|1,0,0]=3 3850 B9R1.6 O=C(O)C1CNCCN1 Amb2720318 [1,0,0,1,0,0|1,0,0]=3 3851 B9R1.6 O=C(O)C1CNCCO1 Amb16232076 [1,0,0,1,0,0|2,0,0]=4 3852 B9R1.6 O=C(O)C1CNCCO1 Amb2696640 [1,0,0,1,0,0|2,0,0]=4 3853 B9R1.6 O=C(O)C1CNCCS1 Amb8631056 [1,0,0,1,0,0|2,0,0]=4 3854 B9R1.6 O=C(O)C1COCCN1 Amb10607157 [1,0,0,1,0,0|1,0,0]=3 3855 B9R1.6 O=C(O)C1COCCN1 Amb2694767 [1,0,0,1,0,0|1,0,0]=3 3856 B9R1.6 O=C(O)C1COCCO1 Amb5399760 [1,0,0,1,0,0|2,0,0]=4 3857 B9R1.6 O=C(O)C1CSCCN1 Amb19888398 [1,0,0,1,0,0|1,0,0]=3 3858 B9R1.6 O=C(O)C1CSCCN1 Amb2695006 [1,0,0,1,0,0|1,0,0]=3 3859 B9R1.6 O=C(O)C1CSCCS1 Amb20622962 [1,0,0,1,0,0|2,0,0]=4 3860 B9R1.6 O=C(O)C1C[NH2+]CC[NH2+]1 Amb5722241 [1,0,0,1,0,0|1,0,1]=4 3861 B9R1.6 O=C(O)C1NCCCN1 Amb27473323 [1,0,0,1,0,0|1,0,0]=3 3862 B9R1.6 O=C(O)C1NCCCO1 Amb33193117 [1,0,0,1,0,0|1,0,0]=3 3863 B9R1.6 O=C(O)C1NCCCS1 Amb22899084 [1,0,0,1,0,0|1,0,0]=3 3864 B9R1.6 O=C(O)C1OCCCO1 Amb24715581 [1,0,0,1,0,0|2,0,0]=4 3865 B9R1.6 O=C(O)C1SCCCS1 Amb22167283 [1,0,0,1,0,0|2,0,0]=4 3866 B9R1.6 O=C(O)N1CCCCC1 Amb20242677 [1,0,0,1,0,0|2,0,0]=4 3867 B9R1.6 O=C(O)N1CCCCC1 Amb35825557 [1,0,0,1,0,0|2,0,0]=4 3868 B9R1.6 O=C(O)[C@@H]1CCC=CN1 Amb19888332 [1,0,0,1,0,0|0,0,2]=4 3869 B9R1.6 O=C(O)[C@@H]1CCC=NN1 Amb27468483 [1,0,0,1,0,0|1,0,1]=4 3870 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb2690345 [1,0,0,1,0,0|0,0,0]=2 3871 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb8384272 [1,0,0,1,0,0|0,0,0]=2 3872 B9R1.6 O=C(O)[C@@H]1CCCCO1 Amb22746821 [1,0,0,1,0,0|1,0,0]=3 3873 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb16232354 [1,0,0,1,0,0|2,0,0]=4 3874 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb8628966 [1,0,0,1,0,0|2,0,0]=4 3875 B9R1.6 O=C(O)[C@@H]1CCCNN1 Amb30666630 [1,0,0,1,0,0|1,0,0]=3 3876 B9R1.6 O=C(O)[C@@H]1CCCOC1 Amb26885613 [1,0,0,1,0,0|2,0,0]=4 3877 B9R1.6 O=C(O)[C@@H]1CCCSC1 Amb27826589 [1,0,0,1,0,0|2,0,0]=4 3878 B9R1.6 O=C(O)[C@@H]1CNCCN1 Amb6307277 [1,0,0,1,0,0|1,0,0]=3 3879 B9R1.6 O=C(O)[C@@H]1CNCCN1 Amb6307319 [1,0,0,1,0,0|1,0,0]=3 3880 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb22737231 [1,0,0,1,0,0|2,0,0]=4 3881 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb8631069 [1,0,0,1,0,0|2,0,0]=4 3882 B9R1.6 O=C(O)[C@@H]1COCCN1 Amb10576585 [1,0,0,1,0,0|1,0,0]=3 3883 B9R1.6 O=C(O)[C@@H]1COCCN1 Amb2696709 [1,0,0,1,0,0|1,0,0]=3 3884 B9R1.6 O=C(O)[C@@H]1COCCO1 Amb23438856 [1,0,0,1,0,0|2,0,0]=4 3885 B9R1.6 O=C(O)[C@@H]1CSCCN1 Amb22386830 [1,0,0,1,0,0|1,0,0]=3 3886 B9R1.6 O=C(O)[C@@H]1CSCCN1 Amb8630483 [1,0,0,1,0,0|1,0,0]=3 3887 B9R1.6 O=C(O)[C@H]1CCC=NN1 Amb27596226 [1,0,0,1,0,0|1,0,1]=4 3888 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb2700060 [1,0,0,1,0,0|0,0,0]=2 3889 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb8515100 [1,0,0,1,0,0|0,0,0]=2 3890 B9R1.6 O=C(O)[C@H]1CCCCO1 Amb26865454 [1,0,0,1,0,0|1,0,0]=3 3891 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8384271 [1,0,0,1,0,0|2,0,0]=4 3892 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8389307 [1,0,0,1,0,0|2,0,0]=4 3893 B9R1.6 O=C(O)[C@H]1CCCNN1 Amb27154761 [1,0,0,1,0,0|1,0,0]=3 3894 B9R1.6 O=C(O)[C@H]1CCCSC1 Amb27809148 [1,0,0,1,0,0|2,0,0]=4 3895 B9R1.6 O=C(O)[C@H]1CCSCN1 Amb25773953 [1,0,0,1,0,0|1,0,0]=3 3896 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb20241207 [1,0,0,1,0,0|1,0,0]=3 3897 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb2694998 [1,0,0,1,0,0|1,0,0]=3 3898 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb8628465 [1,0,0,1,0,0|1,0,0]=3 3899 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb10067023 [1,0,0,1,0,0|2,0,0]=4 3900 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb22737232 [1,0,0,1,0,0|2,0,0]=4 3901 B9R1.6 O=C(O)[C@H]1COCCN1 Amb16232575 [1,0,0,1,0,0|1,0,0]=3 3902 B9R1.6 O=C(O)[C@H]1COCCN1 Amb2696766 [1,0,0,1,0,0|1,0,0]=3 3903 B9R1.6 O=C(O)[C@H]1COCCO1 Amb26430807 [1,0,0,1,0,0|2,0,0]=4 3904 B9R1.6 O=C(O)[C@H]1CSCCN1 Amb2700568 [1,0,0,1,0,0|1,0,0]=3 3905 B9R1.6 O=S(O)C1CCCCC1 Amb24603074 [1,0,0,1,0,0|2,0,0]=4 3906 B9R1.6 O=[PH](O)C1CCCCN1 Amb28131021 [1,0,0,1,0,0|1,0,0]=3 3907 B9R1.9 CCCC[C@H]1CC(=O)N1 Amb27627588 [1,0,0,1,0,0|2,0,0]=4 3908 B9R1.9 NCCCN1CC(=O)C1 Amb28313692 [1,0,0,1,0,0|2,0,0]=4 3909 B9R1.13 C=C(C)CC1CCCN1 Amb25162820 [1,0,0,1,0,0|2,0,0]=4 3910 B9R1.13 CC(=O)CC1CCCC1 Amb2721149 [1,0,0,1,0,0|2,0,0]=4 3911 B9R1.13 CC(=O)CC1CCCN1 Amb24064067 [1,0,0,1,0,0|1,0,0]=3 3912 B9R1.13 CC(=O)CC1CCCO1 Amb13952621 [1,0,0,1,0,0|2,0,0]=4 3913 B9R1.13 CC(=O)CC1CCCS1 Amb33416251 [1,0,0,1,0,0|2,0,0]=4 3914 B9R1.13 CC(=O)C[C@H]1CCCN1 Amb25887375 [1,0,0,1,0,0|1,0,0]=3 3915 B9R1.13 CC(=O)NC1CCCN1 Amb28400896 [1,0,0,1,0,0|2,0,0]=4 3916 B9R1.13 CC(O)CC1CCCN1 Amb22059496 [1,0,0,1,0,0|1,0,1]=4 3917 B9R1.13 C[C@H](O)C[C@@H]1CCCN1 Amb28428898 [1,0,0,1,0,0|1,0,1]=4 3918 B9R1.13 C[C@H](O)C[C@H]1CCCN1 Amb27786187 [1,0,0,1,0,0|1,0,1]=4 3919 B9R1.13 NC(=O)CC1CCCC1 Amb6892422 [1,0,0,1,0,0|2,0,0]=4 3920 B9R1.13 NC(=O)CC1CCCN1 Amb18282785 [1,0,0,1,0,0|1,0,0]=3 3921 B9R1.13 NC(=O)CC1CCCN1 Amb28934952 [1,0,0,1,0,0|1,0,0]=3 3922 B9R1.13 O=C(Cl)CC1CCCC1 Amb3939570 [1,0,0,1,0,0|2,0,0]=4 3923 B9R1.13 O=C(Cl)CC1CCCN1 Amb27792098 [1,0,0,1,0,0|1,0,0]=3 3924 B9R1.13 O=C(Cl)CC1CCCO1 Amb25921099 [1,0,0,1,0,0|2,0,0]=4 3925 B9R1.13 O=C(O)CC1=CCCC1 Amb18642404 [1,0,0,1,0,0|1,0,1]=4 3926 B9R1.13 O=C(O)CC1=NCCN1 Amb28256209 [1,0,0,1,0,0|1,0,1]=4 3927 B9R1.13 O=C(O)CC1C=CCC1 Amb9703199 [1,0,0,1,0,0|1,0,1]=4 3928 B9R1.13 O=C(O)CC1CCCC1 Amb16192937 [1,0,0,1,0,0|1,0,0]=3 3929 B9R1.13 O=C(O)CC1CCCC1 Amb3939847 [1,0,0,1,0,0|1,0,0]=3 3930 B9R1.13 O=C(O)CC1CCCN1 Amb20668514 [1,0,0,1,0,0|0,0,0]=2 3931 B9R1.13 O=C(O)CC1CCCN1 Amb8387921 [1,0,0,1,0,0|0,0,0]=2 3932 B9R1.13 O=C(O)CC1CCCO1 Amb9713389 [1,0,0,1,0,0|1,0,0]=3 3933 B9R1.13 O=C(O)CC1CCNC1 Amb2695002 [1,0,0,1,0,0|2,0,0]=4 3934 B9R1.13 O=C(O)CC1CCNC1 Amb33549788 [1,0,0,1,0,0|2,0,0]=4 3935 B9R1.13 O=C(O)CC1CCOC1 Amb2696440 [1,0,0,1,0,0|2,0,0]=4 3936 B9R1.13 O=C(O)CC1CCSC1 Amb18202318 [1,0,0,1,0,0|2,0,0]=4 3937 B9R1.13 O=C(O)CC1CCSS1 Amb8388096 [1,0,0,1,0,0|2,0,0]=4 3938 B9R1.13 O=C(O)CC1CSCN1 Amb32990250 [1,0,0,1,0,0|1,0,0]=3 3939 B9R1.13 O=C(O)CC1NCCS1 Amb18644340 [1,0,0,1,0,0|1,0,0]=3 3940 B9R1.13 O=C(O)CC1OCCO1 Amb22740193 [1,0,0,1,0,0|2,0,0]=4 3941 B9R1.13 O=C(O)CN1CCCC1 Amb535912 [1,0,0,1,0,0|2,0,0]=4 3942 B9R1.13 O=C(O)CN1CCCC1 Amb9677391 [1,0,0,1,0,0|2,0,0]=4 3943 B9R1.13 O=C(O)C[C@@H]1CCCN1 Amb13891876 [1,0,0,1,0,0|0,0,0]=2 3944 B9R1.13 O=C(O)C[C@@H]1CCCN1 Amb8630792 [1,0,0,1,0,0|0,0,0]=2 3945 B9R1.13 O=C(O)C[C@@H]1CCCO1 Amb24271115 [1,0,0,1,0,0|1,0,0]=3 3946 B9R1.13 O=C(O)C[C@@H]1CCNC1 Amb10067024 [1,0,0,1,0,0|2,0,0]=4 3947 B9R1.13 O=C(O)C[C@@H]1CCNC1 Amb26948232 [1,0,0,1,0,0|2,0,0]=4 3948 B9R1.13 O=C(O)C[C@@H]1CCOC1 Amb25887272 [1,0,0,1,0,0|2,0,0]=4 3949 B9R1.13 O=C(O)C[C@H]1CCCN1 Amb16184011 [1,0,0,1,0,0|0,0,0]=2 3950 B9R1.13 O=C(O)C[C@H]1CCCN1 Amb33295230 [1,0,0,1,0,0|0,0,0]=2 3951 B9R1.13 O=C(O)C[C@H]1CCCO1 Amb24271109 [1,0,0,1,0,0|1,0,0]=3 3952 B9R1.13 O=C(O)C[C@H]1CCNC1 Amb2696648 [1,0,0,1,0,0|2,0,0]=4 3953 B9R1.13 O=C(O)C[C@H]1CCNC1 Amb8384306 [1,0,0,1,0,0|2,0,0]=4 3954 B9R1.13 O=C(O)C[C@H]1CCOC1 Amb23401495 [1,0,0,1,0,0|2,0,0]=4 3955 B9R1.24 NCC1CCCS1(=O)=O Amb17063302 [1,0,0,1,0,0|1,0,1]=4 3956 B9R1.24 NCC1CCCS1(=O)=O Amb32662917 [1,0,0,1,0,0|1,0,1]=4 3957 B9R1.40 CC1(O)CCCCC1N Amb25709525 [1,0,0,1,0,0|1,0,1]=4 3958 B9R1.40 C[C@@]1(O)CCCC[C@@H]1N Amb28134269 [1,0,0,1,0,0|1,0,1]=4 3959 B9R1.40 C[C@@]1(O)CCCC[C@H]1N Amb24382560 [1,0,0,1,0,0|1,0,1]=4 3960 B9R1.41 CC(=O)C1CCCC1N Amb26959185 [1,0,0,1,0,0|1,0,0]=3 3961 B9R1.41 CC(=O)C1CCCC1O Amb25086736 [1,0,0,1,0,0|2,0,0]=4 3962 B9R1.41 CC(=O)C1COCC1N Amb25918760 [1,0,0,1,0,0|2,0,0]=4 3963 B9R1.41 CC(=O)C1OCCC1N Amb33307372 [1,0,0,1,0,0|2,0,0]=4 3964 B9R1.41 CC(=O)[C@@H]1CCCN1N Amb26968682 [1,0,0,1,0,0|2,0,0]=4 3965 B9R1.41 CC(=O)[C@@H]1CCC[C@@H]1N Amb33132196 [1,0,0,1,0,0|1,0,0]=3 3966 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1C Amb24692616 [1,0,0,1,0,0|2,0,0]=4 3967 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1O Amb27440450 [1,0,0,1,0,0|2,0,0]=4 3968 B9R1.41 CC(=O)[C@@H]1OCC[C@@H]1N Amb33307350 [1,0,0,1,0,0|2,0,0]=4 3969 B9R1.41 CC(=O)[C@H]1CCC[C@H]1C Amb27428390 [1,0,0,1,0,0|2,0,0]=4 3970 B9R1.41 CC(O)C1CCCC1N Amb18203228 [1,0,0,1,0,0|1,0,1]=4 3971 B9R1.41 CC(O)[C@@H]1CCC[C@@H]1N Amb30039509 [1,0,0,1,0,0|1,0,1]=4 3972 B9R1.41 CC1CCCC1C(=O)Cl Amb26447682 [1,0,0,1,0,0|2,0,0]=4 3973 B9R1.41 CC1CCCC1C(=O)O Amb8496598 [1,0,0,1,0,0|1,0,0]=3 3974 B9R1.41 CC1CCNC1C(=O)O Amb22496299 [1,0,0,1,0,0|2,0,0]=4 3975 B9R1.41 CC1CCNC1C(=O)O Amb28895929 [1,0,0,1,0,0|2,0,0]=4 3976 B9R1.41 CC1CCN[C@@H]1C(=O)O Amb25786199 [1,0,0,1,0,0|2,0,0]=4 3977 B9R1.41 CC1CCOC1C(=O)O Amb20668280 [1,0,0,1,0,0|2,0,0]=4 3978 B9R1.41 CC1CCSC1C(=O)O Amb33038449 [1,0,0,1,0,0|2,0,0]=4 3979 B9R1.41 CC1CNCC1C(=O)O Amb2695368 [1,0,0,1,0,0|2,0,0]=4 3980 B9R1.41 CC1CNCC1C(=O)O Amb32665482 [1,0,0,1,0,0|2,0,0]=4 3981 B9R1.41 CC1NCCC1C(=O)O Amb18118138 [1,0,0,1,0,0|2,0,0]=4 3982 B9R1.41 CC1NCCC1C(=O)O Amb28555367 [1,0,0,1,0,0|2,0,0]=4 3983 B9R1.41 CC1OCCC1C(=O)O Amb33548509 [1,0,0,1,0,0|2,0,0]=4 3984 B9R1.41 CN1CCCC1C(=O)O Amb33545070 [1,0,0,1,0,0|2,0,0]=4 3985 B9R1.41 CN1CCCC1C(=O)O Amb8559038 [1,0,0,1,0,0|2,0,0]=4 3986 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb17935722 [1,0,0,1,0,0|2,0,0]=4 3987 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb18559228 [1,0,0,1,0,0|2,0,0]=4 3988 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb22748316 [1,0,0,1,0,0|2,0,0]=4 3989 B9R1.41 CN1CCC[C@H]1C(=O)O Amb10604041 [1,0,0,1,0,0|2,0,0]=4 3990 B9R1.41 CN1CCC[C@H]1C(=O)O Amb22587172 [1,0,0,1,0,0|2,0,0]=4 3991 B9R1.41 CN1CCC[C@H]1C(=O)O Amb9825903 [1,0,0,1,0,0|2,0,0]=4 3992 B9R1.41 CS(=O)C1CCCC1N Amb27862371 [1,0,0,1,0,0|2,0,0]=4 3993 B9R1.41 C[C@@H]1CCCC1C(=O)O Amb27167847 [1,0,0,1,0,0|1,0,0]=3 3994 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [1,0,0,1,0,0|1,0,0]=3 3995 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [1,0,0,1,0,0|1,0,0]=3 3996 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O Amb22747259 [1,0,0,1,0,0|2,0,0]=4 3997 B9R1.41 C[C@@H]1CCO[C@@H]1C(=O)O Amb25251332 [1,0,0,1,0,0|2,0,0]=4 3998 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O Amb34916171 [1,0,0,1,0,0|2,0,0]=4 3999 B9R1.41 C[C@@H]1CNC[C@@H]1C(=O)O Amb27440055 [1,0,0,1,0,0|2,0,0]=4 4000 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb26442159 [1,0,0,1,0,0|2,0,0]=4 4001 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb32664837 [1,0,0,1,0,0|2,0,0]=4 4002 B9R1.41 C[C@@H]1COC[C@H]1C(=O)O Amb28286229 [1,0,0,1,0,0|2,0,0]=4 4003 B9R1.41 C[C@@H]1NCC[C@@H]1C(=O)O Amb27969130 [1,0,0,1,0,0|2,0,0]=4 4004 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O Amb18832568 [1,0,0,1,0,0|2,0,0]=4 4005 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O Amb22886528 [1,0,0,1,0,0|2,0,0]=4 4006 B9R1.41 C[C@@H]1OCC[C@H]1C(=O)O Amb25992190 [1,0,0,1,0,0|2,0,0]=4 4007 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [1,0,0,1,0,0|1,0,0]=3 4008 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [1,0,0,1,0,0|1,0,0]=3 4009 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O Amb8387164 [1,0,0,1,0,0|2,0,0]=4 4010 B9R1.41 C[C@H]1CNC[C@@H]1C(=O)O Amb27217270 [1,0,0,1,0,0|2,0,0]=4 4011 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O Amb27655604 [1,0,0,1,0,0|2,0,0]=4 4012 B9R1.41 C[C@H]1OCC[C@H]1C(=O)O Amb25253338 [1,0,0,1,0,0|2,0,0]=4 4013 B9R1.41 N=C(N)C1CCCC1N Amb28124603 [1,0,0,1,0,0|2,0,0]=4 4014 B9R1.41 N=C(N)C1CCCC1N Amb33038277 [1,0,0,1,0,0|2,0,0]=4 4015 B9R1.41 NC(=O)C1CCCC1N Amb19148786 [1,0,0,1,0,0|1,0,0]=3 4016 B9R1.41 NC(=O)C1CCCC1N Amb32644747 [1,0,0,1,0,0|1,0,0]=3 4017 B9R1.41 NC(=O)C1CCCC1N Amb32662680 [1,0,0,1,0,0|1,0,0]=3 4018 B9R1.41 NC(=O)C1CCCC1O Amb25310986 [1,0,0,1,0,0|2,0,0]=4 4019 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N Amb8515831 [1,0,0,1,0,0|1,0,0]=3 4020 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1O Amb8515027 [1,0,0,1,0,0|2,0,0]=4 4021 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb26432403 [1,0,0,1,0,0|1,0,0]=3 4022 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb32662604 [1,0,0,1,0,0|1,0,0]=3 4023 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb32662606 [1,0,0,1,0,0|1,0,0]=3 4024 B9R1.41 NC(=O)[C@H]1CCC[C@H]1O Amb26630221 [1,0,0,1,0,0|2,0,0]=4 4025 B9R1.41 NC1=C(C(=O)O)CCC1 Amb20240586 [1,0,0,1,0,0|0,0,2]=4 4026 B9R1.41 NC1C=CCC1C(=O)O Amb25723511 [1,0,0,1,0,0|0,0,2]=4 4027 B9R1.41 NC1CCCC1C(=O)O Amb2697364 [1,0,0,1,0,0|0,0,0]=2 4028 B9R1.41 NC1CCCC1C(=O)O Amb8630257 [1,0,0,1,0,0|0,0,0]=2 4029 B9R1.41 NC1CCCC1C(O)=[ClH] Amb27883058 [1,0,0,1,0,0|1,0,0]=3 4030 B9R1.41 NC1CCNC1C(=O)O Amb27153692 [1,0,0,1,0,0|1,0,0]=3 4031 B9R1.41 NC1CCOC1C(=O)O Amb26642919 [1,0,0,1,0,0|1,0,0]=3 4032 B9R1.41 NC1CNCC1C(=O)O Amb8630131 [1,0,0,1,0,0|1,0,0]=3 4033 B9R1.41 NC1COCC1C(=O)O Amb24709230 [1,0,0,1,0,0|1,0,0]=3 4034 B9R1.41 NC1CSCC1C(=O)O Amb24457278 [1,0,0,1,0,0|1,0,0]=3 4035 B9R1.41 NN1CCCC1C(=O)O Amb18642792 [1,0,0,1,0,0|1,0,0]=3 4036 B9R1.41 NN1CCC[C@H]1C(=O)O Amb25887284 [1,0,0,1,0,0|1,0,0]=3 4037 B9R1.41 N[C@@H]1C=CC[C@@H]1C(=O)O Amb33716093 [1,0,0,1,0,0|0,0,2]=4 4038 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8387462 [1,0,0,1,0,0|0,0,0]=2 4039 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8516030 [1,0,0,1,0,0|0,0,0]=2 4040 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb20241297 [1,0,0,1,0,0|0,0,0]=2 4041 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb33524005 [1,0,0,1,0,0|0,0,0]=2 4042 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb19929517 [1,0,0,1,0,0|1,0,0]=3 4043 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb31028940 [1,0,0,1,0,0|1,0,0]=3 4044 B9R1.41 N[C@@H]1CCO[C@@H]1C(=O)O Amb31264036 [1,0,0,1,0,0|1,0,0]=3 4045 B9R1.41 N[C@@H]1CCO[C@@H]1C(=O)O Amb32666901 [1,0,0,1,0,0|1,0,0]=3 4046 B9R1.41 N[C@@H]1CNC[C@H]1C(=O)O Amb27207888 [1,0,0,1,0,0|1,0,0]=3 4047 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O Amb24078777 [1,0,0,1,0,0|1,0,0]=3 4048 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O Amb33330248 [1,0,0,1,0,0|1,0,0]=3 4049 B9R1.41 N[C@H]1C=CC[C@H]1C(=O)O Amb26425593 [1,0,0,1,0,0|0,0,2]=4 4050 B9R1.41 N[C@H]1C=CC[C@H]1C(=O)O Amb31307611 [1,0,0,1,0,0|0,0,2]=4 4051 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb20241298 [1,0,0,1,0,0|0,0,0]=2 4052 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb22224860 [1,0,0,1,0,0|0,0,0]=2 4053 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993719 [1,0,0,1,0,0|0,0,0]=2 4054 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993764 [1,0,0,1,0,0|0,0,0]=2 4055 B9R1.41 N[C@H]1CCN[C@@H]1C(=O)O Amb27460833 [1,0,0,1,0,0|1,0,0]=3 4056 B9R1.41 N[C@H]1CCN[C@H]1C(=O)O Amb26904835 [1,0,0,1,0,0|1,0,0]=3 4057 B9R1.41 N[C@H]1CNC[C@@H]1C(=O)O Amb27880509 [1,0,0,1,0,0|1,0,0]=3 4058 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O Amb24605467 [1,0,0,1,0,0|1,0,0]=3 4059 B9R1.41 N[C@H]1CSC[C@H]1C(=O)O Amb25980819 [1,0,0,1,0,0|1,0,0]=3 4060 B9R1.41 O=C(Cl)C1CCCC1O Amb24524192 [1,0,0,1,0,0|2,0,0]=4 4061 B9R1.41 O=C(Cl)[C@@H]1CCC[C@@H]1O Amb27475951 [1,0,0,1,0,0|2,0,0]=4 4062 B9R1.41 O=C(O)C1CCCC1=O Amb18642571 [1,0,0,1,0,0|1,0,1]=4 4063 B9R1.41 O=C(O)C1CCCC1O Amb19148040 [1,0,0,1,0,0|1,0,0]=3 4064 B9R1.41 O=C(O)C1CCCC1S Amb18280971 [1,0,0,1,0,0|1,0,0]=3 4065 B9R1.41 O=C(O)C1CNCC1F Amb26864070 [1,0,0,1,0,0|2,0,0]=4 4066 B9R1.41 O=C(O)C1CNCC1F Amb33496211 [1,0,0,1,0,0|2,0,0]=4 4067 B9R1.41 O=C(O)C1CNCC1O Amb22886381 [1,0,0,1,0,0|2,0,0]=4 4068 B9R1.41 O=C(O)C1CNCC1O Amb26026738 [1,0,0,1,0,0|2,0,0]=4 4069 B9R1.41 O=C(O)C1COCC1O Amb27270738 [1,0,0,1,0,0|2,0,0]=4 4070 B9R1.41 O=C(O)C1CSCC1O Amb18831363 [1,0,0,1,0,0|2,0,0]=4 4071 B9R1.41 O=C(O)C1NCCC1F Amb25772909 [1,0,0,1,0,0|2,0,0]=4 4072 B9R1.41 O=C(O)C1NCCC1O Amb22387784 [1,0,0,1,0,0|2,0,0]=4 4073 B9R1.41 O=C(O)C1NCC[C@@H]1O Amb34913313 [1,0,0,1,0,0|2,0,0]=4 4074 B9R1.41 O=C(O)C1SCCC1F Amb27201981 [1,0,0,1,0,0|2,0,0]=4 4075 B9R1.41 O=C(O)[C@@H]1CNC[C@@H]1O Amb27186915 [1,0,0,1,0,0|2,0,0]=4 4076 B9R1.41 O=C(O)[C@@H]1CNC[C@H]1O Amb24120417 [1,0,0,1,0,0|2,0,0]=4 4077 B9R1.41 O=C(O)[C@@H]1NCCC1F Amb30988050 [1,0,0,1,0,0|2,0,0]=4 4078 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F Amb26904377 [1,0,0,1,0,0|2,0,0]=4 4079 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb22230426 [1,0,0,1,0,0|2,0,0]=4 4080 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801217 [1,0,0,1,0,0|2,0,0]=4 4081 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801367 [1,0,0,1,0,0|2,0,0]=4 4082 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Amb26891987 [1,0,0,1,0,0|2,0,0]=4 4083 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Amb30988051 [1,0,0,1,0,0|2,0,0]=4 4084 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb22746713 [1,0,0,1,0,0|2,0,0]=4 4085 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb24183557 [1,0,0,1,0,0|2,0,0]=4 4086 B9R1.41 O=C(O)[C@H]1CCC[C@@H]1O Amb27437088 [1,0,0,1,0,0|1,0,0]=3 4087 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O Amb22747315 [1,0,0,1,0,0|1,0,0]=3 4088 B9R1.41 O=C(O)[C@H]1CNC[C@@H]1O Amb27421639 [1,0,0,1,0,0|2,0,0]=4 4089 B9R1.41 O=C(O)[C@H]1CNC[C@H]1O Amb27818119 [1,0,0,1,0,0|2,0,0]=4 4090 B9R1.41 O=C(O)[C@H]1NCCC1O Amb10604192 [1,0,0,1,0,0|2,0,0]=4 4091 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1Cl Amb27618755 [1,0,0,1,0,0|2,0,0]=4 4092 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb24055327 [1,0,0,1,0,0|2,0,0]=4 4093 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb34154004 [1,0,0,1,0,0|2,0,0]=4 4094 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb8515204 [1,0,0,1,0,0|2,0,0]=4 4095 B9R1.41 O=C(O)[C@H]1NCC[C@H]1Br Amb27232994 [1,0,0,1,0,0|2,0,0]=4 4096 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb22746928 [1,0,0,1,0,0|2,0,0]=4 4097 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb23439285 [1,0,0,1,0,0|2,0,0]=4 4098 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb24183503 [1,0,0,1,0,0|2,0,0]=4 4099 B9R1.41 O=C(O)[C@H]1NCC[C@H]1S Amb27421961 [1,0,0,1,0,0|2,0,0]=4 4100 B9R1.46 CC(=O)CCC1CC1C Amb25873753 [1,0,0,1,0,0|2,0,0]=4 4101 B9R1.46 CC1CC1CCC(=O)O Amb27220003 [1,0,0,1,0,0|1,0,0]=3 4102 B9R1.46 CC1CC1OCC(=O)O Amb33144889 [1,0,0,1,0,0|2,0,0]=4 4103 B9R1.48 CC1=CC(N)CCCC1 Amb28040829 [1,0,0,1,0,0|2,0,0]=4 4104 B9R1.48 CC1CCCCC(=O)C1 Amb17593325 [1,0,0,1,0,0|2,0,0]=4 4105 B9R1.48 CC1CCCCC(=O)N1 Amb22434912 [1,0,0,1,0,0|2,0,0]=4 4106 B9R1.48 CC1CCCCC(=O)O1 Amb27792220 [1,0,0,1,0,0|1,0,0]=3 4107 B9R1.48 C[C@@H]1CCCCC(=O)C1 Amb26030783 [1,0,0,1,0,0|2,0,0]=4 4108 B9R1.48 N[C@@H]1CCCC[C@H](O)C1 Amb27188377 [1,0,0,1,0,0|1,0,1]=4 4109 B9R1.48 O=C1CCCCC(=O)O1 Amb8487366 [1,0,0,1,0,0|1,0,1]=4 4110 B9R1.48 O=C1CCCCC(O)C1 Amb27838745 [1,0,0,1,0,0|2,0,0]=4 4111 B9R1.48 O=C1CCCCC(O)O1 Amb27424648 [1,0,0,1,0,0|1,0,0]=3 4112 B9R1.48 O=C1CCCC[C@H](O)C1 Amb27618242 [1,0,0,1,0,0|2,0,0]=4 4113 B9R1.59 CCCC1CC1C(=O)O Amb19001459 [1,0,0,1,0,0|1,0,0]=3 4114 B9R1.59 CCCC1OC1C(=O)O Amb24561183 [1,0,0,1,0,0|2,0,0]=4 4115 B9R1.59 CCC[C@@H]1C[C@@H]1C(=O)O Amb9901777 [1,0,0,1,0,0|1,0,0]=3 4116 B9R1.59 CCC[C@@H]1C[C@H]1C(=O)O Amb25368727 [1,0,0,1,0,0|1,0,0]=3 4117 B9R1.59 CCC[C@@H]1C[C@H]1C(N)=O Amb27837259 [1,0,0,1,0,0|2,0,0]=4 4118 B9R1.59 CCC[C@@H]1O[C@H]1C(=O)O Amb27422047 [1,0,0,1,0,0|2,0,0]=4 4119 B9R1.59 CCC[C@H]1C[C@H]1C(=O)O Amb27782329 [1,0,0,1,0,0|1,0,0]=3 4120 B9R1.59 CCC[C@H]1O[C@@H]1C(=O)O Amb27625884 [1,0,0,1,0,0|2,0,0]=4 4121 B9R1.59 CCOC1CC1C(=O)O Amb9677563 [1,0,0,1,0,0|2,0,0]=4 4122 B9R1.59 CCO[C@@H]1C[C@@H]1C(=O)O Amb27818165 [1,0,0,1,0,0|2,0,0]=4 4123 B9R1.59 CCO[C@@H]1C[C@H]1C(=O)O Amb25959626 [1,0,0,1,0,0|2,0,0]=4 4124 B9R1.59 COCC1CC1C(=O)O Amb27404704 [1,0,0,1,0,0|2,0,0]=4 4125 B9R1.59 COC[C@@H]1C[C@H]1C(=O)O Amb33098418 [1,0,0,1,0,0|2,0,0]=4 4126 B9R1.59 COC[C@H]1C[C@H]1C(=O)O Amb33098416 [1,0,0,1,0,0|2,0,0]=4 4127 B9R1.59 CSCC1CC1C(=O)O Amb33272939 [1,0,0,1,0,0|2,0,0]=4 4128 B9R1.59 CSC[C@@H]1C[C@H]1C(=O)O Amb33272937 [1,0,0,1,0,0|2,0,0]=4 4129 B9R1.59 O=C(O)C1CC1CCF Amb33196442 [1,0,0,1,0,0|1,0,0]=3 4130 B9R1.59 O=C(O)[C@@H]1C[C@H]1CCF Amb33196453 [1,0,0,1,0,0|1,0,0]=3 4131 B9R1.67 CC(=O)CC1CCC1F Amb27597070 [1,0,0,1,0,0|2,0,0]=4 4132 B9R1.67 CC1CCN1CC(=O)O Amb27838508 [1,0,0,1,0,0|2,0,0]=4 4133 B9R1.67 CC1CCN1CC(=O)O Amb33552557 [1,0,0,1,0,0|2,0,0]=4 4134 B9R1.67 O=C(O)CC1CCC1F Amb33351668 [1,0,0,1,0,0|1,0,0]=3 4135 B9R1.84 CC(=O)CCC1CCC1 Amb24534447 [1,0,0,1,0,0|2,0,0]=4 4136 B9R1.84 NC(=O)CCC1CCC1 Amb27196680 [1,0,0,1,0,0|2,0,0]=4 4137 B9R1.84 NC(=O)NCC1CCN1 Amb28052840 [1,0,0,1,0,0|2,0,0]=4 4138 B9R1.84 O=C(O)C#CC1CCN1 Amb33168952 [1,0,0,1,0,0|0,0,2]=4 4139 B9R1.84 O=C(O)CCC1CCC1 Amb8011305 [1,0,0,1,0,0|1,0,0]=3 4140 B9R1.84 O=C(O)CCC1CCO1 Amb28280741 [1,0,0,1,0,0|1,0,0]=3 4141 B9R1.84 O=C(O)CCN1CCC1 Amb22292346 [1,0,0,1,0,0|2,0,0]=4 4142 B9R1.84 O=C(O)CC[C@@H]1CCN1 Amb27439305 [1,0,0,1,0,0|0,0,0]=2 4143 B9R1.84 O=C(O)CNC1CCC1 Amb18982434 [1,0,0,1,0,0|2,0,0]=4 4144 B9R1.84 O=C(O)COC1CCC1 Amb18295877 [1,0,0,1,0,0|2,0,0]=4 4145 B9R1.84 O=C([O-])CCC1CCO1 Amb32663662 [1,0,0,1,0,0|1,0,1]=4 4146 B9R1.85 CC(=O)CCCC1CC1 Amb25303589 [1,0,0,1,0,0|2,0,0]=4 4147 B9R1.85 NC(=O)CCCC1CC1 Amb28193047 [1,0,0,1,0,0|2,0,0]=4 4148 B9R1.85 O=C(O)CCCC1CC1 Amb18832629 [1,0,0,1,0,0|1,0,0]=3 4149 B9R1.85 O=C(O)CCCC1CO1 Amb28453878 [1,0,0,1,0,0|1,0,0]=3 4150 B9R1.85 O=C(O)CCC[C@@H]1CO1 Amb27257665 [1,0,0,1,0,0|1,0,0]=3 4151 B9R1.85 O=C(O)CCNC1CC1 Amb1106410 [1,0,0,1,0,0|2,0,0]=4 4152 B9R1.85 O=C(O)CCNC1CC1 Amb532234 [1,0,0,1,0,0|2,0,0]=4 4153 B9R1.85 O=C(O)CCOC1CC1 Amb25926315 [1,0,0,1,0,0|2,0,0]=4 4154 B9R1.85 O=C(O)CNCC1CC1 Amb33038298 [1,0,0,1,0,0|2,0,0]=4 4155 B9R1.85 O=C(O)CNCC1CC1 Amb7766420 [1,0,0,1,0,0|2,0,0]=4 4156 B9R1.85 O=C(O)COCC1CC1 Amb6680905 [1,0,0,1,0,0|2,0,0]=4 4157 B9R1.85 O=C(O)CSCC1CC1 Amb9173460 [1,0,0,1,0,0|2,0,0]=4 4158 B9R1.86 CCC1CC1CC(=O)O Amb27249848 [1,0,0,1,0,0|1,0,0]=3 4159 B9R1.86 O=C(O)CC1CC1CF Amb27237859 [1,0,0,1,0,0|1,0,0]=3 4160 B9R1.96 CC(=O)N1CCC1CN Amb27963054 [1,0,0,1,0,0|2,0,0]=4 4161 B9R1.96 CCC1CCC1C(=O)O Amb25727014 [1,0,0,1,0,0|1,0,0]=3 4162 B9R1.96 CCC1CN[C@@H]1C(=O)O Amb30633665 [1,0,0,1,0,0|2,0,0]=4 4163 B9R1.96 CCN1CCC1C(=O)O Amb22011877 [1,0,0,1,0,0|2,0,0]=4 4164 B9R1.96 CCN1CC[C@@H]1C(=O)O Amb24634744 [1,0,0,1,0,0|2,0,0]=4 4165 B9R1.96 CCN1CC[C@H]1C(=O)O Amb25347394 [1,0,0,1,0,0|2,0,0]=4 4166 B9R1.96 COC1CCC1C(=O)O Amb26516125 [1,0,0,1,0,0|2,0,0]=4 4167 B9R1.96 CO[C@@H]1CC[C@@H]1C(=O)O Amb34912847 [1,0,0,1,0,0|2,0,0]=4 4168 B9R1.96 CO[C@@H]1CC[C@H]1C(=O)O Amb26636288 [1,0,0,1,0,0|2,0,0]=4 4169 B9R1.96 N#CC1CCC1C(=O)O Amb26949285 [1,0,0,1,0,0|0,0,2]=4 4170 B9R1.96 NC[C@@H]1CC[C@H]1C(=O)O Amb27259838 [1,0,0,1,0,0|0,0,0]=2 4171 B9R1.96 NC[C@H]1CC[C@@H]1C(N)=O Amb27966233 [1,0,0,1,0,0|1,0,0]=3 4172 B9R1.96 O=C(O)C1CCC1CF Amb20667674 [1,0,0,1,0,0|1,0,0]=3 4173 B9R1.96 O=C(O)C1CCC1CO Amb24340315 [1,0,0,1,0,0|1,0,0]=3 4174 B9R1.96 O=C(O)N1CCC1CO Amb22756926 [1,0,0,1,0,0|2,0,0]=4 4175 B9R1.148 O=S1(=O)CCCCCN1 Amb35789267 [1,0,0,1,0,0|1,0,1]=4 4176 B9R1.23 C=C1CC(CC)OC1=O Amb8389609 [1,0,0,1,0,0|1,0,1]=4 4177 B9R1.23 CCC1CC(=O)C(=O)O1 Amb27838789 [1,0,0,1,0,0|1,0,1]=4 4178 B9R1.23 CCC1CC(C)C(=O)N1 Amb20623299 [1,0,0,1,0,0|2,0,0]=4 4179 B9R1.23 CCC1CC(N)C(=O)O1 Amb27647519 [1,0,0,1,0,0|0,0,0]=2 4180 B9R1.23 CCC1CC(O)C(=O)O1 Amb28049114 [1,0,0,1,0,0|1,0,0]=3 4181 B9R1.23 CCC1OC(=O)C(F)S1 Amb27232508 [1,0,0,1,0,0|2,0,0]=4 4182 B9R1.23 CC[C@@H]1C[C@@H](O)C(=O)O1 Amb27472678 [1,0,0,1,0,0|1,0,0]=3 4183 B9R1.23 CC[C@@H]1C[C@H](O)C(=O)O1 Amb27184446 [1,0,0,1,0,0|1,0,0]=3 4184 B9R1.23 CC[C@@H]1OC(=O)[C@@H](F)S1 Amb28123499 [1,0,0,1,0,0|2,0,0]=4 4185 B9R1.23 CC[C@H]1C[C@@H](O)C(=O)O1 Amb27428268 [1,0,0,1,0,0|1,0,0]=3 4186 B9R1.23 CC[C@H]1OC(=O)[C@@H](F)S1 Amb24514953 [1,0,0,1,0,0|2,0,0]=4 4187 B9R1.23 CN1CC(CN)OC1=O Amb17506100 [1,0,0,1,0,0|2,0,0]=4 4188 B9R1.23 CN1CC(CN)OC1=O Amb30585182 [1,0,0,1,0,0|2,0,0]=4 4189 B9R1.23 CN1C[C@@H](CN)OC1=O Amb26616895 [1,0,0,1,0,0|2,0,0]=4 4190 B9R1.23 CN1C[C@@H](CN)OC1=O Amb32668350 [1,0,0,1,0,0|2,0,0]=4 4191 B9R1.23 C[C@@H]1C[C@@H](CN)OC1=O Amb27440489 [1,0,0,1,0,0|1,0,0]=3 4192 B9R1.23 C[C@H]1C[C@@H](CO)OC1=O Amb28429767 [1,0,0,1,0,0|2,0,0]=4 4193 B9R1.23 NC1CC(CO)OC1=O Amb18642829 [1,0,0,1,0,0|1,0,0]=3 4194 B9R1.23 NC[C@@H]1C[C@H](N)C(=O)O1 Amb27851651 [1,0,0,1,0,0|0,0,0]=2 4195 B9R1.23 N[C@H]1C[C@@H](CO)OC1=O Amb28059280 [1,0,0,1,0,0|1,0,0]=3 4196 B9R1.23 N[C@H]1C[C@H](CBr)OC1=O Amb27233512 [1,0,0,1,0,0|1,0,0]=3 4197 B9R1.23 O=C1OC(CBr)CC1O Amb27760415 [1,0,0,1,0,0|2,0,0]=4 4198 B9R1.23 O=C1OC(CCl)CC1O Amb27841626 [1,0,0,1,0,0|2,0,0]=4 4199 B9R1.23 O=C1O[C@@H](CO)C[C@@H]1O Amb27783829 [1,0,0,1,0,0|2,0,0]=4 4200 B9R1.35 CC(=O)C1CCC(N)C1 Amb27960182 [1,0,0,1,0,0|2,0,0]=4 4201 B9R1.35 CC(=O)C1CCC(N)C1 Amb33447083 [1,0,0,1,0,0|2,0,0]=4 4202 B9R1.35 CC(=O)C1CC[C@@H](C)O1 Amb33423868 [1,0,0,1,0,0|2,0,0]=4 4203 B9R1.35 CC(=O)C1CC[C@H](C)C1 Amb27261938 [1,0,0,1,0,0|2,0,0]=4 4204 B9R1.35 CC(=O)[C@@H]1CC[C@@H](C)C1 Amb27861348 [1,0,0,1,0,0|2,0,0]=4 4205 B9R1.35 CC(=O)[C@@H]1CC[C@H](C)C1 Amb27861349 [1,0,0,1,0,0|2,0,0]=4 4206 B9R1.35 CC(=O)[C@@H]1CC[C@H](C)O1 Amb26958731 [1,0,0,1,0,0|2,0,0]=4 4207 B9R1.35 CC1=NC(C(=O)O)CC1 Amb23438203 [1,0,0,1,0,0|0,0,2]=4 4208 B9R1.35 CC1=NC(C(=O)O)CC1 Amb32409643 [1,0,0,1,0,0|0,0,2]=4 4209 B9R1.35 CC1=NCC(C(=O)O)N1 Amb24599993 [1,0,0,1,0,0|1,0,1]=4 4210 B9R1.35 CC1=NC[C@H](C(=O)O)N1 Amb27827434 [1,0,0,1,0,0|1,0,1]=4 4211 B9R1.35 CC1=N[C@H](C(=O)O)CC1 Amb27455557 [1,0,0,1,0,0|0,0,2]=4 4212 B9R1.35 CC1C=C(C(=O)O)CC1 Amb18642397 [1,0,0,1,0,0|1,0,1]=4 4213 B9R1.35 CC1CC(C(=O)O)CN1 Amb18832566 [1,0,0,1,0,0|2,0,0]=4 4214 B9R1.35 CC1CC(C(=O)O)CO1 Amb25922998 [1,0,0,1,0,0|2,0,0]=4 4215 B9R1.35 CC1CCC(C(=O)Cl)O1 Amb27424709 [1,0,0,1,0,0|2,0,0]=4 4216 B9R1.35 CC1CCC(C(=O)O)C1 Amb18642624 [1,0,0,1,0,0|1,0,0]=3 4217 B9R1.35 CC1CCC(C(=O)O)N1 Amb18832572 [1,0,0,1,0,0|0,0,0]=2 4218 B9R1.35 CC1CCC(C(=O)O)N1 Amb32652343 [1,0,0,1,0,0|0,0,0]=2 4219 B9R1.35 CC1CCC(C(=O)O)O1 Amb17593370 [1,0,0,1,0,0|1,0,0]=3 4220 B9R1.35 CC1CCC(C(=O)O)S1 Amb25719281 [1,0,0,1,0,0|1,0,0]=3 4221 B9R1.35 CC1CCC(C(N)=O)O1 Amb27838521 [1,0,0,1,0,0|2,0,0]=4 4222 B9R1.35 CC1CC[C@H](C(=O)O)N1 Amb22748252 [1,0,0,1,0,0|0,0,0]=2 4223 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb33756822 [1,0,0,1,0,0|2,0,0]=4 4224 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb8386516 [1,0,0,1,0,0|2,0,0]=4 4225 B9R1.35 CC1COC(C(=O)O)C1 Amb32679237 [1,0,0,1,0,0|2,0,0]=4 4226 B9R1.35 CC1NC(C(=O)O)CS1 Amb9718451 [1,0,0,1,0,0|1,0,0]=3 4227 B9R1.35 CC1NC(C(N)=O)CS1 Amb28194888 [1,0,0,1,0,0|2,0,0]=4 4228 B9R1.35 CC1N[C@H](C(=O)O)CS1 Amb16203706 [1,0,0,1,0,0|1,0,0]=3 4229 B9R1.35 CN1CCC(C(=O)O)C1 Amb3941190 [1,0,0,1,0,0|2,0,0]=4 4230 B9R1.35 CN1CCC(C(=O)O)C1 Amb9154860 [1,0,0,1,0,0|2,0,0]=4 4231 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22746030 [1,0,0,1,0,0|2,0,0]=4 4232 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22756448 [1,0,0,1,0,0|2,0,0]=4 4233 B9R1.35 CN1CC[C@H](C(=O)O)C1 Amb26635487 [1,0,0,1,0,0|2,0,0]=4 4234 B9R1.35 C[C@@H]1CCC(C(=O)O)O1 Amb33423875 [1,0,0,1,0,0|1,0,0]=3 4235 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)C1 Amb28429501 [1,0,0,1,0,0|1,0,0]=3 4236 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 Amb31308105 [1,0,0,1,0,0|0,0,0]=2 4237 B9R1.35 C[C@@H]1CC[C@@H](C(N)=O)N1 Amb28456271 [1,0,0,1,0,0|1,0,0]=3 4238 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)C1 Amb10843961 [1,0,0,1,0,0|1,0,0]=3 4239 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb24399449 [1,0,0,1,0,0|0,0,0]=2 4240 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb32652487 [1,0,0,1,0,0|0,0,0]=2 4241 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)O1 Amb22886534 [1,0,0,1,0,0|1,0,0]=3 4242 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb19888348 [1,0,0,1,0,0|2,0,0]=4 4243 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb33812626 [1,0,0,1,0,0|2,0,0]=4 4244 B9R1.35 C[C@@H]1C[C@H](C(=O)O)CO1 Amb27961253 [1,0,0,1,0,0|2,0,0]=4 4245 B9R1.35 C[C@@H]1O[C@H](C(=O)O)CS1 Amb26951854 [1,0,0,1,0,0|2,0,0]=4 4246 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb24598417 [1,0,0,1,0,0|0,0,0]=2 4247 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb35745779 [1,0,0,1,0,0|0,0,0]=2 4248 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)O1 Amb24651587 [1,0,0,1,0,0|1,0,0]=3 4249 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)C1 Amb27630457 [1,0,0,1,0,0|2,0,0]=4 4250 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)N1 Amb28059269 [1,0,0,1,0,0|1,0,0]=3 4251 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)O1 Amb27390111 [1,0,0,1,0,0|2,0,0]=4 4252 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 Amb33871500 [1,0,0,1,0,0|0,0,0]=2 4253 B9R1.35 C[C@H]1CC[C@H](C(N)=O)N1 Amb27204783 [1,0,0,1,0,0|1,0,0]=3 4254 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb19887682 [1,0,0,1,0,0|2,0,0]=4 4255 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb23439040 [1,0,0,1,0,0|2,0,0]=4 4256 B9R1.35 C[C@H]1N[C@@H](C(=O)O)CS1 Amb28198473 [1,0,0,1,0,0|1,0,0]=3 4257 B9R1.35 C[C@H]1O[C@H](C(=O)O)CS1 Amb27252305 [1,0,0,1,0,0|2,0,0]=4 4258 B9R1.35 NC(=O)C1CCC(N)C1 Amb25104222 [1,0,0,1,0,0|2,0,0]=4 4259 B9R1.35 NC(=O)C1CCC(N)C1 Amb32663130 [1,0,0,1,0,0|2,0,0]=4 4260 B9R1.35 NC(=O)[C@H]1CC[C@@H](N)C1 Amb25321319 [1,0,0,1,0,0|2,0,0]=4 4261 B9R1.35 NC(=O)[C@H]1CC[C@@H](N)C1 Amb28921043 [1,0,0,1,0,0|2,0,0]=4 4262 B9R1.35 NC1=NC(C(=O)O)CC1 Amb32718833 [1,0,0,1,0,0|0,0,2]=4 4263 B9R1.35 NC1=N[C@@H](C(=O)O)CC1 Amb27202599 [1,0,0,1,0,0|0,0,2]=4 4264 B9R1.35 NC1C=C(C(=O)O)CC1 Amb18642496 [1,0,0,1,0,0|1,0,1]=4 4265 B9R1.35 NC1CCC(C(=O)O)C1 Amb10066880 [1,0,0,1,0,0|1,0,0]=3 4266 B9R1.35 NC1CCC(C(=O)O)C1 Amb2694935 [1,0,0,1,0,0|1,0,0]=3 4267 B9R1.35 NC1CN[C@H](C(=O)O)C1 Amb28145911 [1,0,0,1,0,0|2,0,0]=4 4268 B9R1.35 NC1COC(C(=O)O)C1 Amb18642828 [1,0,0,1,0,0|2,0,0]=4 4269 B9R1.35 NC1CSC(C(=O)O)C1 Amb18831415 [1,0,0,1,0,0|2,0,0]=4 4270 B9R1.35 N[C@@H]1CCC(C(=O)O)C1 Amb27263056 [1,0,0,1,0,0|1,0,0]=3 4271 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb10066881 [1,0,0,1,0,0|1,0,0]=3 4272 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb33801942 [1,0,0,1,0,0|1,0,0]=3 4273 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb33801272 [1,0,0,1,0,0|1,0,0]=3 4274 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb8516357 [1,0,0,1,0,0|1,0,0]=3 4275 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb19515889 [1,0,0,1,0,0|2,0,0]=4 4276 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb25992752 [1,0,0,1,0,0|2,0,0]=4 4277 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10070446 [1,0,0,1,0,0|2,0,0]=4 4278 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10603136 [1,0,0,1,0,0|2,0,0]=4 4279 B9R1.35 N[C@@H]1CO[C@@H](C(=O)O)C1 Amb25691536 [1,0,0,1,0,0|2,0,0]=4 4280 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb22746692 [1,0,0,1,0,0|1,0,0]=3 4281 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb8516356 [1,0,0,1,0,0|1,0,0]=3 4282 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb10066883 [1,0,0,1,0,0|1,0,0]=3 4283 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb22756038 [1,0,0,1,0,0|1,0,0]=3 4284 B9R1.35 N[C@H]1CN[C@@H](C(=O)O)C1 Amb27255323 [1,0,0,1,0,0|2,0,0]=4 4285 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10070445 [1,0,0,1,0,0|2,0,0]=4 4286 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10603131 [1,0,0,1,0,0|2,0,0]=4 4287 B9R1.35 N[C@H]1CO[C@H](C(=O)O)C1 Amb24117069 [1,0,0,1,0,0|2,0,0]=4 4288 B9R1.35 O=C(O)C1CCC(Br)C1 Amb2695404 [1,0,0,1,0,0|2,0,0]=4 4289 B9R1.35 O=C(O)C1CCC(F)C1 Amb22886545 [1,0,0,1,0,0|2,0,0]=4 4290 B9R1.35 O=C(O)C1CCC(I)C1 Amb23456141 [1,0,0,1,0,0|2,0,0]=4 4291 B9R1.35 O=C(O)C1CCC(O)C1 Amb21963572 [1,0,0,1,0,0|2,0,0]=4 4292 B9R1.35 O=C(O)C1CCC(S)C1 Amb27403449 [1,0,0,1,0,0|2,0,0]=4 4293 B9R1.35 O=C(O)C1NC(O)CS1 Amb26536906 [1,0,0,1,0,0|2,0,0]=4 4294 B9R1.35 O=C(O)[C@@H]1CCC(=S)N1 Amb26857015 [1,0,0,1,0,0|1,0,1]=4 4295 B9R1.35 O=C(O)[C@@H]1CC[C@@H](O)C1 Amb22746558 [1,0,0,1,0,0|2,0,0]=4 4296 B9R1.35 O=C(O)[C@@H]1CC[C@H](O)C1 Amb27784295 [1,0,0,1,0,0|2,0,0]=4 4297 B9R1.35 O=C(O)[C@@H]1CC[C@H](S)C1 Amb26438302 [1,0,0,1,0,0|2,0,0]=4 4298 B9R1.35 O=C(O)[C@H]1CC[C@H](O)C1 Amb26960428 [1,0,0,1,0,0|2,0,0]=4 4299 B9R1.35 O=C(O)[C@H]1CC[C@H](O)N1 Amb27421972 [1,0,0,1,0,0|1,0,0]=3 4300 B9R1.35 O=C1CCC(C(=O)O)N1 Amb9703102 [1,0,0,1,0,0|1,0,1]=4 4301 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 Amb1995036 [1,0,0,1,0,0|1,0,1]=4 4302 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 Amb24099403 [1,0,0,1,0,0|1,0,1]=4 4303 B9R1.35 O=C1CC[C@H](C(=O)O)N1 Amb2694994 [1,0,0,1,0,0|1,0,1]=4 4304 B9R1.45 C=C(C(=O)O)C1CC1C Amb33144231 [1,0,0,1,0,0|1,0,1]=4 4305 B9R1.45 C=C1CC1C(N)C(=O)O Amb24117258 [1,0,0,1,0,0|0,0,2]=4 4306 B9R1.45 C=C1CC1C(N)C(=O)O Amb27489118 [1,0,0,1,0,0|0,0,2]=4 4307 B9R1.45 C=C1C[C@@H]1[C@H](N)C(=O)O Amb28349320 [1,0,0,1,0,0|0,0,2]=4 4308 B9R1.45 CC1CC1C(=O)C(=O)O Amb24760671 [1,0,0,1,0,0|1,0,1]=4 4309 B9R1.45 CC1CC1C(C)C(=O)O Amb25708709 [1,0,0,1,0,0|1,0,0]=3 4310 B9R1.45 CC1CC1C(N)C(=O)O Amb33359576 [1,0,0,1,0,0|0,0,0]=2 4311 B9R1.45 CC1CC1C(O)C(=O)O Amb33474336 [1,0,0,1,0,0|1,0,0]=3 4312 B9R1.69 CC1CCC(Br)C(=O)C1 Amb27666885 [1,0,0,1,0,0|2,0,0]=4 4313 B9R1.69 CC1CCC(C)C(=O)C1 Amb22228357 [1,0,0,1,0,0|2,0,0]=4 4314 B9R1.69 CC1CCC(C)C(=O)N1 Amb25692572 [1,0,0,1,0,0|2,0,0]=4 4315 B9R1.69 CC1CCC(Cl)C(=O)C1 Amb28195532 [1,0,0,1,0,0|2,0,0]=4 4316 B9R1.69 CC1CCC(F)C(=O)C1 Amb27836782 [1,0,0,1,0,0|2,0,0]=4 4317 B9R1.69 CC1CCC(N)C(=O)N1 Amb26015847 [1,0,0,1,0,0|1,0,0]=3 4318 B9R1.69 CC1CCC(O)C(=O)O1 Amb28285159 [1,0,0,1,0,0|1,0,0]=3 4319 B9R1.69 CC1CCN(N)C(=O)N1 Amb25917643 [1,0,0,1,0,0|2,0,0]=4 4320 B9R1.69 C[C@@H]1CC[C@H](F)C(=O)C1 Amb28246572 [1,0,0,1,0,0|2,0,0]=4 4321 B9R1.69 C[C@@H]1O[C@H](C)CC[C@@H]1N Amb27202482 [1,0,0,1,0,0|1,0,1]=4 4322 B9R1.69 C[C@H]1CC[C@H](Br)C(=O)C1 Amb23592295 [1,0,0,1,0,0|2,0,0]=4 4323 B9R1.69 C[C@H]1CC[C@H](Cl)C(=O)C1 Amb28245372 [1,0,0,1,0,0|2,0,0]=4 4324 B9R1.69 NC1CCC(=O)OC1=O Amb27838431 [1,0,0,1,0,0|1,0,1]=4 4325 B9R1.69 N[C@H]1CCC(O)NC1=O Amb26317903 [1,0,0,1,0,0|2,0,0]=4 4326 B9R1.93 C#CC1CC1(N)C(=O)O Amb23456002 [1,0,0,1,0,0|0,0,2]=4 4327 B9R1.93 C=CC1CC1(N)C(=O)O Amb10068409 [1,0,0,1,0,0|0,0,2]=4 4328 B9R1.93 C=C[C@@H]1C[C@@]1(N)C(=O)O Amb26958678 [1,0,0,1,0,0|0,0,2]=4 4329 B9R1.93 C=C[C@H]1C[C@@]1(N)C(=O)O Amb27221097 [1,0,0,1,0,0|0,0,2]=4 4330 B9R1.93 C=C[C@H]1C[C@]1(N)C(=O)O Amb25105090 [1,0,0,1,0,0|0,0,2]=4 4331 B9R1.93 CC1(C(=O)O)CC1CO Amb24559345 [1,0,0,1,0,0|2,0,0]=4 4332 B9R1.93 CCC1CC1(N)C(=O)O Amb24655862 [1,0,0,1,0,0|0,0,0]=2 4333 B9R1.93 CCC1CC1(O)C(=O)O Amb27607715 [1,0,0,1,0,0|1,0,0]=3 4334 B9R1.93 CC[C@@H]1CC1(N)C(=O)O Amb25104706 [1,0,0,1,0,0|0,0,0]=2 4335 B9R1.93 CC[C@@H]1C[C@@]1(C)C(=O)O Amb33098402 [1,0,0,1,0,0|1,0,0]=3 4336 B9R1.93 CC[C@@H]1C[C@@]1(N)C(=O)O Amb23452849 [1,0,0,1,0,0|0,0,0]=2 4337 B9R1.93 CC[C@@H]1C[C@@]1(N)C(N)=O Amb27215769 [1,0,0,1,0,0|1,0,0]=3 4338 B9R1.93 CC[C@H]1CC1(N)C(=O)O Amb26556180 [1,0,0,1,0,0|0,0,0]=2 4339 B9R1.93 CC[C@H]1C[C@@]1(C)C(=O)O Amb33098405 [1,0,0,1,0,0|1,0,0]=3 4340 B9R1.93 CC[C@H]1C[C@@]1(N)C(N)=O Amb28286397 [1,0,0,1,0,0|1,0,0]=3 4341 B9R1.93 CC[C@H]1C[C@]1(N)C(=O)O Amb27961471 [1,0,0,1,0,0|0,0,0]=2 4342 B9R1.93 CC[C@H]1C[C@]1(N)C(N)=O Amb28286982 [1,0,0,1,0,0|1,0,0]=3 4343 B9R1.93 C[C@@]1(C(=O)O)C[C@@H]1CO Amb33098403 [1,0,0,1,0,0|2,0,0]=4 4344 B9R1.93 C[C@@]1(C(=O)O)C[C@H]1CO Amb33098404 [1,0,0,1,0,0|2,0,0]=4 4345 B9R1.93 C[C@]1(C(=O)O)C[C@@H]1CF Amb33098429 [1,0,0,1,0,0|2,0,0]=4 4346 B9R1.93 C[C@]1(C(=O)O)C[C@@H]1CO Amb33098423 [1,0,0,1,0,0|2,0,0]=4 4347 B9R1.93 NC1(C(=O)O)CC1CO Amb25828351 [1,0,0,1,0,0|1,0,0]=3 4348 B9R1.93 NCC1CC1(N)C(=O)O Amb27873291 [1,0,0,1,0,0|0,0,0]=2 4349 B9R1.93 NC[C@@H]1C[C@@]1(N)C(=O)O Amb24763621 [1,0,0,1,0,0|0,0,0]=2 4350 B9R1.93 N[C@@]1(C(=O)O)C[C@H]1CO Amb26405303 [1,0,0,1,0,0|1,0,0]=3 4351 B9R1.93 N[C@]1(C(=O)O)C[C@@H]1CO Amb2694928 [1,0,0,1,0,0|1,0,0]=3 4352 B9R1.93 N[C@]1(C(=O)O)C[C@H]1CO Amb25101898 [1,0,0,1,0,0|1,0,0]=3 4353 B9R1.93 O=C(O)C1(Cl)CC1CCl Amb24404084 [1,0,0,1,0,0|2,0,0]=4 4354 B9R1.95 CCC1CC(C(=O)Cl)C1 Amb25791521 [1,0,0,1,0,0|2,0,0]=4 4355 B9R1.95 CCC1CC(C(=O)O)C1 Amb23456004 [1,0,0,1,0,0|1,0,0]=3 4356 B9R1.95 CCN1CC(C(=O)O)C1 Amb24117130 [1,0,0,1,0,0|2,0,0]=4 4357 B9R1.95 CC[C@H]1C[C@@H](C(N)=O)C1 Amb27168704 [1,0,0,1,0,0|2,0,0]=4 4358 B9R1.95 CNC1CC(C(=O)O)C1 Amb20622656 [1,0,0,1,0,0|2,0,0]=4 4359 B9R1.95 CNC1CC(C(=O)O)C1 Amb32668940 [1,0,0,1,0,0|2,0,0]=4 4360 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb28903920 [1,0,0,1,0,0|2,0,0]=4 4361 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb32667482 [1,0,0,1,0,0|2,0,0]=4 4362 B9R1.95 COC1CC(C(=O)O)C1 Amb8011538 [1,0,0,1,0,0|2,0,0]=4 4363 B9R1.95 CO[C@H]1C[C@@H](C(=O)O)C1 Amb23440276 [1,0,0,1,0,0|2,0,0]=4 4364 B9R1.95 CO[C@H]1C[C@H](C(=O)O)C1 Amb23440277 [1,0,0,1,0,0|2,0,0]=4 4365 B9R1.95 NCC1CC(C(=O)O)C1 Amb26631130 [1,0,0,1,0,0|1,0,0]=3 4366 B9R1.95 NCC1CC(C(=O)O)C1 Amb31307793 [1,0,0,1,0,0|1,0,0]=3 4367 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34136858 [1,0,0,1,0,0|1,0,0]=3 4368 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34148892 [1,0,0,1,0,0|1,0,0]=3 4369 B9R1.95 NC[C@H]1C[C@H](C(=O)O)C1 Amb33715808 [1,0,0,1,0,0|1,0,0]=3 4370 B9R1.95 O=C(O)C1CC(CBr)C1 Amb19958667 [1,0,0,1,0,0|2,0,0]=4 4371 B9R1.95 O=C(O)C1CC(CF)C1 Amb27186059 [1,0,0,1,0,0|2,0,0]=4 4372 B9R1.95 O=C(O)C1CC(CO)C1 Amb22002175 [1,0,0,1,0,0|2,0,0]=4 4373 B9R1.95 O=C(O)[C@H]1C[C@H](CO)C1 Amb34162163 [1,0,0,1,0,0|2,0,0]=4 4374 B9R1.110 C=C(C(=O)O)C1CCC1 Amb26589067 [1,0,0,1,0,0|1,0,1]=4 4375 B9R1.110 CC(=O)C(C)C1CCC1 Amb35603891 [1,0,0,1,0,0|2,0,0]=4 4376 B9R1.110 CC(=O)C(N)C1CCC1 Amb25062195 [1,0,0,1,0,0|1,0,0]=3 4377 B9R1.110 CC(C(=O)Cl)C1CCC1 Amb29849535 [1,0,0,1,0,0|2,0,0]=4 4378 B9R1.110 CC(C(=O)O)C1CCC1 Amb33543919 [1,0,0,1,0,0|1,0,0]=3 4379 B9R1.110 CC(C(=O)O)C1CCO1 Amb26595674 [1,0,0,1,0,0|2,0,0]=4 4380 B9R1.110 CC(C(=O)O)C1CNC1 Amb26649377 [1,0,0,1,0,0|2,0,0]=4 4381 B9R1.110 CC(C(=O)O)C1CNC1 Amb28555391 [1,0,0,1,0,0|2,0,0]=4 4382 B9R1.110 CC(C(=O)O)C1COC1 Amb33313543 [1,0,0,1,0,0|2,0,0]=4 4383 B9R1.110 CC(C(=O)O)N1CCC1 Amb24178905 [1,0,0,1,0,0|2,0,0]=4 4384 B9R1.110 CC(C(=O)O)N1CCC1 Amb33329262 [1,0,0,1,0,0|2,0,0]=4 4385 B9R1.110 CC(C(N)=O)C1CCC1 Amb30008333 [1,0,0,1,0,0|2,0,0]=4 4386 B9R1.110 C[C@@H](C(=O)O)C1COC1 Amb33727764 [1,0,0,1,0,0|2,0,0]=4 4387 B9R1.110 C[C@@H](O)[C@H](N)C1CCC1 Amb27787967 [1,0,0,1,0,0|1,0,1]=4 4388 B9R1.110 C[C@H](C(=O)O)C1COC1 Amb33749535 [1,0,0,1,0,0|2,0,0]=4 4389 B9R1.110 NC(=O)C(N)C1CCC1 Amb27237393 [1,0,0,1,0,0|1,0,0]=3 4390 B9R1.110 NC(=O)C(N)C1COC1 Amb33065789 [1,0,0,1,0,0|2,0,0]=4 4391 B9R1.110 NC(C(=O)O)C1=CCC1 Amb27792901 [1,0,0,1,0,0|0,0,2]=4 4392 B9R1.110 NC(C(=O)O)C1CCC1 Amb19149365 [1,0,0,1,0,0|0,0,0]=2 4393 B9R1.110 NC(C(=O)O)C1CNC1 Amb30040080 [1,0,0,1,0,0|1,0,0]=3 4394 B9R1.110 NC(C(=O)O)C1COC1 Amb22405987 [1,0,0,1,0,0|1,0,0]=3 4395 B9R1.110 NC(C(=O)O)C1CSC1 Amb27844776 [1,0,0,1,0,0|1,0,0]=3 4396 B9R1.110 N[C@@H](C(=O)O)C1CCC1 Amb8395977 [1,0,0,1,0,0|0,0,0]=2 4397 B9R1.110 N[C@@H](C(=O)O)C1COC1 Amb22737550 [1,0,0,1,0,0|1,0,0]=3 4398 B9R1.110 N[C@H](C(=O)O)C1CCC1 Amb30633821 [1,0,0,1,0,0|0,0,0]=2 4399 B9R1.110 N[C@H](C(=O)O)C1CCC1 Amb8395976 [1,0,0,1,0,0|0,0,0]=2 4400 B9R1.110 N[C@H](C(=O)O)C1COC1 Amb22737551 [1,0,0,1,0,0|1,0,0]=3 4401 B9R1.110 O=C(O)C(F)C1CCC1 Amb27760713 [1,0,0,1,0,0|1,0,0]=3 4402 B9R1.110 O=C(O)C(F)C1COC1 Amb33165607 [1,0,0,1,0,0|2,0,0]=4 4403 B9R1.110 O=C(O)C(O)C1CCC1 Amb24426901 [1,0,0,1,0,0|1,0,0]=3 4404 B9R1.110 O=C(O)C(O)C1COC1 Amb26860151 [1,0,0,1,0,0|2,0,0]=4 4405 B9R1.110 O=C(O)[C@@H](O)C1CCC1 Amb34164748 [1,0,0,1,0,0|1,0,0]=3 4406 B9R1.110 O=C(O)[C@H](O)C1CCC1 Amb34165382 [1,0,0,1,0,0|1,0,0]=3 4407 B9R1.112 C=C(C)C(N)CC1CC1 Amb28313656 [1,0,0,1,0,0|2,0,0]=4 4408 B9R1.112 CC(=O)C(N)CC1CC1 Amb33132583 [1,0,0,1,0,0|1,0,0]=3 4409 B9R1.112 CC(CC1CC1)C(=O)O Amb28075498 [1,0,0,1,0,0|1,0,0]=3 4410 B9R1.112 CC(CC1CC1)C(N)=O Amb33495655 [1,0,0,1,0,0|2,0,0]=4 4411 B9R1.112 CC(NC1CC1)C(=O)O Amb9620653 [1,0,0,1,0,0|2,0,0]=4 4412 B9R1.112 CC(OC1CC1)C(=O)O Amb27667232 [1,0,0,1,0,0|2,0,0]=4 4413 B9R1.112 C[C@@H](CC1CC1)C(=O)O Amb10844014 [1,0,0,1,0,0|1,0,0]=3 4414 B9R1.112 C[C@@H](NC1CC1)C(=O)O Amb24398132 [1,0,0,1,0,0|2,0,0]=4 4415 B9R1.112 C[C@H](CC1CC1)C(=O)O Amb33749387 [1,0,0,1,0,0|1,0,0]=3 4416 B9R1.112 NC(=O)C(N)CC1CC1 Amb25767604 [1,0,0,1,0,0|1,0,0]=3 4417 B9R1.112 NC(=O)C(N)CC1CC1 Amb34199787 [1,0,0,1,0,0|1,0,0]=3 4418 B9R1.112 NC(CC1CC1)C(=O)O Amb23399727 [1,0,0,1,0,0|0,0,0]=2 4419 B9R1.112 NC(CC1CC1)C(=O)O Amb4019455 [1,0,0,1,0,0|0,0,0]=2 4420 B9R1.112 N[C@@H](CC1CC1)C(=O)O Amb24329024 [1,0,0,1,0,0|0,0,0]=2 4421 B9R1.112 N[C@@H](C[C@H]1CO1)C(=O)O Amb28252257 [1,0,0,1,0,0|1,0,0]=3 4422 B9R1.112 N[C@H](CC1CC1)C(=O)O Amb2699114 [1,0,0,1,0,0|0,0,0]=2 4423 B9R1.112 O=C(O)C(=O)CC1CC1 Amb18988329 [1,0,0,1,0,0|1,0,1]=4 4424 B9R1.112 O=C(O)C(F)CC1CC1 Amb27838541 [1,0,0,1,0,0|1,0,0]=3 4425 B9R1.112 O=C(O)C(O)CC1CC1 Amb25082516 [1,0,0,1,0,0|1,0,0]=3 4426 B9R1.112 O=C(O)C(S)CC1CC1 Amb18296302 [1,0,0,1,0,0|1,0,0]=3 4427 B9R1.112 O=C(O)[C@@H](O)CC1CC1 Amb23401512 [1,0,0,1,0,0|1,0,0]=3 4428 B9R1.112 O=C(O)[C@H](O)CC1CC1 Amb26014645 [1,0,0,1,0,0|1,0,0]=3 4429 B9R1.159 CC1(C(=O)O)CCC1N Amb28397422 [1,0,0,1,0,0|1,0,0]=3 4430 B9R1.159 CC1CCC1(C)C(=O)O Amb28397417 [1,0,0,1,0,0|1,0,0]=3 4431 B9R1.159 CC1CCC1(N)C(=O)O Amb23456072 [1,0,0,1,0,0|0,0,0]=2 4432 B9R1.159 C[C@@H]1CC[C@@]1(C)C(=O)O Amb27655982 [1,0,0,1,0,0|1,0,0]=3 4433 B9R1.159 C[C@@H]1CC[C@@]1(N)C(=O)O Amb26027352 [1,0,0,1,0,0|0,0,0]=2 4434 B9R1.159 C[C@@H]1CC[C@@]1(N)C(N)=O Amb28346845 [1,0,0,1,0,0|1,0,0]=3 4435 B9R1.159 C[C@@H]1CC[C@]1(N)C(=O)O Amb24586126 [1,0,0,1,0,0|0,0,0]=2 4436 B9R1.159 C[C@H]1CC[C@@]1(N)C(=O)O Amb28056437 [1,0,0,1,0,0|0,0,0]=2 4437 B9R1.159 C[C@]1(C(=O)O)CC[C@H]1N Amb27961498 [1,0,0,1,0,0|1,0,0]=3 4438 B9R1.159 NC1(C(=O)O)CCC1O Amb27482724 [1,0,0,1,0,0|1,0,0]=3 4439 B9R1.159 NC1CCC1(F)C(=O)O Amb27768660 [1,0,0,1,0,0|1,0,0]=3 4440 B9R1.159 N[C@@H]1CC[C@]1(F)C(=O)O Amb27188263 [1,0,0,1,0,0|1,0,0]=3 4441 B9R1.159 N[C@H]1CC[C@@]1(N)C(=O)O Amb27216513 [1,0,0,1,0,0|0,0,0]=2 4442 B9R1.159 N[C@]1(C(=O)O)CC[C@@H]1O Amb28058284 [1,0,0,1,0,0|1,0,0]=3 4443 B9R1.159 O=C(O)C1(O)CCC1Br Amb28137512 [1,0,0,1,0,0|2,0,0]=4 4444 B9R1.163 C=C(C)C1(N)CCCC1 Amb33201934 [1,0,0,1,0,0|2,0,0]=4 4445 B9R1.163 CC(=O)C1(C)CCCC1 Amb17593318 [1,0,0,1,0,0|2,0,0]=4 4446 B9R1.163 CC(=O)C1(C)CCCN1 Amb25789427 [1,0,0,1,0,0|2,0,0]=4 4447 B9R1.163 CC(=O)C1(Cl)CCCC1 Amb27950094 [1,0,0,1,0,0|2,0,0]=4 4448 B9R1.163 CC(=O)C1(N)CCCC1 Amb1091405 [1,0,0,1,0,0|1,0,0]=3 4449 B9R1.163 CC(=O)C1(N)CCCC1 Amb22283948 [1,0,0,1,0,0|1,0,0]=3 4450 B9R1.163 CC(=O)C1(N)CCOC1 Amb24427660 [1,0,0,1,0,0|2,0,0]=4 4451 B9R1.163 CC(=O)C1(N)NCCS1 Amb27162223 [1,0,0,1,0,0|2,0,0]=4 4452 B9R1.163 CC(=O)C1(O)CCCC1 Amb17593345 [1,0,0,1,0,0|2,0,0]=4 4453 B9R1.163 CC(=O)[C@@]1(C)CCCN1 Amb33307927 [1,0,0,1,0,0|2,0,0]=4 4454 B9R1.163 CC(=O)[C@]1(C)CCCN1 Amb33307921 [1,0,0,1,0,0|2,0,0]=4 4455 B9R1.163 CC1(C(=O)Cl)CCCC1 Amb24476587 [1,0,0,1,0,0|2,0,0]=4 4456 B9R1.163 CC1(C(=O)O)CCCC1 Amb482493 [1,0,0,1,0,0|1,0,0]=3 4457 B9R1.163 CC1(C(=O)O)CCCN1 Amb15701407 [1,0,0,1,0,0|1,0,0]=3 4458 B9R1.163 CC1(C(=O)O)CCCN1 Amb22587331 [1,0,0,1,0,0|1,0,0]=3 4459 B9R1.163 CC1(C(=O)O)CCCO1 Amb1088877 [1,0,0,1,0,0|2,0,0]=4 4460 B9R1.163 CC1(C(=O)O)CCCS1 Amb20623191 [1,0,0,1,0,0|2,0,0]=4 4461 B9R1.163 CC1(C(=O)O)CCNC1 Amb20634439 [1,0,0,1,0,0|2,0,0]=4 4462 B9R1.163 CC1(C(=O)O)CCNC1 Amb2683246 [1,0,0,1,0,0|2,0,0]=4 4463 B9R1.163 CC1(C(=O)O)CCOC1 Amb18280535 [1,0,0,1,0,0|2,0,0]=4 4464 B9R1.163 CC1(C(=O)O)CCSC1 Amb27782020 [1,0,0,1,0,0|2,0,0]=4 4465 B9R1.163 CC1(C(=O)O)NCCS1 Amb27860566 [1,0,0,1,0,0|2,0,0]=4 4466 B9R1.163 CC1(C(N)=O)CCCC1 Amb4018896 [1,0,0,1,0,0|2,0,0]=4 4467 B9R1.163 CC1(C(N)=O)CCCN1 Amb20061427 [1,0,0,1,0,0|2,0,0]=4 4468 B9R1.163 C[C@@]1(C(=O)O)CCCN1 Amb10603262 [1,0,0,1,0,0|1,0,0]=3 4469 B9R1.163 C[C@@]1(C(=O)O)CCCN1 Amb22405952 [1,0,0,1,0,0|1,0,0]=3 4470 B9R1.163 C[C@@]1(C(=O)O)CCCO1 Amb27600317 [1,0,0,1,0,0|2,0,0]=4 4471 B9R1.163 C[C@@]1(C(=O)O)CCNC1 Amb26869183 [1,0,0,1,0,0|2,0,0]=4 4472 B9R1.163 C[C@@]1(C(N)=O)CCCN1 Amb24410858 [1,0,0,1,0,0|2,0,0]=4 4473 B9R1.163 C[C@@]1(C(N)=O)CCCN1 Amb33457642 [1,0,0,1,0,0|2,0,0]=4 4474 B9R1.163 C[C@]1(C(=O)O)CCCN1 Amb22406107 [1,0,0,1,0,0|1,0,0]=3 4475 B9R1.163 C[C@]1(C(=O)O)CCCN1 Amb8630480 [1,0,0,1,0,0|1,0,0]=3 4476 B9R1.163 C[C@]1(C(=O)O)CCCO1 Amb24117235 [1,0,0,1,0,0|2,0,0]=4 4477 B9R1.163 C[C@]1(C(=O)O)CCNC1 Amb24346794 [1,0,0,1,0,0|2,0,0]=4 4478 B9R1.163 C[C@]1(C(N)=O)CCCN1 Amb25146194 [1,0,0,1,0,0|2,0,0]=4 4479 B9R1.163 N=C(N)C1(N)CCCC1 Amb25260496 [1,0,0,1,0,0|2,0,0]=4 4480 B9R1.163 N=C(N)C1(N)CCCC1 Amb32718824 [1,0,0,1,0,0|2,0,0]=4 4481 B9R1.163 NC(=O)C1(Cl)CCCC1 Amb27879093 [1,0,0,1,0,0|2,0,0]=4 4482 B9R1.163 NC(=O)C1(F)CCCC1 Amb28193242 [1,0,0,1,0,0|2,0,0]=4 4483 B9R1.163 NC(=O)C1(N)CCCC1 Amb19265774 [1,0,0,1,0,0|1,0,0]=3 4484 B9R1.163 NC(=O)C1(N)CCCC1 Amb8628017 [1,0,0,1,0,0|1,0,0]=3 4485 B9R1.163 NC(=O)C1(N)CCNC1 Amb27874404 [1,0,0,1,0,0|2,0,0]=4 4486 B9R1.163 NC(=O)C1(N)CCOC1 Amb25835775 [1,0,0,1,0,0|2,0,0]=4 4487 B9R1.163 NC(=O)C1(N)CCOC1 Amb32708549 [1,0,0,1,0,0|2,0,0]=4 4488 B9R1.163 NC(=O)C1(N)CCSC1 Amb18279185 [1,0,0,1,0,0|2,0,0]=4 4489 B9R1.163 NC(=O)C1(O)CCCC1 Amb33529797 [1,0,0,1,0,0|2,0,0]=4 4490 B9R1.163 NC(=S)C1(N)CCCC1 Amb19374908 [1,0,0,1,0,0|1,1,0]=4 4491 B9R1.163 NC1(C(=O)Cl)CCCC1 Amb27236109 [1,0,0,1,0,0|1,0,0]=3 4492 B9R1.163 NC1(C(=O)O)CC=CC1 Amb2683267 [1,0,0,1,0,0|0,0,2]=4 4493 B9R1.163 NC1(C(=O)O)CCCC1 Amb1838882 [1,0,0,1,0,0|0,0,0]=2 4494 B9R1.163 NC1(C(=O)O)CCNC1 Amb8630265 [1,0,0,1,0,0|1,0,0]=3 4495 B9R1.163 NC1(C(=O)O)CCOC1 Amb16232669 [1,0,0,1,0,0|1,0,0]=3 4496 B9R1.163 NC1(C(=O)O)CCOC1 Amb22274600 [1,0,0,1,0,0|1,0,0]=3 4497 B9R1.163 NC1(C(=O)O)CCSC1 Amb9724111 [1,0,0,1,0,0|1,0,0]=3 4498 B9R1.163 NC1(C(=O)O)OCCO1 Amb25887263 [1,0,0,1,0,0|2,0,0]=4 4499 B9R1.163 NC1(P(O)O)CCCC1 Amb28423400 [1,0,0,1,0,0|1,0,1]=4 4500 B9R1.163 N[C@@]1(C(=O)O)CCNC1 Amb6893795 [1,0,0,1,0,0|1,0,0]=3 4501 B9R1.163 N[C@@]1(C(=O)O)CCOC1 Amb20241211 [1,0,0,1,0,0|1,0,0]=3 4502 B9R1.163 N[C@@]1(C(=O)O)CCSC1 Amb27972704 [1,0,0,1,0,0|1,0,0]=3 4503 B9R1.163 N[C@]1(C(=O)O)CCNC1 Amb6893796 [1,0,0,1,0,0|1,0,0]=3 4504 B9R1.163 N[C@]1(C(=O)O)CCOC1 Amb20241209 [1,0,0,1,0,0|1,0,0]=3 4505 B9R1.163 O=C(Cl)C1(Br)CCCC1 Amb25888908 [1,0,0,1,0,0|2,0,0]=4 4506 B9R1.163 O=C(Cl)C1(Cl)CCCC1 Amb25106802 [1,0,0,1,0,0|2,0,0]=4 4507 B9R1.163 O=C(O)C1(Br)CCCC1 Amb17595053 [1,0,0,1,0,0|1,0,0]=3 4508 B9R1.163 O=C(O)C1(Cl)CCCC1 Amb32716554 [1,0,0,1,0,0|1,0,0]=3 4509 B9R1.163 O=C(O)C1(Cl)CCOC1 Amb33127967 [1,0,0,1,0,0|2,0,0]=4 4510 B9R1.163 O=C(O)C1(F)CCCC1 Amb26957187 [1,0,0,1,0,0|1,0,0]=3 4511 B9R1.163 O=C(O)C1(F)CCNC1 Amb24120613 [1,0,0,1,0,0|2,0,0]=4 4512 B9R1.163 O=C(O)C1(F)CCNC1 Amb32992647 [1,0,0,1,0,0|2,0,0]=4 4513 B9R1.163 O=C(O)C1(F)CCOC1 Amb24420228 [1,0,0,1,0,0|2,0,0]=4 4514 B9R1.163 O=C(O)C1(O)CCCC1 Amb1159211 [1,0,0,1,0,0|1,0,0]=3 4515 B9R1.163 O=C(O)C1(O)CCNC1 Amb22500918 [1,0,0,1,0,0|2,0,0]=4 4516 B9R1.163 O=C(O)C1(O)CCNC1 Amb22899772 [1,0,0,1,0,0|2,0,0]=4 4517 B9R1.163 O=C(O)C1(O)CCOC1 Amb26332318 [1,0,0,1,0,0|2,0,0]=4 4518 B9R1.163 O=C(O)C1(O)CCSC1 Amb18944714 [1,0,0,1,0,0|2,0,0]=4 4519 B9R1.163 O=C(O)C1(S)CCCC1 Amb27185727 [1,0,0,1,0,0|1,0,0]=3 4520 B9R1.163 O=C(O)C1(S)CCCN1 Amb28383197 [1,0,0,1,0,0|1,0,0]=3 4521 B9R1.163 O=C(O)[C@@]1(F)CCCN1 Amb22748241 [1,0,0,1,0,0|1,0,0]=3 4522 B9R1.163 O=C(O)[C@@]1(O)CCSC1 Amb28119971 [1,0,0,1,0,0|2,0,0]=4 4523 B9R1.163 O=C(O)[C@]1(F)CCCN1 Amb27216006 [1,0,0,1,0,0|1,0,0]=3 4524 B9R1.163 [NH3+]C1(C(=O)O)CC[NH2+]C1 Amb22583868 [1,0,0,1,0,0|1,0,1]=4 4525 B11R1.27 NCCCCC1CCC(=O)O1 Amb27671667 [0,0,0,1,0,1|2,0,0]=4 4526 B11R1.34 CC1CC(=O)OC(CCO)C1 Amb27172357 [0,0,0,1,0,1|2,0,0]=4 4527 B11R1.34 CCCC1CC(O)CC(=O)O1 Amb27970476 [0,0,0,1,0,1|2,0,0]=4 4528 B11R1.34 CCC[C@@H]1C[C@@H](O)CC(=O)O1 Amb27259046 [0,0,0,1,0,1|2,0,0]=4 4529 B11R1.34 NCCC1CC(O)CC(=O)O1 Amb27619161 [0,0,0,1,0,1|1,0,0]=3 4530 B11R1.34 NCC[C@@H]1C[C@@H](O)CC(=O)O1 Amb26397039 [0,0,0,1,0,1|1,0,0]=3 4531 B11R1.34 O=C1C[C@H](O)C[C@@H](CCCl)O1 Amb27865633 [0,0,0,1,0,1|2,0,0]=4 4532 B11R1.43 CC(=O)CC1CCC(CN)C1 Amb33132949 [0,0,0,1,0,1|2,0,0]=4 4533 B11R1.43 CC(=O)NC1CCC(CN)C1 Amb26652182 [0,0,0,1,0,1|2,0,0]=4 4534 B11R1.43 CC(=O)N[C@@H]1CC[C@H](CN)C1 Amb33071922 [0,0,0,1,0,1|2,0,0]=4 4535 B11R1.43 CCC1CCC(CC(=O)O)O1 Amb33100554 [0,0,0,1,0,1|2,0,0]=4 4536 B11R1.43 NCC1CC(CC(=O)O)CO1 Amb33802879 [0,0,0,1,0,1|2,0,0]=4 4537 B11R1.43 NCC1CC(CC(=O)O)CO1 Amb33802996 [0,0,0,1,0,1|2,0,0]=4 4538 B11R1.43 NCC1CCC(CC(=O)O)C1 Amb32681887 [0,0,0,1,0,1|1,0,0]=3 4539 B11R1.43 NCC1CCC(CC(=O)O)O1 Amb18199868 [0,0,0,1,0,1|1,0,0]=3 4540 B11R1.43 NCC1CCC(CC(=O)O)S1 Amb18197103 [0,0,0,1,0,1|1,0,0]=3 4541 B11R1.43 NC[C@@H]1CC[C@H](CC(=O)O)O1 Amb27202548 [0,0,0,1,0,1|1,0,0]=3 4542 B11R1.43 O=C(O)CC1CCC(CF)O1 Amb33070988 [0,0,0,1,0,1|2,0,0]=4 4543 B11R1.77 CC(=O)CC(N)C1CCCC1 Amb33132598 [0,0,0,1,0,1|2,0,0]=4 4544 B11R1.77 CC(CC(=O)O)C1CCCC1 Amb17506860 [0,0,0,1,0,1|2,0,0]=4 4545 B11R1.77 CC(CC(=O)O)C1CCCO1 Amb536641 [0,0,0,1,0,1|2,0,0]=4 4546 B11R1.77 CC(CC(=O)O)C1CCCS1 Amb33416230 [0,0,0,1,0,1|2,0,0]=4 4547 B11R1.77 NC(=O)CC(N)C1CCCC1 Amb18296015 [0,0,0,1,0,1|2,0,0]=4 4548 B11R1.77 NC(=O)CC(N)C1CCCO1 Amb26592109 [0,0,0,1,0,1|2,0,0]=4 4549 B11R1.77 NC(=O)C[C@@H](N)C1CCCC1 Amb27472957 [0,0,0,1,0,1|2,0,0]=4 4550 B11R1.77 NC(=O)C[C@@H](N)C1CCCO1 Amb24528295 [0,0,0,1,0,1|2,0,0]=4 4551 B11R1.77 NC(=O)C[C@H](N)C1CCCC1 Amb27479392 [0,0,0,1,0,1|2,0,0]=4 4552 B11R1.77 NC(=O)C[C@H](N)C1CCCO1 Amb26918904 [0,0,0,1,0,1|2,0,0]=4 4553 B11R1.77 NC(CC(=O)O)C1=CCCC1 Amb27959057 [0,0,0,1,0,1|1,0,1]=4 4554 B11R1.77 NC(CC(=O)O)C1CCCC1 Amb33529949 [0,0,0,1,0,1|1,0,0]=3 4555 B11R1.77 NC(CC(=O)O)C1CCCO1 Amb2683957 [0,0,0,1,0,1|1,0,0]=3 4556 B11R1.77 NC(CC(=O)O)C1CCCS1 Amb33416245 [0,0,0,1,0,1|1,0,0]=3 4557 B11R1.77 NC(CC(=O)O)C1CCOC1 Amb2697640 [0,0,0,1,0,1|2,0,0]=4 4558 B11R1.77 NC(CC(=O)O)C1CCSC1 Amb33254878 [0,0,0,1,0,1|2,0,0]=4 4559 B11R1.77 N[C@@H](CC(=O)O)C1CCCC1 Amb22748847 [0,0,0,1,0,1|1,0,0]=3 4560 B11R1.77 N[C@@H](CC(=O)O)C1CCCC1 Amb24670269 [0,0,0,1,0,1|1,0,0]=3 4561 B11R1.77 N[C@@H](CC(=O)O)C1CCCO1 Amb25866036 [0,0,0,1,0,1|1,0,0]=3 4562 B11R1.77 N[C@@H](CC(=O)O)C1CCOC1 Amb25893664 [0,0,0,1,0,1|2,0,0]=4 4563 B11R1.77 N[C@H](CC(=O)O)C1CCCC1 Amb28457173 [0,0,0,1,0,1|1,0,0]=3 4564 B11R1.77 N[C@H](CC(=O)O)C1CCCO1 Amb27493681 [0,0,0,1,0,1|1,0,0]=3 4565 B11R1.77 N[C@H](CC(=O)O)C1CCOC1 Amb27493688 [0,0,0,1,0,1|2,0,0]=4 4566 B11R1.77 O=C(O)CC(O)C1CCCC1 Amb18990583 [0,0,0,1,0,1|2,0,0]=4 4567 B11R1.77 O=C(O)CC(O)C1CCCO1 Amb33358384 [0,0,0,1,0,1|2,0,0]=4 4568 B11R1.77 O=C(O)CC(O)C1CCCS1 Amb33415864 [0,0,0,1,0,1|2,0,0]=4 4569 B11R1.77 O=C(O)C[C@@H](O)C1CCCC1 Amb33315761 [0,0,0,1,0,1|2,0,0]=4 4570 B11R1.77 O=C(O)C[C@@H](O)C1CCCO1 Amb33318721 [0,0,0,1,0,1|2,0,0]=4 4571 B11R1.77 O=C(O)C[C@@H](O)C1CCCS1 Amb33415861 [0,0,0,1,0,1|2,0,0]=4 4572 B11R1.77 O=C(O)C[C@H](O)C1CCCC1 Amb33315762 [0,0,0,1,0,1|2,0,0]=4 4573 B11R1.77 O=C(O)C[C@H](O)C1CCCO1 Amb33318722 [0,0,0,1,0,1|2,0,0]=4 4574 B11R1.77 O=C(O)C[C@H](O)C1CCCS1 Amb33415862 [0,0,0,1,0,1|2,0,0]=4 4575 B11R1.88 CC1CCCC1(N)CC(=O)O Amb26436834 [0,0,0,1,0,1|1,0,0]=3 4576 B11R1.88 CC1CCCC1(N)CC(N)=O Amb33254332 [0,0,0,1,0,1|2,0,0]=4 4577 B11R1.88 CC1CCCC1(O)CC(=O)O Amb32680042 [0,0,0,1,0,1|2,0,0]=4 4578 B11R1.88 CC1COCC1(N)CC(=O)O Amb33254749 [0,0,0,1,0,1|2,0,0]=4 4579 B11R1.88 CC1CSCC1(N)CC(=O)O Amb32787293 [0,0,0,1,0,1|2,0,0]=4 4580 B11R1.88 CC1OCCC1(N)CC(=O)O Amb24735357 [0,0,0,1,0,1|2,0,0]=4 4581 B11R1.88 CC1SCCC1(N)CC(=O)O Amb32787740 [0,0,0,1,0,1|2,0,0]=4 4582 B11R1.88 O=C(O)C[C@@]1(O)CCC[C@@H]1Cl Amb27493384 [0,0,0,1,0,1|2,0,0]=4 4583 B11R1.120 CCCC1CC(CC(=O)O)C1 Amb25384948 [0,0,0,1,0,1|2,0,0]=4 4584 B11R1.128 COCC1C[C@]1(N)CC(=O)O Amb27988482 [0,0,0,1,0,1|2,0,0]=4 4585 B11R1.143 CC(=O)C1CCCCCC1N Amb26968176 [0,0,0,1,0,1|2,0,0]=4 4586 B11R1.143 CC(=O)[C@@H]1CCCCC[C@@H]1N Amb33307461 [0,0,0,1,0,1|2,0,0]=4 4587 B11R1.143 NC(=O)C1CCCCCC1N Amb20668797 [0,0,0,1,0,1|2,0,0]=4 4588 B11R1.143 NC(=O)C1CCCCCC1N Amb22059737 [0,0,0,1,0,1|2,0,0]=4 4589 B11R1.143 NC1CCCCCC1C(=O)O Amb2694961 [0,0,0,1,0,1|1,0,0]=3 4590 B11R1.143 NC1CCCCCC1C(=O)O Amb8630073 [0,0,0,1,0,1|1,0,0]=3 4591 B11R1.143 NC1CCNCCC1C(=O)O Amb26917458 [0,0,0,1,0,1|2,0,0]=4 4592 B11R1.143 NC1CCOCCC1C(=O)O Amb28051653 [0,0,0,1,0,1|2,0,0]=4 4593 B11R1.143 NC1CCSCCC1C(=O)O Amb28051654 [0,0,0,1,0,1|2,0,0]=4 4594 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Amb1993851 [0,0,0,1,0,1|1,0,0]=3 4595 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Amb1994004 [0,0,0,1,0,1|1,0,0]=3 4596 B11R1.143 N[C@@H]1CCCCC[C@H]1C(=O)O Amb27635591 [0,0,0,1,0,1|1,0,0]=3 4597 B11R1.143 N[C@H]1CCCCC[C@@H]1C(=O)O Amb28411250 [0,0,0,1,0,1|1,0,0]=3 4598 B11R1.143 N[C@H]1CCCCC[C@H]1C(=O)O Amb1993850 [0,0,0,1,0,1|1,0,0]=3 4599 B11R1.143 N[C@H]1CCCCC[C@H]1C(=O)O Amb1994003 [0,0,0,1,0,1|1,0,0]=3 4600 B11R1.143 O=C(O)C1CCCCCC1O Amb18280963 [0,0,0,1,0,1|2,0,0]=4 4601 B11R1.143 O=C(O)C1CCCCCC1S Amb18949212 [0,0,0,1,0,1|2,0,0]=4 4602 B11R1.143 O=C(O)[C@@H]1CCCCC[C@@H]1O Amb27848050 [0,0,0,1,0,1|2,0,0]=4 4603 B11R1.143 O=C(O)[C@H]1CCCCC[C@@H]1O Amb27848051 [0,0,0,1,0,1|2,0,0]=4 4604 B11R1.156 CC1CCCC(O)C1C(=O)O Amb28422448 [0,0,0,1,0,1|2,0,0]=4 4605 B11R1.156 C[C@H]1CCC[C@@H](N)[C@H]1C(=O)O Amb27818148 [0,0,0,1,0,1|1,0,0]=3 4606 B11R1.156 NC1CCCC(O)C1C(=O)O Amb27176362 [0,0,0,1,0,1|1,0,0]=3 4607 B11R1.157 CC(=O)CC1CCCC(C)N1 Amb25100933 [0,0,0,1,0,1|2,0,0]=4 4608 B11R1.157 CC(=O)CC1CCCC(N)C1 Amb24685265 [0,0,0,1,0,1|2,0,0]=4 4609 B11R1.157 CC(=O)C[C@H]1CCC[C@@H](C)N1 Amb27967295 [0,0,0,1,0,1|2,0,0]=4 4610 B11R1.157 CC(=O)NC1CCCC(N)C1 Amb6256148 [0,0,0,1,0,1|2,0,0]=4 4611 B11R1.157 CC(=O)OC1CCCC(N)C1 Amb27461144 [0,0,0,1,0,1|2,0,0]=4 4612 B11R1.157 CC1CCCC(CC(=O)O)C1 Amb6749251 [0,0,0,1,0,1|2,0,0]=4 4613 B11R1.157 CC1CCCC(CC(=O)O)N1 Amb8387931 [0,0,0,1,0,1|1,0,0]=3 4614 B11R1.157 CC1CCCC(CC(=O)O)O1 Amb18126127 [0,0,0,1,0,1|2,0,0]=4 4615 B11R1.157 C[C@@H]1CCC[C@H](CC(=O)O)O1 Amb27657703 [0,0,0,1,0,1|2,0,0]=4 4616 B11R1.157 NC(=O)CC1CCCC(N)C1 Amb18964224 [0,0,0,1,0,1|2,0,0]=4 4617 B11R1.157 O=C(O)CC1CCCC(=O)N1 Amb18200018 [0,0,0,1,0,1|1,0,1]=4 4618 B11R1.157 O=C(O)CC1CCCC(F)C1 Amb24651233 [0,0,0,1,0,1|2,0,0]=4 4619 B11R1.157 O=C(O)CC1CCCC(O)C1 Amb18645020 [0,0,0,1,0,1|2,0,0]=4 4620 B11R1.157 O=C(O)C[C@@H]1CCCC(=O)N1 Amb27397390 [0,0,0,1,0,1|1,0,1]=4 4621 B11R1.157 O=C(O)C[C@@H]1CCC[C@@H](F)C1 Amb34912969 [0,0,0,1,0,1|2,0,0]=4 4622 B11R1.157 O=C(O)C[C@H]1CCCC(=O)N1 Amb27983727 [0,0,0,1,0,1|1,0,1]=4 4623 B11R1.157 O=C(O)C[C@H]1CCC[C@@H](F)C1 Amb34912973 [0,0,0,1,0,1|2,0,0]=4 4624 B11R1.230 CCCCC1OC(=O)CC1C Amb15692528 [0,0,0,1,0,1|2,0,0]=4 4625 B11R1.230 CCCCC1OC(=O)CC1O Amb27405206 [0,0,0,1,0,1|2,0,0]=4 4626 B11R1.230 CCCC[C@@H]1OC(=O)C[C@H]1O Amb27472606 [0,0,0,1,0,1|2,0,0]=4 4627 B11R1.230 CCCC[C@H]1OC(=O)C[C@@H]1C Amb27234681 [0,0,0,1,0,1|2,0,0]=4 4628 B11R1.230 CCCC[C@H]1OC(=O)C[C@H]1O Amb27969128 [0,0,0,1,0,1|2,0,0]=4 4629 B11R1.230 NC1CC(=O)OC1CCCBr Amb28066067 [0,0,0,1,0,1|1,0,0]=3 4630 B11R1.269 COC1CCC1(N)CC(=O)O Amb33254348 [0,0,0,1,0,1|2,0,0]=4 4631 B11R1.471 CN1CC[C@@H](CN)[C@@H]1C(=O)O Amb18199895 [0,0,0,1,0,1|2,0,0]=4 4632 B11R1.471 CN1CC[C@H](CN)[C@H]1C(=O)O Amb27624410 [0,0,0,1,0,1|2,0,0]=4 4633 B11R1.484 NC(=O)CC(N)CC1CCC1 Amb27671635 [0,0,0,1,0,1|2,0,0]=4 4634 B11R1.484 O=C(O)CC(O)CC1CCC1 Amb33036223 [0,0,0,1,0,1|2,0,0]=4 4635 B11R1.485 NC(=O)CC(N)CCC1CC1 Amb33255650 [0,0,0,1,0,1|2,0,0]=4 4636 B11R1.485 NC(CCC1CC1)CC(=O)O Amb33255553 [0,0,0,1,0,1|1,0,0]=3 4637 B11R1.563 CC1CCCC(O)CC(=O)O1 Amb27651827 [0,0,0,1,0,1|2,0,0]=4 4638 B11R1.563 C[C@@H]1CCC[C@@H](O)CC(=O)O1 Amb27485838 [0,0,0,1,0,1|2,0,0]=4 4639 B11R1.563 C[C@@H]1CCC[C@H](O)CC(=O)O1 Amb28207207 [0,0,0,1,0,1|2,0,0]=4 4640 B11R1.742 CC(=O)CC1CCCCCN1 Amb23585599 [0,0,0,1,0,1|2,0,0]=4 4641 B11R1.742 O=C(O)CC1C=CCCCC1 Amb26951387 [0,0,0,1,0,1|2,0,0]=4 4642 B11R1.742 O=C(O)CC1CCCCCC1 Amb6749261 [0,0,0,1,0,1|2,0,0]=4 4643 B11R1.742 O=C(O)CC1CCCCCN1 Amb18199972 [0,0,0,1,0,1|1,0,0]=3 4644 B11R1.742 O=C(O)CC1CCCCCO1 Amb27823132 [0,0,0,1,0,1|2,0,0]=4 4645 B11R1.742 O=C(O)CC1CCCCNC1 Amb18199974 [0,0,0,1,0,1|1,0,0]=3 4646 B11R1.928 CC(=O)CC1(N)CCCCC1 Amb24488108 [0,0,0,1,0,1|2,0,0]=4 4647 B11R1.928 CC1(CC(=O)O)CCCCC1 Amb17194149 [0,0,0,1,0,1|2,0,0]=4 4648 B11R1.928 CC1(CC(=O)O)CCCCO1 Amb32648987 [0,0,0,1,0,1|2,0,0]=4 4649 B11R1.928 NC(=O)CC1(N)CCCCC1 Amb25151318 [0,0,0,1,0,1|2,0,0]=4 4650 B11R1.928 NC(=O)CC1(N)CCCCC1 Amb30584715 [0,0,0,1,0,1|2,0,0]=4 4651 B11R1.928 NC1(CC(=O)O)C=CCCC1 Amb33036363 [0,0,0,1,0,1|1,0,1]=4 4652 B11R1.928 NC1(CC(=O)O)CCCCC1 Amb10602480 [0,0,0,1,0,1|1,0,0]=3 4653 B11R1.928 NC1(CC(=O)O)CCCCC1 Amb2697380 [0,0,0,1,0,1|1,0,0]=3 4654 B11R1.928 NC1(CC(=O)O)CCCOC1 Amb27960202 [0,0,0,1,0,1|2,0,0]=4 4655 B11R1.928 NC1(CC(=O)O)CCCOC1 Amb32664553 [0,0,0,1,0,1|2,0,0]=4 4656 B11R1.928 NC1(CC(=O)O)CCCSC1 Amb25875659 [0,0,0,1,0,1|2,0,0]=4 4657 B11R1.928 NC1(CC(=O)O)CCNCC1 Amb25085887 [0,0,0,1,0,1|2,0,0]=4 4658 B11R1.928 NC1(CC(=O)O)CCNCC1 Amb28653010 [0,0,0,1,0,1|2,0,0]=4 4659 B11R1.928 NC1(CC(=O)O)CCOCC1 Amb19135893 [0,0,0,1,0,1|2,0,0]=4 4660 B11R1.928 NC1(CC(=O)O)CCOCC1 Amb28652901 [0,0,0,1,0,1|2,0,0]=4 4661 B11R1.928 NC1(CC(=O)O)CCSCC1 Amb19135848 [0,0,0,1,0,1|2,0,0]=4 4662 B11R1.928 O=C(O)CC1(Cl)CCCCC1 Amb27477728 [0,0,0,1,0,1|2,0,0]=4 4663 B11R1.928 O=C(O)CC1(O)CCCCC1 Amb2785810 [0,0,0,1,0,1|2,0,0]=4 4664 B11R1.928 O=C(O)CC1(S)CCCCC1 Amb26951602 [0,0,0,1,0,1|2,0,0]=4 4665 B11R1.155 NC1CCCC(S(=O)(=O)O)C1 Amb28245760 [0,1,0,1,0,0|2,0,0]=4 4666 B11R1.155 N[C@@H]1CCC[C@@H](S(=O)(=O)O)C1 Amb27631340 [0,1,0,1,0,0|2,0,0]=4 4667 B11R1.35 CC(CC1=CCCC1)C(=O)O Amb10844012 [0,1,0,1,0,0|2,0,0]=4 4668 B11R1.35 CC(CC1CCCC1)C(=O)O Amb10844013 [0,1,0,1,0,0|2,0,0]=4 4669 B11R1.35 CC(CC1CCCO1)C(=O)O Amb18994653 [0,1,0,1,0,0|2,0,0]=4 4670 B11R1.35 CC(CC1CCCS1)C(=O)O Amb33416229 [0,1,0,1,0,0|2,0,0]=4 4671 B11R1.35 CC(CC1CCOC1)C(=O)O Amb25315971 [0,1,0,1,0,0|2,0,0]=4 4672 B11R1.35 CC(CC1CCSC1)C(=O)O Amb27856421 [0,1,0,1,0,0|2,0,0]=4 4673 B11R1.35 CC(CC1OCCO1)C(=O)O Amb17334489 [0,1,0,1,0,0|2,0,0]=4 4674 B11R1.35 CC(CN1CCCC1)C(=O)O Amb22587263 [0,1,0,1,0,0|2,0,0]=4 4675 B11R1.35 CC(CN1CCCC1)C(=O)O Amb9400669 [0,1,0,1,0,0|2,0,0]=4 4676 B11R1.35 CC(CN1CCCN1)C(=O)O Amb27236305 [0,1,0,1,0,0|1,0,0]=3 4677 B11R1.35 CC(NC1CCCC1)C(=O)O Amb28872277 [0,1,0,1,0,0|2,0,0]=4 4678 B11R1.35 CC(NC1CCCC1)C(=O)O Amb9326976 [0,1,0,1,0,0|2,0,0]=4 4679 B11R1.35 CC(OC1CCCC1)C(=O)O Amb9281761 [0,1,0,1,0,0|2,0,0]=4 4680 B11R1.35 CC(SC1CCCC1)C(=O)O Amb6260626 [0,1,0,1,0,0|2,0,0]=4 4681 B11R1.35 C[C@@H](CC1CCCC1)C(=O)O Amb33745935 [0,1,0,1,0,0|2,0,0]=4 4682 B11R1.35 C[C@@H](CC1CCCO1)C(=O)O Amb33747708 [0,1,0,1,0,0|2,0,0]=4 4683 B11R1.35 C[C@@H](CC1CCOC1)C(=O)O Amb33744903 [0,1,0,1,0,0|2,0,0]=4 4684 B11R1.35 C[C@@H](NC1CCCC1)C(=O)O Amb25151812 [0,1,0,1,0,0|2,0,0]=4 4685 B11R1.35 C[C@H](CC1CCCC1)C(=O)O Amb33733080 [0,1,0,1,0,0|2,0,0]=4 4686 B11R1.35 C[C@H](CC1CCCO1)C(=O)O Amb33726956 [0,1,0,1,0,0|2,0,0]=4 4687 B11R1.35 C[C@H](CC1CCOC1)C(=O)O Amb33728212 [0,1,0,1,0,0|2,0,0]=4 4688 B11R1.35 C[C@H](NC1CCNC1)C(=O)O Amb27476723 [0,1,0,1,0,0|2,0,0]=4 4689 B11R1.35 NC(=O)C(N)CC1=CCCC1 Amb28288602 [0,1,0,1,0,0|2,0,0]=4 4690 B11R1.35 NC(=O)C(N)CC1CCCC1 Amb25909634 [0,1,0,1,0,0|2,0,0]=4 4691 B11R1.35 NC(=O)C(N)CC1CCCO1 Amb25052480 [0,1,0,1,0,0|2,0,0]=4 4692 B11R1.35 NC(=O)C(N)CC1CCCS1 Amb33036784 [0,1,0,1,0,0|2,0,0]=4 4693 B11R1.35 NC(=O)C(N)CC1CCOC1 Amb24487738 [0,1,0,1,0,0|2,0,0]=4 4694 B11R1.35 NC(=O)C(N)C[C@@H]1CCCO1 Amb33065569 [0,1,0,1,0,0|2,0,0]=4 4695 B11R1.35 NC(=O)C(N)C[C@H]1CCCO1 Amb33034706 [0,1,0,1,0,0|2,0,0]=4 4696 B11R1.35 NC(CC1=CCCC1)C(=O)O Amb2699167 [0,1,0,1,0,0|1,0,0]=3 4697 B11R1.35 NC(CC1=CCCO1)C(=O)O Amb27843735 [0,1,0,1,0,0|1,0,1]=4 4698 B11R1.35 NC(CC1C=NCO1)C(=O)O Amb27244846 [0,1,0,1,0,0|1,0,1]=4 4699 B11R1.35 NC(CC1CC=CC1)C(=O)O Amb25893245 [0,1,0,1,0,0|1,0,1]=4 4700 B11R1.35 NC(CC1CCCC1)C(=O)O Amb28872272 [0,1,0,1,0,0|1,0,0]=3 4701 B11R1.35 NC(CC1CCCC1)C(=O)O Amb6276342 [0,1,0,1,0,0|1,0,0]=3 4702 B11R1.35 NC(CC1CCCO1)C(=O)O Amb6258157 [0,1,0,1,0,0|1,0,0]=3 4703 B11R1.35 NC(CC1CCCS1)C(=O)O Amb26518084 [0,1,0,1,0,0|1,0,0]=3 4704 B11R1.35 NC(CC1CCNC1)C(=O)O Amb22002696 [0,1,0,1,0,0|0,0,0]=2 4705 B11R1.35 NC(CC1CCOC1)C(=O)O Amb18979090 [0,1,0,1,0,0|1,0,0]=3 4706 B11R1.35 NC(CC1CCOC1)C(=O)O Amb33526992 [0,1,0,1,0,0|1,0,0]=3 4707 B11R1.35 NC(CC1CCSC1)C(=O)O Amb30039954 [0,1,0,1,0,0|1,0,0]=3 4708 B11R1.35 NC(CC1CCSC1)C(=O)O Amb33803198 [0,1,0,1,0,0|1,0,0]=3 4709 B11R1.35 NC(CC1OCCO1)C(=O)O Amb27868799 [0,1,0,1,0,0|1,0,0]=3 4710 B11R1.35 NC(CN1CCCC1)C(=O)O Amb18293486 [0,1,0,1,0,0|1,0,0]=3 4711 B11R1.35 NC(C[C@@H]1CCCO1)C(=O)O Amb24639753 [0,1,0,1,0,0|1,0,0]=3 4712 B11R1.35 NC(C[C@H]1CCCO1)C(=O)O Amb28059539 [0,1,0,1,0,0|1,0,0]=3 4713 B11R1.35 N[C@@H](CC1=CCCC1)C(=O)O Amb27856498 [0,1,0,1,0,0|1,0,0]=3 4714 B11R1.35 N[C@@H](CC1CC=CC1)C(=O)O Amb30032914 [0,1,0,1,0,0|1,0,1]=4 4715 B11R1.35 N[C@@H](CC1CCCC1)C(=O)O Amb2699194 [0,1,0,1,0,0|1,0,0]=3 4716 B11R1.35 N[C@@H](CC1CCCO1)C(=O)O Amb24373217 [0,1,0,1,0,0|1,0,0]=3 4717 B11R1.35 N[C@@H](CC1CCCS1)C(=O)O Amb33065570 [0,1,0,1,0,0|1,0,0]=3 4718 B11R1.35 N[C@@H](CC1CCNC1)C(=O)O Amb22228974 [0,1,0,1,0,0|0,0,0]=2 4719 B11R1.35 N[C@@H](CC1CCOC1)C(=O)O Amb18797502 [0,1,0,1,0,0|1,0,0]=3 4720 B11R1.35 N[C@@H](CC1OCCO1)C(=O)O Amb27807719 [0,1,0,1,0,0|1,0,0]=3 4721 B11R1.35 N[C@@H](C[C@@H]1CCCO1)C(=O)O Amb27845376 [0,1,0,1,0,0|1,0,0]=3 4722 B11R1.35 N[C@@H](C[C@H]1CCCO1)C(=O)O Amb27974150 [0,1,0,1,0,0|1,0,0]=3 4723 B11R1.35 N[C@H](CC1=CCCC1)C(=O)O Amb26402835 [0,1,0,1,0,0|1,0,0]=3 4724 B11R1.35 N[C@H](CC1CC=CC1)C(=O)O Amb30032915 [0,1,0,1,0,0|1,0,1]=4 4725 B11R1.35 N[C@H](CC1CCCC1)C(=O)O Amb8385711 [0,1,0,1,0,0|1,0,0]=3 4726 B11R1.35 N[C@H](CC1CCCO1)C(=O)O Amb27666889 [0,1,0,1,0,0|1,0,0]=3 4727 B11R1.35 N[C@H](CC1CCCS1)C(=O)O Amb33308529 [0,1,0,1,0,0|1,0,0]=3 4728 B11R1.35 N[C@H](CC1CCNC1)C(=O)O Amb22228965 [0,1,0,1,0,0|0,0,0]=2 4729 B11R1.35 N[C@H](CC1CCOC1)C(=O)O Amb27817824 [0,1,0,1,0,0|1,0,0]=3 4730 B11R1.35 N[C@H](C[C@@H]1CCCO1)C(=O)O Amb25962704 [0,1,0,1,0,0|1,0,0]=3 4731 B11R1.35 N[C@H](C[C@H]1CCCO1)C(=O)O Amb27637625 [0,1,0,1,0,0|1,0,0]=3 4732 B11R1.35 O=C(O)C(Cl)CC1CCCO1 Amb27865559 [0,1,0,1,0,0|2,0,0]=4 4733 B11R1.35 O=C(O)C(F)CC1CCCC1 Amb25706351 [0,1,0,1,0,0|2,0,0]=4 4734 B11R1.35 O=C(O)C(F)CC1CCCN1 Amb28074339 [0,1,0,1,0,0|1,0,0]=3 4735 B11R1.35 O=C(O)C(F)CN1CCCC1 Amb27842211 [0,1,0,1,0,0|2,0,0]=4 4736 B11R1.35 O=C(O)C(O)CC1CCCC1 Amb28145934 [0,1,0,1,0,0|2,0,0]=4 4737 B11R1.35 O=C(O)C(O)CC1CCCO1 Amb33353451 [0,1,0,1,0,0|2,0,0]=4 4738 B11R1.35 O=C(O)C(O)CC1CCCS1 Amb33416207 [0,1,0,1,0,0|2,0,0]=4 4739 B11R1.35 O=C(O)C(O)CC1CCOC1 Amb24643044 [0,1,0,1,0,0|2,0,0]=4 4740 B11R1.35 O=C(O)C(O)CC1CCSC1 Amb33141332 [0,1,0,1,0,0|2,0,0]=4 4741 B11R1.35 O=C(O)C(O)CC1SCCS1 Amb28240395 [0,1,0,1,0,0|2,0,0]=4 4742 B11R1.35 O=C(O)C(O)CN1CCCC1 Amb24437853 [0,1,0,1,0,0|2,0,0]=4 4743 B11R1.35 O=C(O)C(S)CC1CCCC1 Amb18296291 [0,1,0,1,0,0|2,0,0]=4 4744 B11R1.35 O=C(O)[C@@H](O)CC1CCCC1 Amb25700901 [0,1,0,1,0,0|2,0,0]=4 4745 B11R1.35 O=C(O)[C@H](F)CC1CCCC1 Amb26517246 [0,1,0,1,0,0|2,0,0]=4 4746 B11R1.35 O=C(O)[C@H](O)CC1CCCC1 Amb25861169 [0,1,0,1,0,0|2,0,0]=4 4747 B11R1.35 O=C(O)\C(F)=C\C1CCCN1 Amb28142521 [0,1,0,1,0,0|1,0,1]=4 4748 B11R1.48 CCC1NC(C(=O)O)CC1C Amb18200003 [0,1,0,1,0,0|1,0,0]=3 4749 B11R1.48 C[C@@H]1C[C@@H](C(=O)O)N[C@@H]1CO Amb25918100 [0,1,0,1,0,0|1,0,0]=3 4750 B11R1.48 NCC1OC(C(=O)O)CC1O Amb27596958 [0,1,0,1,0,0|1,0,0]=3 4751 B11R1.48 NC[C@H]1CC(C(=O)O)C[C@H]1O Amb27879994 [0,1,0,1,0,0|1,0,0]=3 4752 B11R1.48 NC[C@H]1O[C@@H](C(=O)O)C[C@@H]1O Amb10066959 [0,1,0,1,0,0|1,0,0]=3 4753 B11R1.48 O=C(O)C1CC(O)C(CO)O1 Amb27596869 [0,1,0,1,0,0|2,0,0]=4 4754 B11R1.48 O=C(O)[C@@H]1C[C@H](O)[C@@H](CO)N1 Amb27658923 [0,1,0,1,0,0|1,0,0]=3 4755 B11R1.48 O=C(O)[C@@H]1C[C@H](O)[C@H](CO)N1 Amb25273969 [0,1,0,1,0,0|1,0,0]=3 4756 B11R1.48 O=C(O)[C@@H]1C[C@H](O)[C@H](CO)O1 Amb28325693 [0,1,0,1,0,0|2,0,0]=4 4757 B11R1.48 O=C(O)[C@H]1C[C@@H](O)[C@H](CO)N1 Amb26456314 [0,1,0,1,0,0|1,0,0]=3 4758 B11R1.48 O=C(O)[C@H]1C[C@H](O)[C@@H](CO)N1 Amb28193760 [0,1,0,1,0,0|1,0,0]=3 4759 B11R1.48 O=C(O)[C@H]1C[C@H](O)[C@@H](CO)O1 Amb27216302 [0,1,0,1,0,0|2,0,0]=4 4760 B11R1.74 CC1CC(=O)CC(C(=O)O)N1 Amb18200027 [0,1,0,1,0,0|1,0,1]=4 4761 B11R1.74 CC1CC(=O)NC(C(=O)O)C1 Amb26352891 [0,1,0,1,0,0|1,0,1]=4 4762 B11R1.74 CC1CC(C)CC(C(=O)O)C1 Amb28314873 [0,1,0,1,0,0|2,0,0]=4 4763 B11R1.74 CC1CC(C)NC(C(=O)O)C1 Amb24588101 [0,1,0,1,0,0|1,0,0]=3 4764 B11R1.74 CC1CC(C)NC(C(N)=O)C1 Amb27750832 [0,1,0,1,0,0|2,0,0]=4 4765 B11R1.74 CC1CC(C)OC(C(=O)O)C1 Amb18830486 [0,1,0,1,0,0|2,0,0]=4 4766 B11R1.74 CC1CC(N)CC(C(=O)O)C1 Amb27212274 [0,1,0,1,0,0|1,0,0]=3 4767 B11R1.74 CC1CS(=O)C[C@@H](C(=O)O)N1 Amb28244788 [0,1,0,1,0,0|2,0,0]=4 4768 B11R1.74 CC1C[C@@H](O)C[C@H](C(=O)O)C1 Amb28195097 [0,1,0,1,0,0|2,0,0]=4 4769 B11R1.74 C[C@@H]1CC(=O)N[C@H](C(=O)O)C1 Amb28134065 [0,1,0,1,0,0|1,0,1]=4 4770 B11R1.74 C[C@@H]1C[C@H](C(=O)O)C[C@H](C)C1 Amb24487888 [0,1,0,1,0,0|2,0,0]=4 4771 B11R1.74 C[C@@H]1C[C@H](O)C[C@H](C(=O)O)C1 Amb28384451 [0,1,0,1,0,0|2,0,0]=4 4772 B11R1.74 C[C@H]1CC(=O)N[C@@H](C(=O)O)C1 Amb28284476 [0,1,0,1,0,0|1,0,1]=4 4773 B11R1.74 C[C@H]1C[C@@H](C)N[C@@H](C(=O)O)C1 Amb28132155 [0,1,0,1,0,0|1,0,0]=3 4774 B11R1.74 C[C@H]1C[C@H](O)C[C@H](C(=O)O)C1 Amb28051869 [0,1,0,1,0,0|2,0,0]=4 4775 B11R1.74 NC1CC(=O)NC(C(=O)O)C1 Amb18199921 [0,1,0,1,0,0|1,0,1]=4 4776 B11R1.74 NC1CC(N)CC(C(=O)O)C1 Amb26941963 [0,1,0,1,0,0|1,0,0]=3 4777 B11R1.74 NC1CC(O)CC(C(=O)O)C1 Amb28285635 [0,1,0,1,0,0|1,0,0]=3 4778 B11R1.74 N[C@@H]1C[C@H](O)C[C@H](C(=O)O)C1 Amb27650583 [0,1,0,1,0,0|1,0,0]=3 4779 B11R1.74 N[C@H]1CC(C(=O)O)C[C@H](N)C1 Amb27776579 [0,1,0,1,0,0|1,0,0]=3 4780 B11R1.74 O=C(O)C1CC(O)CC(O)C1 Amb26351388 [0,1,0,1,0,0|2,0,0]=4 4781 B11R1.74 O=C1CC(O)CC(C(=O)O)N1 Amb28077591 [0,1,0,1,0,0|1,0,1]=4 4782 B11R1.89 C=C(C)C(N)C1CCCN1C Amb35666114 [0,1,0,1,0,0|2,0,0]=4 4783 B11R1.89 CC(C(=O)O)C1CCCC1F Amb27864511 [0,1,0,1,0,0|2,0,0]=4 4784 B11R1.89 CC(C(=O)O)C1CCCC1O Amb28184980 [0,1,0,1,0,0|2,0,0]=4 4785 B11R1.89 CC(C(=O)O)C1CCCN1C Amb18199971 [0,1,0,1,0,0|1,0,0]=3 4786 B11R1.89 CC(C(=O)O)C1OCCC1N Amb27232976 [0,1,0,1,0,0|1,0,0]=3 4787 B11R1.89 CC1CCCC1C(C)C(=O)O Amb24645562 [0,1,0,1,0,0|2,0,0]=4 4788 B11R1.89 CC1CCCC1C(N)C(=O)O Amb35663083 [0,1,0,1,0,0|1,0,0]=3 4789 B11R1.89 CC1CCCC1[C@@H](C)C(=O)O Amb33726954 [0,1,0,1,0,0|2,0,0]=4 4790 B11R1.89 CC1CCCC1[C@H](C)C(=O)O Amb33743260 [0,1,0,1,0,0|2,0,0]=4 4791 B11R1.89 CC1CCCN1C(C)C(=O)O Amb18284138 [0,1,0,1,0,0|2,0,0]=4 4792 B11R1.89 CC1COCC1C(C)C(=O)O Amb35631915 [0,1,0,1,0,0|2,0,0]=4 4793 B11R1.89 CC1COCC1C(F)C(=O)O Amb35631916 [0,1,0,1,0,0|2,0,0]=4 4794 B11R1.89 CC1COCC1C(N)C(=O)O Amb35663294 [0,1,0,1,0,0|1,0,0]=3 4795 B11R1.89 CC1COCC1C(O)C(=O)O Amb35635726 [0,1,0,1,0,0|2,0,0]=4 4796 B11R1.89 CC1CSCC1C(N)C(=O)O Amb30040081 [0,1,0,1,0,0|1,0,0]=3 4797 B11R1.89 CC1OCCC1C(C)C(=O)O Amb26648017 [0,1,0,1,0,0|2,0,0]=4 4798 B11R1.89 CC1OCCC1C(N)C(=O)O Amb33310498 [0,1,0,1,0,0|1,0,0]=3 4799 B11R1.89 CC1OCCC1C(O)C(=O)O Amb26880616 [0,1,0,1,0,0|2,0,0]=4 4800 B11R1.89 CC1SCCC1C(N)C(=O)O Amb30040043 [0,1,0,1,0,0|1,0,0]=3 4801 B11R1.89 CN1CCN=C1C(N)C(=O)O Amb18200006 [0,1,0,1,0,0|1,0,1]=4 4802 B11R1.89 NC(=O)C(N)C1CCCC1O Amb33066224 [0,1,0,1,0,0|2,0,0]=4 4803 B11R1.89 NC(=O)C(N)C1COCC1O Amb33066104 [0,1,0,1,0,0|2,0,0]=4 4804 B11R1.89 NC(C(=O)O)C1CCCC1O Amb24484702 [0,1,0,1,0,0|1,0,0]=3 4805 B11R1.89 NC(C(=O)O)C1COCC1O Amb33127517 [0,1,0,1,0,0|1,0,0]=3 4806 B11R1.89 N[C@@H](C(=O)O)C1CCCC1O Amb24355871 [0,1,0,1,0,0|1,0,0]=3 4807 B11R1.89 N[C@@H](C(=O)O)C1COCC1O Amb33309020 [0,1,0,1,0,0|1,0,0]=3 4808 B11R1.89 N[C@@H](C(=O)O)[C@@H]1CCC[C@@H]1O Amb28051879 [0,1,0,1,0,0|1,0,0]=3 4809 B11R1.89 N[C@H](C(=O)O)C1CCCC1O Amb27791737 [0,1,0,1,0,0|1,0,0]=3 4810 B11R1.89 N[C@H](C(=O)O)C1COCC1O Amb33309059 [0,1,0,1,0,0|1,0,0]=3 4811 B11R1.89 O=C(O)[C@@H](O)[C@@H]1CCCC1=O Amb27781539 [0,1,0,1,0,0|2,0,0]=4 4812 B11R1.89 O=C(O)[C@H](O)[C@H]1CCCC1=O Amb27205679 [0,1,0,1,0,0|2,0,0]=4 4813 B11R1.89 O=C1CCC[C@H]1[C@@H](O)C(=O)O Amb27645466 [0,1,0,1,0,0|2,0,0]=4 4814 B11R1.124 C#CCC1CNC(C(=O)O)C1 Amb26543319 [0,1,0,1,0,0|1,0,1]=4 4815 B11R1.124 C#CC[C@H]1CN[C@H](C(=O)O)C1 Amb26553780 [0,1,0,1,0,0|1,0,1]=4 4816 B11R1.124 C=CC[C@@H]1CC[C@H](C(=O)O)N1 Amb28249783 [0,1,0,1,0,0|1,0,0]=3 4817 B11R1.124 C=CC[C@H]1CN[C@H](C(=O)O)C1 Amb26551150 [0,1,0,1,0,0|1,0,1]=4 4818 B11R1.124 CCCC1CC(C(=O)O)CO1 Amb27791855 [0,1,0,1,0,0|2,0,0]=4 4819 B11R1.124 CCCC1CCC(C(=O)O)O1 Amb27857074 [0,1,0,1,0,0|2,0,0]=4 4820 B11R1.124 CCCC1CC[C@@H](C(=O)O)N1 Amb27478099 [0,1,0,1,0,0|1,0,0]=3 4821 B11R1.124 CCCC1CN[C@H](C(=O)O)C1 Amb24487717 [0,1,0,1,0,0|1,0,0]=3 4822 B11R1.124 CCCN1CCC(C(=O)O)C1 Amb18302805 [0,1,0,1,0,0|2,0,0]=4 4823 B11R1.124 CCC[C@@H]1CC[C@@H](C(=O)O)N1 Amb28400213 [0,1,0,1,0,0|1,0,0]=3 4824 B11R1.124 CCC[C@H]1CN[C@H](C(=O)O)C1 Amb26636529 [0,1,0,1,0,0|1,0,0]=3 4825 B11R1.124 CCOC1CC(C(=O)O)NO1 Amb27176586 [0,1,0,1,0,0|2,0,0]=4 4826 B11R1.124 CCOC1CNC(C(=O)O)C1 Amb25955377 [0,1,0,1,0,0|2,0,0]=4 4827 B11R1.124 CCO[C@@H]1C[C@H](C(=O)O)NO1 Amb27634891 [0,1,0,1,0,0|2,0,0]=4 4828 B11R1.124 CCO[C@H]1CN[C@H](C(=O)O)C1 Amb26060615 [0,1,0,1,0,0|2,0,0]=4 4829 B11R1.124 CCO[C@H]1CN[C@H](C(=O)O)C1 Amb35748112 [0,1,0,1,0,0|2,0,0]=4 4830 B11R1.124 CNCC1CCC(C(=O)O)O1 Amb25140444 [0,1,0,1,0,0|1,0,0]=3 4831 B11R1.124 COCC1CCC(C(=O)O)C1 Amb25780193 [0,1,0,1,0,0|2,0,0]=4 4832 B11R1.124 COCC1CCC(C(=O)O)N1 Amb24441382 [0,1,0,1,0,0|1,0,0]=3 4833 B11R1.124 COCC1CCC(C(=O)O)O1 Amb18988012 [0,1,0,1,0,0|2,0,0]=4 4834 B11R1.124 COC[C@@H]1CC[C@@H](C(=O)O)N1 Amb24547011 [0,1,0,1,0,0|1,0,0]=3 4835 B11R1.124 COC[C@@H]1CC[C@H](C(=O)O)C1 Amb27768044 [0,1,0,1,0,0|2,0,0]=4 4836 B11R1.124 COC[C@@H]1CC[C@H](C(=O)O)N1 Amb25919696 [0,1,0,1,0,0|1,0,0]=3 4837 B11R1.124 COC[C@H]1CC[C@@H](C(=O)O)C1 Amb27781461 [0,1,0,1,0,0|2,0,0]=4 4838 B11R1.124 COC[C@H]1CC[C@@H](C(=O)O)N1 Amb25369771 [0,1,0,1,0,0|1,0,0]=3 4839 B11R1.124 COC[C@H]1CC[C@@H](C(=O)O)O1 Amb27217029 [0,1,0,1,0,0|2,0,0]=4 4840 B11R1.124 N#CC[C@@H]1CN[C@H](C(=O)O)C1 Amb28066566 [0,1,0,1,0,0|0,0,2]=4 4841 B11R1.124 N#CC[C@H]1CN[C@H](C(=O)O)C1 Amb25179025 [0,1,0,1,0,0|0,0,2]=4 4842 B11R1.124 NCCC1CNC(C(=O)O)C1 Amb27952384 [0,1,0,1,0,0|0,0,0]=2 4843 B11R1.124 NCCN1CCC(C(N)=O)C1 Amb27465843 [0,1,0,1,0,0|2,0,0]=4 4844 B11R1.124 NCC[C@H]1CN[C@H](C(=O)O)C1 Amb28385485 [0,1,0,1,0,0|0,0,0]=2 4845 B11R1.124 O=C(O)C1CCC(CNO)O1 Amb27478942 [0,1,0,1,0,0|1,0,0]=3 4846 B11R1.124 O=C(O)C1CSC(CCS)C1 Amb27955882 [0,1,0,1,0,0|2,0,0]=4 4847 B11R1.153 CC1CC(CC(N)C(=O)O)C1 Amb33309211 [0,1,0,1,0,0|1,0,0]=3 4848 B11R1.153 CC1CC(CC(N)C(N)=O)C1 Amb33308702 [0,1,0,1,0,0|2,0,0]=4 4849 B11R1.153 CC1CC(C[C@@H](N)C(=O)O)C1 Amb33065706 [0,1,0,1,0,0|1,0,0]=3 4850 B11R1.153 CC1CC(C[C@H](N)C(=O)O)C1 Amb33066299 [0,1,0,1,0,0|1,0,0]=3 4851 B11R1.153 CC1CN(CC(N)C(=O)O)C1 Amb28135150 [0,1,0,1,0,0|2,0,0]=4 4852 B11R1.192 CCCC1CCC(=O)C(N)C1 Amb18956644 [0,1,0,1,0,0|2,0,0]=4 4853 B11R1.192 CN1CC(CCN)OCC1=O Amb25742323 [0,1,0,1,0,0|2,0,0]=4 4854 B11R1.192 CNC[C@@H]1CC[C@@H](N)C(O)O1 Amb27873532 [0,1,0,1,0,0|0,0,2]=4 4855 B11R1.277 O=C1OC(CO)C(O)CC1O Amb27757261 [0,1,0,1,0,0|2,0,0]=4 4856 B11R1.468 CCC1CC1CC(N)C(=O)O Amb33066051 [0,1,0,1,0,0|1,0,0]=3 4857 B11R1.468 CCC1CC1CC(N)C(N)=O Amb33065736 [0,1,0,1,0,0|2,0,0]=4 4858 B11R1.468 CCC1CC1C[C@@H](N)C(=O)O Amb33065440 [0,1,0,1,0,0|1,0,0]=3 4859 B11R1.468 CCC1CC1C[C@H](N)C(=O)O Amb33036903 [0,1,0,1,0,0|1,0,0]=3 4860 B11R1.468 CCC1CC1NC(C)C(=O)O Amb27271453 [0,1,0,1,0,0|2,0,0]=4 4861 B11R1.468 CC[C@@H]1C[C@H]1CC(N)C(=O)O Amb33066171 [0,1,0,1,0,0|1,0,0]=3 4862 B11R1.468 CC[C@@H]1C[C@H]1CC(N)C(N)=O Amb33065637 [0,1,0,1,0,0|2,0,0]=4 4863 B11R1.468 CC[C@@H]1C[C@H]1C[C@@H](N)C(=O)O Amb33065726 [0,1,0,1,0,0|1,0,0]=3 4864 B11R1.468 CC[C@@H]1C[C@H]1C[C@H](N)C(=O)O Amb33035586 [0,1,0,1,0,0|1,0,0]=3 4865 B11R1.490 CC1CC(N)C(C)(C(=O)O)C1 Amb33232154 [0,1,0,1,0,0|1,0,0]=3 4866 B11R1.497 CC(=O)C1CCCCC(=O)N1 Amb27873410 [0,1,0,1,0,0|2,0,0]=4 4867 B11R1.497 CC(=O)C1CCCCN(C)C1 Amb27638717 [0,1,0,1,0,0|2,0,0]=4 4868 B11R1.497 CC1=NCCC[C@H](C(=O)O)N1 Amb27231815 [0,1,0,1,0,0|1,0,1]=4 4869 B11R1.497 CN1CCCCC(C(=O)O)C1 Amb32668486 [0,1,0,1,0,0|1,0,0]=3 4870 B11R1.497 CN1CCCCC(C(=O)O)C1 Amb8010549 [0,1,0,1,0,0|1,0,0]=3 4871 B11R1.497 CN1CCOCC(C(=O)O)C1 Amb27802817 [0,1,0,1,0,0|2,0,0]=4 4872 B11R1.497 NC(=O)C1CCCCC(=O)N1 Amb26852005 [0,1,0,1,0,0|2,0,0]=4 4873 B11R1.497 O=C1CCCCC(C(=O)O)C1 Amb10603800 [0,1,0,1,0,0|2,0,0]=4 4874 B11R1.497 O=C1CCCCC(C(=O)O)N1 Amb19515429 [0,1,0,1,0,0|1,0,0]=3 4875 B11R1.497 O=C1CCOC[C@H](C(=O)O)N1 Amb27483038 [0,1,0,1,0,0|1,0,1]=4 4876 B11R1.497 O=C1CCSCC(C(=O)O)N1 Amb21937059 [0,1,0,1,0,0|1,0,1]=4 4877 B11R1.497 O=C1NCCCC(C(=O)O)N1 Amb27657613 [0,1,0,1,0,0|1,0,1]=4 4878 B11R1.497 O=C1NCCC[C@H](C(=O)O)N1 Amb27803711 [0,1,0,1,0,0|1,0,1]=4 4879 B11R1.560 O=C1OCCCC(Cl)CC1Cl Amb27233031 [0,1,0,1,0,0|2,0,0]=4 4880 B11R1.667 CC(=O)C1(N)CCCC(C)C1 Amb25369024 [0,1,0,1,0,0|2,0,0]=4 4881 B11R1.667 CC1(C(=O)O)CC(N)CCO1 Amb32675435 [0,1,0,1,0,0|2,0,0]=4 4882 B11R1.667 CC1(C(=O)O)CC(N)CCO1 Amb32682437 [0,1,0,1,0,0|2,0,0]=4 4883 B11R1.667 CC1(C(=O)O)CCCC(Cl)C1 Amb18127807 [0,1,0,1,0,0|2,0,0]=4 4884 B11R1.667 CC1(C(=O)O)CCCC(F)C1 Amb27429155 [0,1,0,1,0,0|2,0,0]=4 4885 B11R1.667 CC1CC(N)(C(=O)O)CCO1 Amb26893175 [0,1,0,1,0,0|2,0,0]=4 4886 B11R1.667 CC1CC(N)(C(=O)O)CCO1 Amb30584653 [0,1,0,1,0,0|2,0,0]=4 4887 B11R1.667 CC1CCCC(C)(C(=O)O)C1 Amb25892566 [0,1,0,1,0,0|2,0,0]=4 4888 B11R1.667 CC1CCCC(Cl)(C(=O)O)C1 Amb33127952 [0,1,0,1,0,0|2,0,0]=4 4889 B11R1.667 CC1CCCC(N)(C(=O)O)C1 Amb2695467 [0,1,0,1,0,0|1,0,0]=3 4890 B11R1.667 CN1CCCC(N)(C(=O)O)C1 Amb28280438 [0,1,0,1,0,0|2,0,0]=4 4891 B11R1.667 C[C@@H]1CCC[C@@](C)(C(=O)O)C1 Amb28384471 [0,1,0,1,0,0|2,0,0]=4 4892 B11R1.667 C[C@@H]1CCC[C@@](N)(C(=O)O)C1 Amb27858765 [0,1,0,1,0,0|1,0,0]=3 4893 B11R1.667 C[C@@H]1CCC[C@](N)(C(=O)O)C1 Amb27444576 [0,1,0,1,0,0|1,0,0]=3 4894 B11R1.667 C[C@H]1CCC[C@](C)(C(=O)O)C1 Amb28132417 [0,1,0,1,0,0|2,0,0]=4 4895 B11R1.667 NC(=O)C1(N)CCCC(O)C1 Amb29866305 [0,1,0,1,0,0|2,0,0]=4 4896 B11R1.667 NC1(C(=O)O)CCCC(=O)C1 Amb23560233 [0,1,0,1,0,0|1,0,1]=4 4897 B11R1.667 NC1(C(=O)O)CCCC(O)C1 Amb27607815 [0,1,0,1,0,0|1,0,0]=3 4898 B11R1.667 NC1CCCC(F)(C(=O)O)C1 Amb27165541 [0,1,0,1,0,0|1,0,0]=3 4899 B11R1.667 N[C@@]1(C(=O)O)CCC[C@@H](O)C1 Amb25377812 [0,1,0,1,0,0|1,0,0]=3 4900 B11R1.667 O=C(O)C1(Cl)CCCC(Cl)C1 Amb28118839 [0,1,0,1,0,0|2,0,0]=4 4901 B11R1.667 O=C(O)C1(O)CCCC(O)C1 Amb28071186 [0,1,0,1,0,0|2,0,0]=4 4902 B11R1.667 O=C(O)[C@@]1(O)CCC[C@H](O)C1 Amb28131475 [0,1,0,1,0,0|2,0,0]=4 4903 B11R1.718 CC(CC(C)C1CC1)C(=O)O Amb32728797 [0,1,0,1,0,0|2,0,0]=4 4904 B11R1.718 CC(CC(N)C(=O)O)C1CC1 Amb32862464 [0,1,0,1,0,0|1,0,0]=3 4905 B11R1.718 CC(CC(N)C(N)=O)C1CC1 Amb33065523 [0,1,0,1,0,0|2,0,0]=4 4906 B11R1.718 CC(CC(O)C(=O)O)C1CC1 Amb32728784 [0,1,0,1,0,0|2,0,0]=4 4907 B11R1.718 CC(CC(O)C1CC1)C(=O)O Amb18182337 [0,1,0,1,0,0|2,0,0]=4 4908 B11R1.718 CC(C[C@@H](N)C(=O)O)C1CC1 Amb33066329 [0,1,0,1,0,0|1,0,0]=3 4909 B11R1.718 CC(C[C@H](N)C(=O)O)C1CC1 Amb33036469 [0,1,0,1,0,0|1,0,0]=3 4910 B11R1.718 NC(CC(=O)C1CC1)C(=O)O Amb27269561 [0,1,0,1,0,0|1,0,1]=4 4911 B11R1.718 N[C@@H](CC(=O)C1CC1)C(=O)O Amb28386949 [0,1,0,1,0,0|1,0,1]=4 4912 B11R1.718 N[C@H](CC(=O)C1CC1)C(=O)O Amb28386950 [0,1,0,1,0,0|1,0,1]=4 4913 B11R1.816 CCCC(C)C1CC1C(=O)O Amb26082561 [0,1,0,1,0,0|2,0,0]=4 4914 B11R1.816 CCCC(C)[C@@H]1C[C@H]1C(=O)O Amb33322343 [0,1,0,1,0,0|2,0,0]=4 4915 B11R1.1112 CC1(CC(N)C(=O)O)CCC1 Amb25689379 [0,1,0,1,0,0|1,0,0]=3 4916 B11R1.1112 CC1(CC(N)C(=O)O)COC1 Amb33314603 [0,1,0,1,0,0|2,0,0]=4 4917 B11R1.1112 CC1(CC(N)C(N)=O)CCC1 Amb25864125 [0,1,0,1,0,0|2,0,0]=4 4918 B11R1.1112 CC1(C[C@@H](N)C(=O)O)CCC1 Amb25127513 [0,1,0,1,0,0|1,0,0]=3 4919 B11R1.1112 CC1(C[C@@H](N)C(=O)O)COC1 Amb32640194 [0,1,0,1,0,0|2,0,0]=4 4920 B11R1.1112 CC1(C[C@H](N)C(=O)O)CCC1 Amb26921425 [0,1,0,1,0,0|1,0,0]=3 4921 B11R1.1112 NC(=O)C(N)CC1(O)CCC1 Amb33065481 [0,1,0,1,0,0|2,0,0]=4 4922 B11R1.1112 NC(CC1(O)CCC1)C(=O)O Amb33065428 [0,1,0,1,0,0|1,0,0]=3 4923 B11R1.1112 N[C@@H](CC1(O)CCC1)C(=O)O Amb33065510 [0,1,0,1,0,0|1,0,0]=3 4924 B11R1.1112 N[C@H](CC1(O)CCC1)C(=O)O Amb33036687 [0,1,0,1,0,0|1,0,0]=3 4925 B11R1.1257 N#CC[C@H]1C[C@@](N)(C(=O)O)C1 Amb34913104 [0,1,0,1,0,0|0,0,2]=4 4926 B11R1.1257 NCCC1CC(N)(C(=O)O)C1 Amb24364754 [0,1,0,1,0,0|0,0,0]=2 4927 B11R1.56 NCC1CCC(F)(F)C(=O)N1 Amb32651717 [0,1,0,1,0,0|2,0,0]=4 4928 B11R1.173 CC(C)(C(=O)O)C1CCCC1 Amb22059619 [0,1,0,1,0,0|2,0,0]=4 4929 B11R1.173 CC(C)(C(=O)O)C1CCCN1 Amb33743717 [0,1,0,1,0,0|1,0,0]=3 4930 B11R1.173 CC(C)(C(=O)O)C1CCCN1 Amb33743830 [0,1,0,1,0,0|1,0,0]=3 4931 B11R1.173 CC(C)(C(=O)O)C1CCCO1 Amb26993259 [0,1,0,1,0,0|2,0,0]=4 4932 B11R1.173 CC(C)(C(=O)O)C1CCCS1 Amb27453009 [0,1,0,1,0,0|2,0,0]=4 4933 B11R1.173 CC(C)(C(=O)O)C1NCCS1 Amb18127466 [0,1,0,1,0,0|2,0,0]=4 4934 B11R1.173 CC(C)(C(N)=O)C1CCCN1 Amb27625201 [0,1,0,1,0,0|2,0,0]=4 4935 B11R1.173 CC(N)(C(N)=O)C1CCCN1 Amb28204197 [0,1,0,1,0,0|1,0,0]=3 4936 B11R1.173 C[C@](N)(C(=O)O)C1CCCC1 Amb27461420 [0,1,0,1,0,0|1,0,0]=3 4937 B11R1.173 O=C(O)C(F)(F)C1CCCC1 Amb19929279 [0,1,0,1,0,0|2,0,0]=4 4938 B11R1.173 O=C(O)C(F)(F)C1CCCO1 Amb23591028 [0,1,0,1,0,0|2,0,0]=4 4939 B11R1.173 O=C(O)C(F)(F)C1CCCS1 Amb32749709 [0,1,0,1,0,0|2,0,0]=4 4940 B11R1.556 CC1CC1CC(C)(C)C(=O)O Amb33144973 [0,1,0,1,0,0|2,0,0]=4 4941 B11R1.556 CC1CC1CC(C)(O)C(=O)O Amb33143885 [0,1,0,1,0,0|2,0,0]=4 4942 B11R1.556 CC1CC1CC(F)(F)C(=O)O Amb32743276 [0,1,0,1,0,0|2,0,0]=4 4943 B11R1.715 CC(C)(CC1CCC1)C(=O)O Amb26950334 [0,1,0,1,0,0|2,0,0]=4 4944 B11R1.715 CC(F)(CC1CCC1)C(=O)O Amb27958908 [0,1,0,1,0,0|2,0,0]=4 4945 B11R1.715 CC(N)(CC1CCC1)C(=O)O Amb27173666 [0,1,0,1,0,0|1,0,0]=3 4946 B11R1.715 CC(N)(CC1CCC1)C(N)=O Amb27791541 [0,1,0,1,0,0|2,0,0]=4 4947 B11R1.715 CC(O)(CC1CCC1)C(=O)O Amb27835404 [0,1,0,1,0,0|2,0,0]=4 4948 B11R1.715 O=C(O)C(F)(F)CC1CCC1 Amb33007922 [0,1,0,1,0,0|2,0,0]=4 4949 B11R1.716 CC(C)(CCC1CC1)C(=O)O Amb22500077 [0,1,0,1,0,0|2,0,0]=4 4950 B11R1.716 CC(N)(CCC1CC1)C(=O)O Amb27673264 [0,1,0,1,0,0|1,0,0]=3 4951 B11R1.716 CC(O)(CCC1CC1)C(=O)O Amb33361184 [0,1,0,1,0,0|2,0,0]=4 4952 B11R1.716 O=C(O)C(F)(F)CCC1CC1 Amb33338324 [0,1,0,1,0,0|2,0,0]=4 4953 B11R1.737 CC1(C(=O)O)CCCCCC1 Amb25152741 [0,1,0,1,0,0|2,0,0]=4 4954 B11R1.737 C[C@@]1(C(=O)O)CCCCCN1 Amb27848065 [0,1,0,1,0,0|1,0,0]=3 4955 B11R1.737 NC(=O)C1(N)CCCCCC1 Amb6892253 [0,1,0,1,0,0|2,0,0]=4 4956 B11R1.737 NC(=O)C1(N)CCCNCC1 Amb27200456 [0,1,0,1,0,0|2,0,0]=4 4957 B11R1.737 NC(=O)C1(N)CCCSCC1 Amb35692548 [0,1,0,1,0,0|2,0,0]=4 4958 B11R1.737 NC1(C(=O)O)CCCCCC1 Amb1841034 [0,1,0,1,0,0|1,0,0]=3 4959 B11R1.737 NC1(C(=O)O)CCCNCC1 Amb27847261 [0,1,0,1,0,0|1,0,0]=3 4960 B11R1.737 NC1(C(=O)O)CCCSCC1 Amb35691496 [0,1,0,1,0,0|1,0,0]=3 4961 B11R1.737 NC1(C(=O)O)COCCOC1 Amb27984548 [0,1,0,1,0,0|2,0,0]=4 4962 B11R1.737 O=C(O)C1(Cl)CCCCCC1 Amb26847917 [0,1,0,1,0,0|2,0,0]=4 4963 B11R1.737 O=C(O)C1(F)CCCCCC1 Amb25151314 [0,1,0,1,0,0|2,0,0]=4 4964 B11R1.737 O=C(O)C1(O)CCCCCC1 Amb33537594 [0,1,0,1,0,0|2,0,0]=4 4965 B11R1.737 O=C(O)C1(O)CCCSCC1 Amb35691488 [0,1,0,1,0,0|2,0,0]=4 4966 B11R1.844 CCOC[C@@H]1C[C@@]1(C)C(=O)O Amb33098433 [0,1,0,1,0,0|2,0,0]=4 4967 B11R1.991 CCCCCC1(C(=O)O)CC1 Amb32426134 [0,1,0,1,0,0|2,0,0]=4 4968 B11R1.1229 CCC1CC(N)(C(=O)O)CN1 Amb28325829 [0,1,0,1,0,0|2,0,0]=4 4969 B11R1.1229 CCC1CC(N)(C(=O)O)CO1 Amb35626631 [0,1,0,1,0,0|2,0,0]=4 4970 B11R1.1229 CCC1CCC(N)(C(N)=O)C1 Amb27863029 [0,1,0,1,0,0|2,0,0]=4 4971 B11R1.1229 CCC1CCC(O)(C(=O)O)C1 Amb33528775 [0,1,0,1,0,0|2,0,0]=4 4972 B11R1.1229 CSC1CCC(N)(C(=O)O)C1 Amb26856563 [0,1,0,1,0,0|2,0,0]=4 4973 B11R1.1229 CS[C@@H]1CC[C@](N)(C(=O)O)C1 Amb28342618 [0,1,0,1,0,0|2,0,0]=4 4974 B11R1.36 CC(=O)C(C)C1CCCCN1 Amb27962848 [0,1,0,1,0,0|2,0,0]=4 4975 B11R1.36 CC(C(=O)O)C1C=CCCC1 Amb18125733 [0,1,0,1,0,0|2,0,0]=4 4976 B11R1.36 CC(C(=O)O)C1CCCCC1 Amb4036008 [0,1,0,1,0,0|2,0,0]=4 4977 B11R1.36 CC(C(=O)O)C1CCCCN1 Amb18830609 [0,1,0,1,0,0|1,0,0]=3 4978 B11R1.36 CC(C(=O)O)C1CCCCO1 Amb18645033 [0,1,0,1,0,0|2,0,0]=4 4979 B11R1.36 CC(C(=O)O)C1CCCNC1 Amb18199993 [0,1,0,1,0,0|1,0,0]=3 4980 B11R1.36 CC(C(=O)O)C1CCCNC1 Amb32664260 [0,1,0,1,0,0|1,0,0]=3 4981 B11R1.36 CC(C(=O)O)C1CCCOC1 Amb18830485 [0,1,0,1,0,0|2,0,0]=4 4982 B11R1.36 CC(C(=O)O)C1CCCSC1 Amb18197517 [0,1,0,1,0,0|2,0,0]=4 4983 B11R1.36 CC(C(=O)O)C1CCNCC1 Amb10607938 [0,1,0,1,0,0|2,0,0]=4 4984 B11R1.36 CC(C(=O)O)C1CCNCC1 Amb13949185 [0,1,0,1,0,0|2,0,0]=4 4985 B11R1.36 CC(C(=O)O)C1CCOCC1 Amb18199913 [0,1,0,1,0,0|2,0,0]=4 4986 B11R1.36 CC(C(=O)O)C1CCSCC1 Amb18197516 [0,1,0,1,0,0|2,0,0]=4 4987 B11R1.36 CC(C(=O)O)C1COCCN1 Amb18199869 [0,1,0,1,0,0|1,0,0]=3 4988 B11R1.36 CC(C(=O)O)C1CSCCN1 Amb18197104 [0,1,0,1,0,0|1,0,0]=3 4989 B11R1.36 CC(C(=O)O)C1OCCCO1 Amb33731305 [0,1,0,1,0,0|2,0,0]=4 4990 B11R1.36 CC(C(=O)O)N1CCCCC1 Amb2693823 [0,1,0,1,0,0|2,0,0]=4 4991 B11R1.36 CC(C(=O)O)N1CCCCC1 Amb9677406 [0,1,0,1,0,0|2,0,0]=4 4992 B11R1.36 CC(C(N)=O)C1CCCCN1 Amb28051755 [0,1,0,1,0,0|2,0,0]=4 4993 B11R1.36 CC(C(N)=O)C1COCCN1 Amb27445875 [0,1,0,1,0,0|2,0,0]=4 4994 B11R1.36 CC(C(N)=O)N1CCCCN1 Amb27815206 [0,1,0,1,0,0|2,0,0]=4 4995 B11R1.36 C[C@@H](C(=O)O)C1=CCCCC1 Amb27865484 [0,1,0,1,0,0|2,0,0]=4 4996 B11R1.36 C[C@@H](C(=O)O)C1CCCCC1 Amb10844024 [0,1,0,1,0,0|2,0,0]=4 4997 B11R1.36 C[C@@H](C(=O)O)C1CCCCO1 Amb33738120 [0,1,0,1,0,0|2,0,0]=4 4998 B11R1.36 C[C@@H](C(=O)O)C1CCCOC1 Amb33726958 [0,1,0,1,0,0|2,0,0]=4 4999 B11R1.36 C[C@@H](C(=O)O)C1CCOCC1 Amb33729605 [0,1,0,1,0,0|2,0,0]=4 5000 B11R1.36 C[C@@H](C(=O)O)C1OCCCO1 Amb33738117 [0,1,0,1,0,0|2,0,0]=4 5001 B11R1.36 C[C@H](C(=O)O)C1CCCCC1 Amb10844035 [0,1,0,1,0,0|2,0,0]=4 5002 B11R1.36 C[C@H](C(=O)O)C1CCCCO1 Amb33744904 [0,1,0,1,0,0|2,0,0]=4 5003 B11R1.36 C[C@H](C(=O)O)C1CCCOC1 Amb33744371 [0,1,0,1,0,0|2,0,0]=4 5004 B11R1.36 C[C@H](C(=O)O)C1CCOCC1 Amb33747706 [0,1,0,1,0,0|2,0,0]=4 5005 B11R1.36 C[C@H](C(=O)O)C1OCCCO1 Amb33744646 [0,1,0,1,0,0|2,0,0]=4 5006 B11R1.36 NC(=O)C(N)C1C=CCCC1 Amb24389817 [0,1,0,1,0,0|2,0,0]=4 5007 B11R1.36 NC(=O)C(N)C1CCCCC1 Amb23580620 [0,1,0,1,0,0|2,0,0]=4 5008 B11R1.36 NC(=O)C(N)C1CCCCO1 Amb25195318 [0,1,0,1,0,0|2,0,0]=4 5009 B11R1.36 NC(=O)C(N)C1CCCOC1 Amb25169231 [0,1,0,1,0,0|2,0,0]=4 5010 B11R1.36 NC(=O)C(N)C1CCOCC1 Amb18961315 [0,1,0,1,0,0|2,0,0]=4 5011 B11R1.36 NC(=O)C(N)C1COCCO1 Amb27633264 [0,1,0,1,0,0|2,0,0]=4 5012 B11R1.36 NC(=O)C(O)C1CCCNC1 Amb19148580 [0,1,0,1,0,0|2,0,0]=4 5013 B11R1.36 NC(C(=O)O)C1=CCCCO1 Amb27962634 [0,1,0,1,0,0|1,0,1]=4 5014 B11R1.36 NC(C(=O)O)C1=COCCC1 Amb33416010 [0,1,0,1,0,0|1,0,1]=4 5015 B11R1.36 NC(C(=O)O)C1C=CCCC1 Amb26874365 [0,1,0,1,0,0|1,0,0]=3 5016 B11R1.36 NC(C(=O)O)C1CC=CCC1 Amb2696736 [0,1,0,1,0,0|1,0,1]=4 5017 B11R1.36 NC(C(=O)O)C1CC=CCC1 Amb35751141 [0,1,0,1,0,0|1,0,1]=4 5018 B11R1.36 NC(C(=O)O)C1CCCCC1 Amb2747009 [0,1,0,1,0,0|1,0,0]=3 5019 B11R1.36 NC(C(=O)O)C1CCCCC1 Amb9718595 [0,1,0,1,0,0|1,0,0]=3 5020 B11R1.36 NC(C(=O)O)C1CCCCN1 Amb23401448 [0,1,0,1,0,0|0,0,0]=2 5021 B11R1.36 NC(C(=O)O)C1CCCCN1 Amb30647385 [0,1,0,1,0,0|0,0,0]=2 5022 B11R1.36 NC(C(=O)O)C1CCCCO1 Amb32646076 [0,1,0,1,0,0|1,0,0]=3 5023 B11R1.36 NC(C(=O)O)C1CCCCO1 Amb33338810 [0,1,0,1,0,0|1,0,0]=3 5024 B11R1.36 NC(C(=O)O)C1CCCNC1 Amb13885812 [0,1,0,1,0,0|0,0,0]=2 5025 B11R1.36 NC(C(=O)O)C1CCCOC1 Amb22011581 [0,1,0,1,0,0|1,0,0]=3 5026 B11R1.36 NC(C(=O)O)C1CCCOC1 Amb32664947 [0,1,0,1,0,0|1,0,0]=3 5027 B11R1.36 NC(C(=O)O)C1CCCSC1 Amb18197110 [0,1,0,1,0,0|1,0,0]=3 5028 B11R1.36 NC(C(=O)O)C1CCNCC1 Amb18199899 [0,1,0,1,0,0|1,0,0]=3 5029 B11R1.36 NC(C(=O)O)C1CCOCC1 Amb33530384 [0,1,0,1,0,0|1,0,0]=3 5030 B11R1.36 NC(C(=O)O)C1CCOCC1 Amb33533150 [0,1,0,1,0,0|1,0,0]=3 5031 B11R1.36 NC(C(=O)O)C1SCCCS1 Amb27488282 [0,1,0,1,0,0|1,0,0]=3 5032 B11R1.36 NC(C(=O)O)[C@H]1CC=CCO1 Amb27839886 [0,1,0,1,0,0|1,0,1]=4 5033 B11R1.36 N[C@@H](C(=O)O)C1=CCCCC1 Amb27831409 [0,1,0,1,0,0|1,0,0]=3 5034 B11R1.36 N[C@@H](C(=O)O)C1C=CCCC1 Amb28411371 [0,1,0,1,0,0|1,0,0]=3 5035 B11R1.36 N[C@@H](C(=O)O)C1CCCCC1 Amb20242426 [0,1,0,1,0,0|1,0,0]=3 5036 B11R1.36 N[C@@H](C(=O)O)C1CCCCC1 Amb8395975 [0,1,0,1,0,0|1,0,0]=3 5037 B11R1.36 N[C@@H](C(=O)O)C1CCCCO1 Amb33065611 [0,1,0,1,0,0|1,0,0]=3 5038 B11R1.36 N[C@@H](C(=O)O)C1CCCOC1 Amb25144455 [0,1,0,1,0,0|1,0,0]=3 5039 B11R1.36 N[C@@H](C(=O)O)C1CCOCC1 Amb16232103 [0,1,0,1,0,0|1,0,0]=3 5040 B11R1.36 N[C@@H](C(=O)O)C1CCOCC1 Amb30874085 [0,1,0,1,0,0|1,0,0]=3 5041 B11R1.36 N[C@H](C(=O)O)C1=CCCCC1 Amb25699117 [0,1,0,1,0,0|1,0,0]=3 5042 B11R1.36 N[C@H](C(=O)O)C1C=CCCC1 Amb25339911 [0,1,0,1,0,0|1,0,0]=3 5043 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 Amb20240588 [0,1,0,1,0,0|1,0,0]=3 5044 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 Amb2694839 [0,1,0,1,0,0|1,0,0]=3 5045 B11R1.36 N[C@H](C(=O)O)C1CCCCO1 Amb33309074 [0,1,0,1,0,0|1,0,0]=3 5046 B11R1.36 N[C@H](C(=O)O)C1CCCOC1 Amb25847027 [0,1,0,1,0,0|1,0,0]=3 5047 B11R1.36 N[C@H](C(=O)O)C1CCNCC1 Amb8385707 [0,1,0,1,0,0|1,0,0]=3 5048 B11R1.36 N[C@H](C(=O)O)C1CCOCC1 Amb10603259 [0,1,0,1,0,0|1,0,0]=3 5049 B11R1.36 N[C@H](C(=O)O)C1CCOCC1 Amb33715649 [0,1,0,1,0,0|1,0,0]=3 5050 B11R1.36 N[C@H](C(=O)O)[C@@H]1CCCCN1 Amb24519512 [0,1,0,1,0,0|0,0,0]=2 5051 B11R1.36 N[C@H](C(=O)O)[C@H]1CCCCN1 Amb28436724 [0,1,0,1,0,0|0,0,0]=2 5052 B11R1.36 O=C(O)C(Br)C1CCCCC1 Amb8439522 [0,1,0,1,0,0|2,0,0]=4 5053 B11R1.36 O=C(O)C(F)C1=CCCCC1 Amb33744039 [0,1,0,1,0,0|2,0,0]=4 5054 B11R1.36 O=C(O)C(F)C1CCCCC1 Amb25921382 [0,1,0,1,0,0|2,0,0]=4 5055 B11R1.36 O=C(O)C(F)C1CCCSC1 Amb27776301 [0,1,0,1,0,0|2,0,0]=4 5056 B11R1.36 O=C(O)C(F)C1CCNCC1 Amb24409024 [0,1,0,1,0,0|2,0,0]=4 5057 B11R1.36 O=C(O)C(F)C1CCOCC1 Amb25071850 [0,1,0,1,0,0|2,0,0]=4 5058 B11R1.36 O=C(O)C(F)C1CCSCC1 Amb28369316 [0,1,0,1,0,0|2,0,0]=4 5059 B11R1.36 O=C(O)C(O)C1=CCCCC1 Amb17593900 [0,1,0,1,0,0|2,0,0]=4 5060 B11R1.36 O=C(O)C(O)C1CCCCC1 Amb2612433 [0,1,0,1,0,0|2,0,0]=4 5061 B11R1.36 O=C(O)C(O)C1CCCCO1 Amb33375691 [0,1,0,1,0,0|2,0,0]=4 5062 B11R1.36 O=C(O)C(O)C1CCCNC1 Amb18830396 [0,1,0,1,0,0|1,0,0]=3 5063 B11R1.36 O=C(O)C(O)C1CCCNC1 Amb28652921 [0,1,0,1,0,0|1,0,0]=3 5064 B11R1.36 O=C(O)C(O)C1CCCSC1 Amb24557625 [0,1,0,1,0,0|2,0,0]=4 5065 B11R1.36 O=C(O)C(O)C1CCNCC1 Amb18830397 [0,1,0,1,0,0|2,0,0]=4 5066 B11R1.36 O=C(O)C(O)C1CCNCC1 Amb31188297 [0,1,0,1,0,0|2,0,0]=4 5067 B11R1.36 O=C(O)C(O)C1CCOCC1 Amb18285838 [0,1,0,1,0,0|2,0,0]=4 5068 B11R1.36 O=C(O)C(S)C1CCCCO1 Amb28458399 [0,1,0,1,0,0|2,0,0]=4 5069 B11R1.36 O=C(O)[C@@H](O)C1CCCCC1 Amb9786753 [0,1,0,1,0,0|2,0,0]=4 5070 B11R1.36 O=C(O)[C@H](O)C1CCCCC1 Amb22361246 [0,1,0,1,0,0|2,0,0]=4 5071 B11R1.36 O=C(O)[C@H](O)[C@@H]1CCCNC1 Amb27484064 [0,1,0,1,0,0|1,0,0]=3 5072 B11R1.85 NC1CCCCCCNC1=O Amb27640572 [0,1,0,1,0,0|2,0,0]=4 5073 B11R1.104 CC(CCC1CC1C)C(=O)O Amb33143872 [0,1,0,1,0,0|2,0,0]=4 5074 B11R1.104 CC(NCC1CC1C)C(=O)O Amb28387391 [0,1,0,1,0,0|2,0,0]=4 5075 B11R1.104 CC1CC1NCC(N)C(N)=O Amb28386720 [0,1,0,1,0,0|2,0,0]=4 5076 B11R1.104 CC1CC1NCC(O)C(=O)O Amb27270953 [0,1,0,1,0,0|2,0,0]=4 5077 B11R1.142 CC1CCC1N[C@H](C)C(=O)O Amb28345484 [0,1,0,1,0,0|2,0,0]=4 5078 B11R1.211 CCCCC1CC(C(=O)O)C1 Amb23537588 [0,1,0,1,0,0|2,0,0]=4 5079 B11R1.211 CCCC[C@H]1C[C@H](C(=O)O)C1 Amb30988015 [0,1,0,1,0,0|2,0,0]=4 5080 B11R1.211 CCCNC1CC(C(=O)O)C1 Amb20622658 [0,1,0,1,0,0|2,0,0]=4 5081 B11R1.211 CCCOC1CC(C(=O)O)C1 Amb23448760 [0,1,0,1,0,0|2,0,0]=4 5082 B11R1.211 COCCC1CC(C(=O)O)C1 Amb23537799 [0,1,0,1,0,0|2,0,0]=4 5083 B11R1.211 O=C(O)C1CC(OCCF)C1 Amb23449204 [0,1,0,1,0,0|2,0,0]=4 5084 B11R1.231 C=CCC[C@@H]1C[C@@H](C)C(=O)O1 Amb27261563 [0,1,0,1,0,0|2,0,0]=4 5085 B11R1.231 CCCCC1CC(Cl)C(=O)O1 Amb26032369 [0,1,0,1,0,0|2,0,0]=4 5086 B11R1.231 CCCCC1CC(O)C(=O)O1 Amb28349942 [0,1,0,1,0,0|2,0,0]=4 5087 B11R1.231 CCCC[C@@H]1C[C@@H](N)C(=O)O1 Amb26971852 [0,1,0,1,0,0|1,0,0]=3 5088 B11R1.231 CCCC[C@@H]1C[C@H](N)C(=O)O1 Amb25263992 [0,1,0,1,0,0|1,0,0]=3 5089 B11R1.231 CNCCC1CN(C)C(=O)O1 Amb25279452 [0,1,0,1,0,0|2,0,0]=4 5090 B11R1.231 O=C1OC(CCCCl)CC1O Amb28290258 [0,1,0,1,0,0|2,0,0]=4 5091 B11R1.266 CC(=O)C1CCCC(CN)C1 Amb33132402 [0,1,0,1,0,0|2,0,0]=4 5092 B11R1.266 CCC1CC(C(=O)O)CCN1 Amb18199986 [0,1,0,1,0,0|2,0,0]=4 5093 B11R1.266 CCC1CC(C(=O)O)CCO1 Amb25679263 [0,1,0,1,0,0|2,0,0]=4 5094 B11R1.266 CCC1CCCC(C(=O)O)N1 Amb25110486 [0,1,0,1,0,0|1,0,0]=3 5095 B11R1.266 CCC1CCNC(C(=O)O)C1 Amb18830613 [0,1,0,1,0,0|2,0,0]=4 5096 B11R1.266 CCC1CCNC(C(=O)O)C1 Amb33338905 [0,1,0,1,0,0|2,0,0]=4 5097 B11R1.266 CCC1CCNC(C(=O)O)O1 Amb33193374 [0,1,0,1,0,0|2,0,0]=4 5098 B11R1.266 CCC1CNCC(C(=O)O)C1 Amb33275578 [0,1,0,1,0,0|2,0,0]=4 5099 B11R1.266 CCC1NC(C(=O)O)CCS1 Amb18950378 [0,1,0,1,0,0|1,0,0]=3 5100 B11R1.266 CCC1NC(C(=O)O)CCS1 Amb32990136 [0,1,0,1,0,0|1,0,0]=3 5101 B11R1.266 CCN1CCCC(C(=O)O)C1 Amb10609659 [0,1,0,1,0,0|2,0,0]=4 5102 B11R1.266 CCN1CCCC(C(=O)O)C1 Amb9238837 [0,1,0,1,0,0|2,0,0]=4 5103 B11R1.266 CC[C@@H]1CCC[C@H](C(=O)O)O1 Amb27233410 [0,1,0,1,0,0|2,0,0]=4 5104 B11R1.266 CC[C@@H]1CCN[C@H](C(=O)O)C1 Amb27421998 [0,1,0,1,0,0|2,0,0]=4 5105 B11R1.266 CC[C@@H]1CSC[C@@H](C(=O)O)N1 Amb27965031 [0,1,0,1,0,0|1,0,0]=3 5106 B11R1.266 CC[C@H]1CCN[C@@H](C(=O)O)C1 Amb25937982 [0,1,0,1,0,0|2,0,0]=4 5107 B11R1.266 CC[C@H]1CCN[C@@H](C(=O)O)C1 Amb33338984 [0,1,0,1,0,0|2,0,0]=4 5108 B11R1.266 CC[C@H]1CSC[C@@H](C(=O)O)N1 Amb27781560 [0,1,0,1,0,0|1,0,0]=3 5109 B11R1.266 CNC1CCCC(C(C)=O)C1 Amb25802837 [0,1,0,1,0,0|2,0,0]=4 5110 B11R1.266 CNC1CCOC(C(=O)O)C1 Amb27419779 [0,1,0,1,0,0|2,0,0]=4 5111 B11R1.266 COC1CCCC(C(=O)O)C1 Amb3939936 [0,1,0,1,0,0|2,0,0]=4 5112 B11R1.266 COC1CCCC(C(=O)O)O1 Amb27483979 [0,1,0,1,0,0|2,0,0]=4 5113 B11R1.266 CO[C@H]1CCC[C@@H](C(=O)O)C1 Amb28411305 [0,1,0,1,0,0|2,0,0]=4 5114 B11R1.266 CSC1CCCC(C(=O)O)C1 Amb28322463 [0,1,0,1,0,0|2,0,0]=4 5115 B11R1.266 N#CC1COC[C@H](C(=O)O)N1 Amb18200250 [0,1,0,1,0,0|0,0,2]=4 5116 B11R1.266 NCC1CCCC(C(=O)O)C1 Amb25684748 [0,1,0,1,0,0|1,0,0]=3 5117 B11R1.266 NCC1CCCC(C(=O)O)C1 Amb27777100 [0,1,0,1,0,0|1,0,0]=3 5118 B11R1.266 NCC1CNCC(C(=O)O)C1 Amb27984747 [0,1,0,1,0,0|1,0,0]=3 5119 B11R1.266 O=C(O)C1CCCC(CF)C1 Amb27958907 [0,1,0,1,0,0|2,0,0]=4 5120 B11R1.266 O=C(O)C1CCCC(CO)C1 Amb24488127 [0,1,0,1,0,0|2,0,0]=4 5121 B11R1.266 O=C(O)C1CNCC(CO)C1 Amb28240330 [0,1,0,1,0,0|2,0,0]=4 5122 B11R1.266 O=C(O)[C@@H]1CCC[C@H](CF)C1 Amb35789416 [0,1,0,1,0,0|2,0,0]=4 5123 B11R1.266 O=C(O)[C@H]1CCC[C@@H](CO)N1 Amb25348501 [0,1,0,1,0,0|1,0,0]=3 5124 B11R1.266 O=C(O)[C@H]1CNC[C@@H](CO)C1 Amb27240274 [0,1,0,1,0,0|2,0,0]=4 5125 B11R1.332 CC(CCC1CCC1)C(=O)O Amb24765911 [0,1,0,1,0,0|2,0,0]=4 5126 B11R1.332 CC(CCC1CCN1)C(=O)O Amb27674317 [0,1,0,1,0,0|1,0,0]=3 5127 B11R1.332 CC(CCC1CNC1)C(=O)O Amb27674316 [0,1,0,1,0,0|1,0,0]=3 5128 B11R1.332 CC(CSC1CCC1)C(=O)O Amb27671369 [0,1,0,1,0,0|2,0,0]=4 5129 B11R1.332 CC(NCC1CCC1)C(=O)O Amb18182199 [0,1,0,1,0,0|2,0,0]=4 5130 B11R1.332 CC(SCC1CCC1)C(=O)O Amb27986475 [0,1,0,1,0,0|2,0,0]=4 5131 B11R1.332 CC(SCC1CNC1)C(=O)O Amb27492019 [0,1,0,1,0,0|2,0,0]=4 5132 B11R1.332 C[C@@H](OCC1CCC1)C(=O)O Amb27986313 [0,1,0,1,0,0|2,0,0]=4 5133 B11R1.332 C[C@H](OCC1CCC1)C(=O)O Amb27986315 [0,1,0,1,0,0|2,0,0]=4 5134 B11R1.332 NC(=O)C(N)CCC1CCC1 Amb24765839 [0,1,0,1,0,0|2,0,0]=4 5135 B11R1.332 NC(=O)C(N)CCC1COC1 Amb27989324 [0,1,0,1,0,0|2,0,0]=4 5136 B11R1.332 NC(=O)C(N)CNC1CCC1 Amb28386724 [0,1,0,1,0,0|2,0,0]=4 5137 B11R1.332 NC(=O)C(N)COC1CCC1 Amb18179817 [0,1,0,1,0,0|2,0,0]=4 5138 B11R1.332 NC(CCC1CCC1)C(=O)O Amb24765840 [0,1,0,1,0,0|1,0,0]=3 5139 B11R1.332 NC(CNC1CCC1)C(=O)O Amb28386722 [0,1,0,1,0,0|1,0,0]=3 5140 B11R1.332 NC(CNC1COC1)C(=O)O Amb28386733 [0,1,0,1,0,0|2,0,0]=4 5141 B11R1.332 NC(COC1CCC1)C(=O)O Amb18792070 [0,1,0,1,0,0|1,0,0]=3 5142 B11R1.332 NC(COC1COC1)C(=O)O Amb27269341 [0,1,0,1,0,0|2,0,0]=4 5143 B11R1.332 NC(CSC1COC1)C(=O)O Amb27271344 [0,1,0,1,0,0|2,0,0]=4 5144 B11R1.332 N[C@@H](CCC1CCC1)C(=O)O Amb24765842 [0,1,0,1,0,0|1,0,0]=3 5145 B11R1.332 N[C@@H](CCN1CCC1)C(=O)O Amb27271129 [0,1,0,1,0,0|1,0,0]=3 5146 B11R1.332 N[C@H](CCC1CCC1)C(=O)O Amb24765843 [0,1,0,1,0,0|1,0,0]=3 5147 B11R1.332 N[C@H](CCN1CCC1)C(=O)O Amb32698162 [0,1,0,1,0,0|1,0,0]=3 5148 B11R1.332 O=C(O)C(O)CNC1CCC1 Amb27270956 [0,1,0,1,0,0|2,0,0]=4 5149 B11R1.332 O=C(O)C(O)COC1CCC1 Amb27270960 [0,1,0,1,0,0|2,0,0]=4 5150 B11R1.333 CC(CCCC1CC1)C(=O)O Amb33167109 [0,1,0,1,0,0|2,0,0]=4 5151 B11R1.333 NC(=O)C(N)CCCC1CC1 Amb33034701 [0,1,0,1,0,0|2,0,0]=4 5152 B11R1.333 NC(=O)C(N)CCOC1CC1 Amb33065571 [0,1,0,1,0,0|2,0,0]=4 5153 B11R1.333 NC(=O)C(N)COCC1CC1 Amb18177597 [0,1,0,1,0,0|2,0,0]=4 5154 B11R1.333 NC(CC#CC1CC1)C(=O)O Amb33036720 [0,1,0,1,0,0|1,0,1]=4 5155 B11R1.333 NC(CCCC1CC1)C(=O)O Amb33065871 [0,1,0,1,0,0|1,0,0]=3 5156 B11R1.333 NC(CCOC1CC1)C(=O)O Amb33036851 [0,1,0,1,0,0|1,0,0]=3 5157 B11R1.333 NC(COCC1CC1)C(=O)O Amb18177625 [0,1,0,1,0,0|1,0,0]=3 5158 B11R1.333 N[C@@H](CC#CC1CC1)C(=O)O Amb32937010 [0,1,0,1,0,0|1,0,1]=4 5159 B11R1.333 N[C@@H](CCCC1CC1)C(=O)O Amb33309079 [0,1,0,1,0,0|1,0,0]=3 5160 B11R1.333 N[C@@H](CCOC1CC1)C(=O)O Amb33036882 [0,1,0,1,0,0|1,0,0]=3 5161 B11R1.333 N[C@@H](COCC1CC1)C(=O)O Amb33036937 [0,1,0,1,0,0|1,0,0]=3 5162 B11R1.333 N[C@@H](CSCC1CC1)C(=O)O Amb18795685 [0,1,0,1,0,0|1,0,0]=3 5163 B11R1.333 N[C@H](CC#CC1CC1)C(=O)O Amb33066204 [0,1,0,1,0,0|1,0,1]=4 5164 B11R1.333 N[C@H](CCCC1CC1)C(=O)O Amb33308609 [0,1,0,1,0,0|1,0,0]=3 5165 B11R1.333 N[C@H](CCOC1CC1)C(=O)O Amb32864910 [0,1,0,1,0,0|1,0,0]=3 5166 B11R1.333 N[C@H](COCC1CC1)C(=O)O Amb33036519 [0,1,0,1,0,0|1,0,0]=3 5167 B11R1.421 CC1(C(=O)O)CCCC1CN Amb28121250 [0,1,0,1,0,0|1,0,0]=3 5168 B11R1.421 CC1(C(=O)O)CNCC1CO Amb2696582 [0,1,0,1,0,0|2,0,0]=4 5169 B11R1.421 CCC1CCCC1(C)C(=O)O Amb32654895 [0,1,0,1,0,0|2,0,0]=4 5170 B11R1.421 CCC1CCCC1(N)C(=O)O Amb27823632 [0,1,0,1,0,0|1,0,0]=3 5171 B11R1.421 CCC1CCCC1(N)C(N)=O Amb27395574 [0,1,0,1,0,0|2,0,0]=4 5172 B11R1.421 CCC1CNCC1(C)C(=O)O Amb2696678 [0,1,0,1,0,0|2,0,0]=4 5173 B11R1.421 CCC1CNCC1(F)C(=O)O Amb27855308 [0,1,0,1,0,0|2,0,0]=4 5174 B11R1.421 CCC1COCC1(N)C(=O)O Amb35646986 [0,1,0,1,0,0|1,0,0]=3 5175 B11R1.421 CCC1COCC1(N)C(N)=O Amb35616334 [0,1,0,1,0,0|2,0,0]=4 5176 B11R1.421 CCC1COCC1(O)C(=O)O Amb35632036 [0,1,0,1,0,0|2,0,0]=4 5177 B11R1.421 CCN1CCCC1(O)C(=O)O Amb27490977 [0,1,0,1,0,0|2,0,0]=4 5178 B11R1.421 CCN1CCC[C@@]1(C)C(=O)O Amb27163575 [0,1,0,1,0,0|2,0,0]=4 5179 B11R1.421 CC[C@@H]1CCC[C@]1(N)C(=O)O Amb25295379 [0,1,0,1,0,0|1,0,0]=3 5180 B11R1.421 CC[C@H]1CCC[C@@]1(N)C(N)=O Amb27433439 [0,1,0,1,0,0|2,0,0]=4 5181 B11R1.421 COC1CCCC1(N)C(=O)O Amb26054799 [0,1,0,1,0,0|1,0,0]=3 5182 B11R1.421 COC1CCCC1(N)C(N)=O Amb27203913 [0,1,0,1,0,0|2,0,0]=4 5183 B11R1.421 COC1CCC[C@@]1(N)C(=O)O Amb27791756 [0,1,0,1,0,0|1,0,0]=3 5184 B11R1.421 CO[C@H]1CCC[C@@]1(C)C(=O)O Amb27232824 [0,1,0,1,0,0|2,0,0]=4 5185 B11R1.421 C[C@@]1(C(=O)O)CCC[C@H]1CN Amb27865504 [0,1,0,1,0,0|1,0,0]=3 5186 B11R1.421 C[C@]1(C(=O)O)CCC[C@H]1CCl Amb27847582 [0,1,0,1,0,0|2,0,0]=4 5187 B11R1.421 O=C(O)C1(Cl)CCCC1CCl Amb18130208 [0,1,0,1,0,0|2,0,0]=4 5188 B11R1.520 CC(=O)C1(C)CCCCC1N Amb33131336 [0,1,0,1,0,0|2,0,0]=4 5189 B11R1.520 CC1(C(=O)O)CCCCC1=O Amb24487822 [0,1,0,1,0,0|2,0,0]=4 5190 B11R1.520 CC1(C(=O)O)CCCCC1N Amb25759350 [0,1,0,1,0,0|1,0,0]=3 5191 B11R1.520 CC1(C(=O)O)CCCCC1N Amb28652993 [0,1,0,1,0,0|1,0,0]=3 5192 B11R1.520 CC1(C(=O)O)CCCCN1O Amb27201259 [0,1,0,1,0,0|1,0,0]=3 5193 B11R1.520 CC1(C(=O)O)CCNCC1F Amb28143827 [0,1,0,1,0,0|2,0,0]=4 5194 B11R1.520 CC1(C(=O)O)CCSCC1N Amb28246102 [0,1,0,1,0,0|1,0,0]=3 5195 B11R1.520 CC1(C(=O)O)COCCC1F Amb27624636 [0,1,0,1,0,0|2,0,0]=4 5196 B11R1.520 CC1(C(=O)O)COCCC1N Amb28135554 [0,1,0,1,0,0|1,0,0]=3 5197 B11R1.520 CC1(C(=O)O)CSCCC1N Amb27864531 [0,1,0,1,0,0|1,0,0]=3 5198 B11R1.520 CC1(C(N)=O)CCCCC1N Amb35688628 [0,1,0,1,0,0|2,0,0]=4 5199 B11R1.520 CC1CCCCC1(C)C(=O)O Amb24635732 [0,1,0,1,0,0|2,0,0]=4 5200 B11R1.520 CC1CCCCC1(N)C(=O)O Amb2695544 [0,1,0,1,0,0|1,0,0]=3 5201 B11R1.520 CC1CCNCC1(C)C(=O)O Amb35640245 [0,1,0,1,0,0|2,0,0]=4 5202 B11R1.520 CC1CNCCC1(N)C(=O)O Amb27645081 [0,1,0,1,0,0|1,0,0]=3 5203 B11R1.520 CC1COCCC1(N)C(=O)O Amb28247182 [0,1,0,1,0,0|1,0,0]=3 5204 B11R1.520 CC1COCCC1(N)C(N)=O Amb27984486 [0,1,0,1,0,0|2,0,0]=4 5205 B11R1.520 CC1NCCCC1(C)C(=O)O Amb32419093 [0,1,0,1,0,0|2,0,0]=4 5206 B11R1.520 CN1CCCCC1(C)C(=O)O Amb24691634 [0,1,0,1,0,0|1,0,0]=3 5207 B11R1.520 C[C@@H]1CCCC[C@@]1(N)C(=O)O Amb26431408 [0,1,0,1,0,0|1,0,0]=3 5208 B11R1.520 C[C@@H]1CCCC[C@]1(C)C(=O)O Amb28062305 [0,1,0,1,0,0|2,0,0]=4 5209 B11R1.520 C[C@@H]1CCCC[C@]1(N)C(=O)O Amb25263952 [0,1,0,1,0,0|1,0,0]=3 5210 B11R1.520 C[C@@]1(C(=O)O)CCCC[C@@H]1N Amb27870245 [0,1,0,1,0,0|1,0,0]=3 5211 B11R1.520 C[C@H]1CCCC[C@@]1(N)C(N)=O Amb27194330 [0,1,0,1,0,0|2,0,0]=4 5212 B11R1.520 C[C@H]1CCCC[C@]1(N)C(=O)O Amb28319347 [0,1,0,1,0,0|1,0,0]=3 5213 B11R1.520 C[C@H]1CCCC[C@]1(O)C(=O)O Amb28051865 [0,1,0,1,0,0|2,0,0]=4 5214 B11R1.520 C[C@]1(C(=O)O)CCCC[C@@H]1N Amb27202576 [0,1,0,1,0,0|1,0,0]=3 5215 B11R1.520 C[C@]1(C(=O)O)CCCC[C@H]1N Amb27792116 [0,1,0,1,0,0|1,0,0]=3 5216 B11R1.520 NC1(C(=O)O)CCCCC1Cl Amb2695413 [0,1,0,1,0,0|1,0,0]=3 5217 B11R1.520 NC1(C(=O)O)CCCCC1F Amb27784196 [0,1,0,1,0,0|1,0,0]=3 5218 B11R1.520 NC1CCCCC1(N)C(=O)O Amb25348456 [0,1,0,1,0,0|0,0,0]=2 5219 B11R1.520 NC1CCCCC1(O)C(=O)O Amb26350763 [0,1,0,1,0,0|1,0,0]=3 5220 B11R1.520 NC1COCCC1(O)C(=O)O Amb33133259 [0,1,0,1,0,0|1,0,0]=3 5221 B11R1.520 N[C@@H]1CCCC[C@]1(N)C(=O)O Amb24675453 [0,1,0,1,0,0|0,0,0]=2 5222 B11R1.520 N[C@]1(C(=O)O)CCCCC1O Amb28119925 [0,1,0,1,0,0|1,0,0]=3 5223 B11R1.520 N[C@]1(C(=O)O)CCCC[C@@H]1O Amb24602384 [0,1,0,1,0,0|1,0,0]=3 5224 B11R1.520 N[C@]1(C(=O)O)CCCC[C@H]1O Amb24626559 [0,1,0,1,0,0|1,0,0]=3 5225 B11R1.520 O=C(O)C1(Cl)CCCCC1Cl Amb18652202 [0,1,0,1,0,0|2,0,0]=4 5226 B11R1.520 O=C(O)C1(F)CCCCC1O Amb24334791 [0,1,0,1,0,0|2,0,0]=4 5227 B11R1.520 O=C(O)C1(F)CSCCC1F Amb27429066 [0,1,0,1,0,0|2,0,0]=4 5228 B11R1.520 O=C(O)C1(O)CCCCC1Cl Amb28385703 [0,1,0,1,0,0|2,0,0]=4 5229 B11R1.520 O=C(O)C1(O)CCCCC1O Amb24348654 [0,1,0,1,0,0|2,0,0]=4 5230 B11R1.520 O=C(O)[C@@]1(F)CCCC[C@H]1O Amb27455477 [0,1,0,1,0,0|2,0,0]=4 5231 B11R1.520 O=C(O)[C@]1(F)CCCC[C@@H]1O Amb25912005 [0,1,0,1,0,0|2,0,0]=4 5232 B11R1.706 O=C(O)C1C=CCCCCC1 Amb27401809 [0,1,0,1,0,0|2,0,0]=4 5233 B11R1.706 O=C(O)C1CCCCCCC1 Amb18278612 [0,1,0,1,0,0|2,0,0]=4 5234 B11R1.706 O=C(O)C1CCCCCCN1 Amb27760420 [0,1,0,1,0,0|1,0,0]=3 5235 B11R1.706 O=C(O)C1CCCCCCN1 Amb28652940 [0,1,0,1,0,0|1,0,0]=3 5236 B11R1.706 O=C(O)C1CCCSCCC1 Amb28239756 [0,1,0,1,0,0|2,0,0]=4 5237 B11R1.757 CCCCC[C@@H]1NC(=O)[C@@H]1O Amb28080085 [0,1,0,1,0,0|1,0,1]=4 5238 B11R1.14 CC[C@H]1C[C@@H](O)[C@H](O)C(=O)O1 Amb27854197 [0,1,0,1,0,0|2,0,0]=4 5239 B11R1.50 CC[C@@H]1C[C@H](C(=O)O)[C@H](N)C1 Amb28246143 [0,1,0,1,0,0|2,0,0]=4 5240 B11R1.149 C=C1CC1C(C)C(N)C(=O)O Amb25916404 [0,1,0,1,0,0|1,0,1]=4 5241 B11R1.149 CC1CC1C(C)C(C)C(=O)O Amb27758189 [0,1,0,1,0,0|2,0,0]=4 5242 B11R1.149 CC1CC1C(C)C(N)C(=O)O Amb35660764 [0,1,0,1,0,0|1,0,0]=3 5243 B11R1.149 CC1CC1C(N)C(C)C(=O)O Amb33036413 [0,1,0,1,0,0|2,0,0]=4 5244 B11R1.149 CC1CC1C(N)C(F)C(=O)O Amb33036378 [0,1,0,1,0,0|2,0,0]=4 5245 B11R1.149 CC1CC1C(O)C(C)C(=O)O Amb33036276 [0,1,0,1,0,0|2,0,0]=4 5246 B11R1.149 CC1CC1C(O)C(F)C(=O)O Amb33036240 [0,1,0,1,0,0|2,0,0]=4 5247 B11R1.149 CC1CC1C(O)C(N)C(=O)O Amb33359777 [0,1,0,1,0,0|1,0,0]=3 5248 B11R1.167 CC1CCC(C)C(C(=O)O)C1 Amb27870887 [0,1,0,1,0,0|2,0,0]=4 5249 B11R1.167 CC1CCC(C)C(C(=O)O)N1 Amb33072383 [0,1,0,1,0,0|1,0,0]=3 5250 B11R1.167 CC1CCC(Cl)CC1C(=O)O Amb25260877 [0,1,0,1,0,0|2,0,0]=4 5251 B11R1.167 CC1CCC(F)CC1C(=O)O Amb28050842 [0,1,0,1,0,0|2,0,0]=4 5252 B11R1.167 CC1CCC(N)C(C(=O)O)C1 Amb18200001 [0,1,0,1,0,0|2,0,0]=4 5253 B11R1.167 CC1CCC(N)CC1C(=O)O Amb26073941 [0,1,0,1,0,0|1,0,0]=3 5254 B11R1.167 CC1CCC(O)CC1C(=O)O Amb24392245 [0,1,0,1,0,0|2,0,0]=4 5255 B11R1.167 CC1CC[C@H](O)C[C@H]1C(=O)O Amb28195098 [0,1,0,1,0,0|2,0,0]=4 5256 B11R1.167 C[C@H]1CC[C@@H](C)[C@@H](C(=O)O)C1 Amb26927968 [0,1,0,1,0,0|2,0,0]=4 5257 B11R1.167 NC1CCC(O)CC1C(=O)O Amb25139597 [0,1,0,1,0,0|2,0,0]=4 5258 B11R1.167 N[C@@H]1CC[C@@H](O)C[C@H]1C(=O)O Amb27231807 [0,1,0,1,0,0|2,0,0]=4 5259 B11R1.167 N[C@@H]1CC[C@H](O)C[C@@H]1C(=O)O Amb27444612 [0,1,0,1,0,0|2,0,0]=4 5260 B11R1.167 N[C@@H]1CC[C@H](O)C[C@H]1C(=O)O Amb27878771 [0,1,0,1,0,0|2,0,0]=4 5261 B11R1.167 N[C@H]1CC[C@@H](O)C[C@H]1C(=O)O Amb28193740 [0,1,0,1,0,0|2,0,0]=4 5262 B11R1.167 O=C(O)C1CC(O)CCC1O Amb25809422 [0,1,0,1,0,0|2,0,0]=4 5263 B11R1.167 O=C1CC[C@H](O)[C@H](C(=O)O)N1 Amb25174915 [0,1,0,1,0,0|1,0,1]=4 5264 B11R1.186 O=C1O[C@H](CCO)[C@H](O)[C@H]1O Amb27218933 [0,1,0,1,0,0|2,0,0]=4 5265 B11R1.204 NCCNC1CCC1C(=O)O Amb28386725 [0,1,0,1,0,0|2,0,0]=4 5266 B11R1.204 O=C(O)C1NCC1CCCO Amb27673478 [0,1,0,1,0,0|1,0,0]=3 5267 B11R1.314 CC(C(=O)O)C1CCC(=O)N1 Amb24741902 [0,1,0,1,0,0|1,0,1]=4 5268 B11R1.314 CC(C(=O)O)C1CC[C@@H](C)O1 Amb33423414 [0,1,0,1,0,0|2,0,0]=4 5269 B11R1.314 CC1C=CC(C(N)C(=O)O)C1 Amb27605764 [0,1,0,1,0,0|1,0,1]=4 5270 B11R1.314 CC1CC(C(N)C(=O)O)CO1 Amb35660772 [0,1,0,1,0,0|2,0,0]=4 5271 B11R1.314 CC1CC(C(N)C(=O)O)CS1 Amb35660559 [0,1,0,1,0,0|2,0,0]=4 5272 B11R1.314 CC1CCC(C(C)C(=O)O)C1 Amb28119009 [0,1,0,1,0,0|2,0,0]=4 5273 B11R1.314 CC1CCC(C(F)C(=O)O)C1 Amb26371222 [0,1,0,1,0,0|2,0,0]=4 5274 B11R1.314 CC1CCC(C(N)C(=O)O)C1 Amb35663080 [0,1,0,1,0,0|1,0,0]=3 5275 B11R1.314 CC1CCC(C(O)C(=O)O)O1 Amb27485267 [0,1,0,1,0,0|2,0,0]=4 5276 B11R1.314 CC1CCC([C@@H](C)C(=O)O)C1 Amb33728206 [0,1,0,1,0,0|2,0,0]=4 5277 B11R1.314 CC1CCC([C@H](C)C(=O)O)C1 Amb33749539 [0,1,0,1,0,0|2,0,0]=4 5278 B11R1.314 CN1CCC(C(N)C(=O)O)C1 Amb18199896 [0,1,0,1,0,0|2,0,0]=4 5279 B11R1.314 C[C@@H]1CCC(C(N)C(=O)O)O1 Amb33423685 [0,1,0,1,0,0|1,0,0]=3 5280 B11R1.314 C[C@@H]1CCC(C(O)C(=O)O)O1 Amb33423394 [0,1,0,1,0,0|2,0,0]=4 5281 B11R1.314 C[C@@H]1CC[C@H]([C@H](N)C(=O)O)O1 Amb28457487 [0,1,0,1,0,0|1,0,0]=3 5282 B11R1.314 C[C@H]1CC[C@@H]([C@H](C)C(=O)O)O1 Amb27477593 [0,1,0,1,0,0|2,0,0]=4 5283 B11R1.314 NC(C(=O)O)C1CCC(=O)C1 Amb27828292 [0,1,0,1,0,0|1,0,1]=4 5284 B11R1.314 NC(C(=O)O)C1CCC(=O)O1 Amb27955898 [0,1,0,1,0,0|1,0,1]=4 5285 B11R1.314 N[C@@H](C(=O)O)C1CCC(=O)C1 Amb25148224 [0,1,0,1,0,0|1,0,1]=4 5286 B11R1.314 N[C@H](C(=O)O)C1CCC(=O)C1 Amb26955070 [0,1,0,1,0,0|1,0,1]=4 5287 B11R1.314 O=C1CCC(C(O)C(=O)O)N1 Amb28121038 [0,1,0,1,0,0|1,0,1]=4 5288 B11R1.501 CC(C(=O)O)C(C)C1CCC1 Amb28065282 [0,1,0,1,0,0|2,0,0]=4 5289 B11R1.501 CC(C(=O)O)C(N)C1CCC1 Amb33036294 [0,1,0,1,0,0|2,0,0]=4 5290 B11R1.501 CC(C(=O)O)C(O)C1CCC1 Amb33036110 [0,1,0,1,0,0|2,0,0]=4 5291 B11R1.501 CC(C1CCC1)C(N)C(=O)O Amb28436391 [0,1,0,1,0,0|1,0,0]=3 5292 B11R1.501 NC(C(=O)O)C(O)C1CCC1 Amb26593830 [0,1,0,1,0,0|1,0,0]=3 5293 B11R1.501 NC(C1CCC1)C(F)C(=O)O Amb33036288 [0,1,0,1,0,0|2,0,0]=4 5294 B11R1.501 O=C(O)C(F)C(O)C1CCC1 Amb33036105 [0,1,0,1,0,0|2,0,0]=4 5295 B11R1.503 CC(C(=O)O)C(N)CC1CC1 Amb33036318 [0,1,0,1,0,0|2,0,0]=4 5296 B11R1.503 CC(C(=O)O)C(O)CC1CC1 Amb33036196 [0,1,0,1,0,0|2,0,0]=4 5297 B11R1.503 NC(C(=O)O)C(O)CC1CC1 Amb33362398 [0,1,0,1,0,0|1,0,0]=3 5298 B11R1.503 NC(CC1CC1)C(F)C(=O)O Amb33036380 [0,1,0,1,0,0|2,0,0]=4 5299 B11R1.503 NC(CC1CC1)C(O)C(=O)O Amb28079550 [0,1,0,1,0,0|2,0,0]=4 5300 B11R1.503 O=C(O)C(F)C(O)CC1CC1 Amb33036243 [0,1,0,1,0,0|2,0,0]=4 5301 B11R1.513 CC1CCC(C)C1(C)C(=O)O Amb27791975 [0,1,0,1,0,0|2,0,0]=4 5302 B11R1.513 CC1CCC(N)C1(C)C(=O)O Amb20623942 [0,1,0,1,0,0|1,0,0]=3 5303 B11R1.513 CN1CCC(N)C1(C)C(=O)O Amb27804189 [0,1,0,1,0,0|2,0,0]=4 5304 B11R1.558 O=C1C(O)CCCCCC1O Amb28284893 [0,1,0,1,0,0|2,0,0]=4 5305 B11R1.558 O=C1[C@@H](O)CCCCC[C@H]1O Amb27970147 [0,1,0,1,0,0|2,0,0]=4 5306 B11R1.1105 CC(C(=O)O)C1(C)CCCC1 Amb33738450 [0,1,0,1,0,0|2,0,0]=4 5307 B11R1.1105 CC(C(=O)O)C1(N)CCCC1 Amb33036390 [0,1,0,1,0,0|2,0,0]=4 5308 B11R1.1105 CC(C(=O)O)C1(O)CCCC1 Amb18961458 [0,1,0,1,0,0|2,0,0]=4 5309 B11R1.1105 CC1(C(N)C(=O)O)CCCC1 Amb27758593 [0,1,0,1,0,0|1,0,0]=3 5310 B11R1.1105 CC1(C(O)C(=O)O)CCCC1 Amb28396620 [0,1,0,1,0,0|2,0,0]=4 5311 B11R1.1105 CC1(C(S)C(=O)O)CCCO1 Amb28132753 [0,1,0,1,0,0|2,0,0]=4 5312 B11R1.1105 C[C@@H](C(=O)O)C1(C)CCCC1 Amb33728207 [0,1,0,1,0,0|2,0,0]=4 5313 B11R1.1105 C[C@H](C(=O)O)C1(C)CCCC1 Amb33749540 [0,1,0,1,0,0|2,0,0]=4 5314 B11R1.1105 NC(C(=O)O)C1(S)CCCC1 Amb18127518 [0,1,0,1,0,0|1,0,0]=3 5315 B11R1.1105 NC1(C(O)C(=O)O)CCCC1 Amb32946642 [0,1,0,1,0,0|2,0,0]=4 5316 B11R1.1105 O=C(O)C(F)C1(O)CCCC1 Amb33742670 [0,1,0,1,0,0|2,0,0]=4 5317 B11R1.1105 O=C(O)C(O)C1(O)CCCC1 Amb32946564 [0,1,0,1,0,0|2,0,0]=4 5318 B11R1.3 CC(=O)C1CCC(CN)CC1 Amb27398780 [0,1,0,1,0,0|2,0,0]=4 5319 B11R1.3 CC(=O)C1CCC(CN)CC1 Amb33447096 [0,1,0,1,0,0|2,0,0]=4 5320 B11R1.3 CCC1CCC(C(=O)O)CC1 Amb2413128 [0,1,0,1,0,0|2,0,0]=4 5321 B11R1.3 CCC1CCC(C(=O)O)CN1 Amb25848341 [0,1,0,1,0,0|1,0,0]=3 5322 B11R1.3 CCC1CCC(C(=O)O)NC1 Amb18126073 [0,1,0,1,0,0|1,0,0]=3 5323 B11R1.3 CCC1CNC(C(=O)O)CO1 Amb28188774 [0,1,0,1,0,0|2,0,0]=4 5324 B11R1.3 CC[C@H]1CC[C@H](C(=O)O)CC1 Amb9786888 [0,1,0,1,0,0|2,0,0]=4 5325 B11R1.3 NCC1CC=C(C(=O)O)CC1 Amb17608157 [0,1,0,1,0,0|1,0,1]=4 5326 B11R1.3 NCC1CC=C(C(=O)O)CC1 Amb32652585 [0,1,0,1,0,0|1,0,1]=4 5327 B11R1.3 NCC1CCC(C(=O)Cl)CC1 Amb24440899 [0,1,0,1,0,0|2,0,0]=4 5328 B11R1.3 NCC1CCC(C(=O)O)CC1 Amb3940763 [0,1,0,1,0,0|1,0,0]=3 5329 B11R1.3 NCC1CCC(C(N)=O)CC1 Amb18287382 [0,1,0,1,0,0|2,0,0]=4 5330 B11R1.3 NCC1CCC(C(N)=O)CC1 Amb20622451 [0,1,0,1,0,0|2,0,0]=4 5331 B11R1.3 NCC1OCC(C(=O)O)CO1 Amb27441090 [0,1,0,1,0,0|2,0,0]=4 5332 B11R1.3 NC[C@@H]1CC[C@@H](C(=O)O)OC1 Amb27658954 [0,1,0,1,0,0|1,0,0]=3 5333 B11R1.3 NC[C@H]1CC[C@@H](C(=O)O)CC1 Amb17620787 [0,1,0,1,0,0|1,0,0]=3 5334 B11R1.3 NC[C@H]1CC[C@H](C(=O)O)CC1 Amb540893 [0,1,0,1,0,0|1,0,0]=3 5335 B11R1.3 NC[C@H]1CC[C@H](C(N)=O)CC1 Amb25873866 [0,1,0,1,0,0|2,0,0]=4 5336 B11R1.3 NC[C@H]1CC[C@H](C(N)=O)CC1 Amb32663860 [0,1,0,1,0,0|2,0,0]=4 5337 B11R1.3 NC[C@H]1CO[C@H](C(=O)O)CO1 Amb28385581 [0,1,0,1,0,0|2,0,0]=4 5338 B11R1.3 NC[C@H]1OC[C@H](C(=O)O)CO1 Amb27231624 [0,1,0,1,0,0|2,0,0]=4 5339 B11R1.3 NN[C@H]1CC[C@H](C(=O)O)CC1 Amb27944771 [0,1,0,1,0,0|2,0,0]=4 5340 B11R1.3 O=C(O)C1CCC(CO)CC1 Amb7089021 [0,1,0,1,0,0|2,0,0]=4 5341 B11R1.3 O=C(O)C1CCC(CO)NC1 Amb27880322 [0,1,0,1,0,0|1,0,0]=3 5342 B11R1.3 O=C(O)[C@H]1CC[C@@H](CO)CC1 Amb28254647 [0,1,0,1,0,0|2,0,0]=4 5343 B11R1.3 O=C(O)[C@H]1CC[C@H](CF)CC1 Amb25351015 [0,1,0,1,0,0|2,0,0]=4 5344 B11R1.3 O=C(O)[C@H]1CC[C@H](CO)CC1 Amb22750650 [0,1,0,1,0,0|2,0,0]=4 5345 B11R1.21 C=C1CCC(C(=O)O)CC1N Amb27651677 [0,1,0,1,0,0|1,0,1]=4 5346 B11R1.21 C=C1CC[C@@H](C(=O)O)C[C@@H]1N Amb28142351 [0,1,0,1,0,0|1,0,1]=4 5347 B11R1.21 CC1CCC(C(=O)O)CC1C Amb26037213 [0,1,0,1,0,0|2,0,0]=4 5348 B11R1.21 CC1CCC(C(=O)O)CC1N Amb25065260 [0,1,0,1,0,0|1,0,0]=3 5349 B11R1.21 CC1CCC(C(=O)O)NC1C Amb27862874 [0,1,0,1,0,0|1,0,0]=3 5350 B11R1.21 CC1CCC(C(=O)O)NC1C Amb28594270 [0,1,0,1,0,0|1,0,0]=3 5351 B11R1.21 CC1CCC(C(N)=O)NC1C Amb27875309 [0,1,0,1,0,0|2,0,0]=4 5352 B11R1.21 CC1NC(C(=O)O)CCC1O Amb28344643 [0,1,0,1,0,0|1,0,0]=3 5353 B11R1.21 CC1NC(C(=O)O)COC1C Amb28248835 [0,1,0,1,0,0|2,0,0]=4 5354 B11R1.21 CC1NC(C(=O)O)COC1C Amb32663609 [0,1,0,1,0,0|2,0,0]=4 5355 B11R1.21 C[C@H]1C[C@H](C(=O)O)CC[C@H]1Cl Amb28245232 [0,1,0,1,0,0|2,0,0]=4 5356 B11R1.21 NC(=O)C1CCC(N)C(=O)N1 Amb24707747 [0,1,0,1,0,0|1,0,1]=4 5357 B11R1.21 NC1CC(C(=O)O)CCC1O Amb28251132 [0,1,0,1,0,0|1,0,0]=3 5358 B11R1.21 N[C@@H]1C[C@H](C(=O)O)CC[C@@H]1O Amb26636622 [0,1,0,1,0,0|1,0,0]=3 5359 B11R1.21 O=C(O)C1CCC(Cl)C(Cl)C1 Amb28076627 [0,1,0,1,0,0|2,0,0]=4 5360 B11R1.21 O=C(O)[C@@H]1CC[C@@H](F)[C@@H](F)C1 Amb27226178 [0,1,0,1,0,0|2,0,0]=4 5361 B11R1.21 O=C(O)[C@@H]1CC[C@@H](O)[C@H](O)C1 Amb28320743 [0,1,0,1,0,0|2,0,0]=4 5362 B11R1.21 O=C(O)[C@@H]1CC[C@H](O)[C@@H](O)C1 Amb28245268 [0,1,0,1,0,0|2,0,0]=4 5363 B11R1.146 CC1CC(C(N)C(=O)O)C1C Amb35663081 [0,1,0,1,0,0|1,0,0]=3 5364 B11R1.220 CC1(C(=O)O)CCC(N)CC1 Amb23536219 [0,1,0,1,0,0|2,0,0]=4 5365 B11R1.220 CC1(C(=O)O)CCC(O)CC1 Amb18126139 [0,1,0,1,0,0|2,0,0]=4 5366 B11R1.220 CC1CCC(C)(C(=O)O)CC1 Amb25083864 [0,1,0,1,0,0|2,0,0]=4 5367 B11R1.220 CC1CCC(Cl)(C(=O)O)CC1 Amb32716553 [0,1,0,1,0,0|2,0,0]=4 5368 B11R1.220 CC1CCC(F)(C(=O)O)CC1 Amb26530517 [0,1,0,1,0,0|2,0,0]=4 5369 B11R1.220 CC1CCC(N)(C(=O)O)CC1 Amb4134830 [0,1,0,1,0,0|1,0,0]=3 5370 B11R1.220 CC1CCC(N)(C(=O)O)CO1 Amb35694652 [0,1,0,1,0,0|2,0,0]=4 5371 B11R1.220 CC1CCC(N)(C(=O)O)CS1 Amb35725377 [0,1,0,1,0,0|2,0,0]=4 5372 B11R1.220 CC1CCC(N)(C(N)=O)CC1 Amb18279188 [0,1,0,1,0,0|2,0,0]=4 5373 B11R1.220 CC1CCC(O)(C(=O)O)CC1 Amb18944702 [0,1,0,1,0,0|2,0,0]=4 5374 B11R1.220 CN1CCC(N)(C(=O)O)CC1 Amb22899584 [0,1,0,1,0,0|2,0,0]=4 5375 B11R1.220 CN1CCC(N)(C(=O)O)CC1 Amb3941917 [0,1,0,1,0,0|2,0,0]=4 5376 B11R1.220 C[C@H]1CC[C@@](C)(C(=O)O)CC1 Amb27406355 [0,1,0,1,0,0|2,0,0]=4 5377 B11R1.220 C[C@H]1CC[C@@](N)(C(=O)O)CC1 Amb27863411 [0,1,0,1,0,0|1,0,0]=3 5378 B11R1.220 C[C@]1(C(=O)O)CC[C@@H](O)CC1 Amb25085529 [0,1,0,1,0,0|2,0,0]=4 5379 B11R1.220 C[C@]1(C(=O)O)CC[C@H](O)CC1 Amb27484088 [0,1,0,1,0,0|2,0,0]=4 5380 B11R1.220 NC1(C(=O)O)CCC(=O)CC1 Amb16183881 [0,1,0,1,0,0|1,0,1]=4 5381 B11R1.220 NC1(C(=O)O)CCC(O)CC1 Amb2699209 [0,1,0,1,0,0|1,0,0]=3 5382 B11R1.220 NC1(C(=O)O)CCS(=O)CC1 Amb28250020 [0,1,0,1,0,0|2,0,0]=4 5383 B11R1.220 NC1CCC(F)(C(=O)O)CC1 Amb24105434 [0,1,0,1,0,0|2,0,0]=4 5384 B11R1.220 NC1CCC(N)(C(=O)O)CC1 Amb27645400 [0,1,0,1,0,0|1,0,0]=3 5385 B11R1.220 NC1CCC(N)(C(=O)O)CC1 Amb28652943 [0,1,0,1,0,0|1,0,0]=3 5386 B11R1.220 NC1CCC(O)(C(=O)O)CC1 Amb24116860 [0,1,0,1,0,0|2,0,0]=4 5387 B11R1.226 C[C@@H]1C[C@@H]([C@@H](N)CO)OC1=O Amb27620412 [0,1,0,1,0,0|2,0,0]=4 5388 B11R1.226 NC1CC(C(O)CO)OC1=O Amb27794665 [0,1,0,1,0,0|1,0,0]=3 5389 B11R1.226 N[C@@H]1CC([C@H](O)CO)OC1=O Amb27470966 [0,1,0,1,0,0|1,0,0]=3 5390 B11R1.226 N[C@H]1C[C@@H]([C@@H](Cl)CO)OC1=O Amb28132386 [0,1,0,1,0,0|1,0,0]=3 5391 B11R1.226 O=C1OC(C(O)CO)CC1Cl Amb27777246 [0,1,0,1,0,0|2,0,0]=4 5392 B11R1.226 O=C1OC(C(O)CO)CC1O Amb27457805 [0,1,0,1,0,0|2,0,0]=4 5393 B11R1.226 O=C1O[C@H](C(O)CO)C[C@H]1O Amb27184251 [0,1,0,1,0,0|2,0,0]=4 5394 B11R1.226 O=C1O[C@H]([C@H](O)CF)C[C@H]1O Amb28321336 [0,1,0,1,0,0|2,0,0]=4 5395 B11R1.226 O=C1O[C@H]([C@H](O)CO)C[C@@H]1O Amb27443506 [0,1,0,1,0,0|2,0,0]=4 5396 B11R1.226 O=C1O[C@H]([C@H](O)CO)C[C@H]1O Amb27844265 [0,1,0,1,0,0|2,0,0]=4 5397 B11R1.417 CCC1(C)CCC(C(=O)O)O1 Amb28047490 [0,1,0,1,0,0|2,0,0]=4 5398 B11R1.417 CCC1(C)CCC(C(N)=O)N1 Amb28052740 [0,1,0,1,0,0|2,0,0]=4 5399 B11R1.417 CCC1(C)NC(C(=O)O)CS1 Amb27865459 [0,1,0,1,0,0|2,0,0]=4 5400 B11R1.417 NC[C@@]1(F)CC[C@@H](C(=O)O)C1 Amb35788228 [0,1,0,1,0,0|1,0,0]=3 5401 B11R1.417 NC[C@@]1(F)CC[C@@H](C(=O)O)C1 Amb35788859 [0,1,0,1,0,0|1,0,0]=3 5402 B11R1.417 NC[C@@]1(F)CC[C@H](C(=O)O)C1 Amb35788594 [0,1,0,1,0,0|1,0,0]=3 5403 B11R1.417 NC[C@@]1(F)CC[C@H](C(=O)O)C1 Amb35788896 [0,1,0,1,0,0|1,0,0]=3 5404 B11R1.565 CC1CCCC(C(=O)O)CC1 Amb24487583 [0,1,0,1,0,0|2,0,0]=4 5405 B11R1.565 CC1CCNC(C(=O)O)CC1 Amb27441897 [0,1,0,1,0,0|1,0,0]=3 5406 B11R1.565 CC1CCNC(C(N)=O)CC1 Amb27962650 [0,1,0,1,0,0|2,0,0]=4 5407 B11R1.565 CN1CCNC(C(=O)O)CC1 Amb27246780 [0,1,0,1,0,0|2,0,0]=4 5408 B11R1.565 NC1CCCC(C(=O)O)CC1 Amb33743493 [0,1,0,1,0,0|1,0,0]=3 5409 B11R1.565 NC1CCCC(C(=O)O)CC1 Amb33743673 [0,1,0,1,0,0|1,0,0]=3 5410 B11R1.744 CC(CCC1(C)CC1)C(=O)O Amb33312593 [0,1,0,1,0,0|2,0,0]=4 5411 B11R1.744 CC1(CC[C@@H](N)C(=O)O)N=N1 Amb26999792 [0,1,0,1,0,0|1,0,1]=4 5412 B11R1.744 CC1(CC[C@H](N)C(=O)O)N=N1 Amb27990207 [0,1,0,1,0,0|1,0,1]=4 5413 B11R1.1068 CCC1(C)CC1C(C)C(=O)O Amb27441202 [0,1,0,1,0,0|2,0,0]=4 5414 B11R1.1073 NNC1(O)CCC(N)C(=O)O1 Amb27778444 [0,1,0,1,0,0|1,0,0]=3 5415 B11R1.1079 CC1(CN)CCC1(C)C(=O)O Amb27252371 [0,1,0,1,0,0|1,0,0]=3 5416 B11R1.1270 CC1OCC(N)(C(=O)O)C1C Amb35730991 [0,1,0,1,0,0|2,0,0]=4 5417 B11R1.23 C#CC(=O)C1CCCC(N)C1 Amb27173391 [0,1,0,1,0,0|2,0,0]=4 5418 B11R1.23 C#CC(=O)[C@@H]1CCC[C@@H](N)C1 Amb33307839 [0,1,0,1,0,0|2,0,0]=4 5419 B11R1.23 C#CC(=O)[C@@H]1CCC[C@H](N)C1 Amb33132812 [0,1,0,1,0,0|2,0,0]=4 5420 B11R1.23 C=CC(=O)C1CCCC(N)C1 Amb27404448 [0,1,0,1,0,0|2,0,0]=4 5421 B11R1.23 C=CC(=O)[C@@H]1CCC[C@@H](N)C1 Amb33307840 [0,1,0,1,0,0|2,0,0]=4 5422 B11R1.23 C=CC(=O)[C@@H]1CCC[C@H](N)C1 Amb33132813 [0,1,0,1,0,0|2,0,0]=4 5423 B11R1.23 CCC(=O)C1CCCC(N)C1 Amb25188889 [0,1,0,1,0,0|2,0,0]=4 5424 B11R1.23 CCC(=O)[C@@H]1CCC[C@@H](N)C1 Amb33307841 [0,1,0,1,0,0|2,0,0]=4 5425 B11R1.23 CCC(=O)[C@@H]1CCC[C@H](N)C1 Amb33132814 [0,1,0,1,0,0|2,0,0]=4 5426 B11R1.23 CNC(=O)C1CCCC(N)C1 Amb33164159 [0,1,0,1,0,0|2,0,0]=4 5427 B11R1.23 CNC(=O)C1CCCC(N)C1 Amb6252711 [0,1,0,1,0,0|2,0,0]=4 5428 B11R1.23 COC(=O)C1CCCC(=O)N1 Amb13886339 [0,1,0,1,0,0|1,0,1]=4 5429 B11R1.23 COC(=O)C1CCCC(C)C1 Amb27607963 [0,1,0,1,0,0|2,0,0]=4 5430 B11R1.23 COC(=O)C1CCCC(C)N1 Amb18644928 [0,1,0,1,0,0|1,0,0]=3 5431 B11R1.23 COC(=O)C1CCCC(Cl)C1 Amb24390370 [0,1,0,1,0,0|2,0,0]=4 5432 B11R1.23 COC(=O)C1CCCC(N)=N1 Amb27803936 [0,1,0,1,0,0|0,0,2]=4 5433 B11R1.23 COC(=O)C1CCCC(N)C1 Amb18288448 [0,1,0,1,0,0|1,0,0]=3 5434 B11R1.23 COC(=O)C1CCCC(N)C1 Amb20668217 [0,1,0,1,0,0|1,0,0]=3 5435 B11R1.23 COC(=O)C1CCCC(O)C1 Amb19516181 [0,1,0,1,0,0|2,0,0]=4 5436 B11R1.23 COC(=O)C1CCCC(S)C1 Amb32788133 [0,1,0,1,0,0|2,0,0]=4 5437 B11R1.23 COC(=O)C1COCC(N)C1 Amb27783317 [0,1,0,1,0,0|2,0,0]=4 5438 B11R1.23 COC(=O)C1CSCC(C)N1 Amb22304714 [0,1,0,1,0,0|2,0,0]=4 5439 B11R1.23 COC(=O)N1CCCC(N)C1 Amb13951817 [0,1,0,1,0,0|2,0,0]=4 5440 B11R1.23 COC(=O)[C@@H]1CCCC(=O)N1 Amb25375349 [0,1,0,1,0,0|1,0,1]=4 5441 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](Cl)C1 Amb28244806 [0,1,0,1,0,0|2,0,0]=4 5442 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](N)C1 Amb10873181 [0,1,0,1,0,0|1,0,0]=3 5443 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](N)C1 Amb24563866 [0,1,0,1,0,0|1,0,0]=3 5444 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](O)C1 Amb22899456 [0,1,0,1,0,0|2,0,0]=4 5445 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 Amb22747531 [0,1,0,1,0,0|1,0,0]=3 5446 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 Amb23438867 [0,1,0,1,0,0|1,0,0]=3 5447 B11R1.23 COC(=O)[C@@H]1CCC[C@H](O)C1 Amb27844007 [0,1,0,1,0,0|2,0,0]=4 5448 B11R1.23 COC(=O)[C@@H]1CSC[C@H](N)C1 Amb27870756 [0,1,0,1,0,0|2,0,0]=4 5449 B11R1.23 COC(=O)[C@@H]1C[C@@H](N)CCO1 Amb33039930 [0,1,0,1,0,0|2,0,0]=4 5450 B11R1.23 COC(=O)[C@H]1CCCC(=O)N1 Amb27862528 [0,1,0,1,0,0|1,0,1]=4 5451 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C)N1 Amb33456356 [0,1,0,1,0,0|1,0,0]=3 5452 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C)N1 Amb33482785 [0,1,0,1,0,0|1,0,0]=3 5453 B11R1.23 COC(=O)[C@H]1CCC[C@@H](N)C1 Amb26618546 [0,1,0,1,0,0|1,0,0]=3 5454 B11R1.23 COC(=O)[C@H]1CCC[C@@H](O)C1 Amb25198846 [0,1,0,1,0,0|2,0,0]=4 5455 B11R1.23 COC(=O)[C@H]1CCC[C@H](N)C1 Amb33871486 [0,1,0,1,0,0|1,0,0]=3 5456 B11R1.23 COC(=O)[C@H]1CCC[C@H](O)C1 Amb25225913 [0,1,0,1,0,0|2,0,0]=4 5457 B11R1.23 COC(=O)[C@H]1COC[C@@H](C)N1 Amb33035910 [0,1,0,1,0,0|2,0,0]=4 5458 B11R1.31 COC(=O)C(C)C1CCCC1 Amb24744320 [0,1,0,1,0,0|2,0,0]=4 5459 B11R1.31 COC(=O)C(C)C1CCCN1 Amb18126061 [0,1,0,1,0,0|1,0,0]=3 5460 B11R1.31 COC(=O)C(C)C1CCCO1 Amb32685776 [0,1,0,1,0,0|2,0,0]=4 5461 B11R1.31 COC(=O)C(N)C1C=CCC1 Amb18125865 [0,1,0,1,0,0|1,0,1]=4 5462 B11R1.31 COC(=O)C(N)C1CCCC1 Amb18294470 [0,1,0,1,0,0|1,0,0]=3 5463 B11R1.31 COC(=O)C(N)C1CCCC1 Amb30647399 [0,1,0,1,0,0|1,0,0]=3 5464 B11R1.31 COC(=O)C(N)C1CCCO1 Amb24570094 [0,1,0,1,0,0|1,0,0]=3 5465 B11R1.31 COC(=O)C(N)C1CCCS1 Amb33416210 [0,1,0,1,0,0|1,0,0]=3 5466 B11R1.31 COC(=O)C(N)C1CCOC1 Amb18968187 [0,1,0,1,0,0|2,0,0]=4 5467 B11R1.31 COC(=O)C(N)C1CCOC1 Amb30586498 [0,1,0,1,0,0|2,0,0]=4 5468 B11R1.31 COC(=O)C(N)C1CCSC1 Amb28188242 [0,1,0,1,0,0|2,0,0]=4 5469 B11R1.31 COC(=O)C(O)C1CCCC1 Amb18183256 [0,1,0,1,0,0|2,0,0]=4 5470 B11R1.31 COC(=O)C(O)C1CCCO1 Amb25052508 [0,1,0,1,0,0|2,0,0]=4 5471 B11R1.31 COC(=O)C(O)C1CCCS1 Amb33415449 [0,1,0,1,0,0|2,0,0]=4 5472 B11R1.31 COC(=O)[C@@H](N)C1CCCC1 Amb22226722 [0,1,0,1,0,0|1,0,0]=3 5473 B11R1.31 COC(=O)[C@@H](N)C1CCCC1 Amb27657576 [0,1,0,1,0,0|1,0,0]=3 5474 B11R1.31 COC(=O)[C@H](N)C1CCCC1 Amb27832604 [0,1,0,1,0,0|1,0,0]=3 5475 B11R1.31 COC(=O)[C@H](N)C1CCCC1 Amb33871580 [0,1,0,1,0,0|1,0,0]=3 5476 B11R1.31 COC(=O)[C@H](N)C1SCCS1 Amb27463968 [0,1,0,1,0,0|2,0,0]=4 5477 B11R1.31 O=C(CO)C(O)C1CCCC1 Amb28201017 [0,1,0,1,0,0|2,0,0]=4 5478 B11R1.44 C#CC(=O)C1CCC(CN)O1 Amb24351346 [0,1,0,1,0,0|2,0,0]=4 5479 B11R1.44 C#CC1CCC(C(=O)OC)N1 Amb28343273 [0,1,0,1,0,0|1,0,1]=4 5480 B11R1.44 C=CC(=O)C1CCC(CN)O1 Amb28284928 [0,1,0,1,0,0|2,0,0]=4 5481 B11R1.44 C=CC1CCC(C(=O)OC)N1 Amb27605757 [0,1,0,1,0,0|1,0,1]=4 5482 B11R1.44 C=CC1CC[C@@H](C(=O)OC)N1 Amb26064244 [0,1,0,1,0,0|1,0,1]=4 5483 B11R1.44 C=C[C@@H]1CC[C@@H](C(=O)OC)N1 Amb32410416 [0,1,0,1,0,0|1,0,1]=4 5484 B11R1.44 C=C[C@H]1CC[C@@H](C(=O)OC)N1 Amb32410415 [0,1,0,1,0,0|1,0,1]=4 5485 B11R1.44 CCC(=O)C1CCC(CN)O1 Amb25921030 [0,1,0,1,0,0|2,0,0]=4 5486 B11R1.44 CCC1CCC(C(=O)NO)O1 Amb28138279 [0,1,0,1,0,0|2,0,0]=4 5487 B11R1.44 CCC1CCC(C(=O)OC)N1 Amb23454511 [0,1,0,1,0,0|1,0,0]=3 5488 B11R1.44 CCC1NC(C(=O)OC)CS1 Amb22261542 [0,1,0,1,0,0|2,0,0]=4 5489 B11R1.44 COC(=O)C1CCC(C#N)N1 Amb28454010 [0,1,0,1,0,0|0,0,2]=4 5490 B11R1.44 COC(=O)C1CCC(CN)C1 Amb26987439 [0,1,0,1,0,0|1,0,0]=3 5491 B11R1.44 COC(=O)C1CCC(CN)C1 Amb34157870 [0,1,0,1,0,0|1,0,0]=3 5492 B11R1.44 COC(=O)C1CCC(CN)O1 Amb28989504 [0,1,0,1,0,0|1,0,0]=3 5493 B11R1.44 COC(=O)C1CCC(CO)C1 Amb26448823 [0,1,0,1,0,0|2,0,0]=4 5494 B11R1.44 COC(=O)C1CCC(CO)O1 Amb13951705 [0,1,0,1,0,0|2,0,0]=4 5495 B11R1.44 COC(=O)N1CCC(CN)C1 Amb18958263 [0,1,0,1,0,0|2,0,0]=4 5496 B11R1.44 COC(=O)N1CCC(CN)C1 Amb33550726 [0,1,0,1,0,0|2,0,0]=4 5497 B11R1.44 COC(=O)[C@@H]1CC[C@H](CN)O1 Amb25231224 [0,1,0,1,0,0|1,0,0]=3 5498 B11R1.44 COC(=O)[C@@H]1CC[C@H](CO)C1 Amb6299837 [0,1,0,1,0,0|2,0,0]=4 5499 B11R1.44 COC(=O)[C@@H]1CC[C@H](CO)O1 Amb25168854 [0,1,0,1,0,0|2,0,0]=4 5500 B11R1.44 COC(=O)[C@@H]1CO[C@H](CN)C1 Amb32685045 [0,1,0,1,0,0|2,0,0]=4 5501 B11R1.44 COC(=O)[C@H]1CC[C@@H](CN)N1 Amb28056103 [0,1,0,1,0,0|0,0,0]=2 5502 B11R1.44 COC(=O)[C@H]1CC[C@@H](CO)C1 Amb26970565 [0,1,0,1,0,0|2,0,0]=4 5503 B11R1.44 COC(=O)[C@H]1CC[C@@H](CO)O1 Amb27775833 [0,1,0,1,0,0|2,0,0]=4 5504 B11R1.44 NCC1CCN(C(=O)CO)C1 Amb28400064 [0,1,0,1,0,0|2,0,0]=4 5505 B11R1.121 COC(=O)C1CC(CCN)C1 Amb27989393 [0,1,0,1,0,0|1,0,0]=3 5506 B11R1.121 COC(=O)C1CC(CCN)C1 Amb34165340 [0,1,0,1,0,0|1,0,0]=3 5507 B11R1.121 COC(=O)C1CC(CCO)C1 Amb34913710 [0,1,0,1,0,0|2,0,0]=4 5508 B11R1.180 CCCCCC1COCC1=O Amb27672690 [0,1,0,1,0,0|2,0,0]=4 5509 B11R1.180 NCCCCC1NCNC1=O Amb27673315 [0,1,0,1,0,0|1,0,0]=3 5510 B11R1.180 NCCCSC1CCOC1=O Amb27271115 [0,1,0,1,0,0|2,0,0]=4 5511 B11R1.180 O=C1OCCC1CCCCO Amb27989920 [0,1,0,1,0,0|2,0,0]=4 5512 B11R1.187 CCCC1CC(CO)C(=O)O1 Amb27829894 [0,1,0,1,0,0|2,0,0]=4 5513 B11R1.187 CCN1CC(CCN)OC1=O Amb18199898 [0,1,0,1,0,0|2,0,0]=4 5514 B11R1.274 COC(=O)C1(C)CCC1CO Amb28294106 [0,1,0,1,0,0|2,0,0]=4 5515 B11R1.280 CO[C@H]1O[C@@H](CN)CC[C@@H]1N Amb27214188 [0,1,0,1,0,0|0,0,2]=4 5516 B11R1.280 CO[C@H]1O[C@@H](CN)CC[C@H]1N Amb28057516 [0,1,0,1,0,0|0,0,2]=4 5517 B11R1.292 COC(=O)C(N)CC1CC1C Amb32789397 [0,1,0,1,0,0|1,0,0]=3 5518 B11R1.292 COC(=O)C(O)CC1CC1C Amb33144863 [0,1,0,1,0,0|2,0,0]=4 5519 B11R1.293 COC(=O)C(C)CC1CCN1 Amb27674318 [0,1,0,1,0,0|1,0,0]=3 5520 B11R1.293 COC(=O)C(N)CC1CCC1 Amb25380472 [0,1,0,1,0,0|1,0,0]=3 5521 B11R1.293 COC(=O)C(N)CC1CCC1 Amb28652960 [0,1,0,1,0,0|1,0,0]=3 5522 B11R1.293 COC(=O)C(N)CC1CNC1 Amb27989396 [0,1,0,1,0,0|2,0,0]=4 5523 B11R1.293 COC(=O)C(N)CC1COC1 Amb27989526 [0,1,0,1,0,0|2,0,0]=4 5524 B11R1.293 COC(=O)C(O)CC1CCC1 Amb26083284 [0,1,0,1,0,0|2,0,0]=4 5525 B11R1.293 COC(=O)N(C)CC1CCN1 Amb27674423 [0,1,0,1,0,0|2,0,0]=4 5526 B11R1.293 COC(=O)N(N)CC1CCC1 Amb33191673 [0,1,0,1,0,0|2,0,0]=4 5527 B11R1.293 COC(=O)[C@@H](N)CC1CCC1 Amb34913506 [0,1,0,1,0,0|1,0,0]=3 5528 B11R1.293 COC(=O)[C@H](N)CC1CCC1 Amb28388100 [0,1,0,1,0,0|1,0,0]=3 5529 B11R1.293 COC(=O)[C@H](O)CC1CCC1 Amb25383753 [0,1,0,1,0,0|2,0,0]=4 5530 B11R1.294 COC(=O)C(N)CCC1CC1 Amb33065490 [0,1,0,1,0,0|1,0,0]=3 5531 B11R1.294 COC(=O)C(O)CCC1CC1 Amb33359331 [0,1,0,1,0,0|2,0,0]=4 5532 B11R1.295 COC(=O)C(N)C1CCC1C Amb35660549 [0,1,0,1,0,0|1,0,0]=3 5533 B11R1.295 COC(=O)C(N)C1CCC1O Amb33066143 [0,1,0,1,0,0|1,0,0]=3 5534 B11R1.852 C#CC(=O)C1CCCCCN1 Amb24584920 [0,1,0,1,0,0|2,0,0]=4 5535 B11R1.852 C=CC(=O)C1CCCCCN1 Amb27760184 [0,1,0,1,0,0|2,0,0]=4 5536 B11R1.852 CCC(=O)C1CCCCCN1 Amb27173385 [0,1,0,1,0,0|2,0,0]=4 5537 B11R1.852 COC(=O)C1=NNCCCC1 Amb26432638 [0,1,0,1,0,0|0,0,2]=4 5538 B11R1.852 COC(=O)C1CCCCCC1 Amb18182101 [0,1,0,1,0,0|2,0,0]=4 5539 B11R1.852 COC(=O)C1CCCCCN1 Amb21963566 [0,1,0,1,0,0|1,0,0]=3 5540 B11R1.852 COC(=O)C1CCCCCN1 Amb33548478 [0,1,0,1,0,0|1,0,0]=3 5541 B11R1.852 COC(=O)C1CCCCNC1 Amb21963336 [0,1,0,1,0,0|1,0,0]=3 5542 B11R1.852 COC(=O)C1CCCCNC1 Amb22490910 [0,1,0,1,0,0|1,0,0]=3 5543 B11R1.852 COC(=O)C1CCSCCN1 Amb27191806 [0,1,0,1,0,0|2,0,0]=4 5544 B11R1.852 COC(=O)C1CNCCCN1 Amb22406405 [0,1,0,1,0,0|2,0,0]=4 5545 B11R1.852 COC(=O)C1CNCCOC1 Amb27782567 [0,1,0,1,0,0|2,0,0]=4 5546 B11R1.852 COC(=O)C1CNCCOC1 Amb32434762 [0,1,0,1,0,0|2,0,0]=4 5547 B11R1.852 COC(=O)C1CNCCSC1 Amb25988488 [0,1,0,1,0,0|2,0,0]=4 5548 B11R1.852 COC(=O)[C@@H]1CCOCCN1 Amb35825220 [0,1,0,1,0,0|2,0,0]=4 5549 B11R1.852 COC(=O)[C@@H]1COCCCN1 Amb27210558 [0,1,0,1,0,0|2,0,0]=4 5550 B11R1.852 COC(=O)[C@H]1CCOCCN1 Amb35825221 [0,1,0,1,0,0|2,0,0]=4 5551 B11R1.852 COC(=O)[C@H]1COCCCN1 Amb27214865 [0,1,0,1,0,0|2,0,0]=4 5552 B11R1.852 O=C(CO)C1CCCCCN1 Amb28053242 [0,1,0,1,0,0|1,0,0]=3 5553 B11R1.852 O=C(NO)C1CCCCCC1 Amb18182216 [0,1,0,1,0,0|2,0,0]=4 5554 B11R1.878 C#CC(=O)C1(C)CCCCN1 Amb24610432 [0,1,0,1,0,0|2,0,0]=4 5555 B11R1.878 C#CC(=O)C1(N)CCCCC1 Amb24698347 [0,1,0,1,0,0|2,0,0]=4 5556 B11R1.878 C=CC(=O)C1(C)CCCCN1 Amb24548157 [0,1,0,1,0,0|2,0,0]=4 5557 B11R1.878 C=CC(=O)C1(N)CCCCC1 Amb27447141 [0,1,0,1,0,0|2,0,0]=4 5558 B11R1.878 CCC(=O)C1(C)CCCCN1 Amb25800558 [0,1,0,1,0,0|2,0,0]=4 5559 B11R1.878 CCC(=O)C1(N)CCCCC1 Amb18200346 [0,1,0,1,0,0|2,0,0]=4 5560 B11R1.878 CCC(=O)C1(N)CCCCC1 Amb35788204 [0,1,0,1,0,0|2,0,0]=4 5561 B11R1.878 CNC(=O)C1(C)CCCCN1 Amb27877945 [0,1,0,1,0,0|2,0,0]=4 5562 B11R1.878 CNC(=O)C1(N)CCCCC1 Amb33548507 [0,1,0,1,0,0|2,0,0]=4 5563 B11R1.878 CNC(=O)C1(N)CCCCC1 Amb6271066 [0,1,0,1,0,0|2,0,0]=4 5564 B11R1.878 COC(=O)C1(Br)CCCCC1 Amb9786360 [0,1,0,1,0,0|2,0,0]=4 5565 B11R1.878 COC(=O)C1(C)CCCCC1 Amb25808571 [0,1,0,1,0,0|2,0,0]=4 5566 B11R1.878 COC(=O)C1(C)CCCCN1 Amb18644927 [0,1,0,1,0,0|1,0,0]=3 5567 B11R1.878 COC(=O)C1(C)CCCCN1 Amb21960057 [0,1,0,1,0,0|1,0,0]=3 5568 B11R1.878 COC(=O)C1(C)CCCCO1 Amb10072963 [0,1,0,1,0,0|2,0,0]=4 5569 B11R1.878 COC(=O)C1(C)COCCN1 Amb22899735 [0,1,0,1,0,0|2,0,0]=4 5570 B11R1.878 COC(=O)C1(F)CCCCC1 Amb25189563 [0,1,0,1,0,0|2,0,0]=4 5571 B11R1.878 COC(=O)C1(N)C=CCCC1 Amb27226110 [0,1,0,1,0,0|1,0,1]=4 5572 B11R1.878 COC(=O)C1(N)CCCCC1 Amb2607792 [0,1,0,1,0,0|1,0,0]=3 5573 B11R1.878 COC(=O)C1(N)CCCCC1 Amb6892077 [0,1,0,1,0,0|1,0,0]=3 5574 B11R1.878 COC(=O)C1(N)CCCOC1 Amb25340372 [0,1,0,1,0,0|2,0,0]=4 5575 B11R1.878 COC(=O)C1(N)CCCOC1 Amb35789330 [0,1,0,1,0,0|2,0,0]=4 5576 B11R1.878 COC(=O)C1(N)CCCSC1 Amb18287675 [0,1,0,1,0,0|2,0,0]=4 5577 B11R1.878 COC(=O)C1(N)CCNCC1 Amb18281934 [0,1,0,1,0,0|2,0,0]=4 5578 B11R1.878 COC(=O)C1(N)CCNCC1 Amb19373642 [0,1,0,1,0,0|2,0,0]=4 5579 B11R1.878 COC(=O)C1(N)CCOCC1 Amb22167156 [0,1,0,1,0,0|2,0,0]=4 5580 B11R1.878 COC(=O)C1(N)CCOCC1 Amb8630471 [0,1,0,1,0,0|2,0,0]=4 5581 B11R1.878 COC(=O)C1(N)CCOCC1 Amb9677646 [0,1,0,1,0,0|2,0,0]=4 5582 B11R1.878 COC(=O)C1(N)CCSCC1 Amb18953112 [0,1,0,1,0,0|2,0,0]=4 5583 B11R1.878 COC(=O)C1(N)CCSCC1 Amb8630470 [0,1,0,1,0,0|2,0,0]=4 5584 B11R1.878 COC(=O)C1(O)CCCCO1 Amb27646855 [0,1,0,1,0,0|2,0,0]=4 5585 B11R1.878 COC(=O)C1(S)CCCCC1 Amb22499490 [0,1,0,1,0,0|2,0,0]=4 5586 B11R1.878 COC(=O)[C@@]1(C)CCCCN1 Amb22748861 [0,1,0,1,0,0|1,0,0]=3 5587 B11R1.878 COC(=O)[C@@]1(C)COCCN1 Amb23439327 [0,1,0,1,0,0|2,0,0]=4 5588 B11R1.878 COC(=O)[C@@]1(N)C=CCCC1 Amb27876507 [0,1,0,1,0,0|1,0,1]=4 5589 B11R1.878 COC(=O)[C@]1(C)CCCCN1 Amb25299311 [0,1,0,1,0,0|1,0,0]=3 5590 B11R1.878 COC(=O)[C@]1(C)COCCN1 Amb27240934 [0,1,0,1,0,0|2,0,0]=4 5591 B11R1.878 N\C(=N/O)C1(N)CCCCC1 Amb25784235 [0,1,0,1,0,0|2,0,0]=4 5592 B11R1.878 O=C(CO)C1(O)CCCCC1 Amb25892493 [0,1,0,1,0,0|2,0,0]=4 5593 B11R1.878 O=C(NO)C1(F)CCCCC1 Amb27826048 [0,1,0,1,0,0|2,0,0]=4 5594 B11R1.878 O=C(NO)C1(O)CCCCC1 Amb26896457 [0,1,0,1,0,0|2,0,0]=4 5595 B11R1.1470 C#CC(=O)C1(C)CCCC1N Amb27855317 [0,1,0,1,0,0|2,0,0]=4 5596 B11R1.1470 C=CC(=O)C1(C)CCCC1N Amb25681906 [0,1,0,1,0,0|2,0,0]=4 5597 B11R1.1470 CC1(C(=O)NN)CCCC1N Amb27258865 [0,1,0,1,0,0|2,0,0]=4 5598 B11R1.1470 CCC(=O)C1(C)CCCC1N Amb26460252 [0,1,0,1,0,0|2,0,0]=4 5599 B11R1.1470 COC(=O)C1(C)CCCC1N Amb25338939 [0,1,0,1,0,0|1,0,0]=3 5600 B11R1.1470 COC(=O)C1(C)CCCC1O Amb25098676 [0,1,0,1,0,0|2,0,0]=4 5601 B11R1.1470 COC(=O)C1(C)COCC1N Amb24467181 [0,1,0,1,0,0|2,0,0]=4 5602 B11R1.1470 COC(=O)C1(N)CCCC1C Amb26863410 [0,1,0,1,0,0|1,0,0]=3 5603 B11R1.1470 COC(=O)C1(N)CCCC1O Amb35744330 [0,1,0,1,0,0|1,0,0]=3 5604 B11R1.1470 COC(=O)C1(N)CCOC1C Amb28190399 [0,1,0,1,0,0|2,0,0]=4 5605 B11R1.1470 COC(=O)C1(N)CNCC1C Amb25837462 [0,1,0,1,0,0|2,0,0]=4 5606 B11R1.1470 COC(=O)C1(N)COCC1C Amb35646805 [0,1,0,1,0,0|2,0,0]=4 5607 B11R1.1470 COC(=O)C1(O)CCCC1C Amb26009874 [0,1,0,1,0,0|2,0,0]=4 5608 B11R1.1470 COC(=O)C1(O)CCCC1N Amb24394721 [0,1,0,1,0,0|1,0,0]=3 5609 B11R1.1470 COC(=O)C1(O)CCCC1N Amb32645973 [0,1,0,1,0,0|1,0,0]=3 5610 B11R1.1470 COC(=O)[C@@]1(C)CCC[C@@H]1O Amb24741879 [0,1,0,1,0,0|2,0,0]=4 5611 B11R1.1470 COC(=O)[C@@]1(O)CCC[C@H]1N Amb24610147 [0,1,0,1,0,0|1,0,0]=3 5612 B11R1.1470 COC(=O)[C@@]1(O)CCC[C@H]1N Amb32646086 [0,1,0,1,0,0|1,0,0]=3 5613 B11R1.1470 COC(=O)[C@]1(C)CCC[C@@H]1O Amb27427927 [0,1,0,1,0,0|2,0,0]=4 5614 B11R1.1470 COC(=O)[C@]1(C)CCC[C@H]1O Amb24618782 [0,1,0,1,0,0|2,0,0]=4 5615 B11R1.159 CC1C(N)CCCC1C(N)=O Amb18182134 [0,1,0,1,0,0|2,0,0]=4 5616 B11R1.159 CC1CCCC(C(=O)O)C1N Amb28132204 [0,1,0,1,0,0|1,0,0]=3 5617 B11R1.159 CN1C(=O)CCCC1C(=O)O Amb18830654 [0,1,0,1,0,0|1,0,1]=4 5618 B11R1.159 C[C@H]1COC[C@@H](C(=O)O)N1C Amb27883227 [0,1,0,1,0,0|2,0,0]=4 5619 B11R1.159 C[C@H]1[C@@H](O)CCC[C@H]1C(=O)O Amb28051870 [0,1,0,1,0,0|2,0,0]=4 5620 B11R1.159 NC1CCCC(C(=O)O)C1O Amb27237633 [0,1,0,1,0,0|1,0,0]=3 5621 B11R1.159 N[C@H]1CCC[C@H](C(=O)O)[C@@H]1O Amb24557744 [0,1,0,1,0,0|1,0,0]=3 5622 B11R1.159 N[C@H]1[C@@H](C(=O)O)CCC[C@H]1O Amb27640678 [0,1,0,1,0,0|1,0,0]=3 5623 B11R1.159 O=C(O)C1CCCC(Br)C1=O Amb32409892 [0,1,0,1,0,0|2,0,0]=4 5624 B11R1.279 CCN1CC[C@@H](CN)OC1=O Amb28398058 [0,1,0,1,0,0|2,0,0]=4 5625 B11R1.298 CCC(C(=O)O)C1CCCC1 Amb18125995 [0,1,0,1,0,0|2,0,0]=4 5626 B11R1.298 CCC(C(=O)O)C1CCCS1 Amb33416231 [0,1,0,1,0,0|2,0,0]=4 5627 B11R1.298 CCC(C(=O)O)N1CCCN1 Amb28073426 [0,1,0,1,0,0|2,0,0]=4 5628 B11R1.298 CNC(C(=O)O)C1CCSC1 Amb28065934 [0,1,0,1,0,0|2,0,0]=4 5629 B11R1.298 CNC(C(N)=O)C1CCCC1 Amb18985418 [0,1,0,1,0,0|2,0,0]=4 5630 B11R1.298 CN[C@H](C(=O)O)C1CCCC1 Amb27863568 [0,1,0,1,0,0|1,0,0]=3 5631 B11R1.298 COC(C(=O)O)C1CCCC1 Amb25060695 [0,1,0,1,0,0|2,0,0]=4 5632 B11R1.298 COC(C(=O)O)C1CCCO1 Amb27198651 [0,1,0,1,0,0|2,0,0]=4 5633 B11R1.298 N#CC(C(=O)O)C1CCCC1 Amb24422965 [0,1,0,1,0,0|1,0,1]=4 5634 B11R1.298 NC(=O)C(CO)C1CCCN1 Amb27225007 [0,1,0,1,0,0|2,0,0]=4 5635 B11R1.298 NCC(C(=O)O)C1=CCCC1 Amb27593851 [0,1,0,1,0,0|1,0,1]=4 5636 B11R1.298 NCC(C(=O)O)C1CCCC1 Amb18830612 [0,1,0,1,0,0|1,0,0]=3 5637 B11R1.298 NCC(C(=O)O)C1CCCN1 Amb27623580 [0,1,0,1,0,0|0,0,0]=2 5638 B11R1.298 NCC(C(=O)O)C1CCCO1 Amb26530264 [0,1,0,1,0,0|1,0,0]=3 5639 B11R1.298 NCC(C(=O)O)C1CCCS1 Amb33416242 [0,1,0,1,0,0|1,0,0]=3 5640 B11R1.298 NCC(C(=O)O)C1CCNC1 Amb26653533 [0,1,0,1,0,0|2,0,0]=4 5641 B11R1.298 NCC(C(=O)O)C1CCOC1 Amb27160836 [0,1,0,1,0,0|2,0,0]=4 5642 B11R1.298 NCC(C(=O)O)C1CCSC1 Amb33141657 [0,1,0,1,0,0|2,0,0]=4 5643 B11R1.298 NCC(C(=O)O)N1CCCC1 Amb25761853 [0,1,0,1,0,0|2,0,0]=4 5644 B11R1.298 O=C(O)C(CF)C1CCCC1 Amb28140884 [0,1,0,1,0,0|2,0,0]=4 5645 B11R1.298 O=C(O)C(CO)C1CCCN1 Amb27209616 [0,1,0,1,0,0|1,0,0]=3 5646 B11R1.473 CCC1CCC(C(=O)O)C1N Amb27596871 [0,1,0,1,0,0|1,0,0]=3 5647 B11R1.473 CC[C@@H]1CC[C@@H](C(=O)O)[C@H]1N Amb28052145 [0,1,0,1,0,0|1,0,0]=3 5648 B11R1.473 COC1CCC(C(=O)O)C1N Amb27437876 [0,1,0,1,0,0|2,0,0]=4 5649 B11R1.473 CO[C@H]1CC[C@@H](C(=O)O)[C@@H]1N Amb27666963 [0,1,0,1,0,0|2,0,0]=4 5650 B11R1.1016 CCC(CC1CCC1)C(=O)O Amb27986521 [0,1,0,1,0,0|2,0,0]=4 5651 B11R1.1016 COC(CC1CCC1)C(=O)O Amb26998885 [0,1,0,1,0,0|2,0,0]=4 5652 B11R1.1016 N#CC(CC1CCC1)C(=O)O Amb27254338 [0,1,0,1,0,0|1,0,1]=4 5653 B11R1.1016 NCC(OC1CCC1)C(=O)O Amb28387354 [0,1,0,1,0,0|2,0,0]=4 5654 B11R1.1017 COC(CCC1CC1)C(=O)O Amb33361887 [0,1,0,1,0,0|2,0,0]=4 5655 B11R1.1033 CC1CC1CC(CN)C(=O)O Amb32650410 [0,1,0,1,0,0|1,0,0]=3 5656 B11R1.1033 COC(CC1CC1C)C(=O)O Amb33143916 [0,1,0,1,0,0|2,0,0]=4 5657 B11R1.1064 CC1CCCC1(C#N)C(=O)O Amb26350739 [0,1,0,1,0,0|1,0,1]=4 5658 B11R1.1064 CC1CCCC1(CN)C(=O)O Amb24702744 [0,1,0,1,0,0|1,0,0]=3 5659 B11R1.1064 CCC1(C(=O)O)CCCC1C Amb28319268 [0,1,0,1,0,0|2,0,0]=4 5660 B11R1.1064 CCC1(C(=O)O)CCCC1N Amb33232159 [0,1,0,1,0,0|1,0,0]=3 5661 B11R1.1064 CNC1(C(=O)O)COCC1C Amb35646806 [0,1,0,1,0,0|2,0,0]=4 5662 B11R1.1064 COC1(C(=O)O)CCCC1C Amb27669490 [0,1,0,1,0,0|2,0,0]=4 5663 B11R1.1074 C#CC1(C(=O)O)CCCCC1 Amb27862593 [0,1,0,1,0,0|2,0,0]=4 5664 B11R1.1074 CC(=O)C1(CN)CCCCC1 Amb24445563 [0,1,0,1,0,0|2,0,0]=4 5665 B11R1.1074 CCC1(C(=O)O)CCCCC1 Amb1016524 [0,1,0,1,0,0|2,0,0]=4 5666 B11R1.1074 CCC1(C(=O)O)CCCCN1 Amb15701483 [0,1,0,1,0,0|1,0,0]=3 5667 B11R1.1074 CCC1(C(=O)O)CCCCN1 Amb19892167 [0,1,0,1,0,0|1,0,0]=3 5668 B11R1.1074 CCC1(C(=O)O)CCCCO1 Amb26529853 [0,1,0,1,0,0|2,0,0]=4 5669 B11R1.1074 CCC1(C(=O)O)COCCN1 Amb25848403 [0,1,0,1,0,0|2,0,0]=4 5670 B11R1.1074 CNC1(C(=O)O)CCCCC1 Amb9619738 [0,1,0,1,0,0|1,0,0]=3 5671 B11R1.1074 CNC1(C(=O)O)CCOCC1 Amb32653408 [0,1,0,1,0,0|2,0,0]=4 5672 B11R1.1074 CNC1(C(=O)O)CCOCC1 Amb9619632 [0,1,0,1,0,0|2,0,0]=4 5673 B11R1.1074 CNC1(C(=O)O)CCSCC1 Amb18282840 [0,1,0,1,0,0|2,0,0]=4 5674 B11R1.1074 CNC1(C(C)=O)CCCCC1 Amb24406380 [0,1,0,1,0,0|2,0,0]=4 5675 B11R1.1074 CNC1(C(N)=O)CCCCC1 Amb18950561 [0,1,0,1,0,0|2,0,0]=4 5676 B11R1.1074 COC1(C(=O)O)CCCCC1 Amb18953825 [0,1,0,1,0,0|2,0,0]=4 5677 B11R1.1074 N#CC1(C(=O)O)CCCCC1 Amb33529310 [0,1,0,1,0,0|1,0,1]=4 5678 B11R1.1074 NCC1(C(=O)O)CCCCC1 Amb18959883 [0,1,0,1,0,0|1,0,0]=3 5679 B11R1.1074 NCC1(C(=O)O)CCCCC1 Amb22371113 [0,1,0,1,0,0|1,0,0]=3 5680 B11R1.1074 NCC1(C(=O)O)CCCNC1 Amb27630487 [0,1,0,1,0,0|2,0,0]=4 5681 B11R1.1074 NCC1(C(=O)O)CCCOC1 Amb26021711 [0,1,0,1,0,0|2,0,0]=4 5682 B11R1.1074 NCC1(C(=O)O)CCCOC1 Amb30584733 [0,1,0,1,0,0|2,0,0]=4 5683 B11R1.1074 NCC1(C(=O)O)CCNCC1 Amb26341115 [0,1,0,1,0,0|2,0,0]=4 5684 B11R1.1074 NCC1(C(=O)O)CCOCC1 Amb24077508 [0,1,0,1,0,0|2,0,0]=4 5685 B11R1.1074 NCC1(C(=O)O)CCOCC1 Amb8631333 [0,1,0,1,0,0|2,0,0]=4 5686 B11R1.1074 NNC1(C(=O)O)CCCCC1 Amb19515065 [0,1,0,1,0,0|1,0,0]=3 5687 B11R1.1074 O=C(O)C1(CBr)CCCCC1 Amb27803027 [0,1,0,1,0,0|2,0,0]=4 5688 B11R1.1074 O=C(O)C1(CCl)CCCCC1 Amb27439666 [0,1,0,1,0,0|2,0,0]=4 5689 B11R1.1074 O=C(O)C1(CF)CCCCO1 Amb27647178 [0,1,0,1,0,0|2,0,0]=4 5690 B11R1.1074 O=C(O)C1(CO)CCCCC1 Amb17400032 [0,1,0,1,0,0|2,0,0]=4 5691 B11R1.1074 O=CC1(C(=O)O)CCCCC1 Amb27641173 [0,1,0,1,0,0|2,0,0]=4 5692 B11R1.80 CC1CC(CC(Cl)Cl)OC1=O Amb27955891 [0,1,0,1,0,0|2,0,0]=4 5693 B11R1.175 CC(C)C1CCC(C(=O)O)C1 Amb27791822 [0,1,0,1,0,0|2,0,0]=4 5694 B11R1.175 CC(C)C1CCC(C(=O)O)N1 Amb18200002 [0,1,0,1,0,0|1,0,0]=3 5695 B11R1.175 CC(C)C1CCC(C(N)=O)N1 Amb27441555 [0,1,0,1,0,0|2,0,0]=4 5696 B11R1.175 CC(C)C1CSC(C(=O)O)N1 Amb27816571 [0,1,0,1,0,0|2,0,0]=4 5697 B11R1.175 CC(C)C1NC(C(=O)O)CS1 Amb9729147 [0,1,0,1,0,0|2,0,0]=4 5698 B11R1.175 CC(C)C1N[C@@H](C(=O)O)CS1 Amb27221507 [0,1,0,1,0,0|2,0,0]=4 5699 B11R1.175 CC(C)[C@@H]1CC[C@@H](C(=O)O)N1 Amb25960203 [0,1,0,1,0,0|1,0,0]=3 5700 B11R1.175 CC(C)[C@@H]1CC[C@H](C(=O)O)N1 Amb24514876 [0,1,0,1,0,0|1,0,0]=3 5701 B11R1.175 CC(C)[C@H]1CC[C@H](C(=O)O)N1 Amb25947463 [0,1,0,1,0,0|1,0,0]=3 5702 B11R1.175 NC(=O)C1CCC(C(=O)O)C1 Amb18126050 [0,1,0,1,0,0|1,0,1]=4 5703 B11R1.175 NC(=O)C1CCC(C(=O)O)N1 Amb27397702 [0,1,0,1,0,0|0,0,1]=3 5704 B11R1.175 NC(=O)C1CCC(C(=O)O)O1 Amb25111716 [0,1,0,1,0,0|1,0,1]=4 5705 B11R1.175 NC(=O)[C@@H]1CC[C@@H](C(=O)O)N1 Amb23560427 [0,1,0,1,0,0|0,0,1]=3 5706 B11R1.175 NC(=O)[C@@H]1CC[C@@H](C(=O)O)S1 Amb23560425 [0,1,0,1,0,0|1,0,1]=4 5707 B11R1.175 NC(=O)[C@@H]1CC[C@@H](C(N)=O)N1 Amb27863644 [0,1,0,1,0,0|1,0,1]=4 5708 B11R1.175 NC(=O)[C@@H]1CC[C@H](C(=O)O)C1 Amb25983681 [0,1,0,1,0,0|1,0,1]=4 5709 B11R1.175 NC(=O)[C@@H]1CC[C@H](C(=O)O)N1 Amb23560440 [0,1,0,1,0,0|0,0,1]=3 5710 B11R1.175 NC(=O)[C@@H]1CC[C@H](C(=O)O)O1 Amb24384443 [0,1,0,1,0,0|1,0,1]=4 5711 B11R1.175 NC(=O)[C@@H]1CC[C@H](C(=O)O)S1 Amb23560409 [0,1,0,1,0,0|1,0,1]=4 5712 B11R1.175 O=C(O)C1CCC(C(F)F)C1 Amb27617334 [0,1,0,1,0,0|2,0,0]=4 5713 B11R1.175 O=C(O)C1CCC(C(F)F)N1 Amb19515716 [0,1,0,1,0,0|1,0,0]=3 5714 B11R1.175 O=C(O)[C@@H]1CCC(C(F)F)N1 Amb28281181 [0,1,0,1,0,0|1,0,0]=3 5715 B11R1.175 O=C(O)[C@@H]1CC[C@@H](C(=O)O)N1 Amb25174831 [0,1,0,1,0,0|1,0,1]=4 5716 B11R1.175 O=C(O)[C@H]1CC[C@H](C(=O)O)N1 Amb27195626 [0,1,0,1,0,0|1,0,1]=4 5717 B11R1.704 CC(=O)[C@@H]1C[C@H]1C(N)C(=O)O Amb27467898 [0,1,0,1,0,0|1,0,1]=4 5718 B11R1.704 CC(C)C1CC1C(C)C(=O)O Amb28132856 [0,1,0,1,0,0|2,0,0]=4 5719 B11R1.704 NC(C(=O)O)C1CC1C(=O)O Amb24447417 [0,1,0,1,0,0|1,0,1]=4 5720 B11R1.704 NC(C(=O)O)[C@@H]1C[C@@H]1C(=O)O Amb27878614 [0,1,0,1,0,0|1,0,1]=4 5721 B11R1.704 N[C@@H](C(=O)O)C1CC1C(=O)O Amb27772027 [0,1,0,1,0,0|1,0,1]=4 5722 B11R1.704 N[C@H](C(=O)O)[C@@H]1C[C@@H]1C(=O)O Amb22352678 [0,1,0,1,0,0|1,0,1]=4 5723 B11R1.704 N[C@H](C(=O)O)[C@H]1C[C@@H]1C(=O)O Amb19930360 [0,1,0,1,0,0|1,0,1]=4 5724 B11R1.704 N[C@H](C(=O)O)[C@H]1C[C@H]1C(=O)O Amb22388556 [0,1,0,1,0,0|1,0,1]=4 5725 B11R1.711 CC(C)CCC1CC1C(=O)O Amb27989325 [0,1,0,1,0,0|2,0,0]=4 5726 B11R1.723 CC(C)C1CCC1(N)C(=O)O Amb23456073 [0,1,0,1,0,0|1,0,0]=3 5727 B11R1.723 CC(C)C1CCC1(N)C(N)=O Amb28365378 [0,1,0,1,0,0|2,0,0]=4 5728 B11R1.723 CC(C)[C@@H]1CC[C@@]1(N)C(=O)O Amb25349511 [0,1,0,1,0,0|1,0,0]=3 5729 B11R1.723 CC(C)[C@H]1CC[C@@]1(N)C(=O)O Amb27848068 [0,1,0,1,0,0|1,0,0]=3 5730 B11R1.723 CC(C)[C@H]1CC[C@]1(N)C(N)=O Amb27483157 [0,1,0,1,0,0|2,0,0]=4 5731 B11R1.723 NC1(C(=O)O)CCC1C(=O)O Amb24381448 [0,1,0,1,0,0|1,0,1]=4 5732 B11R1.730 CC1(C)CCCC(C(=O)O)C1 Amb22059548 [0,1,0,1,0,0|2,0,0]=4 5733 B11R1.730 CC1(C)CCCC(C(=O)O)O1 Amb26317586 [0,1,0,1,0,0|2,0,0]=4 5734 B11R1.730 CC1(C)COCC(C(=O)O)N1 Amb28653017 [0,1,0,1,0,0|2,0,0]=4 5735 B11R1.730 CC1(C)CSC[C@@H](C(=O)O)N1 Amb28142682 [0,1,0,1,0,0|2,0,0]=4 5736 B11R1.730 CC1(Cl)CCCC(C(=O)O)C1 Amb18648012 [0,1,0,1,0,0|2,0,0]=4 5737 B11R1.730 CC1(F)CCCC(C(=O)O)C1 Amb27872745 [0,1,0,1,0,0|2,0,0]=4 5738 B11R1.730 O=C(O)C1CCCC(F)(F)C1 Amb22738663 [0,1,0,1,0,0|2,0,0]=4 5739 B11R1.743 CC(C)CC1CC(C(=O)O)C1 Amb23456005 [0,1,0,1,0,0|2,0,0]=4 5740 B11R1.743 CC(C)C[C@H]1C[C@@H](C(=O)O)C1 Amb33715980 [0,1,0,1,0,0|2,0,0]=4 5741 B11R1.927 CC(C)CC1CC1(N)C(=O)O Amb27481515 [0,1,0,1,0,0|1,0,0]=3 5742 B11R1.927 NC1(C(=O)O)CC1CC(=O)O Amb26493344 [0,1,0,1,0,0|1,0,1]=4 5743 B11R1.927 NC1(C(=O)O)CC1CC(=O)O Amb32665933 [0,1,0,1,0,0|1,0,1]=4 5744 B11R1.927 N[C@@]1(C(=O)O)C[C@H]1CC(=O)O Amb25179270 [0,1,0,1,0,0|1,0,1]=4 5745 B11R1.1107 CC1(C)CCC1C(N)C(=O)O Amb35663082 [0,1,0,1,0,0|1,0,0]=3 5746 B11R1.1107 CC1(C)CCC1C(O)C(=O)O Amb28365752 [0,1,0,1,0,0|2,0,0]=4 5747 B11R1.1111 CC(CC1CC1(C)C)C(=O)O Amb33747127 [0,1,0,1,0,0|2,0,0]=4 5748 B11R1.1111 CC(CC1CC1(F)F)C(=O)O Amb33728723 [0,1,0,1,0,0|2,0,0]=4 5749 B11R1.1111 CC1(C)CC1CC(N)C(N)=O Amb33308922 [0,1,0,1,0,0|2,0,0]=4 5750 B11R1.1111 CC1(C)CC1CC(O)C(=O)O Amb33353251 [0,1,0,1,0,0|2,0,0]=4 5751 B11R1.1111 CC1(C)CC1C[C@@H](N)C(=O)O Amb33036936 [0,1,0,1,0,0|1,0,0]=3 5752 B11R1.1111 CC1(C)CC1C[C@H](N)C(=O)O Amb33308895 [0,1,0,1,0,0|1,0,0]=3 5753 B11R1.1111 C[C@@H](CC1CC1(C)C)C(=O)O Amb33744647 [0,1,0,1,0,0|2,0,0]=4 5754 B11R1.1111 C[C@@H](CC1CC1(F)F)C(=O)O Amb33744937 [0,1,0,1,0,0|2,0,0]=4 5755 B11R1.1111 C[C@H](CC1CC1(C)C)C(=O)O Amb33738118 [0,1,0,1,0,0|2,0,0]=4 5756 B11R1.1111 C[C@H](CC1CC1(F)F)C(=O)O Amb33738419 [0,1,0,1,0,0|2,0,0]=4 5757 B11R1.1111 NC(=O)C(N)CC1CC1(F)F Amb33035581 [0,1,0,1,0,0|2,0,0]=4 5758 B11R1.1111 NC(CC1CC1(F)F)C(=O)O Amb26471124 [0,1,0,1,0,0|1,0,0]=3 5759 B11R1.1111 N[C@@H](CC1CC1(F)F)C(=O)O Amb33036591 [0,1,0,1,0,0|1,0,0]=3 5760 B11R1.1111 N[C@H](CC1CC1(F)F)C(=O)O Amb33308619 [0,1,0,1,0,0|1,0,0]=3 5761 B11R1.1111 O=C(O)C(O)CC1CC1(F)F Amb30030021 [0,1,0,1,0,0|2,0,0]=4 5762 B11R1.1386 CC1(C(=O)O)CCCC1(F)F Amb25223204 [0,1,0,1,0,0|2,0,0]=4 5763 B11R1.1386 CC1(C)CCCC1(C)C(=O)O Amb25806188 [0,1,0,1,0,0|2,0,0]=4 5764 B11R1.1386 CC1(C)CCCC1(N)C(=O)O Amb2695714 [0,1,0,1,0,0|1,0,0]=3 5765 B11R1.1386 CC1(C)CCCC1(O)C(=O)O Amb28202508 [0,1,0,1,0,0|2,0,0]=4 5766 B11R1.1386 CC1(C)COCC1(N)C(=O)O Amb27944406 [0,1,0,1,0,0|2,0,0]=4 5767 B11R1.1386 CC1(C)OCCC1(N)C(=O)O Amb27822912 [0,1,0,1,0,0|2,0,0]=4 5768 B11R1.1386 CC1(O)CCCC1(C)C(=O)O Amb18126142 [0,1,0,1,0,0|2,0,0]=4 5769 B11R2.8 NC1C(O)CN2CCCC12 Amb26331333 [0,0,0,2,0,0|1,0,1]=4 5770 B11R2.8 N[C@@H]1C(=O)O[C@@H]2CCC[C@H]12 Amb27447235 [0,0,0,2,0,0|1,0,0]=3 5771 B11R2.8 N[C@H]1C(=O)O[C@H]2CCC[C@H]21 Amb26603825 [0,0,0,2,0,0|1,0,0]=3 5772 B11R2.8 N[C@H]1C(=O)O[C@H]2CCC[C@H]21 Amb33299442 [0,0,0,2,0,0|1,0,0]=3 5773 B11R2.8 O=C1OC2CCCC2C1Br Amb28364996 [0,0,0,2,0,0|2,0,0]=4 5774 B11R2.8 O=C1O[C@@H]2CCC[C@@H]2[C@H]1Br Amb27782361 [0,0,0,2,0,0|2,0,0]=4 5775 B11R2.357 O=C1NCC2CCCC1N2 Amb33804444 [0,0,0,2,0,0|2,0,0]=4 5776 B11R2.357 O=C1NCC2CCCC1N2 Amb33804625 [0,0,0,2,0,0|2,0,0]=4 5777 B11R2.130 CC1C(=O)CC2CCC1N2 Amb32656003 [0,0,0,2,0,0|2,0,0]=4 5778 B11R2.130 CC1C(=O)CC2CCC1N2 Amb32656004 [0,0,0,2,0,0|2,0,0]=4 5779 B11R2.141 NC(=O)C1CC12CCCN2 Amb27463452 [0,0,0,2,0,0|2,0,0]=4 5780 B11R2.141 O=C(O)C1CC12CCCC2 Amb33530349 [0,0,0,2,0,0|2,0,0]=4 5781 B11R2.141 O=C(O)C1CC12CCCN2 Amb27472084 [0,0,0,2,0,0|1,0,0]=3 5782 B11R2.141 O=C(O)C1OC12CCCC2 Amb27249665 [0,0,0,2,0,0|2,0,0]=4 5783 B11R2.694 NC1C(=O)SC12CCCC2 Amb33330909 [0,0,0,2,0,0|1,1,0]=4 5784 B11R2.694 NC1C(=O)SC12CCCC2 Amb33482810 [0,0,0,2,0,0|1,1,0]=4 5785 B11R2.814 O=C(O)C1CC2CCCC21 Amb24524606 [0,0,0,2,0,0|2,0,0]=4 5786 B11R2.814 O=C(O)C1C[C@H]2CCC[C@@H]12 Amb28196683 [0,0,0,2,0,0|2,0,0]=4 5787 B11R2.814 O=C(O)[C@@H]1C[C@H]2CCO[C@H]21 Amb28059243 [0,0,0,2,0,0|2,0,0]=4 5788 B11R2.845 CC(=O)C1CC2CCC1N2 Amb28050434 [0,0,0,2,0,0|2,0,0]=4 5789 B11R2.845 NC(=O)[C@@H]1C[C@@H]2CC[C@H]1N2 Amb32723446 [0,0,0,2,0,0|2,0,0]=4 5790 B11R2.845 O=C(O)C1CC2CCC1C2 Amb32643951 [0,0,0,2,0,0|2,0,0]=4 5791 B11R2.845 O=C(O)C1CC2CCC1C2 Amb6335820 [0,0,0,2,0,0|2,0,0]=4 5792 B11R2.845 O=C(O)C1CC2CCC1N2 Amb28048880 [0,0,0,2,0,0|1,0,0]=3 5793 B11R2.845 O=C(O)C1CC2CCC1N2 Amb32932453 [0,0,0,2,0,0|1,0,0]=3 5794 B11R2.845 O=C(O)C1CC2CCC1O2 Amb18202638 [0,0,0,2,0,0|2,0,0]=4 5795 B11R2.845 O=C(O)C1CC2CNC1C2 Amb33714481 [0,0,0,2,0,0|1,0,0]=3 5796 B11R2.845 O=C(O)C1CC2CNC1C2 Amb34162363 [0,0,0,2,0,0|1,0,0]=3 5797 B11R2.845 O=C(O)C1C[C@@H]2CC[C@H]1C2 Amb28068735 [0,0,0,2,0,0|2,0,0]=4 5798 B11R2.845 O=C(O)C1NC2C=CC1C2 Amb18832102 [0,0,0,2,0,0|1,0,1]=4 5799 B11R2.845 O=C(O)C1NC2CCC1C2 Amb2796335 [0,0,0,2,0,0|1,0,0]=3 5800 B11R2.845 O=C(O)C1NC2CCC1C2 Amb32665985 [0,0,0,2,0,0|1,0,0]=3 5801 B11R2.845 O=C(O)C1N[C@H]2C=CC1C2 Amb33716016 [0,0,0,2,0,0|1,0,1]=4 5802 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@@H]1O2 Amb28133849 [0,0,0,2,0,0|2,0,0]=4 5803 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@H]1C2 Amb27421974 [0,0,0,2,0,0|2,0,0]=4 5804 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@H]1N2 Amb23385246 [0,0,0,2,0,0|1,0,0]=3 5805 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@H]1O2 Amb24120328 [0,0,0,2,0,0|2,0,0]=4 5806 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1C2 Amb24630346 [0,0,0,2,0,0|2,0,0]=4 5807 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1N2 Amb23385249 [0,0,0,2,0,0|1,0,0]=3 5808 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1N2 Amb27254084 [0,0,0,2,0,0|1,0,0]=3 5809 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1O2 Amb19334556 [0,0,0,2,0,0|2,0,0]=4 5810 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@H]1O2 Amb27963653 [0,0,0,2,0,0|2,0,0]=4 5811 B11R2.845 O=C(O)[C@@H]1NC2C=CC1C2 Amb25693328 [0,0,0,2,0,0|1,0,1]=4 5812 B11R2.845 O=C(O)[C@@H]1NC2CCC1C2 Amb27776982 [0,0,0,2,0,0|1,0,0]=3 5813 B11R2.845 O=C(O)[C@@H]1N[C@@H]2CC[C@H]1C2 Amb24560741 [0,0,0,2,0,0|1,0,0]=3 5814 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 Amb18180724 [0,0,0,2,0,0|1,0,0]=3 5815 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 Amb22748360 [0,0,0,2,0,0|1,0,0]=3 5816 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@H]1C2 Amb22745380 [0,0,0,2,0,0|1,0,0]=3 5817 B11R2.845 O=C(O)[C@H]1CC2CCC1C2 Amb27252127 [0,0,0,2,0,0|2,0,0]=4 5818 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1C2 Amb27420163 [0,0,0,2,0,0|2,0,0]=4 5819 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1N2 Amb27631268 [0,0,0,2,0,0|1,0,0]=3 5820 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1O2 Amb27810803 [0,0,0,2,0,0|2,0,0]=4 5821 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@@H]1C2 Amb24548859 [0,0,0,2,0,0|2,0,0]=4 5822 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@@H]1O2 Amb24681023 [0,0,0,2,0,0|2,0,0]=4 5823 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@H]1O2 Amb25230625 [0,0,0,2,0,0|2,0,0]=4 5824 B11R2.845 O=C(O)[C@H]1NC2C=CC1C2 Amb27147360 [0,0,0,2,0,0|1,0,1]=4 5825 B11R2.845 O=C(O)[C@H]1NC2CCC1C2 Amb26570917 [0,0,0,2,0,0|1,0,0]=3 5826 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@@H]1C2 Amb26546902 [0,0,0,2,0,0|1,0,0]=3 5827 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@@H]1C2 Amb34916347 [0,0,0,2,0,0|1,0,0]=3 5828 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@H]1C2 Amb2371885 [0,0,0,2,0,0|1,0,0]=3 5829 B11R2.1825 O=C(O)C1(F)C2CCCC21 Amb33743731 [0,0,0,2,0,0|2,0,0]=4 5830 B11R2.1825 O=C(O)C1(O)C2CCCC21 Amb27838105 [0,0,0,2,0,0|2,0,0]=4 5831 B11R2.1825 O=C(O)[C@]1(O)[C@H]2CCC[C@H]21 Amb28050108 [0,0,0,2,0,0|2,0,0]=4 5832 B11R2.201 O=C1OC(=O)C2CCC1N2 Amb26355979 [0,0,0,2,0,0|1,0,1]=4 5833 B11R2.221 NCC12CCC(C1)C(=O)N2 Amb32992754 [0,0,0,2,0,0|2,0,0]=4 5834 B11R2.564 O=C(O)C1CC2C(F)C2C1 Amb28056630 [0,0,0,2,0,0|2,0,0]=4 5835 B11R2.587 N[C@@H]1[C@H]2CCC(C(=O)O)[C@H]21 Amb27880917 [0,0,0,2,0,0|1,0,0]=3 5836 B11R2.822 O=C(O)[C@@H]1NC[C@@H]2CC[C@@H]21 Amb33743872 [0,0,0,2,0,0|1,0,0]=3 5837 B11R2.822 O=C(O)[C@@H]1NC[C@@H]2CC[C@@H]21 Amb33803658 [0,0,0,2,0,0|1,0,0]=3 5838 B11R2.822 O=C(O)[C@@H]1NC[C@H]2CC[C@H]21 Amb33714601 [0,0,0,2,0,0|1,0,0]=3 5839 B11R2.822 O=C(O)[C@@H]1NC[C@H]2CC[C@H]21 Amb33803580 [0,0,0,2,0,0|1,0,0]=3 5840 B11R2.822 O=C(O)[C@H]1OC[C@@H]2CC[C@H]12 Amb28203936 [0,0,0,2,0,0|2,0,0]=4 5841 B11R2.842 O=C(O)C1CC2CCC2C1 Amb25256091 [0,0,0,2,0,0|2,0,0]=4 5842 B11R2.842 O=C(O)[C@@H]1C[C@@H]2CC[C@@H]2N1 Amb33714602 [0,0,0,2,0,0|1,0,0]=3 5843 B11R2.1839 NC(=O)C12CCC(CC1)N2 Amb32685257 [0,0,0,2,0,0|2,0,0]=4 5844 B11R2.1839 O=C(O)C12C=CC(CC1)N2 Amb27631647 [0,0,0,2,0,0|1,0,1]=4 5845 B11R2.1839 O=C(O)C12CCC(CC1)C2 Amb3987516 [0,0,0,2,0,0|2,0,0]=4 5846 B11R2.1839 O=C(O)C12CCC(CC1)N2 Amb17719274 [0,0,0,2,0,0|1,0,0]=3 5847 B11R2.1839 O=C(O)C12CCC(CC1)N2 Amb2372047 [0,0,0,2,0,0|1,0,0]=3 5848 B11R2.1839 O=C(O)C12CCC(CC1)O2 Amb23452647 [0,0,0,2,0,0|2,0,0]=4 5849 B11R2.1839 O=C(O)C12CCC(CN1)C2 Amb27876491 [0,0,0,2,0,0|1,0,0]=3 5850 B11R2.1839 O=C(O)C12CCC(CN1)C2 Amb32665852 [0,0,0,2,0,0|1,0,0]=3 5851 B11R2.1839 O=C(O)C12CCC(CO1)C2 Amb33017573 [0,0,0,2,0,0|2,0,0]=4 5852 B11R2.1839 O=C(O)C12CNC(CN1)C2 Amb27225081 [0,0,0,2,0,0|2,0,0]=4 5853 B11R2.1839 O=C(O)C12CNC(CN1)C2 Amb32665962 [0,0,0,2,0,0|2,0,0]=4 5854 B11R2.1839 O=C(O)C12CN[C@H](CN1)C2 Amb26954452 [0,0,0,2,0,0|2,0,0]=4 5855 B11R2.1839 O=C(O)C12CN[C@H](CN1)C2 Amb32662021 [0,0,0,2,0,0|2,0,0]=4 5856 B11R2.1839 O=C(O)C12COC(CN1)C2 Amb34152470 [0,0,0,2,0,0|2,0,0]=4 5857 B11R2.1839 O=C(O)[C@@]12CC[C@@H](CN1)C2 Amb2372048 [0,0,0,2,0,0|1,0,0]=3 5858 B11R2.1839 O=C(O)[C@@]12CC[C@@H](CN1)C2 Amb34164310 [0,0,0,2,0,0|1,0,0]=3 5859 B11R2.1839 O=C(O)[C@]12CC[C@H](CN1)C2 Amb2372049 [0,0,0,2,0,0|1,0,0]=3 5860 B11R2.1839 O=C(O)[C@]12CNC(CN1)C2 Amb28384572 [0,0,0,2,0,0|2,0,0]=4 5861 B11R2.1868 O=C(O)C1CCC2(CC2)C1 Amb28423485 [0,0,0,2,0,0|2,0,0]=4 5862 B11R2.1868 O=C(O)C1CCC2(CC2)N1 Amb28283410 [0,0,0,2,0,0|1,0,0]=3 5863 B11R2.440 O=C(O)C1CC2(C1)CC2F Amb33295163 [0,0,0,2,0,0|2,0,0]=4 5864 B11R2.740 O=C(O)C12CC(C[C@H]1O)C2 Amb27874073 [0,0,0,2,0,0|2,0,0]=4 5865 B11R2.848 O=C(O)C1CC(C2CC2)C1 Amb27798923 [0,0,0,2,0,0|2,0,0]=4 5866 B11R2.1826 NC(=O)C12CC(CCN1)C2 Amb27245125 [0,0,0,2,0,0|2,0,0]=4 5867 B11R2.1826 O=C(O)C12CC(CCN1)C2 Amb24479083 [0,0,0,2,0,0|1,0,0]=3 5868 B11R2.1826 O=C(O)C12CC(CCN1)C2 Amb9677536 [0,0,0,2,0,0|1,0,0]=3 5869 B11R2.1826 O=C(O)C12CCCC(C1)C2 Amb25261064 [0,0,0,2,0,0|2,0,0]=4 5870 B11R2.1867 O=C(O)C1CC2(CCC2)C1 Amb33544314 [0,0,0,2,0,0|2,0,0]=4 5871 B11R2.47 O=C1OC2CCC1CC2Cl Amb27816305 [0,0,0,2,0,0|2,0,0]=4 5872 B11R2.47 O=C1O[C@H]2CC[C@@H]1C[C@@H]2O Amb27630933 [0,0,0,2,0,0|2,0,0]=4 5873 B11R2.411 NC1CC2CC2(C(=O)O)C1 Amb32654399 [0,0,0,2,0,0|1,0,0]=3 5874 B11R2.411 NC1CC2CC2(C(=O)O)C1 Amb32753234 [0,0,0,2,0,0|1,0,0]=3 5875 B11R2.411 N[C@@H]1C[C@H]2C[C@@]2(C(=O)O)C1 Amb32671170 [0,0,0,2,0,0|1,0,0]=3 5876 B11R2.411 N[C@@H]1C[C@H]2C[C@@]2(C(=O)O)C1 Amb32674773 [0,0,0,2,0,0|1,0,0]=3 5877 B11R2.411 O=C1CC2CC2(C(=O)O)N1 Amb24480704 [0,0,0,2,0,0|1,0,1]=4 5878 B11R2.411 O=C1C[C@@H]2C[C@]2(C(=O)O)N1 Amb27784689 [0,0,0,2,0,0|1,0,1]=4 5879 B11R2.530 NC1CCC2C(C(=O)O)C12 Amb26946971 [0,0,0,2,0,0|1,0,0]=3 5880 B11R2.612 NC1CC(C(=O)O)C2CC12 Amb28436938 [0,0,0,2,0,0|1,0,0]=3 5881 B11R2.612 N[C@@H]1C[C@H](C(=O)O)[C@H]2C[C@H]21 Amb27471877 [0,0,0,2,0,0|1,0,0]=3 5882 B11R2.612 N[C@@H]1C[C@H](C(=O)O)[C@H]2C[C@H]21 Amb33097390 [0,0,0,2,0,0|1,0,0]=3 5883 B11R2.612 O=C1N[C@@H](C(=O)O)[C@H]2C[C@@H]12 Amb35752797 [0,0,0,2,0,0|1,0,1]=4 5884 B11R2.818 O=C(O)C12CCCC1(Br)C2 Amb27797171 [0,0,0,2,0,0|2,0,0]=4 5885 B11R2.839 NC(=O)C1CCC2CC2N1 Amb27186297 [0,0,0,2,0,0|2,0,0]=4 5886 B11R2.839 O=C(O)C1CCC2CC2C1 Amb27876727 [0,0,0,2,0,0|2,0,0]=4 5887 B11R2.839 O=C(O)[C@@H]1C[C@@H]2O[C@@H]2CN1 Amb27216871 [0,0,0,2,0,0|2,0,0]=4 5888 B11R2.839 O=C(O)[C@H]1CC[C@H]2O[C@H]2C1 Amb27420168 [0,0,0,2,0,0|2,0,0]=4 5889 B11R2.846 O=C(O)C1CC2CC(C1)N2 Amb28314296 [0,0,0,2,0,0|1,0,0]=3 5890 B11R2.1837 O=C(O)C1CCCC2CC21 Amb26335134 [0,0,0,2,0,0|2,0,0]=4 5891 B11R2.1837 O=C(O)C1CCCC2OC21 Amb26014539 [0,0,0,2,0,0|2,0,0]=4 5892 B11R2.1837 O=C(O)C1NCCC2CC21 Amb24758905 [0,0,0,2,0,0|1,0,0]=3 5893 B11R2.1837 O=C(O)C1NCCC2CC21 Amb33295309 [0,0,0,2,0,0|1,0,0]=3 5894 B11R2.1837 O=C(O)C1NCC[C@@H]2C[C@H]12 Amb34913022 [0,0,0,2,0,0|1,0,0]=3 5895 B11R2.1837 O=C(O)C1NCC[C@H]2C[C@@H]12 Amb34158527 [0,0,0,2,0,0|1,0,0]=3 5896 B11R2.1837 O=C(O)[C@@H]1CCC[C@@H]2O[C@@H]21 Amb27626945 [0,0,0,2,0,0|2,0,0]=4 5897 B11R2.1837 O=C(O)[C@@H]1NCC[C@H]2C[C@H]21 Amb33496159 [0,0,0,2,0,0|1,0,0]=3 5898 B11R2.1837 O=C(O)[C@@H]1NCC[C@H]2C[C@H]21 Amb33496160 [0,0,0,2,0,0|1,0,0]=3 5899 B11R2.1837 O=C(O)[C@H]1CCC[C@@H]2C[C@H]12 Amb27630509 [0,0,0,2,0,0|2,0,0]=4 5900 B11R2.2479 C[C@@]12CC[C@@H]1[C@@]2(C)C(=O)O Amb27205184 [0,0,0,2,0,0|2,0,0]=4 5901 B11R2.119 O=C1CC2CCCC1(O)N2 Amb27411235 [0,0,0,2,0,0|2,0,0]=4 5902 B11R2.355 O=C1O[C@H]([C@H]2CO2)C[C@@H]1O Amb27206565 [0,0,0,2,0,0|2,0,0]=4 5903 B11R2.457 CC1CC1C2CC2C(=O)O Amb32671154 [0,0,0,2,0,0|2,0,0]=4 5904 B11R2.457 CC1CC1[C@@H]2C[C@H]2C(=O)O Amb33144660 [0,0,0,2,0,0|2,0,0]=4 5905 B11R2.540 NC1CCC2CC12C(=O)O Amb27796812 [0,0,0,2,0,0|1,0,0]=3 5906 B11R2.813 NC(=O)C12CNCCC1C2 Amb27670222 [0,0,0,2,0,0|2,0,0]=4 5907 B11R2.813 NC(=O)[C@@]12C[C@@H]1CCCN2 Amb33038428 [0,0,0,2,0,0|2,0,0]=4 5908 B11R2.813 NC(=O)[C@]12C[C@H]1CCCN2 Amb35746877 [0,0,0,2,0,0|2,0,0]=4 5909 B11R2.813 O=C(O)C12CC1CCCN2 Amb24112951 [0,0,0,2,0,0|1,0,0]=3 5910 B11R2.813 O=C(O)C12CC1CCCN2 Amb33714480 [0,0,0,2,0,0|1,0,0]=3 5911 B11R2.813 O=C(O)C12CCCCC1C2 Amb25709012 [0,0,0,2,0,0|2,0,0]=4 5912 B11R2.813 O=C(O)C12CCCCC1O2 Amb26396244 [0,0,0,2,0,0|2,0,0]=4 5913 B11R2.813 O=C(O)C12CNCCC1C2 Amb10610566 [0,0,0,2,0,0|1,0,0]=3 5914 B11R2.813 O=C(O)C12CNCCC1C2 Amb24426368 [0,0,0,2,0,0|1,0,0]=3 5915 B11R2.813 O=C(O)C12CNCCC1O2 Amb28434668 [0,0,0,2,0,0|2,0,0]=4 5916 B11R2.813 O=C(O)[C@@]12CNCC[C@@H]1C2 Amb32662009 [0,0,0,2,0,0|1,0,0]=3 5917 B11R2.813 O=C(O)[C@@]12CNCC[C@@H]1C2 Amb32662022 [0,0,0,2,0,0|1,0,0]=3 5918 B11R2.813 O=C(O)[C@@]12CNCC[C@@H]1O2 Amb27252360 [0,0,0,2,0,0|2,0,0]=4 5919 B11R2.813 O=C(O)[C@@]12CNCC[C@H]1C2 Amb32662007 [0,0,0,2,0,0|1,0,0]=3 5920 B11R2.813 O=C(O)[C@@]12CNCC[C@H]1C2 Amb32662020 [0,0,0,2,0,0|1,0,0]=3 5921 B11R2.813 O=C(O)[C@@]12C[C@@H]1CCCN2 Amb33098529 [0,0,0,2,0,0|1,0,0]=3 5922 B11R2.813 O=C(O)[C@]12CNCC[C@@H]1C2 Amb28429201 [0,0,0,2,0,0|1,0,0]=3 5923 B11R2.813 O=C(O)[C@]12C[C@H]1CCCN2 Amb24609781 [0,0,0,2,0,0|1,0,0]=3 5924 B11R2.813 O=C(O)[C@]12C[C@H]1CCCN2 Amb35746859 [0,0,0,2,0,0|1,0,0]=3 5925 B11R2.817 O=C(O)C1CC1CC2CC2 Amb33361503 [0,0,0,2,0,0|2,0,0]=4 5926 B11R2.817 O=C(O)[C@@H]1C[C@H]1CC2CC2 Amb33361501 [0,0,0,2,0,0|2,0,0]=4 5927 B11R2.951 O=C(O)C1CC12CC2CO Amb27837999 [0,0,0,2,0,0|2,0,0]=4 5928 B11R2.951 O=C(O)[C@@H]1C[C@@]12CC2CO Amb28411313 [0,0,0,2,0,0|2,0,0]=4 5929 B11R2.951 O=C(O)[C@@H]1C[C@@]12C[C@H]2CO Amb28429601 [0,0,0,2,0,0|2,0,0]=4 5930 B11R2.951 O=C(O)[C@H]1C[C@@]12CC2CO Amb27789922 [0,0,0,2,0,0|2,0,0]=4 5931 B11R2.1024 O=C1O[C@H](CCl)C[C@H]2O[C@@H]12 Amb27817804 [0,0,0,2,0,0|2,0,0]=4 5932 B11R2.1024 O=C1O[C@H](CO)C[C@H]2O[C@@H]12 Amb27980384 [0,0,0,2,0,0|2,0,0]=4 5933 B11R2.1836 O=C(O)C1CC1C2CCC2 Amb20622343 [0,0,0,2,0,0|2,0,0]=4 5934 B11R2.1836 O=C(O)[C@@H]1C[C@H]1C2CCC2 Amb27878873 [0,0,0,2,0,0|2,0,0]=4 5935 B11R2.1852 CC(=O)C1C2CCCNC21 Amb27469821 [0,0,0,2,0,0|2,0,0]=4 5936 B11R2.1852 O=C(O)C1C2CCCCC21 Amb9774962 [0,0,0,2,0,0|2,0,0]=4 5937 B11R2.1852 O=C(O)C1C2CCCCN21 Amb32681201 [0,0,0,2,0,0|1,0,0]=3 5938 B11R2.1852 O=C(O)C1C2CCCNC21 Amb18831774 [0,0,0,2,0,0|1,0,0]=3 5939 B11R2.1852 O=C(O)C1C2CCCOC21 Amb9677556 [0,0,0,2,0,0|2,0,0]=4 5940 B11R2.1852 O=C(O)C1[C@H]2CCCO[C@@H]12 Amb28135263 [0,0,0,2,0,0|2,0,0]=4 5941 B11R2.1852 O=C(O)C1[C@H]2CCCS[C@@H]12 Amb27403707 [0,0,0,2,0,0|2,0,0]=4 5942 B11R2.1852 O=C(O)[C@@H]1[C@H]2CCCC[C@H]21 Amb27615049 [0,0,0,2,0,0|2,0,0]=4 5943 B11R2.1852 O=C(O)[C@@H]1[C@H]2CCCO[C@H]21 Amb27784643 [0,0,0,2,0,0|2,0,0]=4 5944 B11R2.1852 O=C(O)[C@H]1[C@@H]2CCCO[C@@H]21 Amb25296387 [0,0,0,2,0,0|2,0,0]=4 5945 B11R2.1852 O=C(O)[C@H]1[C@H]2CCCO[C@@H]12 Amb27784682 [0,0,0,2,0,0|2,0,0]=4 5946 B11R2.849 NC1(C(=O)O)CCC2CC21 Amb19148505 [0,0,0,2,0,0|1,0,0]=3 5947 B11R2.849 NC1(C(=O)O)CCC2CC21 Amb33482905 [0,0,0,2,0,0|1,0,0]=3 5948 B11R2.48 O=C1NC2CCC1CNC2 Amb27405712 [0,0,0,2,0,0|2,0,0]=4 5949 B11R2.48 O=C1N[C@@H]2CC[C@H]1CNC2 Amb28290884 [0,0,0,2,0,0|2,0,0]=4 5950 B11R2.48 O=C1N[C@H]2CC[C@@H]1CNC2 Amb22757913 [0,0,0,2,0,0|2,0,0]=4 5951 B11R2.679 CC12CCC(CC1)OC2=O Amb27622507 [0,0,0,2,0,0|2,0,0]=4 5952 B11R2.1850 CC1(C(=O)O)CC2CC2C1 Amb25952225 [0,0,0,2,0,0|2,0,0]=4 5953 B11R2.2148 N[C@@H](CC12CC1C2)C(=O)O Amb32640179 [0,0,0,2,0,0|1,0,0]=3 5954 B11R2.820 NC1(C(=O)O)CC2CC1C2 Amb25362310 [0,0,0,2,0,0|1,0,0]=3 5955 B11R2.820 O=C(O)[C@]1(O)CC2CC1C2 Amb27882736 [0,0,0,2,0,0|2,0,0]=4 5956 B11R2.851 NC1(C(=O)O)CC12CCC2 Amb25126310 [0,0,0,2,0,0|1,0,0]=3 5957 B11R2.851 NC1(C(=O)O)CC12CSC2 Amb27793731 [0,0,0,2,0,0|2,0,0]=4 5958 B11R2.851 O=C(O)C1(O)CC12CCC2 Amb28077303 [0,0,0,2,0,0|2,0,0]=4 5959 B11R2.852 C[C@]1(C(=O)O)C[C@@H]1C2CC2 Amb33098445 [0,0,0,2,0,0|2,0,0]=4 5960 B11R2.852 NC1(C(=O)O)CC1C2CC2 Amb27259131 [0,0,0,2,0,0|1,0,0]=3 5961 B11R2.852 N[C@@]1(C(=O)O)C[C@H]1C2CC2 Amb27419976 [0,0,0,2,0,0|1,0,0]=3 5962 B11R2.1875 NC1(C(=O)O)CCC12CC2 Amb28057523 [0,0,0,2,0,0|1,0,0]=3 5963 B11R2.819 O=C(O)C12CCC1CNC2 Amb25688250 [0,0,0,2,0,0|1,0,0]=3 5964 B11R2.819 O=C(O)C12CCC1CNC2 Amb32661276 [0,0,0,2,0,0|1,0,0]=3 5965 B11R2.819 O=C(O)[C@@]12CC[C@@H]1CCN2 Amb31156565 [0,0,0,2,0,0|1,0,0]=3 5966 B11R2.819 O=C(O)[C@@]12CC[C@@H]1CCN2 Amb33044344 [0,0,0,2,0,0|1,0,0]=3 5967 B11R2.819 O=C(O)[C@]12CC[C@H]1CCN2 Amb35745854 [0,0,0,2,0,0|1,0,0]=3 5968 B11R2.819 O=C(O)[C@]12CC[C@H]1CNC2 Amb32992853 [0,0,0,2,0,0|1,0,0]=3 5969 B11R2.819 O=C(O)[C@]12CC[C@H]1CNC2 Amb33482775 [0,0,0,2,0,0|1,0,0]=3 5970 B11R0.46 CCCCCC(C)CCC(=O)O Amb10807482 [0,0,0,0,0,2|2,0,0]=4