0 B8R0.8 C#CCCC(C)C(=O)O Amb27464960 [0,0,0,0,0,0|2,0,1]=3 1 B8R0.8 C#CCCC(C)C(N)=O Amb28341068 [0,0,0,0,0,0|3,0,1]=4 2 B8R0.8 C#CCCC(N)C(=O)O Amb6277526 [0,0,0,0,0,0|1,0,1]=2 3 B8R0.8 C#CCCC(N)C(N)=O Amb25703121 [0,0,0,0,0,0|2,0,1]=3 4 B8R0.8 C#CCCC(O)C(N)=O Amb28057741 [0,0,0,0,0,0|3,0,1]=4 5 B8R0.8 C#CCC[C@@H](N)C(=O)O Amb24088809 [0,0,0,0,0,0|1,0,1]=2 6 B8R0.8 C#CCC[C@H](N)C(=O)O Amb24088866 [0,0,0,0,0,0|1,0,1]=2 7 B8R0.8 C#CCC[C@H](N)C(=O)O Amb33744060 [0,0,0,0,0,0|1,0,1]=2 8 B8R0.8 C#CCNC(C)C(=O)O Amb9327029 [0,0,0,0,0,0|3,0,1]=4 9 B8R0.8 C#CCN[C@H](C)C(=O)O Amb27815665 [0,0,0,0,0,0|3,0,1]=4 10 B8R0.8 C#CCOC(C)C(=O)O Amb9208661 [0,0,0,0,0,0|3,0,1]=4 11 B8R0.8 C#CCO[C@H](C)C(=O)O Amb28042909 [0,0,0,0,0,0|3,0,1]=4 12 B8R0.8 C#CCSC(C)C(=O)O Amb6274343 [0,0,0,0,0,0|3,0,1]=4 13 B8R0.8 C=C(Br)C(O)CCCC Amb27978217 [0,0,0,0,0,0|4,0,0]=4 14 B8R0.8 C=C(C)C(Cl)CCCC Amb27433963 [0,0,0,0,0,0|4,0,0]=4 15 B8R0.8 C=C(C)C(N)CSCC Amb27252910 [0,0,0,0,0,0|4,0,0]=4 16 B8R0.8 C=C(C)C(O)CCCC Amb4037317 [0,0,0,0,0,0|4,0,0]=4 17 B8R0.8 C=C(C)C(O)CCOC Amb27844656 [0,0,0,0,0,0|3,1,0]=4 18 B8R0.8 C=C(C)[C@H](O)CCCC Amb28205959 [0,0,0,0,0,0|4,0,0]=4 19 B8R0.8 C=C(CCCC)C(=O)O Amb18642649 [0,0,0,0,0,0|2,0,1]=3 20 B8R0.8 C=C(CCCC)C(C)=O Amb27260457 [0,0,0,0,0,0|3,0,1]=4 21 B8R0.8 C=C(CCCO)C(=O)O Amb28313844 [0,0,0,0,0,0|3,0,1]=4 22 B8R0.8 C=C(CCOC)C(=O)O Amb26588153 [0,0,0,0,0,0|1,1,1]=3 23 B8R0.8 C=C(CCSC)C(=O)O Amb27188177 [0,0,0,0,0,0|1,0,1]=2 24 B8R0.8 C=C(COCC)C(=O)O Amb27444042 [0,0,0,0,0,0|3,0,1]=4 25 B8R0.8 C=C(CSCC)C(=O)O Amb26023918 [0,0,0,0,0,0|3,0,1]=4 26 B8R0.8 C=C(OCOC)C(=O)O Amb27467648 [0,0,0,0,0,0|2,1,1]=4 27 B8R0.8 C=C=CCC(N)C(=O)O Amb25843448 [0,0,0,0,0,0|1,0,2]=3 28 B8R0.8 C=C=CC[C@@H](N)C(=O)O Amb28070890 [0,0,0,0,0,0|1,0,2]=3 29 B8R0.8 C=C=CC[C@@H](N)C(N)=O Amb27623437 [0,0,0,0,0,0|2,0,2]=4 30 B8R0.8 C=CCCC(=O)C(=O)O Amb25738669 [0,0,0,0,0,0|2,0,2]=4 31 B8R0.8 C=CCCC(Br)C(=O)O Amb28047448 [0,0,0,0,0,0|2,0,1]=3 32 B8R0.8 C=CCCC(C)C(=O)O Amb18642656 [0,0,0,0,0,0|2,0,1]=3 33 B8R0.8 C=CCCC(C)C(C)=O Amb27470888 [0,0,0,0,0,0|3,0,1]=4 34 B8R0.8 C=CCCC(N)C(=O)O Amb24383848 [0,0,0,0,0,0|1,0,1]=2 35 B8R0.8 C=CCCC(N)C(=O)O Amb28934988 [0,0,0,0,0,0|1,0,1]=2 36 B8R0.8 C=CCCC(N)C(N)=O Amb24333721 [0,0,0,0,0,0|2,0,1]=3 37 B8R0.8 C=CCC[C@@H](N)C(=O)O Amb23439045 [0,0,0,0,0,0|1,0,1]=2 38 B8R0.8 C=CCC[C@@H](N)C(N)=O Amb27168705 [0,0,0,0,0,0|2,0,1]=3 39 B8R0.8 C=CCC[C@H](N)C(=O)O Amb28285244 [0,0,0,0,0,0|1,0,1]=2 40 B8R0.8 C=CCC[C@H](O)C(=O)O Amb28122952 [0,0,0,0,0,0|2,0,1]=3 41 B8R0.8 C=CCNC(C)C(=O)O Amb9326762 [0,0,0,0,0,0|3,0,1]=4 42 B8R0.8 C=CCOC(C)C(=O)O Amb9208699 [0,0,0,0,0,0|3,0,1]=4 43 B8R0.8 C=CCSC(C)C(=O)O Amb6273705 [0,0,0,0,0,0|3,0,1]=4 44 B8R0.8 C=CSCC(N)C(=O)O Amb28321669 [0,0,0,0,0,0|2,0,1]=3 45 B8R0.8 C=C\C=C\[C@H](N)C(=O)O Amb28324791 [0,0,0,0,0,0|1,0,3]=4 46 B8R0.8 CC#CCC(C)C(=O)O Amb28281174 [0,0,0,0,0,0|2,0,1]=3 47 B8R0.8 CC#CCC(C)C(C)=O Amb28049063 [0,0,0,0,0,0|3,0,1]=4 48 B8R0.8 CC#CCC(N)C(=O)O Amb18988250 [0,0,0,0,0,0|1,0,1]=2 49 B8R0.8 CC#CCC(N)C(=O)O Amb33551077 [0,0,0,0,0,0|1,0,1]=2 50 B8R0.8 CC#CCC(N)C(N)=O Amb25793338 [0,0,0,0,0,0|2,0,1]=3 51 B8R0.8 CC#CC[C@@H](N)C(=O)O Amb22746783 [0,0,0,0,0,0|1,0,1]=2 52 B8R0.8 CC#CC[C@H](N)C(=O)O Amb27815040 [0,0,0,0,0,0|1,0,1]=2 53 B8R0.8 CC(=O)C(C)CCC#N Amb8394545 [0,0,0,0,0,0|4,0,0]=4 54 B8R0.8 CC(=O)C(C)CCCF Amb27593343 [0,0,0,0,0,0|4,0,0]=4 55 B8R0.8 CC(=O)C(C)CCCO Amb27628329 [0,0,0,0,0,0|4,0,0]=4 56 B8R0.8 CC(=O)C(Cl)CCCO Amb27860344 [0,0,0,0,0,0|4,0,0]=4 57 B8R0.8 CC(=O)C(O)CCC=O Amb25965289 [0,0,0,0,0,0|4,0,0]=4 58 B8R0.8 CC(=O)N(N)CCCN Amb27404575 [0,0,0,0,0,0|4,0,0]=4 59 B8R0.8 CC(=O)[C@@H](N)CCCO Amb27835141 [0,0,0,0,0,0|3,0,0]=3 60 B8R0.8 CC(CCC#N)C(=O)O Amb24462559 [0,0,0,0,0,0|3,0,0]=3 61 B8R0.8 CC(CCCCl)C(=O)O Amb2720283 [0,0,0,0,0,0|3,0,0]=3 62 B8R0.8 CC(CCCF)C(=O)O Amb25244585 [0,0,0,0,0,0|3,0,0]=3 63 B8R0.8 CC(CCCN)C(=O)O Amb25146072 [0,0,0,0,0,0|3,0,0]=3 64 B8R0.8 CC(CCCN)C(=O)O Amb32686960 [0,0,0,0,0,0|3,0,0]=3 65 B8R0.8 CC(CCCN)C(N)=O Amb27667997 [0,0,0,0,0,0|4,0,0]=4 66 B8R0.8 CC(CN=C=O)C(=O)O Amb33471309 [0,0,0,0,0,0|4,0,0]=4 67 B8R0.8 CC(CN=C=S)C(=O)O Amb33471538 [0,0,0,0,0,0|4,0,0]=4 68 B8R0.8 CC(CNC#N)C(=O)O Amb35634505 [0,0,0,0,0,0|4,0,0]=4 69 B8R0.8 CC(C\C=N\O)C(=O)O Amb27217284 [0,0,0,0,0,0|3,0,1]=4 70 B8R0.8 CC(NCCS)C(=O)O Amb28057720 [0,0,0,0,0,0|4,0,0]=4 71 B8R0.8 CC(OCC#N)C(=O)O Amb27465969 [0,0,0,0,0,0|4,0,0]=4 72 B8R0.8 CC(OCCF)C(=O)O Amb27240801 [0,0,0,0,0,0|4,0,0]=4 73 B8R0.8 CC(OCCN)C(=O)O Amb22546285 [0,0,0,0,0,0|4,0,0]=4 74 B8R0.8 CC(OCCO)C(=O)O Amb6680915 [0,0,0,0,0,0|4,0,0]=4 75 B8R0.8 CC(OCCS)C(=O)O Amb27857332 [0,0,0,0,0,0|4,0,0]=4 76 B8R0.8 CC(SCC#N)C(=O)O Amb6260833 [0,0,0,0,0,0|4,0,0]=4 77 B8R0.8 CC(SCCCl)C(=O)O Amb27404902 [0,0,0,0,0,0|4,0,0]=4 78 B8R0.8 CC(SCCN)C(=O)O Amb17500447 [0,0,0,0,0,0|4,0,0]=4 79 B8R0.8 CCCCC(=O)C(=O)O Amb18642761 [0,0,0,0,0,0|2,0,1]=3 80 B8R0.8 CCCCC(=O)C(=O)[O-] Amb32664416 [0,0,0,0,0,0|2,0,2]=4 81 B8R0.8 CCCCC(=O)C(C)=O Amb2721315 [0,0,0,0,0,0|3,0,1]=4 82 B8R0.8 CCCCC(Br)C(=O)Br Amb22347914 [0,0,0,0,0,0|3,0,0]=3 83 B8R0.8 CCCCC(Br)C(=O)Cl Amb17569836 [0,0,0,0,0,0|3,0,0]=3 84 B8R0.8 CCCCC(Br)C(=O)O Amb9703129 [0,0,0,0,0,0|2,0,0]=2 85 B8R0.8 CCCCC(Br)C(C)O Amb27400344 [0,0,0,0,0,0|3,0,1]=4 86 B8R0.8 CCCCC(Br)C(N)=O Amb19514624 [0,0,0,0,0,0|3,0,0]=3 87 B8R0.8 CCCCC(Br)C(N)=S Amb27239240 [0,0,0,0,0,0|3,1,0]=4 88 B8R0.8 CCCCC(C)C(=O)O Amb3939937 [0,0,0,0,0,0|2,0,0]=2 89 B8R0.8 CCCCC(C)C(C)=O Amb4034582 [0,0,0,0,0,0|3,0,0]=3 90 B8R0.8 CCCCC(C)C(C)O Amb4017613 [0,0,0,0,0,0|3,0,1]=4 91 B8R0.8 CCCCC(C)C(N)=O Amb8504697 [0,0,0,0,0,0|3,0,0]=3 92 B8R0.8 CCCCC(C)S(=O)Cl Amb32720495 [0,0,0,0,0,0|4,0,0]=4 93 B8R0.8 CCCCC(C)S(=O)[O-] Amb32754844 [0,0,0,0,0,0|3,0,1]=4 94 B8R0.8 CCCCC(C)S(N)=O Amb32720496 [0,0,0,0,0,0|4,0,0]=4 95 B8R0.8 CCCCC(C)[N+](=O)[O-] Amb27229455 [0,0,0,0,0,0|3,0,1]=4 96 B8R0.8 CCCCC(Cl)C(=O)O Amb17593750 [0,0,0,0,0,0|2,0,0]=2 97 B8R0.8 CCCCC(Cl)C(N)=O Amb27803407 [0,0,0,0,0,0|3,0,0]=3 98 B8R0.8 CCCCC(F)C(=O)O Amb25238781 [0,0,0,0,0,0|2,0,0]=2 99 B8R0.8 CCCCC(F)C(C)=O Amb27228475 [0,0,0,0,0,0|3,0,0]=3 100 B8R0.8 CCCCC(F)C(N)=O Amb28060527 [0,0,0,0,0,0|3,0,0]=3 101 B8R0.8 CCCCC(N)B(O)O Amb26622066 [0,0,0,0,0,0|2,0,1]=3 102 B8R0.8 CCCCC(N)C(=O)O Amb4134813 [0,0,0,0,0,0|1,0,0]=1 103 B8R0.8 CCCCC(N)C(C)=O Amb1099238 [0,0,0,0,0,0|2,0,0]=2 104 B8R0.8 CCCCC(N)C(C)=O Amb22284085 [0,0,0,0,0,0|2,0,0]=2 105 B8R0.8 CCCCC(N)C(C)O Amb24351619 [0,0,0,0,0,0|2,0,1]=3 106 B8R0.8 CCCCC(N)C(C)O Amb28935013 [0,0,0,0,0,0|2,0,1]=3 107 B8R0.8 CCCCC(N)C(F)F Amb27852425 [0,0,0,0,0,0|3,0,1]=4 108 B8R0.8 CCCCC(N)C(N)=O Amb18303664 [0,0,0,0,0,0|2,0,0]=2 109 B8R0.8 CCCCC(N)[PH](=O)O Amb27863480 [0,0,0,0,0,0|2,0,0]=2 110 B8R0.8 CCCCC(O)C(=O)O Amb3941634 [0,0,0,0,0,0|2,0,0]=2 111 B8R0.8 CCCCC(O)C(C)=O Amb27877068 [0,0,0,0,0,0|3,0,0]=3 112 B8R0.8 CCCCC(O)C(N)=O Amb24116640 [0,0,0,0,0,0|3,0,0]=3 113 B8R0.8 CCCCC(O)[PH](=O)O Amb27488929 [0,0,0,0,0,0|3,0,0]=3 114 B8R0.8 CCCCC(S)C(=O)O Amb25323873 [0,0,0,0,0,0|2,0,0]=2 115 B8R0.8 CCCCN(C)C(=O)Cl Amb17563097 [0,0,0,0,0,0|4,0,0]=4 116 B8R0.8 CCCCN(C)C(N)=O Amb6245238 [0,0,0,0,0,0|4,0,0]=4 117 B8R0.8 CCCCN(N)C(C)=O Amb33191476 [0,0,0,0,0,0|3,0,0]=3 118 B8R0.8 CCCC[C@@H](C)C(=O)O Amb24590691 [0,0,0,0,0,0|2,0,0]=2 119 B8R0.8 CCCC[C@@H](C)[C@H](C)O Amb27763643 [0,0,0,0,0,0|3,0,1]=4 120 B8R0.8 CCCC[C@@H](Cl)B(O)O Amb27657838 [0,0,0,0,0,0|3,0,1]=4 121 B8R0.8 CCCC[C@@H](Cl)C(=O)O Amb27471038 [0,0,0,0,0,0|2,0,0]=2 122 B8R0.8 CCCC[C@@H](N)C(=O)O Amb1995006 [0,0,0,0,0,0|1,0,0]=1 123 B8R0.8 CCCC[C@H](Br)C(=O)O Amb28385588 [0,0,0,0,0,0|2,0,0]=2 124 B8R0.8 CCCC[C@H](C)C(=O)O Amb25850678 [0,0,0,0,0,0|2,0,0]=2 125 B8R0.8 CCCC[C@H](Cl)C(=O)Cl Amb28291526 [0,0,0,0,0,0|3,0,0]=3 126 B8R0.8 CCCC[C@H](Cl)C(=O)O Amb27955265 [0,0,0,0,0,0|2,0,0]=2 127 B8R0.8 CCCC[C@H](N)C(=O)O Amb1995007 [0,0,0,0,0,0|1,0,0]=1 128 B8R0.8 CCCC[C@H](N)C(N)=O Amb9813732 [0,0,0,0,0,0|2,0,0]=2 129 B8R0.8 CCCC[C@H](O)C(=O)O Amb27626002 [0,0,0,0,0,0|2,0,0]=2 130 B8R0.8 CCCC[C@H](O)[C@@H](C)O Amb28139279 [0,0,0,0,0,0|3,0,1]=4 131 B8R0.8 CCCNC(=O)C(=O)O Amb9303791 [0,0,0,0,0,0|3,0,1]=4 132 B8R0.8 CCCNC(C)C(=O)O Amb9326994 [0,0,0,0,0,0|3,0,0]=3 133 B8R0.8 CCCN[C@H](C)C(=O)O Amb28073462 [0,0,0,0,0,0|3,0,0]=3 134 B8R0.8 CCCOC(=O)C(=O)O Amb28399593 [0,0,0,0,0,0|3,0,1]=4 135 B8R0.8 CCCOC(C)C(=O)O Amb8874518 [0,0,0,0,0,0|3,0,0]=3 136 B8R0.8 CCCOC(C)C(N)=O Amb27424673 [0,0,0,0,0,0|4,0,0]=4 137 B8R0.8 CCCSC(=S)C(=O)O Amb27808849 [0,0,0,0,0,0|3,0,1]=4 138 B8R0.8 CCCSC(C)C(=O)O Amb6274283 [0,0,0,0,0,0|3,0,0]=3 139 B8R0.8 CCCSC(C)C(N)=O Amb28070722 [0,0,0,0,0,0|4,0,0]=4 140 B8R0.8 CCCSC(F)C(=O)O Amb27655346 [0,0,0,0,0,0|3,0,0]=3 141 B8R0.8 CCCSC(N)C(=O)O Amb27865736 [0,0,0,0,0,0|2,0,0]=2 142 B8R0.8 CCCSC(O)C(=O)O Amb27592135 [0,0,0,0,0,0|3,0,0]=3 143 B8R0.8 CCC\C=C(/Br)C(=O)O Amb27816159 [0,0,0,0,0,0|2,0,2]=4 144 B8R0.8 CCC\C=C(/C)C(=O)O Amb10844998 [0,0,0,0,0,0|2,0,2]=4 145 B8R0.8 CCC\C=C(\F)C(=O)O Amb27448669 [0,0,0,0,0,0|2,0,2]=4 146 B8R0.8 CCNCC(C)C(=O)O Amb13952782 [0,0,0,0,0,0|3,0,0]=3 147 B8R0.8 CCNCC(C)C(=O)O Amb9400285 [0,0,0,0,0,0|3,0,0]=3 148 B8R0.8 CCNCC(C)C(N)=O Amb8944545 [0,0,0,0,0,0|4,0,0]=4 149 B8R0.8 CCNCC(O)C(N)=O Amb28049207 [0,0,0,0,0,0|4,0,0]=4 150 B8R0.8 CCOCC(Br)C(=O)O Amb28458425 [0,0,0,0,0,0|3,0,0]=3 151 B8R0.8 CCOCC(C)C(=O)O Amb9172215 [0,0,0,0,0,0|3,0,0]=3 152 B8R0.8 CCOCC(C)C(N)=O Amb28067564 [0,0,0,0,0,0|4,0,0]=4 153 B8R0.8 CCOCC(N)C(=O)O Amb28048685 [0,0,0,0,0,0|2,0,0]=2 154 B8R0.8 CCOCC(N)C(=O)O Amb33542705 [0,0,0,0,0,0|2,0,0]=2 155 B8R0.8 CCOCC(N)C(N)=O Amb26973746 [0,0,0,0,0,0|3,0,0]=3 156 B8R0.8 CCOC[C@@H](C)C(=O)O Amb25790635 [0,0,0,0,0,0|3,0,0]=3 157 B8R0.8 CCOC[C@@H](N)C(=O)O Amb25889733 [0,0,0,0,0,0|2,0,0]=2 158 B8R0.8 CCOC[C@@H](N)C(=O)O Amb30585227 [0,0,0,0,0,0|2,0,0]=2 159 B8R0.8 CCOC[C@@H](O)C(=O)O Amb33347463 [0,0,0,0,0,0|3,0,0]=3 160 B8R0.8 CCOC[C@H](C)C(=O)O Amb10844265 [0,0,0,0,0,0|3,0,0]=3 161 B8R0.8 CCOC[C@H](N)C(=O)O Amb22737184 [0,0,0,0,0,0|2,0,0]=2 162 B8R0.8 CCOC[C@H](N)C(=O)O Amb24478577 [0,0,0,0,0,0|2,0,0]=2 163 B8R0.8 CCSCC(C)C(=O)O Amb9400067 [0,0,0,0,0,0|3,0,0]=3 164 B8R0.8 CCSCC(C)C(C)=O Amb27409600 [0,0,0,0,0,0|4,0,0]=4 165 B8R0.8 CCSCC(N)C(=O)O Amb6257004 [0,0,0,0,0,0|2,0,0]=2 166 B8R0.8 CCSCC(O)C(=O)O Amb27231753 [0,0,0,0,0,0|3,0,0]=3 167 B8R0.8 CCSC[C@H](O)C(=O)O Amb27983830 [0,0,0,0,0,0|3,0,0]=3 168 B8R0.8 CC\C=C\C(C)C(=O)O Amb33172515 [0,0,0,0,0,0|2,0,2]=4 169 B8R0.8 CC\C=C\C(N)C(=O)O Amb33449874 [0,0,0,0,0,0|1,0,2]=3 170 B8R0.8 CC\C=C\C(O)C(=O)O Amb27781864 [0,0,0,0,0,0|2,0,2]=4 171 B8R0.8 CC\C=C\[C@@H](N)C(=O)O Amb27239476 [0,0,0,0,0,0|1,0,2]=3 172 B8R0.8 CNCCC(C)C(N)=O Amb28368198 [0,0,0,0,0,0|3,0,0]=3 173 B8R0.8 CNCCC(N)C(C)C Amb27952651 [0,0,0,0,0,0|3,0,1]=4 174 B8R0.8 CNCCC(N)C(F)F Amb33071732 [0,0,0,0,0,0|3,0,1]=4 175 B8R0.8 CNCCN(C)C(=O)S Amb27473520 [0,0,0,0,0,0|3,1,0]=4 176 B8R0.8 CNCCN(C)C(C)=O Amb20669225 [0,0,0,0,0,0|4,0,0]=4 177 B8R0.8 CNCCN(C)C(N)=O Amb27765294 [0,0,0,0,0,0|4,0,0]=4 178 B8R0.8 CNCCN(C)C(N)=O Amb32674843 [0,0,0,0,0,0|4,0,0]=4 179 B8R0.8 COCCC(=O)C(=O)O Amb27959741 [0,0,0,0,0,0|1,1,1]=3 180 B8R0.8 COCCC(Br)C(=O)Cl Amb27209614 [0,0,0,0,0,0|2,1,0]=3 181 B8R0.8 COCCC(C)C(=O)O Amb18523823 [0,0,0,0,0,0|1,1,0]=2 182 B8R0.8 COCCC(C)S(=O)Cl Amb32720499 [0,0,0,0,0,0|3,1,0]=4 183 B8R0.8 COCCC(C)S(=O)[O-] Amb32754663 [0,0,0,0,0,0|2,1,1]=4 184 B8R0.8 COCCC(C)S(N)=O Amb32720500 [0,0,0,0,0,0|3,1,0]=4 185 B8R0.8 COCCC(Cl)C(=O)Cl Amb28118917 [0,0,0,0,0,0|2,1,0]=3 186 B8R0.8 COCCC(Cl)C(=O)O Amb27424361 [0,0,0,0,0,0|1,1,0]=2 187 B8R0.8 COCCC(N)C(=O)O Amb32675454 [0,0,0,0,0,0|0,1,0]=1 188 B8R0.8 COCCC(N)C(=O)O Amb6281324 [0,0,0,0,0,0|0,1,0]=1 189 B8R0.8 COCCC(N)C(C)C Amb18523844 [0,0,0,0,0,0|2,1,1]=4 190 B8R0.8 COCCC(N)C(F)F Amb33337741 [0,0,0,0,0,0|2,1,1]=4 191 B8R0.8 COCCC(N)C(N)=O Amb18311365 [0,0,0,0,0,0|1,1,0]=2 192 B8R0.8 COCCC(N)C(N)=O Amb32712112 [0,0,0,0,0,0|1,1,0]=2 193 B8R0.8 COCCC(O)C(=O)O Amb27647966 [0,0,0,0,0,0|1,1,0]=2 194 B8R0.8 COCCN(C)C(=O)Cl Amb27595784 [0,0,0,0,0,0|3,1,0]=4 195 B8R0.8 COCCN(C)C(=O)O Amb32677018 [0,0,0,0,0,0|2,1,0]=3 196 B8R0.8 COCCN(C)C(N)=O Amb27475656 [0,0,0,0,0,0|3,1,0]=4 197 B8R0.8 COCC[C@@H](N)C(=O)O Amb16183870 [0,0,0,0,0,0|0,1,0]=1 198 B8R0.8 COCC[C@H](N)C(=O)O Amb16183872 [0,0,0,0,0,0|0,1,0]=1 199 B8R0.8 COCC[C@H](N)C(=O)O Amb24054991 [0,0,0,0,0,0|0,1,0]=1 200 B8R0.8 COCOC(C)C(=O)O Amb28120688 [0,0,0,0,0,0|2,1,0]=3 201 B8R0.8 COCOC(C)C(C)=O Amb24563208 [0,0,0,0,0,0|3,1,0]=4 202 B8R0.8 COCSC(C)C(=O)O Amb28410278 [0,0,0,0,0,0|2,1,0]=3 203 B8R0.8 COCSC(C)C(C)=O Amb28189229 [0,0,0,0,0,0|3,1,0]=4 204 B8R0.8 COC\C=C(\Br)C(=O)O Amb24580462 [0,0,0,0,0,0|1,1,2]=4 205 B8R0.8 COC\C=C(\C)C(=O)O Amb27169036 [0,0,0,0,0,0|1,1,2]=4 206 B8R0.8 COC\C=C(\F)C(=O)O Amb27872029 [0,0,0,0,0,0|1,1,2]=4 207 B8R0.8 CONCC(N)C(N)=O Amb27216151 [0,0,0,0,0,0|2,1,0]=3 208 B8R0.8 CO\C=C\[C@@H](N)C(=O)O Amb27427471 [0,0,0,0,0,0|0,1,2]=3 209 B8R0.8 CPOC[C@H](N)C(=O)O Amb27424475 [0,0,0,0,0,0|2,0,0]=2 210 B8R0.8 CSCCC(=N)C(=O)O Amb27196552 [0,0,0,0,0,0|0,0,2]=2 211 B8R0.8 CSCCC(=O)C(=O)O Amb18643588 [0,0,0,0,0,0|1,0,1]=2 212 B8R0.8 CSCCC(=O)C(N)=O Amb28042492 [0,0,0,0,0,0|2,0,1]=3 213 B8R0.8 CSCCC(C)C(=O)O Amb24739356 [0,0,0,0,0,0|1,0,0]=1 214 B8R0.8 CSCCC(C)C(C)Br Amb28141386 [0,0,0,0,0,0|3,0,1]=4 215 B8R0.8 CSCCC(Cl)C(=O)O Amb27468599 [0,0,0,0,0,0|1,0,0]=1 216 B8R0.8 CSCCC(Cl)C(N)=O Amb18185555 [0,0,0,0,0,0|2,0,0]=2 217 B8R0.8 CSCCC(N)C(=O)O Amb9703095 [0,0,0,0,0,0|0,0,0]=0 218 B8R0.8 CSCCC(N)C(C)=O Amb28388741 [0,0,0,0,0,0|1,0,0]=1 219 B8R0.8 CSCCC(N)C(C)C Amb27763912 [0,0,0,0,0,0|2,0,1]=3 220 B8R0.8 CSCCC(N)C(C)O Amb27655583 [0,0,0,0,0,0|1,0,1]=2 221 B8R0.8 CSCCC(N)C(F)F Amb27635873 [0,0,0,0,0,0|2,0,1]=3 222 B8R0.8 CSCCC(N)C(N)=O Amb17142872 [0,0,0,0,0,0|1,0,0]=1 223 B8R0.8 CSCCC(N)C(N)=O Amb32752921 [0,0,0,0,0,0|1,0,0]=1 224 B8R0.8 CSCCC(O)C(=O)O Amb18304609 [0,0,0,0,0,0|1,0,0]=1 225 B8R0.8 CSCCC(O)C(=O)[O-] Amb8393072 [0,0,0,0,0,0|1,0,1]=2 226 B8R0.8 CSCCC(O)C(F)F Amb25699236 [0,0,0,0,0,0|3,0,1]=4 227 B8R0.8 CSCCC(O)C(N)=O Amb20669403 [0,0,0,0,0,0|2,0,0]=2 228 B8R0.8 CSCC[C@@H](N)C(=O)O Amb2720567 [0,0,0,0,0,0|0,0,0]=0 229 B8R0.8 CSCC[C@@H](N)C(=O)[O-] Amb32414686 [0,0,0,0,0,0|0,0,1]=1 230 B8R0.8 CSCC[C@@H](N)C(N)=O Amb18035930 [0,0,0,0,0,0|1,0,0]=1 231 B8R0.8 CSCC[C@@H](N)C(N)=O Amb22750575 [0,0,0,0,0,0|1,0,0]=1 232 B8R0.8 CSCC[C@@H](O)C(=O)O Amb25124092 [0,0,0,0,0,0|1,0,0]=1 233 B8R0.8 CSCC[C@H](Cl)C(=O)O Amb28286496 [0,0,0,0,0,0|1,0,0]=1 234 B8R0.8 CSCC[C@H](N)C(=O)O Amb5720611 [0,0,0,0,0,0|0,0,0]=0 235 B8R0.8 CSCC[C@H](N)C(C)=O Amb27763449 [0,0,0,0,0,0|1,0,0]=1 236 B8R0.8 CSCC[C@H](N)C(N)=O Amb8390412 [0,0,0,0,0,0|1,0,0]=1 237 B8R0.8 CSCC[C@H](N)C(N)=O Amb9813735 [0,0,0,0,0,0|1,0,0]=1 238 B8R0.8 CSCC[C@H](O)C(=O)O Amb28285270 [0,0,0,0,0,0|1,0,0]=1 239 B8R0.8 CSCOC(C)C(C)O Amb27650395 [0,0,0,0,0,0|3,0,1]=4 240 B8R0.8 CSCOC(N)C(=O)O Amb27634144 [0,0,0,0,0,0|1,0,0]=1 241 B8R0.8 CSCO[C@@H](C)[C@@H](C)O Amb27971809 [0,0,0,0,0,0|3,0,1]=4 242 B8R0.8 CSCO[C@H](N)C(=O)O Amb28183053 [0,0,0,0,0,0|1,0,0]=1 243 B8R0.8 CSOCC(N)C(=O)O Amb28285144 [0,0,0,0,0,0|1,0,0]=1 244 B8R0.8 CSSCC(C)C(=O)O Amb27240302 [0,0,0,0,0,0|2,0,0]=2 245 B8R0.8 CSSC[C@@H](N)C(=O)O Amb28381312 [0,0,0,0,0,0|1,0,0]=1 246 B8R0.8 CSSC[C@H](N)C(=O)O Amb28118786 [0,0,0,0,0,0|1,0,0]=1 247 B8R0.8 CS\C=C/[C@H](N)C(=O)O Amb26006745 [0,0,0,0,0,0|0,0,2]=2 248 B8R0.8 CS\C=C\C(N)C(=O)O Amb27759361 [0,0,0,0,0,0|0,0,2]=2 249 B8R0.8 C[C@@H](CCC#N)C(=O)O Amb27870712 [0,0,0,0,0,0|3,0,0]=3 250 B8R0.8 C[C@@H](CCCN)C(=O)O Amb28314637 [0,0,0,0,0,0|3,0,0]=3 251 B8R0.8 C[C@@H](CN=[N+]=[N-])C(=O)O Amb27955982 [0,0,0,0,0,0|4,0,0]=4 252 B8R0.8 C[C@@H](NCCF)C(=O)O Amb28073998 [0,0,0,0,0,0|4,0,0]=4 253 B8R0.8 C[C@@H](NCCO)C(=O)O Amb26885478 [0,0,0,0,0,0|4,0,0]=4 254 B8R0.8 C[C@@H](OCCF)C(=O)O Amb27763930 [0,0,0,0,0,0|4,0,0]=4 255 B8R0.8 C[C@@H](OCCO)C(=O)O Amb28318043 [0,0,0,0,0,0|4,0,0]=4 256 B8R0.8 C[C@@H](SCCN)C(=O)O Amb27170977 [0,0,0,0,0,0|4,0,0]=4 257 B8R0.8 C[C@H](NCC#N)C(=O)O Amb28079480 [0,0,0,0,0,0|4,0,0]=4 258 B8R0.8 C[C@H](NCCO)C(=O)O Amb28058421 [0,0,0,0,0,0|4,0,0]=4 259 B8R0.8 C[C@H](OCCN)C(=O)O Amb27479935 [0,0,0,0,0,0|4,0,0]=4 260 B8R0.8 C[C@H](OCCO)C(=O)O Amb27398048 [0,0,0,0,0,0|4,0,0]=4 261 B8R0.8 C[Se]CCC(N)C(=O)O Amb8514803 [0,0,0,0,0,0|0,1,0]=1 262 B8R0.8 C[Se]CC[C@@H](N)C(=O)O Amb31031165 [0,0,0,0,0,0|0,1,0]=1 263 B8R0.8 C[Se]CC[C@H](N)C(=O)O Amb8514895 [0,0,0,0,0,0|0,1,0]=1 264 B8R0.8 C\C=C/CC(=O)C(=O)O Amb27450808 [0,0,0,0,0,0|2,0,2]=4 265 B8R0.8 C\C=C\CC(=O)C(=O)O Amb18642583 [0,0,0,0,0,0|2,0,2]=4 266 B8R0.8 C\C=C\CC(C)C(=O)O Amb18642630 [0,0,0,0,0,0|2,0,1]=3 267 B8R0.8 C\C=C\CC(C)C(C)=O Amb27799374 [0,0,0,0,0,0|3,0,1]=4 268 B8R0.8 C\C=C\CC(F)C(=O)O Amb27959670 [0,0,0,0,0,0|2,0,1]=3 269 B8R0.8 C\C=C\CC(N)C(=O)O Amb6256663 [0,0,0,0,0,0|1,0,1]=2 270 B8R0.8 C\C=C\CC(N)C(N)=O Amb26904386 [0,0,0,0,0,0|2,0,1]=3 271 B8R0.8 C\C=C\CC(O)C(C)=O Amb25707027 [0,0,0,0,0,0|3,0,1]=4 272 B8R0.8 C\C=C\C[C@@H](N)C(=O)O Amb33065673 [0,0,0,0,0,0|1,0,1]=2 273 B8R0.8 C\C=C\C[C@H](C)C(=O)O Amb28368854 [0,0,0,0,0,0|2,0,1]=3 274 B8R0.8 C\C=C\C[C@H](C)C(C)=O Amb26891739 [0,0,0,0,0,0|3,0,1]=4 275 B8R0.8 C\C=C\C[C@H](N)C(=O)O Amb27768785 [0,0,0,0,0,0|1,0,1]=2 276 B8R0.8 N#CCCC(Br)C(=O)O Amb27863558 [0,0,0,0,0,0|3,0,0]=3 277 B8R0.8 N#CCCC(N)C(=O)O Amb18642589 [0,0,0,0,0,0|2,0,0]=2 278 B8R0.8 N#CCCC(N)C(N)=O Amb26567424 [0,0,0,0,0,0|3,0,0]=3 279 B8R0.8 N#CCCC(O)C(=O)O Amb28239951 [0,0,0,0,0,0|3,0,0]=3 280 B8R0.8 N#CCCC([AlH5])C(=O)O Amb31132465 [0,0,0,0,0,0|3,0,0]=3 281 B8R0.8 N#CCC[C@@H](N)C(=O)O Amb25063958 [0,0,0,0,0,0|2,0,0]=2 282 B8R0.8 N#CCC[C@H](N)C(=O)O Amb16183912 [0,0,0,0,0,0|2,0,0]=2 283 B8R0.8 N#CCC[C@H](O)C(=O)O Amb28144260 [0,0,0,0,0,0|3,0,0]=3 284 B8R0.8 N#CNCC(O)C(=O)O Amb35634509 [0,0,0,0,0,0|4,0,0]=4 285 B8R0.8 N#CNC[C@H](O)C(=O)O Amb35634507 [0,0,0,0,0,0|4,0,0]=4 286 B8R0.8 N#CSCC(N)C(=O)O Amb17593655 [0,0,0,0,0,0|3,0,0]=3 287 B8R0.8 NC(=O)C(N)CCCF Amb27424739 [0,0,0,0,0,0|3,0,0]=3 288 B8R0.8 NC(=O)C(N)CCCO Amb33066182 [0,0,0,0,0,0|3,0,0]=3 289 B8R0.8 NC(=O)C(N)C\C=C\Cl Amb27860856 [0,0,0,0,0,0|3,0,1]=4 290 B8R0.8 NC(CCCBr)C(=O)O Amb24480263 [0,0,0,0,0,0|2,0,0]=2 291 B8R0.8 NC(CCCCl)B(O)O Amb27491021 [0,0,0,0,0,0|3,0,1]=4 292 B8R0.8 NC(CCCF)C(=O)O Amb25366994 [0,0,0,0,0,0|2,0,0]=2 293 B8R0.8 NC(CCCO)C(=O)O Amb18642915 [0,0,0,0,0,0|2,0,0]=2 294 B8R0.8 NC(CCCO)C(=O)O Amb22900028 [0,0,0,0,0,0|2,0,0]=2 295 B8R0.8 NC(CCCS)C(=O)O Amb27947968 [0,0,0,0,0,0|2,0,0]=2 296 B8R0.8 NC(CCNO)C(=O)O Amb28285114 [0,0,0,0,0,0|2,0,0]=2 297 B8R0.8 NC(CN=C=S)C(=O)O Amb28281778 [0,0,0,0,0,0|3,0,0]=3 298 B8R0.8 NC(C\C=C\Br)C(=O)O Amb27607572 [0,0,0,0,0,0|2,0,1]=3 299 B8R0.8 NC(C\C=C\Cl)C(=O)O Amb33037023 [0,0,0,0,0,0|2,0,1]=3 300 B8R0.8 NCCCC(Br)C(=O)O Amb17595166 [0,0,0,0,0,0|3,0,0]=3 301 B8R0.8 NCCCC(F)C(=O)O Amb27235092 [0,0,0,0,0,0|3,0,0]=3 302 B8R0.8 NCCCC(N)C(=O)O Amb22489477 [0,0,0,0,0,0|2,0,0]=2 303 B8R0.8 NCCCC(N)C(=O)O Amb4006442 [0,0,0,0,0,0|2,0,0]=2 304 B8R0.8 NCCCC(N)C(=O)O Amb9173756 [0,0,0,0,0,0|2,0,0]=2 305 B8R0.8 NCCCC(N)C(=S)S Amb27657930 [0,0,0,0,0,0|2,2,0]=4 306 B8R0.8 NCCCC(N)C(N)=O Amb24118008 [0,0,0,0,0,0|3,0,0]=3 307 B8R0.8 NCCCC(N)[PH](=O)O Amb27645413 [0,0,0,0,0,0|3,0,0]=3 308 B8R0.8 NCCC[C@@H](N)C(=O)O Amb32411789 [0,0,0,0,0,0|2,0,0]=2 309 B8R0.8 NCCC[C@@H](N)C(=O)O Amb6600152 [0,0,0,0,0,0|2,0,0]=2 310 B8R0.8 NCCC[C@@H](N)C(=O)O Amb8390415 [0,0,0,0,0,0|2,0,0]=2 311 B8R0.8 NCCC[C@H](N)C(=O)O Amb20240598 [0,0,0,0,0,0|2,0,0]=2 312 B8R0.8 NCCC[C@H](N)C(=O)O Amb22746434 [0,0,0,0,0,0|2,0,0]=2 313 B8R0.8 NCCC[C@H](N)C(=O)O Amb8513279 [0,0,0,0,0,0|2,0,0]=2 314 B8R0.8 NCCC[C@H](N)C(=O)O Amb8627869 [0,0,0,0,0,0|2,0,0]=2 315 B8R0.8 NCCC[C@H](O)C(=O)O Amb27804309 [0,0,0,0,0,0|3,0,0]=3 316 B8R0.8 NCOCC(N)C(=O)O Amb27429950 [0,0,0,0,0,0|3,0,0]=3 317 B8R0.8 NCOC[C@@H](N)C(=O)O Amb27233969 [0,0,0,0,0,0|3,0,0]=3 318 B8R0.8 NC\C=C\[C@H](N)C(=O)O Amb24580033 [0,0,0,0,0,0|2,0,2]=4 319 B8R0.8 NOCCC(N)C(=O)O Amb17593409 [0,0,0,0,0,0|1,1,0]=2 320 B8R0.8 NOCCC(N)C(=O)O Amb21858490 [0,0,0,0,0,0|1,1,0]=2 321 B8R0.8 NOCC[C@H](N)C(=O)O Amb26346874 [0,0,0,0,0,0|1,1,0]=2 322 B8R0.8 NOCC[C@H](N)C(=O)O Amb33038084 [0,0,0,0,0,0|1,1,0]=2 323 B8R0.8 N[C@@H](CCCCl)C(=O)O Amb27227989 [0,0,0,0,0,0|2,0,0]=2 324 B8R0.8 N[C@@H](CCCF)C(=O)O Amb27223043 [0,0,0,0,0,0|2,0,0]=2 325 B8R0.8 N[C@@H](CCCO)C(=O)O Amb16183887 [0,0,0,0,0,0|2,0,0]=2 326 B8R0.8 N[C@@H](CCNO)C(=O)O Amb24117852 [0,0,0,0,0,0|2,0,0]=2 327 B8R0.8 N[C@@H](CSCO)C(=O)O Amb27470985 [0,0,0,0,0,0|3,0,0]=3 328 B8R0.8 N[C@@H](CSN=O)C(=O)O Amb28182982 [0,0,0,0,0,0|3,0,0]=3 329 B8R0.8 N[C@@H](C\C=C\Cl)C(=O)O Amb33065741 [0,0,0,0,0,0|2,0,1]=3 330 B8R0.8 N[C@H](CCCBr)C(=O)O Amb26080278 [0,0,0,0,0,0|2,0,0]=2 331 B8R0.8 N[C@H](CCCF)C(=O)O Amb26908418 [0,0,0,0,0,0|2,0,0]=2 332 B8R0.8 N[C@H](CCCO)C(=O)O Amb28120579 [0,0,0,0,0,0|2,0,0]=2 333 B8R0.8 N[C@H](CCCO)C(=O)O Amb34913429 [0,0,0,0,0,0|2,0,0]=2 334 B8R0.8 N[C@H](CSN=O)C(=O)O Amb27845439 [0,0,0,0,0,0|3,0,0]=3 335 B8R0.8 N[C@H](C\C=C\Cl)C(=O)O Amb33309034 [0,0,0,0,0,0|2,0,1]=3 336 B8R0.8 O=C(O)C(=O)CCCF Amb33196459 [0,0,0,0,0,0|3,0,1]=4 337 B8R0.8 O=C(O)C(=O)CCCO Amb27470301 [0,0,0,0,0,0|3,0,1]=4 338 B8R0.8 O=C(O)C(=O)CCCO Amb30666618 [0,0,0,0,0,0|3,0,1]=4 339 B8R0.8 O=C(O)C(Br)CCCCl Amb17595866 [0,0,0,0,0,0|3,0,0]=3 340 B8R0.8 O=C(O)C(Br)CCCO Amb28313364 [0,0,0,0,0,0|3,0,0]=3 341 B8R0.8 O=C(O)C(O)CC#CBr Amb27634839 [0,0,0,0,0,0|3,0,1]=4 342 B8R0.8 O=C(O)C(O)CCCF Amb33196454 [0,0,0,0,0,0|3,0,0]=3 343 B8R0.8 O=C(O)C(O)CCCO Amb18642939 [0,0,0,0,0,0|3,0,0]=3 344 B8R0.8 O=C(O)[C@H](F)CN=C=S Amb33471626 [0,0,0,0,0,0|4,0,0]=4 345 B8R0.8 O=C([O-])C(O)CCCO Amb28935028 [0,0,0,0,0,0|3,0,1]=4 346 B8R0.8 O=C=NC[C@@H](F)C(=O)O Amb33037069 [0,0,0,0,0,0|4,0,0]=4 347 B8R0.8 O=CCCC(=O)C(=O)O Amb27882544 [0,0,0,0,0,0|3,0,1]=4 348 B8R0.8 O=CCCC(=O)C(=O)O Amb32670694 [0,0,0,0,0,0|3,0,1]=4 349 B8R0.8 O=CNC[C@@H](O)C(=O)O Amb27637039 [0,0,0,0,0,0|4,0,0]=4 350 B8R0.8 O=COCC(Cl)C(=O)O Amb27477082 [0,0,0,0,0,0|4,0,0]=4 351 B8R0.8 [N-]=[N+]=NCC(N)C(=O)O Amb28342834 [0,0,0,0,0,0|3,0,0]=3 352 B8R0.8 [N-]=[N+]=NCC(N)C(=O)O Amb35752605 [0,0,0,0,0,0|3,0,0]=3 353 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O Amb26007532 [0,0,0,0,0,0|3,0,0]=3 354 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O Amb33734276 [0,0,0,0,0,0|3,0,0]=3 355 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O Amb25072668 [0,0,0,0,0,0|3,0,0]=3 356 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O Amb30586485 [0,0,0,0,0,0|3,0,0]=3 357 B7R0.3 C#CC(C)CCSC Amb33198285 [1,0,0,0,0,0|2,0,1]=4 358 B7R0.3 C#CC(N)CCCC Amb25798992 [1,0,0,0,0,0|2,0,1]=4 359 B7R0.3 C#CC(N)CCOC Amb24679127 [1,0,0,0,0,0|1,1,1]=4 360 B7R0.3 C#CC(N)CCSC Amb27850266 [1,0,0,0,0,0|1,0,1]=3 361 B7R0.3 C#CCCC(C)C=O Amb28054858 [1,0,0,0,0,0|2,0,1]=4 362 B7R0.3 C#CCCC(O)C=O Amb28246623 [1,0,0,0,0,0|2,0,1]=4 363 B7R0.3 C#CCC[C@@H](N)CO Amb32620217 [1,0,0,0,0,0|1,0,2]=4 364 B7R0.3 C#CCC[C@H](N)CO Amb27468137 [1,0,0,0,0,0|1,0,2]=4 365 B7R0.3 C#CCC[C@H](N)CO Amb32620220 [1,0,0,0,0,0|1,0,2]=4 366 B7R0.3 C#C[C@H](N)CCCC Amb27797061 [1,0,0,0,0,0|2,0,1]=4 367 B7R0.3 C=C(C=O)CCCC Amb4025817 [1,0,0,0,0,0|2,0,1]=4 368 B7R0.3 C=C(C=O)CCOC Amb27948778 [1,0,0,0,0,0|1,1,1]=4 369 B7R0.3 C=CC(=O)CCSC Amb25334636 [1,0,0,0,0,0|2,0,1]=4 370 B7R0.3 C=CC(Br)CCCC Amb25758328 [1,0,0,0,0,0|3,0,0]=4 371 B7R0.3 C=CC(C)CCCC Amb22641469 [1,0,0,0,0,0|3,0,0]=4 372 B7R0.3 C=CC(Cl)CCOC Amb25989152 [1,0,0,0,0,0|2,1,0]=4 373 B7R0.3 C=CC(N)CCC=O Amb33036368 [1,0,0,0,0,0|3,0,0]=4 374 B7R0.3 C=CC(N)CCSC Amb28316202 [1,0,0,0,0,0|1,0,0]=2 375 B7R0.3 C=CC(N)COCC Amb27248147 [1,0,0,0,0,0|3,0,0]=4 376 B7R0.3 C=CC(N)CSCC Amb27648478 [1,0,0,0,0,0|3,0,0]=4 377 B7R0.3 C=CC(O)CCOC Amb27868318 [1,0,0,0,0,0|2,1,0]=4 378 B7R0.3 C=CC(O)CCSC Amb28123529 [1,0,0,0,0,0|2,0,0]=3 379 B7R0.3 C=CCCC(C)C=O Amb25100921 [1,0,0,0,0,0|2,0,1]=4 380 B7R0.3 C=CCCC(N)CO Amb33532619 [1,0,0,0,0,0|1,0,2]=4 381 B7R0.3 C=CCCC(O)C=O Amb27863605 [1,0,0,0,0,0|2,0,1]=4 382 B7R0.3 C=CCC[C@H](C)C=O Amb27799770 [1,0,0,0,0,0|2,0,1]=4 383 B7R0.3 C=CCC[C@H](N)CO Amb27390564 [1,0,0,0,0,0|1,0,2]=4 384 B7R0.3 C=C[C@@H](Cl)CCCC Amb27954902 [1,0,0,0,0,0|3,0,0]=4 385 B7R0.3 C=C[C@@H](N)CCCC Amb27477524 [1,0,0,0,0,0|2,0,0]=3 386 B7R0.3 C=C[C@H](Cl)CCCC Amb27590978 [1,0,0,0,0,0|3,0,0]=4 387 B7R0.3 CC#CCC(N)CO Amb26475841 [1,0,0,0,0,0|1,0,2]=4 388 B7R0.3 CC#CC[C@H](N)CO Amb27493024 [1,0,0,0,0,0|1,0,2]=4 389 B7R0.3 CC(C=O)CCC#N Amb26607829 [1,0,0,0,0,0|3,0,0]=4 390 B7R0.3 CC(C=O)CCCBr Amb26526795 [1,0,0,0,0,0|3,0,0]=4 391 B7R0.3 CCC(N)CCNC Amb28048985 [1,0,0,0,0,0|2,0,1]=4 392 B7R0.3 CCC(N)CCOC Amb19016193 [1,0,0,0,0,0|1,1,1]=4 393 B7R0.3 CCC(N)CCSC Amb28048993 [1,0,0,0,0,0|1,0,1]=3 394 B7R0.3 CCCCC(Br)C=O Amb17594581 [1,0,0,0,0,0|2,0,0]=3 395 B7R0.3 CCCCC(C)C=O Amb17593191 [1,0,0,0,0,0|2,0,0]=3 396 B7R0.3 CCCCC(C)CO Amb17593205 [1,0,0,0,0,0|2,0,1]=4 397 B7R0.3 CCCCC(F)C=O Amb27838938 [1,0,0,0,0,0|2,0,0]=3 398 B7R0.3 CCCCC(N)C#N Amb18975861 [1,0,0,0,0,0|2,0,1]=4 399 B7R0.3 CCCCC(N)C=O Amb28422291 [1,0,0,0,0,0|1,0,0]=2 400 B7R0.3 CCCCC(N)CC Amb33527796 [1,0,0,0,0,0|2,0,1]=4 401 B7R0.3 CCCCC(N)CC Amb9031866 [1,0,0,0,0,0|2,0,1]=4 402 B7R0.3 CCCCC(N)CN Amb19009750 [1,0,0,0,0,0|2,0,1]=4 403 B7R0.3 CCCCC(N)CO Amb3939373 [1,0,0,0,0,0|1,0,1]=3 404 B7R0.3 CCCCC(N)CS Amb27961155 [1,0,0,0,0,0|1,1,1]=4 405 B7R0.3 CCCCC(O)CO Amb8390318 [1,0,0,0,0,0|2,0,1]=4 406 B7R0.3 CCCCN(C)C=O Amb26967032 [1,0,0,0,0,0|3,0,0]=4 407 B7R0.3 CCCC[C@@H](Br)CO Amb27658529 [1,0,0,0,0,0|2,0,1]=4 408 B7R0.3 CCCC[C@@H](C)CO Amb27481144 [1,0,0,0,0,0|2,0,1]=4 409 B7R0.3 CCCC[C@@H](F)CO Amb27593926 [1,0,0,0,0,0|2,0,1]=4 410 B7R0.3 CCCC[C@@H](N)CC Amb28461624 [1,0,0,0,0,0|2,0,1]=4 411 B7R0.3 CCCC[C@@H](N)CO Amb8517438 [1,0,0,0,0,0|1,0,1]=3 412 B7R0.3 CCCC[C@H](C)C=O Amb26587628 [1,0,0,0,0,0|2,0,0]=3 413 B7R0.3 CCCC[C@H](C)CO Amb26370424 [1,0,0,0,0,0|2,0,1]=4 414 B7R0.3 CCCC[C@H](F)CO Amb28315208 [1,0,0,0,0,0|2,0,1]=4 415 B7R0.3 CCCC[C@H](N)CO Amb3941478 [1,0,0,0,0,0|1,0,1]=3 416 B7R0.3 CCCC[C@H](S)CO Amb27804425 [1,0,0,0,0,0|2,0,1]=4 417 B7R0.3 CCCC\C(N)=N/O Amb2696577 [1,0,0,0,0,0|2,0,1]=4 418 B7R0.3 CCCC\C(N)=N\O Amb8391665 [1,0,0,0,0,0|2,0,1]=4 419 B7R0.3 CCCSC(C)C=O Amb18124367 [1,0,0,0,0,0|3,0,0]=4 420 B7R0.3 CCOCC(N)CO Amb25890491 [1,0,0,0,0,0|2,0,1]=4 421 B7R0.3 CCOCC(N)CO Amb32666301 [1,0,0,0,0,0|2,0,1]=4 422 B7R0.3 CCOCC(O)C=O Amb27883256 [1,0,0,0,0,0|3,0,0]=4 423 B7R0.3 CCOC[C@@H](N)CO Amb27838360 [1,0,0,0,0,0|2,0,1]=4 424 B7R0.3 CCOC[C@@H](N)CO Amb32653631 [1,0,0,0,0,0|2,0,1]=4 425 B7R0.3 CCSCC(C)C=O Amb27592961 [1,0,0,0,0,0|3,0,0]=4 426 B7R0.3 CCSCC(N)CO Amb18643038 [1,0,0,0,0,0|2,0,1]=4 427 B7R0.3 CCSC[C@@H](N)CO Amb26504944 [1,0,0,0,0,0|2,0,1]=4 428 B7R0.3 CCSC[C@H](N)CO Amb26564857 [1,0,0,0,0,0|2,0,1]=4 429 B7R0.3 CC[C@H](N)CCOC Amb28123823 [1,0,0,0,0,0|1,1,1]=4 430 B7R0.3 CNC(C)CCSC Amb19515468 [1,0,0,0,0,0|3,0,0]=4 431 B7R0.3 CNCCC(C)CO Amb17569900 [1,0,0,0,0,0|2,0,1]=4 432 B7R0.3 CNCC\C(N)=N/O Amb19981296 [1,0,0,0,0,0|2,0,1]=4 433 B7R0.3 CNCC\C(N)=N\O Amb22410480 [1,0,0,0,0,0|2,0,1]=4 434 B7R0.3 COCCC(C)C=O Amb26896518 [1,0,0,0,0,0|1,1,0]=3 435 B7R0.3 COCCC(N)C#N Amb33249714 [1,0,0,0,0,0|1,1,1]=4 436 B7R0.3 COCCC(N)C=O Amb28397866 [1,0,0,0,0,0|0,1,0]=2 437 B7R0.3 COCCC(N)CN Amb19023234 [1,0,0,0,0,0|1,1,1]=4 438 B7R0.3 COCCC(N)CN Amb33309583 [1,0,0,0,0,0|1,1,1]=4 439 B7R0.3 COCCC(N)CO Amb32952892 [1,0,0,0,0,0|0,1,1]=3 440 B7R0.3 COCCC(N)CO Amb33532817 [1,0,0,0,0,0|0,1,1]=3 441 B7R0.3 COCCC(O)CO Amb28128880 [1,0,0,0,0,0|1,1,1]=4 442 B7R0.3 COCC[C@@H](C)C=O Amb28351588 [1,0,0,0,0,0|1,1,0]=3 443 B7R0.3 COCC[C@@H](N)CO Amb33377807 [1,0,0,0,0,0|0,1,1]=3 444 B7R0.3 COCC[C@H](N)CO Amb25937729 [1,0,0,0,0,0|0,1,1]=3 445 B7R0.3 COCC\C(N)=C\O Amb28364926 [1,0,0,0,0,0|0,1,1]=3 446 B7R0.3 COCC\C(N)=N/O Amb19890177 [1,0,0,0,0,0|1,1,1]=4 447 B7R0.3 COCC\C(N)=N/O Amb2696139 [1,0,0,0,0,0|1,1,1]=4 448 B7R0.3 COCC\C(N)=N\O Amb22490466 [1,0,0,0,0,0|1,1,1]=4 449 B7R0.3 COCC\C(N)=N\O Amb8384548 [1,0,0,0,0,0|1,1,1]=4 450 B7R0.3 COCO[C@@H](C)C=O Amb28422010 [1,0,0,0,0,0|2,1,0]=4 451 B7R0.3 CSCCC(C)C#N Amb33198760 [1,0,0,0,0,0|2,0,1]=4 452 B7R0.3 CSCCC(C)C=O Amb26624792 [1,0,0,0,0,0|1,0,0]=2 453 B7R0.3 CSCCC(C)CBr Amb26508349 [1,0,0,0,0,0|2,0,1]=4 454 B7R0.3 CSCCC(C)CCl Amb27870601 [1,0,0,0,0,0|2,0,1]=4 455 B7R0.3 CSCCC(C)CN Amb28291178 [1,0,0,0,0,0|2,0,1]=4 456 B7R0.3 CSCCC(C)NN Amb27391703 [1,0,0,0,0,0|3,0,0]=4 457 B7R0.3 CSCCC(C)ON Amb33198297 [1,0,0,0,0,0|3,0,0]=4 458 B7R0.3 CSCCC(F)CN Amb33198736 [1,0,0,0,0,0|2,0,1]=4 459 B7R0.3 CSCCC(N)CN Amb19003937 [1,0,0,0,0,0|1,0,1]=3 460 B7R0.3 CSCCC(N)CN Amb33291358 [1,0,0,0,0,0|1,0,1]=3 461 B7R0.3 CSCCC(N)CO Amb4036829 [1,0,0,0,0,0|0,0,1]=2 462 B7R0.3 CSCCC(O)CBr Amb25824128 [1,0,0,0,0,0|2,0,1]=4 463 B7R0.3 CSCCC(O)CCl Amb25067893 [1,0,0,0,0,0|2,0,1]=4 464 B7R0.3 CSCCC(O)CF Amb33198282 [1,0,0,0,0,0|2,0,1]=4 465 B7R0.3 CSCCC(O)CN Amb25785761 [1,0,0,0,0,0|2,0,1]=4 466 B7R0.3 CSCCC(O)CO Amb26019209 [1,0,0,0,0,0|1,0,1]=3 467 B7R0.3 CSCC[C@@H](N)CO Amb8516106 [1,0,0,0,0,0|0,0,1]=2 468 B7R0.3 CSCC[C@@H](O)CN Amb26515632 [1,0,0,0,0,0|2,0,1]=4 469 B7R0.3 CSCC[C@H](N)CN Amb26023438 [1,0,0,0,0,0|1,0,1]=3 470 B7R0.3 CSCC[C@H](N)CO Amb2720562 [1,0,0,0,0,0|0,0,1]=2 471 B7R0.3 CSCC[C@H](O)C#N Amb27594841 [1,0,0,0,0,0|2,0,1]=4 472 B7R0.3 CSCC[C@H](O)CN Amb33198735 [1,0,0,0,0,0|2,0,1]=4 473 B7R0.3 CSCC\C(N)=N\O Amb25127504 [1,0,0,0,0,0|1,0,1]=3 474 B7R0.3 CSSCC(C)CO Amb27166642 [1,0,0,0,0,0|2,0,1]=4 475 B7R0.3 C\C=C\CC(C)C=O Amb17593164 [1,0,0,0,0,0|2,0,1]=4 476 B7R0.3 C\C=C\CC(N)CO Amb24625761 [1,0,0,0,0,0|1,0,2]=4 477 B7R0.3 C\C=C\CC(N)CO Amb30585118 [1,0,0,0,0,0|1,0,2]=4 478 B7R0.3 C\C=C\C[C@H](C)C=O Amb27403477 [1,0,0,0,0,0|2,0,1]=4 479 B7R0.3 NC(CO)CCCF Amb28069002 [1,0,0,0,0,0|2,0,1]=4 480 B7R0.3 NC(CO)CCCO Amb18641979 [1,0,0,0,0,0|2,0,1]=4 481 B7R0.3 NCCCC(N)CO Amb27665423 [1,0,0,0,0,0|2,0,1]=4 482 B7R0.3 NCCC[C@H](N)C=O Amb27838296 [1,0,0,0,0,0|2,0,0]=3 483 B7R0.3 NOCC[C@H](N)CO Amb27430113 [1,0,0,0,0,0|1,1,1]=4 484 B7R0.3 N[C@@H](CO)CCCO Amb28254525 [1,0,0,0,0,0|2,0,1]=4 485 B7R0.3 N[C@H](CO)CCCO Amb24117047 [1,0,0,0,0,0|2,0,1]=4 486 B7R0.3 O=CC(Cl)CCCO Amb27831369 [1,0,0,0,0,0|3,0,0]=4 487 B7R0.3 O=CCCC(Cl)C=O Amb27232955 [1,0,0,0,0,0|3,0,0]=4 488 B7R0.3 O=C[C@H](O)CCCO Amb27164637 [1,0,0,0,0,0|3,0,0]=4 489 B7R0.3 [C-]#[N+]C(C)CCSC Amb33198738 [1,0,0,0,0,0|3,0,0]=4 490 B7R0.4 C#CCCCC(=O)Cl Amb2688725 [1,0,0,0,0,0|2,0,1]=4 491 B7R0.4 C#CCCCC(=O)O Amb2721705 [1,0,0,0,0,0|1,0,1]=3 492 B7R0.4 C#CCCCC(C)=O Amb18115312 [1,0,0,0,0,0|2,0,1]=4 493 B7R0.4 C#CCCCC(N)=O Amb27590599 [1,0,0,0,0,0|2,0,1]=4 494 B7R0.4 C#CCNCC(=O)O Amb33551387 [1,0,0,0,0,0|2,0,1]=4 495 B7R0.4 C#CCNCC(=O)O Amb6740302 [1,0,0,0,0,0|2,0,1]=4 496 B7R0.4 C#CCOCC(=O)O Amb9208655 [1,0,0,0,0,0|2,0,1]=4 497 B7R0.4 C#CCSCC(=O)O Amb2372297 [1,0,0,0,0,0|2,0,1]=4 498 B7R0.4 C=C(C)CCCCC Amb6298938 [1,0,0,0,0,0|3,0,0]=4 499 B7R0.4 C=CCCCC(=O)Cl Amb8392411 [1,0,0,0,0,0|2,0,1]=4 500 B7R0.4 C=CCCCC(=O)O Amb3941675 [1,0,0,0,0,0|1,0,1]=3 501 B7R0.4 C=CCCCC(C)=O Amb17593171 [1,0,0,0,0,0|2,0,1]=4 502 B7R0.4 C=CCNCC(=O)O Amb7766404 [1,0,0,0,0,0|2,0,1]=4 503 B7R0.4 C=CCNCC(=O)O Amb8631497 [1,0,0,0,0,0|2,0,1]=4 504 B7R0.4 C=CCOCC(=O)O Amb9208694 [1,0,0,0,0,0|2,0,1]=4 505 B7R0.4 C=CCSCC(=O)O Amb33526723 [1,0,0,0,0,0|2,0,1]=4 506 B7R0.4 C=CNCCC(=O)O Amb27429817 [1,0,0,0,0,0|2,0,1]=4 507 B7R0.4 C=COCCC(=O)O Amb28350126 [1,0,0,0,0,0|2,0,1]=4 508 B7R0.4 CC#CCCC(=O)O Amb3987196 [1,0,0,0,0,0|1,0,1]=3 509 B7R0.4 CC(=O)CCCC#N Amb17106756 [1,0,0,0,0,0|3,0,0]=4 510 B7R0.4 CC(=O)CCCCBr Amb16234126 [1,0,0,0,0,0|3,0,0]=4 511 B7R0.4 CC(=O)CCCCCl Amb3941549 [1,0,0,0,0,0|3,0,0]=4 512 B7R0.4 CC(=O)CCCCF Amb27490855 [1,0,0,0,0,0|3,0,0]=4 513 B7R0.4 CC(=O)CCCCN Amb27401218 [1,0,0,0,0,0|3,0,0]=4 514 B7R0.4 CC(=O)CCCCO Amb10603864 [1,0,0,0,0,0|3,0,0]=4 515 B7R0.4 CCC#CCC(=O)O Amb26515701 [1,0,0,0,0,0|1,0,2]=4 516 B7R0.4 CCCC#CC(=O)O Amb2721706 [1,0,0,0,0,0|1,0,2]=4 517 B7R0.4 CCCCCB(O)O Amb2447470 [1,0,0,0,0,0|2,0,1]=4 518 B7R0.4 CCCCCC(=N)N Amb19890171 [1,0,0,0,0,0|3,0,0]=4 519 B7R0.4 CCCCCC(=N)N Amb2696574 [1,0,0,0,0,0|3,0,0]=4 520 B7R0.4 CCCCCC(=N)N Amb35747068 [1,0,0,0,0,0|3,0,0]=4 521 B7R0.4 CCCCCC(=O)F Amb26061517 [1,0,0,0,0,0|2,0,0]=3 522 B7R0.4 CCCCCC(=O)O Amb3939846 [1,0,0,0,0,0|1,0,0]=2 523 B7R0.4 CCCCCC(=O)[O-] Amb22337624 [1,0,0,0,0,0|1,0,1]=3 524 B7R0.4 CCCCCC(C)=O Amb6608885 [1,0,0,0,0,0|2,0,0]=3 525 B7R0.4 CCCCCC(C)O Amb8383668 [1,0,0,0,0,0|2,0,1]=4 526 B7R0.4 CCCCCC(N)=S Amb6246072 [1,0,0,0,0,0|2,1,0]=4 527 B7R0.4 CCCCCC(O)Cl Amb27232933 [1,0,0,0,0,0|2,0,1]=4 528 B7R0.4 CCCCCC(O)O Amb25921998 [1,0,0,0,0,0|1,0,2]=4 529 B7R0.4 CCCCCN(C)O Amb33428427 [1,0,0,0,0,0|3,0,0]=4 530 B7R0.4 CCCCCS(=O)Cl Amb32720370 [1,0,0,0,0,0|3,0,0]=4 531 B7R0.4 CCCCCS(=O)[O-] Amb32754032 [1,0,0,0,0,0|2,0,1]=4 532 B7R0.4 CCCCCS(C)=O Amb27457494 [1,0,0,0,0,0|3,0,0]=4 533 B7R0.4 CCCCCS(N)=O Amb32720371 [1,0,0,0,0,0|3,0,0]=4 534 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [1,0,0,0,0,0|2,0,1]=4 535 B7R0.4 CCCCC[C@H](C)O Amb8395591 [1,0,0,0,0,0|2,0,1]=4 536 B7R0.4 CCCCC[N+](=O)[O-] Amb22227991 [1,0,0,0,0,0|2,0,1]=4 537 B7R0.4 CCCCNC(=O)Cl Amb24574309 [1,0,0,0,0,0|3,0,0]=4 538 B7R0.4 CCCCNC(C)=O Amb5835711 [1,0,0,0,0,0|3,0,0]=4 539 B7R0.4 CCCCNC(N)=O Amb6663202 [1,0,0,0,0,0|3,0,0]=4 540 B7R0.4 CCCCOC(=O)Cl Amb6608833 [1,0,0,0,0,0|3,0,0]=4 541 B7R0.4 CCCCOC(C)=O Amb6608782 [1,0,0,0,0,0|3,0,0]=4 542 B7R0.4 CCCCOC(N)=O Amb4136361 [1,0,0,0,0,0|3,0,0]=4 543 B7R0.4 CCCCO[PH](=O)O Amb26035392 [1,0,0,0,0,0|3,0,0]=4 544 B7R0.4 CCCCSC(=O)Cl Amb22352826 [1,0,0,0,0,0|3,0,0]=4 545 B7R0.4 CCCNCC(=O)O Amb10609640 [1,0,0,0,0,0|2,0,0]=3 546 B7R0.4 CCCNCC(=O)O Amb1110628 [1,0,0,0,0,0|2,0,0]=3 547 B7R0.4 CCCNCC(C)=O Amb26954588 [1,0,0,0,0,0|3,0,0]=4 548 B7R0.4 CCCNCC(N)=O Amb1124632 [1,0,0,0,0,0|3,0,0]=4 549 B7R0.4 CCCNCC(N)=O Amb28934788 [1,0,0,0,0,0|3,0,0]=4 550 B7R0.4 CCCOCC(=O)Cl Amb27260778 [1,0,0,0,0,0|3,0,0]=4 551 B7R0.4 CCCOCC(=O)O Amb8874504 [1,0,0,0,0,0|2,0,0]=3 552 B7R0.4 CCCOCC(N)=O Amb27844884 [1,0,0,0,0,0|3,0,0]=4 553 B7R0.4 CCCSCC(=O)O Amb1137113 [1,0,0,0,0,0|2,0,0]=3 554 B7R0.4 CCCSCC(C)=O Amb9668676 [1,0,0,0,0,0|3,0,0]=4 555 B7R0.4 CCCSCC(N)=O Amb27424658 [1,0,0,0,0,0|3,0,0]=4 556 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [1,0,0,0,0,0|1,0,2]=4 557 B7R0.4 CCNCCC(=O)O Amb28934794 [1,0,0,0,0,0|2,0,0]=3 558 B7R0.4 CCNCCC(=O)O Amb7766402 [1,0,0,0,0,0|2,0,0]=3 559 B7R0.4 CCNCCC(C)=O Amb18641851 [1,0,0,0,0,0|3,0,0]=4 560 B7R0.4 CCNCCC(N)=O Amb33533384 [1,0,0,0,0,0|3,0,0]=4 561 B7R0.4 CCNCCC(N)=O Amb35749820 [1,0,0,0,0,0|3,0,0]=4 562 B7R0.4 CCNNCC(=O)O Amb28326075 [1,0,0,0,0,0|3,0,0]=4 563 B7R0.4 CCOCCC(=O)Cl Amb20672027 [1,0,0,0,0,0|3,0,0]=4 564 B7R0.4 CCOCCC(=O)O Amb3939859 [1,0,0,0,0,0|2,0,0]=3 565 B7R0.4 CCOCCC(C)=O Amb7764636 [1,0,0,0,0,0|3,0,0]=4 566 B7R0.4 CCSCCC(=O)O Amb6273140 [1,0,0,0,0,0|2,0,0]=3 567 B7R0.4 CCSCCC(C)=O Amb9655821 [1,0,0,0,0,0|3,0,0]=4 568 B7R0.4 CCSCCC(N)=O Amb27258252 [1,0,0,0,0,0|3,0,0]=4 569 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [1,0,0,0,0,0|1,0,2]=4 570 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [1,0,0,0,0,0|1,0,2]=4 571 B7R0.4 CNCC#CC(=O)O Amb27218273 [1,0,0,0,0,0|1,0,2]=4 572 B7R0.4 CNCCCC(=O)O Amb1153115 [1,0,0,0,0,0|1,0,0]=2 573 B7R0.4 CNCCCC(=O)O Amb4521435 [1,0,0,0,0,0|1,0,0]=2 574 B7R0.4 CNCCCC(C)=O Amb27838406 [1,0,0,0,0,0|2,0,0]=3 575 B7R0.4 CNCCCC(C)O Amb17569899 [1,0,0,0,0,0|2,0,1]=4 576 B7R0.4 CNCCCC(N)=O Amb18303611 [1,0,0,0,0,0|2,0,0]=3 577 B7R0.4 CNCCCC(N)=O Amb31307731 [1,0,0,0,0,0|2,0,0]=3 578 B7R0.4 CNCCCS(C)=O Amb27827686 [1,0,0,0,0,0|3,0,0]=4 579 B7R0.4 CNCCC[C@@H](C)O Amb27784601 [1,0,0,0,0,0|2,0,1]=4 580 B7R0.4 CNCCNC(C)=O Amb28934797 [1,0,0,0,0,0|3,0,0]=4 581 B7R0.4 CNCCNC(C)=O Amb9256137 [1,0,0,0,0,0|3,0,0]=4 582 B7R0.4 CNCCNC(N)=O Amb18299975 [1,0,0,0,0,0|3,0,0]=4 583 B7R0.4 CNCCOC(C)=O Amb18124262 [1,0,0,0,0,0|3,0,0]=4 584 B7R0.4 CNCCOC(C)=O Amb33621071 [1,0,0,0,0,0|3,0,0]=4 585 B7R0.4 CNCCOC(N)=O Amb25136928 [1,0,0,0,0,0|3,0,0]=4 586 B7R0.4 CNCCOC(N)=O Amb32693459 [1,0,0,0,0,0|3,0,0]=4 587 B7R0.4 CNC\C=C\C(=O)O Amb25368293 [1,0,0,0,0,0|1,0,2]=4 588 B7R0.4 COCC#CC(=O)O Amb33544473 [1,0,0,0,0,0|0,1,2]=4 589 B7R0.4 COCCCB(O)O Amb27754195 [1,0,0,0,0,0|1,1,1]=4 590 B7R0.4 COCCCC(=N)N Amb19269156 [1,0,0,0,0,0|2,1,0]=4 591 B7R0.4 COCCCC(=N)N Amb6266770 [1,0,0,0,0,0|2,1,0]=4 592 B7R0.4 COCCCC(=O)O Amb6275629 [1,0,0,0,0,0|0,1,0]=2 593 B7R0.4 COCCCC(C)=O Amb9031556 [1,0,0,0,0,0|1,1,0]=3 594 B7R0.4 COCCCC(C)O Amb4020863 [1,0,0,0,0,0|1,1,1]=4 595 B7R0.4 COCCCC(N)=S Amb6270649 [1,0,0,0,0,0|1,2,0]=4 596 B7R0.4 COCCCN(C)O Amb33377831 [1,0,0,0,0,0|2,1,0]=4 597 B7R0.4 COCCCS(=O)Cl Amb26013061 [1,0,0,0,0,0|2,1,0]=4 598 B7R0.4 COCCCS(=O)[O-] Amb27974844 [1,0,0,0,0,0|1,1,1]=4 599 B7R0.4 COCCCS(N)=O Amb32720360 [1,0,0,0,0,0|2,1,0]=4 600 B7R0.4 COCCC[C@@H](C)O Amb33428680 [1,0,0,0,0,0|1,1,1]=4 601 B7R0.4 COCCC[C@H](C)O Amb27396064 [1,0,0,0,0,0|1,1,1]=4 602 B7R0.4 COCCC[N+](=O)[O-] Amb33428678 [1,0,0,0,0,0|1,1,1]=4 603 B7R0.4 COCCNC(C)=O Amb3358082 [1,0,0,0,0,0|2,1,0]=4 604 B7R0.4 COCCNC(N)=O Amb1104938 [1,0,0,0,0,0|2,1,0]=4 605 B7R0.4 COCCOC(=O)Cl Amb2689125 [1,0,0,0,0,0|2,1,0]=4 606 B7R0.4 COCCOC(C)=O Amb4037074 [1,0,0,0,0,0|2,1,0]=4 607 B7R0.4 COCCOC(N)=O Amb25054225 [1,0,0,0,0,0|2,1,0]=4 608 B7R0.4 COCOCC(=O)O Amb28059312 [1,0,0,0,0,0|1,1,0]=3 609 B7R0.4 COCSCC(=O)O Amb27466837 [1,0,0,0,0,0|1,1,0]=3 610 B7R0.4 COC\C=C\C(=O)O Amb33986212 [1,0,0,0,0,0|0,1,2]=4 611 B7R0.4 CSCCCC(=N)N Amb27829199 [1,0,0,0,0,0|2,0,0]=3 612 B7R0.4 CSCCCC(=O)O Amb17503622 [1,0,0,0,0,0|0,0,0]=1 613 B7R0.4 CSCCCC(C)=O Amb25122381 [1,0,0,0,0,0|1,0,0]=2 614 B7R0.4 CSCCCC(C)Br Amb27798199 [1,0,0,0,0,0|2,0,1]=4 615 B7R0.4 CSCCCC(C)C Amb28289938 [1,0,0,0,0,0|2,0,1]=4 616 B7R0.4 CSCCCC(C)N Amb18124381 [1,0,0,0,0,0|2,0,1]=4 617 B7R0.4 CSCCCC(C)O Amb25958947 [1,0,0,0,0,0|1,0,1]=3 618 B7R0.4 CSCCCC(N)=S Amb28048945 [1,0,0,0,0,0|1,1,0]=3 619 B7R0.4 CSCCCN(C)O Amb33198763 [1,0,0,0,0,0|2,0,0]=3 620 B7R0.4 CSCCC[C@@H](C)N Amb33200177 [1,0,0,0,0,0|2,0,1]=4 621 B7R0.4 CSCCC[C@@H](C)O Amb33198286 [1,0,0,0,0,0|1,0,1]=3 622 B7R0.4 CSCCC[C@H](C)N Amb33200176 [1,0,0,0,0,0|2,0,1]=4 623 B7R0.4 CSCCC[C@H](C)O Amb33198288 [1,0,0,0,0,0|1,0,1]=3 624 B7R0.4 CSCCC[N+](=O)[O-] Amb33200220 [1,0,0,0,0,0|1,0,1]=3 625 B7R0.4 CSCCNC(=O)Cl Amb29882959 [1,0,0,0,0,0|2,0,0]=3 626 B7R0.4 CSCCNC(C)=O Amb8504699 [1,0,0,0,0,0|2,0,0]=3 627 B7R0.4 CSCCNC(N)=O Amb27424586 [1,0,0,0,0,0|2,0,0]=3 628 B7R0.4 CSCCNC(N)=S Amb24414359 [1,0,0,0,0,0|2,1,0]=4 629 B7R0.4 CSCCSC(=N)N Amb27984752 [1,0,0,0,0,0|3,0,0]=4 630 B7R0.4 CSCCSC(C)=O Amb27635033 [1,0,0,0,0,0|2,0,0]=3 631 B7R0.4 CSCSCC(=O)O Amb27858824 [1,0,0,0,0,0|1,0,0]=2 632 B7R0.4 CSC\C=C/C(C)=O Amb25713058 [1,0,0,0,0,0|1,0,2]=4 633 B7R0.4 CSC\C=C\C(C)=O Amb33359530 [1,0,0,0,0,0|1,0,2]=4 634 B7R0.4 CSSCCC(=O)O Amb26848465 [1,0,0,0,0,0|1,0,0]=2 635 B7R0.4 CS\C=C\CC(=O)O Amb26656267 [1,0,0,0,0,0|0,0,2]=3 636 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [1,0,0,0,0,0|1,0,1]=3 637 B7R0.4 C\C=C\CCC(C)=O Amb9031579 [1,0,0,0,0,0|2,0,1]=4 638 B7R0.4 N#CCCCC(=O)O Amb33542831 [1,0,0,0,0,0|2,0,0]=3 639 B7R0.4 N#CCSCC(=O)O Amb6243720 [1,0,0,0,0,0|3,0,0]=4 640 B7R0.4 N#CNCCC(=O)O Amb30031691 [1,0,0,0,0,0|3,0,0]=4 641 B7R0.4 NC(=O)CCCCBr Amb27875083 [1,0,0,0,0,0|3,0,0]=4 642 B7R0.4 NC(=O)CCCCCl Amb7782532 [1,0,0,0,0,0|3,0,0]=4 643 B7R0.4 NC(=O)CCCCO Amb3939470 [1,0,0,0,0,0|3,0,0]=4 644 B7R0.4 NC(=O)CCCCS Amb27839239 [1,0,0,0,0,0|3,0,0]=4 645 B7R0.4 NCCCCC(=O)Cl Amb26599615 [1,0,0,0,0,0|3,0,0]=4 646 B7R0.4 NCCCCC(=O)O Amb2780021 [1,0,0,0,0,0|2,0,0]=3 647 B7R0.4 NCCCCC(=O)O Amb3941646 [1,0,0,0,0,0|2,0,0]=3 648 B7R0.4 NCCCCC(=O)O Amb9825855 [1,0,0,0,0,0|2,0,0]=3 649 B7R0.4 NCCCCC(N)=O Amb18641897 [1,0,0,0,0,0|3,0,0]=4 650 B7R0.4 NCCCCC(N)=O Amb33552086 [1,0,0,0,0,0|3,0,0]=4 651 B7R0.4 NCCCCS(=O)O Amb27882127 [1,0,0,0,0,0|3,0,0]=4 652 B7R0.4 NCCCNC(=O)O Amb24093884 [1,0,0,0,0,0|3,0,0]=4 653 B7R0.4 NCCNCC(=O)O Amb17608063 [1,0,0,0,0,0|3,0,0]=4 654 B7R0.4 NCCNCC(=O)O Amb33339058 [1,0,0,0,0,0|3,0,0]=4 655 B7R0.4 NCCOCC(=O)O Amb18630146 [1,0,0,0,0,0|3,0,0]=4 656 B7R0.4 NCCOCC(=O)O Amb33550947 [1,0,0,0,0,0|3,0,0]=4 657 B7R0.4 NCCSCC(=O)O Amb17500446 [1,0,0,0,0,0|3,0,0]=4 658 B7R0.4 NCCSCC(=O)O Amb20622325 [1,0,0,0,0,0|3,0,0]=4 659 B7R0.4 NOCCCC(=O)O Amb10975956 [1,0,0,0,0,0|1,1,0]=3 660 B7R0.4 NOCCCC(=O)O Amb22011795 [1,0,0,0,0,0|1,1,0]=3 661 B7R0.4 NOCCCC(=O)O Amb31283653 [1,0,0,0,0,0|1,1,0]=3 662 B7R0.4 O=C(Cl)CCCCBr Amb2685557 [1,0,0,0,0,0|3,0,0]=4 663 B7R0.4 O=C(Cl)CCCCCl Amb6296596 [1,0,0,0,0,0|3,0,0]=4 664 B7R0.4 O=C(O)CCCCBr Amb6608763 [1,0,0,0,0,0|2,0,0]=3 665 B7R0.4 O=C(O)CCCCCl Amb3940369 [1,0,0,0,0,0|2,0,0]=3 666 B7R0.4 O=C(O)CCCCF Amb26639920 [1,0,0,0,0,0|2,0,0]=3 667 B7R0.4 O=C(O)CCCCO Amb9214971 [1,0,0,0,0,0|2,0,0]=3 668 B7R0.4 O=C(O)CCCCS Amb17503767 [1,0,0,0,0,0|2,0,0]=3 669 B7R0.4 O=C(O)CCCNCl Amb27173950 [1,0,0,0,0,0|2,0,0]=3 670 B7R0.4 O=C(O)CCN=C=S Amb24562253 [1,0,0,0,0,0|3,0,0]=4 671 B7R0.4 O=C(O)CC\C=C\Br Amb25238247 [1,0,0,0,0,0|2,0,1]=4 672 B7R0.4 O=C(O)CC\C=N\O Amb27211579 [1,0,0,0,0,0|2,0,1]=4 673 B7R0.4 O=C(O)CNCCF Amb28076282 [1,0,0,0,0,0|3,0,0]=4 674 B7R0.4 O=C(O)CNCCO Amb9325653 [1,0,0,0,0,0|3,0,0]=4 675 B7R0.4 O=C(O)COCCCl Amb21857870 [1,0,0,0,0,0|3,0,0]=4 676 B7R0.4 O=C(O)COCCF Amb27866609 [1,0,0,0,0,0|3,0,0]=4 677 B7R0.4 O=C(O)COCCO Amb6680914 [1,0,0,0,0,0|3,0,0]=4 678 B7R0.4 O=C(O)CSCCCl Amb18644703 [1,0,0,0,0,0|3,0,0]=4 679 B7R0.4 O=C([O-])CCCCF Amb33527827 [1,0,0,0,0,0|2,0,1]=4 680 B7R0.4 O=C([O-])CCCCO Amb13952763 [1,0,0,0,0,0|2,0,1]=4 681 B7R0.4 O=C([O-])CCCCO Amb22749314 [1,0,0,0,0,0|2,0,1]=4 682 B7R0.4 O=C=NCCC(=O)O Amb26053417 [1,0,0,0,0,0|3,0,0]=4 683 B7R0.4 O=CCCCC(=O)O Amb17593198 [1,0,0,0,0,0|2,0,0]=3 684 B7R0.4 O=CNCCC(=O)O Amb18290434 [1,0,0,0,0,0|3,0,0]=4 685 B7R0.4 O=NSCCC(=O)O Amb28429846 [1,0,0,0,0,0|3,0,0]=4 686 B7R0.4 OC(O)CCCSS Amb27978339 [1,0,0,0,0,0|1,0,2]=4 687 B7R0.4 [N-]=[N+]=NCCC(=O)O Amb20622326 [1,0,0,0,0,0|3,0,0]=4 688 B7R0.5 C#CCC(C)C(=O)O Amb18633959 [1,0,0,0,0,0|1,0,2]=4 689 B7R0.5 C#CCC(N)C(=O)O Amb19944472 [1,0,0,0,0,0|0,0,2]=3 690 B7R0.5 C#CCC(N)C(=O)O Amb9721758 [1,0,0,0,0,0|0,0,2]=3 691 B7R0.5 C#CCC(N)C(C)=O Amb27228190 [1,0,0,0,0,0|1,0,2]=4 692 B7R0.5 C#CCC(N)C(N)=O Amb22059485 [1,0,0,0,0,0|1,0,2]=4 693 B7R0.5 C#CCC(N)C(N)=O Amb33543329 [1,0,0,0,0,0|1,0,2]=4 694 B7R0.5 C#CCC(N)[PH](=O)O Amb27838345 [1,0,0,0,0,0|1,0,2]=4 695 B7R0.5 C#CCC(O)C(=O)O Amb27154881 [1,0,0,0,0,0|1,0,2]=4 696 B7R0.5 C#CC[C@@H](N)C(=O)O Amb16183954 [1,0,0,0,0,0|0,0,2]=3 697 B7R0.5 C#CC[C@@H](N)C(=O)O Amb22748688 [1,0,0,0,0,0|0,0,2]=3 698 B7R0.5 C#CC[C@@H](N)C(N)=O Amb27473309 [1,0,0,0,0,0|1,0,2]=4 699 B7R0.5 C#CC[C@H](C)C(=O)O Amb10844036 [1,0,0,0,0,0|1,0,2]=4 700 B7R0.5 C#CC[C@H](N)C(=O)O Amb8396606 [1,0,0,0,0,0|0,0,2]=3 701 B7R0.5 C#CC[C@H](N)C(N)=O Amb28345609 [1,0,0,0,0,0|1,0,2]=4 702 B7R0.5 C=C(C)C(Cl)CCC Amb28121399 [1,0,0,0,0,0|3,0,0]=4 703 B7R0.5 C=C(C)C(N)CCO Amb27391185 [1,0,0,0,0,0|2,1,0]=4 704 B7R0.5 C=C(C)C(O)CSC Amb27795952 [1,0,0,0,0,0|3,0,0]=4 705 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [1,0,0,0,0,0|1,0,1]=3 706 B7R0.5 C=C(CCF)C(=O)O Amb33480692 [1,0,0,0,0,0|2,0,1]=4 707 B7R0.5 C=C(CCN)C(=O)O Amb27267272 [1,0,0,0,0,0|2,0,1]=4 708 B7R0.5 C=C(CCO)C(=O)O Amb27173904 [1,0,0,0,0,0|1,1,1]=4 709 B7R0.5 C=C(COC)C(=O)O Amb26978134 [1,0,0,0,0,0|1,1,1]=4 710 B7R0.5 C=C(CSC)C(=O)O Amb26953041 [1,0,0,0,0,0|1,0,1]=3 711 B7R0.5 C=C(Cl)C(O)CSC Amb27660824 [1,0,0,0,0,0|3,0,0]=4 712 B7R0.5 C=C(F)C(O)CCC Amb27833609 [1,0,0,0,0,0|3,0,0]=4 713 B7R0.5 C=CCC(C)C(=O)O Amb33545044 [1,0,0,0,0,0|1,0,2]=4 714 B7R0.5 C=CCC(Cl)C(=O)O Amb25056173 [1,0,0,0,0,0|1,0,2]=4 715 B7R0.5 C=CCC(F)C(=O)O Amb28071391 [1,0,0,0,0,0|1,0,2]=4 716 B7R0.5 C=CCC(N)C(=O)Cl Amb27413912 [1,0,0,0,0,0|1,0,2]=4 717 B7R0.5 C=CCC(N)C(=O)O Amb21856826 [1,0,0,0,0,0|0,0,2]=3 718 B7R0.5 C=CCC(N)C(=O)O Amb9729145 [1,0,0,0,0,0|0,0,2]=3 719 B7R0.5 C=CCC(N)C(C)=O Amb27194092 [1,0,0,0,0,0|1,0,2]=4 720 B7R0.5 C=CCC(N)C(N)=O Amb26585896 [1,0,0,0,0,0|1,0,2]=4 721 B7R0.5 C=CC[C@@H](N)C(=O)O Amb22745310 [1,0,0,0,0,0|0,0,2]=3 722 B7R0.5 C=CC[C@@H](N)C(=O)O Amb8389451 [1,0,0,0,0,0|0,0,2]=3 723 B7R0.5 C=CC[C@@H](N)C(N)=O Amb27838370 [1,0,0,0,0,0|1,0,2]=4 724 B7R0.5 C=CC[C@H](N)C(=O)Cl Amb28120452 [1,0,0,0,0,0|1,0,2]=4 725 B7R0.5 C=CC[C@H](N)C(=O)O Amb10982568 [1,0,0,0,0,0|0,0,2]=3 726 B7R0.5 C=CC[C@H](N)C(=O)O Amb2699115 [1,0,0,0,0,0|0,0,2]=3 727 B7R0.5 CC#CC(C)C(=O)O Amb22748425 [1,0,0,0,0,0|1,0,2]=4 728 B7R0.5 CC#CC(O)C(=O)O Amb27451308 [1,0,0,0,0,0|1,0,2]=4 729 B7R0.5 CC(=O)C(Br)CCBr Amb26442822 [1,0,0,0,0,0|3,0,0]=4 730 B7R0.5 CC(=O)C(Br)CCO Amb27858653 [1,0,0,0,0,0|2,1,0]=4 731 B7R0.5 CC(=O)C(C)CCBr Amb26849777 [1,0,0,0,0,0|3,0,0]=4 732 B7R0.5 CC(=O)C(C)CCCl Amb26326637 [1,0,0,0,0,0|3,0,0]=4 733 B7R0.5 CC(=O)C(C)CCO Amb13881368 [1,0,0,0,0,0|2,1,0]=4 734 B7R0.5 CC(=O)C(Cl)CCBr Amb27259779 [1,0,0,0,0,0|3,0,0]=4 735 B7R0.5 CC(=O)C(Cl)CCCl Amb20671951 [1,0,0,0,0,0|3,0,0]=4 736 B7R0.5 CC(=O)C(Cl)CCO Amb4017890 [1,0,0,0,0,0|2,1,0]=4 737 B7R0.5 CC(=O)C(F)CCBr Amb28429129 [1,0,0,0,0,0|3,0,0]=4 738 B7R0.5 CC(=O)C(F)CCCl Amb27390864 [1,0,0,0,0,0|3,0,0]=4 739 B7R0.5 CC(=O)C(N)CCO Amb25087112 [1,0,0,0,0,0|1,1,0]=3 740 B7R0.5 CC(=O)C(S)CCO Amb25831127 [1,0,0,0,0,0|2,1,0]=4 741 B7R0.5 CC(=O)[C@@H](N)CCO Amb28410323 [1,0,0,0,0,0|1,1,0]=3 742 B7R0.5 CC(CC#N)C(=O)O Amb17334056 [1,0,0,0,0,0|2,0,1]=4 743 B7R0.5 CC(CC=O)C(=O)O Amb27952476 [1,0,0,0,0,0|1,1,1]=4 744 B7R0.5 CC(CCBr)C(=O)Br Amb27948455 [1,0,0,0,0,0|3,0,0]=4 745 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [1,0,0,0,0,0|2,0,0]=3 746 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [1,0,0,0,0,0|3,0,0]=4 747 B7R0.5 CC(CCF)C(=O)O Amb24678386 [1,0,0,0,0,0|2,0,0]=3 748 B7R0.5 CC(CCN)C(=O)O Amb20667970 [1,0,0,0,0,0|2,0,0]=3 749 B7R0.5 CC(CCN)C(=O)O Amb538221 [1,0,0,0,0,0|2,0,0]=3 750 B7R0.5 CC(CCO)C(=O)O Amb18641949 [1,0,0,0,0,0|1,1,0]=3 751 B7R0.5 CC(CCO)C(=O)[O-] Amb33330478 [1,0,0,0,0,0|1,1,1]=4 752 B7R0.5 CC(CCO)C(N)=O Amb28280962 [1,0,0,0,0,0|2,1,0]=4 753 B7R0.5 CC(CNO)C(=O)O Amb28315956 [1,0,0,0,0,0|2,1,0]=4 754 B7R0.5 CC(CSS)C(=O)O Amb27437183 [1,0,0,0,0,0|2,0,0]=3 755 B7R0.5 CC(NCO)C(=O)O Amb27468253 [1,0,0,0,0,0|2,1,0]=4 756 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [1,0,0,0,0,0|1,0,1]=3 757 B7R0.5 CCCC(=O)C(C)=O Amb8517524 [1,0,0,0,0,0|2,0,1]=4 758 B7R0.5 CCCC(Br)C(=O)Cl Amb17569837 [1,0,0,0,0,0|2,0,0]=3 759 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [1,0,0,0,0,0|1,0,0]=2 760 B7R0.5 CCCC(Br)C(C)=O Amb26870127 [1,0,0,0,0,0|2,0,0]=3 761 B7R0.5 CCCC(Br)S(C)=O Amb27471989 [1,0,0,0,0,0|3,0,0]=4 762 B7R0.5 CCCC(C)C(=N)N Amb27810844 [1,0,0,0,0,0|3,0,0]=4 763 B7R0.5 CCCC(C)C(=N)N Amb33212650 [1,0,0,0,0,0|3,0,0]=4 764 B7R0.5 CCCC(C)C(=O)Cl Amb2689582 [1,0,0,0,0,0|2,0,0]=3 765 B7R0.5 CCCC(C)C(=O)O Amb3938958 [1,0,0,0,0,0|1,0,0]=2 766 B7R0.5 CCCC(C)C(C)=O Amb4034597 [1,0,0,0,0,0|2,0,0]=3 767 B7R0.5 CCCC(C)C(C)O Amb4036337 [1,0,0,0,0,0|2,0,1]=4 768 B7R0.5 CCCC(C)C(N)=O Amb3886535 [1,0,0,0,0,0|2,0,0]=3 769 B7R0.5 CCCC(C)C(N)=S Amb25138492 [1,0,0,0,0,0|2,1,0]=4 770 B7R0.5 CCCC(C)S(=O)Cl Amb32720536 [1,0,0,0,0,0|3,0,0]=4 771 B7R0.5 CCCC(C)S(=O)[O-] Amb32754802 [1,0,0,0,0,0|2,0,1]=4 772 B7R0.5 CCCC(C)S(N)=O Amb32720511 [1,0,0,0,0,0|3,0,0]=4 773 B7R0.5 CCCC(C)[C@@H](C)O Amb33322347 [1,0,0,0,0,0|2,0,1]=4 774 B7R0.5 CCCC(C)[C@H](C)O Amb33322346 [1,0,0,0,0,0|2,0,1]=4 775 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [1,0,0,0,0,0|1,0,0]=2 776 B7R0.5 CCCC(F)C(=O)O Amb25842008 [1,0,0,0,0,0|1,0,0]=2 777 B7R0.5 CCCC(F)C(C)=O Amb28316211 [1,0,0,0,0,0|2,0,0]=3 778 B7R0.5 CCCC(F)C(N)=O Amb28127390 [1,0,0,0,0,0|2,0,0]=3 779 B7R0.5 CCCC(N)C(=N)N Amb27222841 [1,0,0,0,0,0|2,0,0]=3 780 B7R0.5 CCCC(N)C(=O)O Amb6262055 [1,0,0,0,0,0|0,0,0]=1 781 B7R0.5 CCCC(N)C(C)=O Amb27838289 [1,0,0,0,0,0|1,0,0]=2 782 B7R0.5 CCCC(N)C(C)C Amb9031899 [1,0,0,0,0,0|2,0,1]=4 783 B7R0.5 CCCC(N)C(F)F Amb25355340 [1,0,0,0,0,0|2,0,1]=4 784 B7R0.5 CCCC(N)C(N)=O Amb22284825 [1,0,0,0,0,0|1,0,0]=2 785 B7R0.5 CCCC(N)C(N)=O Amb9514970 [1,0,0,0,0,0|1,0,0]=2 786 B7R0.5 CCCC(N)C(N)=S Amb28121515 [1,0,0,0,0,0|1,1,0]=3 787 B7R0.5 CCCC(O)C(=N)N Amb27881736 [1,0,0,0,0,0|3,0,0]=4 788 B7R0.5 CCCC(O)C(=O)O Amb2818222 [1,0,0,0,0,0|1,0,0]=2 789 B7R0.5 CCCC(O)C(C)=O Amb22495823 [1,0,0,0,0,0|2,0,0]=3 790 B7R0.5 CCCC(O)C(N)=O Amb24116553 [1,0,0,0,0,0|2,0,0]=3 791 B7R0.5 CCCC(S)C(=O)O Amb18124440 [1,0,0,0,0,0|1,0,0]=2 792 B7R0.5 CCCN(C)C(=O)Cl Amb26478280 [1,0,0,0,0,0|3,0,0]=4 793 B7R0.5 CCCN(C)C(N)=O Amb8898960 [1,0,0,0,0,0|3,0,0]=4 794 B7R0.5 CCCN(N)C(C)=O Amb18641903 [1,0,0,0,0,0|2,0,0]=3 795 B7R0.5 CCCN(O)C(N)=O Amb28347092 [1,0,0,0,0,0|3,0,0]=4 796 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [1,0,0,0,0,0|1,0,0]=2 797 B7R0.5 CCC[C@@H](C)C(C)O Amb28187641 [1,0,0,0,0,0|2,0,1]=4 798 B7R0.5 CCC[C@@H](C)[C@@H](C)O Amb27181050 [1,0,0,0,0,0|2,0,1]=4 799 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [1,0,0,0,0,0|1,0,0]=2 800 B7R0.5 CCC[C@@H](Cl)[C@H](C)O Amb27668868 [1,0,0,0,0,0|2,0,1]=4 801 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [1,0,0,0,0,0|0,0,0]=1 802 B7R0.5 CCC[C@@H](N)C(C)=O Amb35659946 [1,0,0,0,0,0|1,0,0]=2 803 B7R0.5 CCC[C@@H](N)C(C)O Amb29849610 [1,0,0,0,0,0|1,0,1]=3 804 B7R0.5 CCC[C@@H](N)C(F)F Amb27806404 [1,0,0,0,0,0|2,0,1]=4 805 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [1,0,0,0,0,0|1,0,0]=2 806 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [1,0,0,0,0,0|1,0,0]=2 807 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [1,0,0,0,0,0|1,0,0]=2 808 B7R0.5 CCC[C@@H](O)[C@@H](C)O Amb27457775 [1,0,0,0,0,0|2,0,1]=4 809 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [1,0,0,0,0,0|1,0,0]=2 810 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [1,0,0,0,0,0|1,0,0]=2 811 B7R0.5 CCC[C@H](C)C(C)=O Amb27463637 [1,0,0,0,0,0|2,0,0]=3 812 B7R0.5 CCC[C@H](C)[C@H](C)O Amb28065150 [1,0,0,0,0,0|2,0,1]=4 813 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [1,0,0,0,0,0|1,0,0]=2 814 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [1,0,0,0,0,0|0,0,0]=1 815 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [1,0,0,0,0,0|0,0,0]=1 816 B7R0.5 CCC[C@H](N)C(C)=O Amb35662324 [1,0,0,0,0,0|1,0,0]=2 817 B7R0.5 CCC[C@H](N)C(C)C Amb27229389 [1,0,0,0,0,0|2,0,1]=4 818 B7R0.5 CCC[C@H](N)C(C)O Amb35664016 [1,0,0,0,0,0|1,0,1]=3 819 B7R0.5 CCC[C@H](N)C(F)F Amb28049026 [1,0,0,0,0,0|2,0,1]=4 820 B7R0.5 CCC[C@H](N)C(N)=O Amb26916392 [1,0,0,0,0,0|1,0,0]=2 821 B7R0.5 CCC[C@H](N)C(N)=O Amb33813498 [1,0,0,0,0,0|1,0,0]=2 822 B7R0.5 CCC[C@H](N)[C@H](C)O Amb27883481 [1,0,0,0,0,0|1,0,1]=3 823 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [1,0,0,0,0,0|1,0,0]=2 824 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [1,0,0,0,0,0|2,0,0]=3 825 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [1,0,0,0,0,0|1,0,0]=2 826 B7R0.5 CCC\[N+](N)=C(/C)N Amb27207661 [1,0,0,0,0,0|3,0,0]=4 827 B7R0.5 CCNC(=O)C(=O)O Amb9303800 [1,0,0,0,0,0|2,0,1]=4 828 B7R0.5 CCNC(C)C(=O)O Amb33527634 [1,0,0,0,0,0|2,0,0]=3 829 B7R0.5 CCNC(C)C(=O)O Amb9326962 [1,0,0,0,0,0|2,0,0]=3 830 B7R0.5 CCNC(C)C(N)=O Amb21959648 [1,0,0,0,0,0|3,0,0]=4 831 B7R0.5 CCNC(C)C(N)=O Amb7758139 [1,0,0,0,0,0|3,0,0]=4 832 B7R0.5 CCNC(O)C(=O)O Amb27259098 [1,0,0,0,0,0|2,0,0]=3 833 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [1,0,0,0,0,0|2,0,0]=3 834 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [1,0,0,0,0,0|2,0,0]=3 835 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [1,0,0,0,0,0|2,0,1]=4 836 B7R0.5 CCOC(C)C(=O)O Amb9725271 [1,0,0,0,0,0|2,0,0]=3 837 B7R0.5 CCOC(C)C(C)=O Amb9666103 [1,0,0,0,0,0|3,0,0]=4 838 B7R0.5 CCOC(C)C(N)=O Amb19960053 [1,0,0,0,0,0|3,0,0]=4 839 B7R0.5 CCOC(Cl)C(=O)Cl Amb27659279 [1,0,0,0,0,0|3,0,0]=4 840 B7R0.5 CCOC(Cl)C(N)=O Amb27468650 [1,0,0,0,0,0|3,0,0]=4 841 B7R0.5 CCOC(F)C(=O)O Amb27210743 [1,0,0,0,0,0|2,0,0]=3 842 B7R0.5 CCSC(=O)C(=O)O Amb28410577 [1,0,0,0,0,0|2,0,1]=4 843 B7R0.5 CCSC(C)C(=O)O Amb9721554 [1,0,0,0,0,0|2,0,0]=3 844 B7R0.5 CCSC(C)C(N)=O Amb27830179 [1,0,0,0,0,0|3,0,0]=4 845 B7R0.5 CCSC(Cl)C(C)=O Amb27862346 [1,0,0,0,0,0|3,0,0]=4 846 B7R0.5 CC\C=C(/C)C(=O)O Amb2689584 [1,0,0,0,0,0|1,0,2]=4 847 B7R0.5 CC\C=C(/F)C(=O)O Amb27968785 [1,0,0,0,0,0|1,0,2]=4 848 B7R0.5 CC\C=C(\C)C(=O)O Amb27233430 [1,0,0,0,0,0|1,0,2]=4 849 B7R0.5 CNCC(C)C(=O)O Amb13952364 [1,0,0,0,0,0|2,0,0]=3 850 B7R0.5 CNCC(C)C(=O)O Amb9400281 [1,0,0,0,0,0|2,0,0]=3 851 B7R0.5 CNCC(C)C(N)=O Amb8943991 [1,0,0,0,0,0|3,0,0]=4 852 B7R0.5 CNCC(N)C(=O)O Amb10845350 [1,0,0,0,0,0|1,0,0]=2 853 B7R0.5 CNCC(O)C(=O)O Amb26894610 [1,0,0,0,0,0|2,0,0]=3 854 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [1,0,0,0,0,0|1,0,0]=2 855 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [1,0,0,0,0,0|1,0,0]=2 856 B7R0.5 COCC(Br)C(=O)Cl Amb27797270 [1,0,0,0,0,0|2,1,0]=4 857 B7R0.5 COCC(Br)C(=O)O Amb17594709 [1,0,0,0,0,0|1,1,0]=3 858 B7R0.5 COCC(C)C(=O)O Amb33545090 [1,0,0,0,0,0|1,1,0]=3 859 B7R0.5 COCC(C)C(C)=O Amb24683449 [1,0,0,0,0,0|2,1,0]=4 860 B7R0.5 COCC(C)C(N)=O Amb27401584 [1,0,0,0,0,0|2,1,0]=4 861 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [1,0,0,0,0,0|1,1,0]=3 862 B7R0.5 COCC(N)C(=O)O Amb33551350 [1,0,0,0,0,0|0,1,0]=2 863 B7R0.5 COCC(N)C(=O)O Amb6752055 [1,0,0,0,0,0|0,1,0]=2 864 B7R0.5 COCC(N)C(C)=O Amb27468401 [1,0,0,0,0,0|1,1,0]=3 865 B7R0.5 COCC(N)C(C)O Amb18124266 [1,0,0,0,0,0|1,1,1]=4 866 B7R0.5 COCC(N)C(N)=O Amb18984372 [1,0,0,0,0,0|1,1,0]=3 867 B7R0.5 COCC(N)C(N)=O Amb32693410 [1,0,0,0,0,0|1,1,0]=3 868 B7R0.5 COCC(O)C(=O)O Amb18124273 [1,0,0,0,0,0|1,1,0]=3 869 B7R0.5 COCC(O)C(N)=O Amb28069186 [1,0,0,0,0,0|2,1,0]=4 870 B7R0.5 COCC(S)C(=O)O Amb27763656 [1,0,0,0,0,0|1,1,0]=3 871 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [1,0,0,0,0,0|1,1,0]=3 872 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [1,0,0,0,0,0|0,1,0]=2 873 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [1,0,0,0,0,0|0,1,0]=2 874 B7R0.5 COC[C@@H](N)[C@H](C)O Amb27843279 [1,0,0,0,0,0|1,1,1]=4 875 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [1,0,0,0,0,0|1,1,0]=3 876 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [1,0,0,0,0,0|0,1,0]=2 877 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [1,0,0,0,0,0|0,1,0]=2 878 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [1,0,0,0,0,0|1,1,0]=3 879 B7R0.5 CON[C@@H](C)C(=O)O Amb27862116 [1,0,0,0,0,0|2,1,0]=4 880 B7R0.5 CO\C=C(\N)C(=O)O Amb27390812 [1,0,0,0,0,0|0,1,2]=4 881 B7R0.5 CSCC(C)C(=O)O Amb18967825 [1,0,0,0,0,0|1,0,0]=2 882 B7R0.5 CSCC(Cl)C(=O)Cl Amb27801927 [1,0,0,0,0,0|2,0,0]=3 883 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [1,0,0,0,0,0|1,0,0]=2 884 B7R0.5 CSCC(N)C(=O)O Amb33804791 [1,0,0,0,0,0|0,0,0]=1 885 B7R0.5 CSCC(N)C(=O)O Amb6280829 [1,0,0,0,0,0|0,0,0]=1 886 B7R0.5 CSCC(N)C(F)F Amb33413040 [1,0,0,0,0,0|2,0,1]=4 887 B7R0.5 CSCC(O)C(=O)O Amb25131873 [1,0,0,0,0,0|1,0,0]=2 888 B7R0.5 CSCC(O)C(C)=O Amb25983211 [1,0,0,0,0,0|2,0,0]=3 889 B7R0.5 CSCC(O)C(N)=O Amb27168145 [1,0,0,0,0,0|2,0,0]=3 890 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [1,0,0,0,0,0|1,0,0]=2 891 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [1,0,0,0,0,0|0,0,0]=1 892 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [1,0,0,0,0,0|0,0,0]=1 893 B7R0.5 CSC[C@H](N)C(N)=O Amb27607700 [1,0,0,0,0,0|1,0,0]=2 894 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [1,0,0,0,0,0|2,0,0]=3 895 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [1,0,0,0,0,0|2,0,0]=3 896 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [1,0,0,0,0,0|2,0,0]=3 897 B7R0.5 C[C@H](NCO)C(=O)O Amb24401217 [1,0,0,0,0,0|2,1,0]=4 898 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [1,0,0,0,0,0|0,1,0]=2 899 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [1,0,0,0,0,0|0,1,0]=2 900 B7R0.5 C\C(=C/CS)C(=O)O Amb28041309 [1,0,0,0,0,0|1,0,2]=4 901 B7R0.5 C\C=C\C(Br)C(=O)O Amb27451575 [1,0,0,0,0,0|1,0,2]=4 902 B7R0.5 C\C=C\C(O)C(=O)O Amb30585115 [1,0,0,0,0,0|1,0,2]=4 903 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [1,0,0,0,0,0|0,0,2]=3 904 B7R0.5 C\C=C\[C@@H](O)C(=O)O Amb28368832 [1,0,0,0,0,0|1,0,2]=4 905 B7R0.5 C\C=C\[C@H](O)C(=O)O Amb27162651 [1,0,0,0,0,0|1,0,2]=4 906 B7R0.5 N#CCC(N)C(=O)O Amb18641766 [1,0,0,0,0,0|1,0,1]=3 907 B7R0.5 N#CCC(N)C(N)=O Amb33308724 [1,0,0,0,0,0|2,0,1]=4 908 B7R0.5 N#CC[C@@H](N)C(=O)O Amb26397494 [1,0,0,0,0,0|1,0,1]=3 909 B7R0.5 N#CC[C@H](N)C(=O)O Amb16183916 [1,0,0,0,0,0|1,0,1]=3 910 B7R0.5 NC(=O)C(Br)CCCl Amb27954931 [1,0,0,0,0,0|3,0,0]=4 911 B7R0.5 NC(=O)C(N)CCF Amb24391278 [1,0,0,0,0,0|2,0,0]=3 912 B7R0.5 NC(=O)C(N)CCO Amb24481392 [1,0,0,0,0,0|1,1,0]=3 913 B7R0.5 NC(=O)C(N)CNO Amb27396201 [1,0,0,0,0,0|2,1,0]=4 914 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [1,0,0,0,0,0|1,0,0]=2 915 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [1,0,0,0,0,0|1,0,0]=2 916 B7R0.5 NC(CCF)C(=O)O Amb25889337 [1,0,0,0,0,0|1,0,0]=2 917 B7R0.5 NC(CCF)C(=O)O Amb28934889 [1,0,0,0,0,0|1,0,0]=2 918 B7R0.5 NC(CCO)C(=O)O Amb8514287 [1,0,0,0,0,0|0,1,0]=2 919 B7R0.5 NC(CCS)C(=O)O Amb19267093 [1,0,0,0,0,0|0,0,0]=1 920 B7R0.5 NC(CCS)C(=O)O Amb3499433 [1,0,0,0,0,0|0,0,0]=1 921 B7R0.5 NC(CCS)[PH](=O)O Amb27409002 [1,0,0,0,0,0|1,0,0]=2 922 B7R0.5 NC(CNO)C(=O)O Amb4092732 [1,0,0,0,0,0|1,1,0]=3 923 B7R0.5 NC(CO[SiH3])C(=O)O Amb27461306 [1,0,0,0,0,0|0,2,0]=3 924 B7R0.5 NC(\C=C\F)C(=O)O Amb27666430 [1,0,0,0,0,0|1,0,2]=4 925 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [1,0,0,0,0,0|2,0,0]=3 926 B7R0.5 NCCC(F)C(=O)O Amb10838221 [1,0,0,0,0,0|2,0,0]=3 927 B7R0.5 NCCC(F)C(=O)O Amb22229524 [1,0,0,0,0,0|2,0,0]=3 928 B7R0.5 NCCC(F)[PH](=O)O Amb27639139 [1,0,0,0,0,0|3,0,0]=4 929 B7R0.5 NCCC(N)C(=O)O Amb2697841 [1,0,0,0,0,0|1,0,0]=2 930 B7R0.5 NCCC(N)C(=O)O Amb8514694 [1,0,0,0,0,0|1,0,0]=2 931 B7R0.5 NCCC(O)C(=O)O Amb16232090 [1,0,0,0,0,0|2,0,0]=3 932 B7R0.5 NCCC(O)C(N)=O Amb28121985 [1,0,0,0,0,0|3,0,0]=4 933 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [1,0,0,0,0,0|2,0,0]=3 934 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [1,0,0,0,0,0|1,0,0]=2 935 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [1,0,0,0,0,0|1,0,0]=2 936 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [1,0,0,0,0,0|1,0,0]=2 937 B7R0.5 NCC[C@@H](N)C(N)=O Amb31031077 [1,0,0,0,0,0|2,0,0]=3 938 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [1,0,0,0,0,0|2,0,0]=3 939 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [1,0,0,0,0,0|2,0,0]=3 940 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [1,0,0,0,0,0|1,0,0]=2 941 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [1,0,0,0,0,0|1,0,0]=2 942 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [1,0,0,0,0,0|1,0,0]=2 943 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [1,0,0,0,0,0|1,0,0]=2 944 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [1,0,0,0,0,0|2,0,0]=3 945 B7R0.5 NCC[C@H](O)C(N)=O Amb27390493 [1,0,0,0,0,0|3,0,0]=4 946 B7R0.5 NOCC(N)C(=O)O Amb24184086 [1,0,0,0,0,0|1,1,0]=3 947 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [1,0,0,0,0,0|1,0,0]=2 948 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [1,0,0,0,0,0|1,0,0]=2 949 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [1,0,0,0,0,0|0,1,0]=2 950 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [1,0,0,0,0,0|0,1,0]=2 951 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [1,0,0,0,0,0|0,0,0]=1 952 B7R0.5 N[C@@H](OCS)C(=O)O Amb27591629 [1,0,0,0,0,0|1,0,0]=2 953 B7R0.5 N[C@@H](\C=C/F)C(=O)O Amb27447269 [1,0,0,0,0,0|1,0,2]=4 954 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [1,0,0,0,0,0|0,1,1]=3 955 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [1,0,0,0,0,0|1,0,0]=2 956 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [1,0,0,0,0,0|1,0,0]=2 957 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [1,0,0,0,0,0|0,1,0]=2 958 B7R0.5 N[C@H](C[SH]=O)C(=O)O Amb27596028 [1,0,0,0,0,0|1,0,1]=3 959 B7R0.5 O=C(Cl)C(Br)CCBr Amb19930045 [1,0,0,0,0,0|3,0,0]=4 960 B7R0.5 O=C(Cl)C(Br)CCCl Amb26515711 [1,0,0,0,0,0|3,0,0]=4 961 B7R0.5 O=C(Cl)C(Cl)CSCl Amb28138021 [1,0,0,0,0,0|3,0,0]=4 962 B7R0.5 O=C(O)C(=O)CCF Amb33377241 [1,0,0,0,0,0|2,0,1]=4 963 B7R0.5 O=C(O)C(=O)CCO Amb25677024 [1,0,0,0,0,0|1,1,1]=4 964 B7R0.5 O=C(O)C(Br)CCBr Amb19889695 [1,0,0,0,0,0|2,0,0]=3 965 B7R0.5 O=C(O)C(Br)CCO Amb28325416 [1,0,0,0,0,0|1,1,0]=3 966 B7R0.5 O=C(O)C(Cl)CCCl Amb18126030 [1,0,0,0,0,0|2,0,0]=3 967 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [1,0,0,0,0,0|2,0,0]=3 968 B7R0.5 O=C(O)C(O)CCF Amb28071189 [1,0,0,0,0,0|2,0,0]=3 969 B7R0.5 O=C(O)C(O)CCO Amb24689942 [1,0,0,0,0,0|1,1,0]=3 970 B7R0.5 O=C(O)C(O)CNO Amb27405525 [1,0,0,0,0,0|2,1,0]=4 971 B7R0.5 O=C(O)C(S)CCS Amb27634893 [1,0,0,0,0,0|1,0,0]=2 972 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [1,0,0,0,0,0|2,0,0]=3 973 B7R0.5 [NH3+]CCC([NH3+])C(=O)[O-] Amb33513240 [1,0,0,0,0,0|1,0,2]=4 974 B9R0.3 CCCCC(N)C(C)(C)O Amb33214880 [0,1,0,0,0,0|2,0,1]=4 975 B9R0.3 CCCCC(N)P(C)(=O)O Amb27863006 [0,1,0,0,0,0|2,0,0]=3 976 B9R0.3 CCCCC(N)S(=O)(=O)O Amb27229977 [0,1,0,0,0,0|2,0,0]=3 977 B9R0.3 CCCCC(O)P(=O)(O)O Amb25356317 [0,1,0,0,0,0|3,0,0]=4 978 B9R0.3 CSCCC(N)C(C)(C)O Amb26851421 [0,1,0,0,0,0|1,0,1]=3 979 B9R0.3 CSCCC(N)C(F)(F)F Amb24649613 [0,1,0,0,0,0|2,0,1]=4 980 B9R0.3 CSCCC(N)P(=O)(O)O Amb26427856 [0,1,0,0,0,0|1,0,0]=2 981 B9R0.3 CSCCC(N)S(=O)(=O)O Amb28142834 [0,1,0,0,0,0|1,0,0]=2 982 B9R0.3 CSCCC(O)S(=O)(=O)[O-] Amb22475712 [0,1,0,0,0,0|2,0,1]=4 983 B9R0.3 CSCC[C@@H](N)C(C)(C)O Amb22406055 [0,1,0,0,0,0|1,0,1]=3 984 B9R0.3 CSCC[C@@H](N)C(C)(C)O Amb24712389 [0,1,0,0,0,0|1,0,1]=3 985 B9R0.3 CSCC[C@@H](N)C(F)(F)F Amb33216645 [0,1,0,0,0,0|2,0,1]=4 986 B9R0.3 CSCC[C@@H](N)P(=O)(O)O Amb28457689 [0,1,0,0,0,0|1,0,0]=2 987 B9R0.3 CSCC[C@H](N)C(C)(C)O Amb25118779 [0,1,0,0,0,0|1,0,1]=3 988 B9R0.3 CSCC[C@H](N)C(C)(C)O Amb31204698 [0,1,0,0,0,0|1,0,1]=3 989 B9R0.3 CSCC[C@H](N)C(F)(F)F Amb33216635 [0,1,0,0,0,0|2,0,1]=4 990 B9R0.3 CSCC[C@H](N)P(=O)(O)O Amb28396596 [0,1,0,0,0,0|1,0,0]=2 991 B9R0.6 C#CCC(C)C(C)C(=O)O Amb28049486 [0,1,0,0,0,0|2,0,1]=4 992 B9R0.6 C=C(C(=O)O)C(C)CCC Amb33321132 [0,1,0,0,0,0|2,0,1]=4 993 B9R0.6 C=C(C)C(N)C(C)CSC Amb28138457 [0,1,0,0,0,0|2,0,0]=3 994 B9R0.6 C=C(CCC)[C@H](N)C(=O)O Amb27404609 [0,1,0,0,0,0|1,0,1]=3 995 B9R0.6 C=CCC(C)C(C)C(=O)O Amb18643938 [0,1,0,0,0,0|2,0,1]=4 996 B9R0.6 C=CCC(C)C(N)C(=O)O Amb26381874 [0,1,0,0,0,0|1,0,1]=3 997 B9R0.6 C=CCC(C)C(N)C(N)=O Amb33066012 [0,1,0,0,0,0|2,0,1]=4 998 B9R0.6 C=CCC(C)[C@@H](N)C(=O)O Amb33037030 [0,1,0,0,0,0|1,0,1]=3 999 B9R0.6 C=CCC(C)[C@H](N)C(=O)O Amb32865926 [0,1,0,0,0,0|1,0,1]=3 1000 B9R0.6 CC(CC#N)C(C)C(=O)O Amb35719228 [0,1,0,0,0,0|3,0,0]=4 1001 B9R0.6 CC(CC#N)C(N)C(=O)O Amb33066130 [0,1,0,0,0,0|2,0,0]=3 1002 B9R0.6 CC(CC#N)C(N)C(N)=O Amb33036532 [0,1,0,0,0,0|3,0,0]=4 1003 B9R0.6 CC(CC#N)[C@@H](N)C(=O)O Amb33308829 [0,1,0,0,0,0|2,0,0]=3 1004 B9R0.6 CC(CC#N)[C@H](N)C(=O)O Amb32865927 [0,1,0,0,0,0|2,0,0]=3 1005 B9R0.6 CC(CC=O)C(C)C(=O)O Amb18644133 [0,1,0,0,0,0|3,0,0]=4 1006 B9R0.6 CC(OC=O)C(N)C(=O)O Amb27456598 [0,1,0,0,0,0|3,0,0]=4 1007 B9R0.6 CCCC(C)C(=O)C(=O)O Amb24747027 [0,1,0,0,0,0|2,0,1]=4 1008 B9R0.6 CCCC(C)C(C)C(=O)O Amb28050123 [0,1,0,0,0,0|2,0,0]=3 1009 B9R0.6 CCCC(C)C(Cl)C(N)=O Amb18800738 [0,1,0,0,0,0|3,0,0]=4 1010 B9R0.6 CCCC(C)C(N)C(=O)O Amb20622789 [0,1,0,0,0,0|1,0,0]=2 1011 B9R0.6 CCCC(C)C(N)C(N)=O Amb27809015 [0,1,0,0,0,0|2,0,0]=3 1012 B9R0.6 CCCC(C)C(O)C(=O)O Amb27809670 [0,1,0,0,0,0|2,0,0]=3 1013 B9R0.6 CCCC(C)C(O)C(C)=O Amb27645205 [0,1,0,0,0,0|3,0,0]=4 1014 B9R0.6 CCCC(C)C(O)C(N)=O Amb27407802 [0,1,0,0,0,0|3,0,0]=4 1015 B9R0.6 CCCC(C)[C@@H](C)C(=O)O Amb33727115 [0,1,0,0,0,0|2,0,0]=3 1016 B9R0.6 CCCC(C)[C@@H](N)C(=O)O Amb26624121 [0,1,0,0,0,0|1,0,0]=2 1017 B9R0.6 CCCC(C)[C@H](C)C(=O)O Amb33749068 [0,1,0,0,0,0|2,0,0]=3 1018 B9R0.6 CCCC(C)[C@H](N)C(=O)O Amb26512364 [0,1,0,0,0,0|1,0,0]=2 1019 B9R0.6 CCCC(Cl)C(O)C(C)=O Amb25943692 [0,1,0,0,0,0|3,0,0]=4 1020 B9R0.6 CCCC(F)C(Br)C(=O)O Amb27623862 [0,1,0,0,0,0|2,0,0]=3 1021 B9R0.6 CCCC(F)C(N)C(=O)O Amb10839857 [0,1,0,0,0,0|1,0,0]=2 1022 B9R0.6 CCCC(N)C(C)C(=O)O Amb24763852 [0,1,0,0,0,0|2,0,0]=3 1023 B9R0.6 CCCC(N)C(F)C(=O)O Amb33036385 [0,1,0,0,0,0|2,0,0]=3 1024 B9R0.6 CCCC(N)C(O)C(N)=O Amb8391315 [0,1,0,0,0,0|3,0,0]=4 1025 B9R0.6 CCCC(O)C(C)C(=O)O Amb18310700 [0,1,0,0,0,0|2,0,0]=3 1026 B9R0.6 CCCC(O)C(C)C(N)=O Amb27816041 [0,1,0,0,0,0|3,0,0]=4 1027 B9R0.6 CCCC(O)C(Cl)C(=O)O Amb28120934 [0,1,0,0,0,0|2,0,0]=3 1028 B9R0.6 CCCC(O)C(Cl)C(C)=O Amb26066170 [0,1,0,0,0,0|3,0,0]=4 1029 B9R0.6 CCCC(O)C(F)C(=O)O Amb33036248 [0,1,0,0,0,0|2,0,0]=3 1030 B9R0.6 CCCC(O)C(N)C(=O)O Amb18124815 [0,1,0,0,0,0|1,0,0]=2 1031 B9R0.6 CCCC(O)C(O)C(=O)O Amb27772742 [0,1,0,0,0,0|2,0,0]=3 1032 B9R0.6 CCCC(O)C(O)C(C)=O Amb28122464 [0,1,0,0,0,0|3,0,0]=4 1033 B9R0.6 CCCC(O)[C@@H](O)C(=O)O Amb27256644 [0,1,0,0,0,0|2,0,0]=3 1034 B9R0.6 CCCC(O)[C@H](N)C(=O)O Amb26635079 [0,1,0,0,0,0|1,0,0]=2 1035 B9R0.6 CCCC(S)C(N)C(=O)O Amb27860699 [0,1,0,0,0,0|1,0,0]=2 1036 B9R0.6 CCCC(S)[C@@H](N)C(=O)O Amb27759942 [0,1,0,0,0,0|1,0,0]=2 1037 B9R0.6 CCC[C@@H](C)[C@@H](C)C(=O)O Amb27961440 [0,1,0,0,0,0|2,0,0]=3 1038 B9R0.6 CCC[C@@H](N)C(O)C(N)=O Amb33716855 [0,1,0,0,0,0|3,0,0]=4 1039 B9R0.6 CCC[C@@H](N)[C@@H](C)C(=O)O Amb27784849 [0,1,0,0,0,0|2,0,0]=3 1040 B9R0.6 CCC[C@@H](N)[C@@H](O)C(=O)O Amb22747816 [0,1,0,0,0,0|2,0,0]=3 1041 B9R0.6 CCC[C@@H](N)[C@H](O)C(=O)O Amb22747809 [0,1,0,0,0,0|2,0,0]=3 1042 B9R0.6 CCC[C@@H](O)[C@@H](N)C(=O)O Amb25367288 [0,1,0,0,0,0|1,0,0]=2 1043 B9R0.6 CCC[C@@H](O)[C@H](N)C(=O)O Amb24715802 [0,1,0,0,0,0|1,0,0]=2 1044 B9R0.6 CCC[C@H](C)[C@@H](N)C(=O)O Amb27801051 [0,1,0,0,0,0|1,0,0]=2 1045 B9R0.6 CCC[C@H](C)[C@@H](O)C(=O)O Amb28050149 [0,1,0,0,0,0|2,0,0]=3 1046 B9R0.6 CCC[C@H](C)[C@H](N)C(=O)O Amb29838293 [0,1,0,0,0,0|1,0,0]=2 1047 B9R0.6 CCC[C@H](N)C(O)C(=O)O Amb27229636 [0,1,0,0,0,0|2,0,0]=3 1048 B9R0.6 CCC[C@H](N)[C@@H](C)C(=O)O Amb27618082 [0,1,0,0,0,0|2,0,0]=3 1049 B9R0.6 CCC[C@H](N)[C@@H](O)C(=O)O Amb26344900 [0,1,0,0,0,0|2,0,0]=3 1050 B9R0.6 CCC[C@H](N)[C@H](O)C(=O)O Amb25084552 [0,1,0,0,0,0|2,0,0]=3 1051 B9R0.6 CCC[C@H](O)[C@@H](N)C(=O)O Amb26415873 [0,1,0,0,0,0|1,0,0]=2 1052 B9R0.6 CCC[C@H](O)[C@H](N)C(=O)O Amb25113866 [0,1,0,0,0,0|1,0,0]=2 1053 B9R0.6 CCOC(C)C(C)C(=O)O Amb33427356 [0,1,0,0,0,0|3,0,0]=4 1054 B9R0.6 CCOC(C)C(N)C(=O)O Amb25887694 [0,1,0,0,0,0|2,0,0]=3 1055 B9R0.6 CCOC(C)C(N)C(N)=O Amb33037044 [0,1,0,0,0,0|3,0,0]=4 1056 B9R0.6 CCOC(C)C(O)C(=O)O Amb33425709 [0,1,0,0,0,0|3,0,0]=4 1057 B9R0.6 CCOC(C)[C@@H](N)C(=O)O Amb33065865 [0,1,0,0,0,0|2,0,0]=3 1058 B9R0.6 CCOC(C)[C@H](N)C(=O)O Amb33065957 [0,1,0,0,0,0|2,0,0]=3 1059 B9R0.6 CCO[C@H](C)[C@@H](N)C(=O)O Amb22747686 [0,1,0,0,0,0|2,0,0]=3 1060 B9R0.6 CCSC(C)C(C)C(=O)O Amb27753248 [0,1,0,0,0,0|3,0,0]=4 1061 B9R0.6 CCSC(C)C(N)C(=O)O Amb26359481 [0,1,0,0,0,0|2,0,0]=3 1062 B9R0.6 COCC(C)C(C)C(=O)O Amb26369700 [0,1,0,0,0,0|1,1,0]=3 1063 B9R0.6 COCC(C)C(Cl)C(N)=O Amb27614969 [0,1,0,0,0,0|2,1,0]=4 1064 B9R0.6 COCC(C)C(N)C(=O)O Amb24116980 [0,1,0,0,0,0|0,1,0]=2 1065 B9R0.6 COCC(C)C(N)C(N)=O Amb24468545 [0,1,0,0,0,0|1,1,0]=3 1066 B9R0.6 COCC(C)C(O)C(=O)O Amb27596283 [0,1,0,0,0,0|1,1,0]=3 1067 B9R0.6 COCC(C)[C@@H](N)C(=O)O Amb26467489 [0,1,0,0,0,0|0,1,0]=2 1068 B9R0.6 COCC(C)[C@H](N)C(=O)O Amb25729786 [0,1,0,0,0,0|0,1,0]=2 1069 B9R0.6 COCC(O)C(N)C(=O)O Amb25147551 [0,1,0,0,0,0|0,1,0]=2 1070 B9R0.6 COC\C(O)=C(/N)C(=O)O Amb27786739 [0,1,0,0,0,0|0,1,2]=4 1071 B9R0.6 CSCC(C)C(N)C(=O)O Amb27161222 [0,1,0,0,0,0|0,0,0]=1 1072 B9R0.6 CSCC(C)N(C)C(N)=O Amb27974848 [0,1,0,0,0,0|3,0,0]=4 1073 B9R0.6 CSCC(C)[C@H](N)C(=O)O Amb28137881 [0,1,0,0,0,0|0,0,0]=1 1074 B9R0.6 CSCC(O)C(N)C(=O)O Amb18646340 [0,1,0,0,0,0|0,0,0]=1 1075 B9R0.6 CSC[C@@H](C)C(N)C(=O)O Amb27629392 [0,1,0,0,0,0|0,0,0]=1 1076 B9R0.6 CSC[C@H](O)[C@@H](N)C(=O)O Amb28320767 [0,1,0,0,0,0|0,0,0]=1 1077 B9R0.6 C[C@@H](CCCl)[C@H](N)C(=O)O Amb28203940 [0,1,0,0,0,0|2,0,0]=3 1078 B9R0.6 C[C@@H](OC=O)[C@H](N)C(=O)O Amb27972267 [0,1,0,0,0,0|3,0,0]=4 1079 B9R0.6 C\C=C\C(C)C(C)C(=O)O Amb28346501 [0,1,0,0,0,0|2,0,1]=4 1080 B9R0.6 C\C=C\[C@@H](C)[C@H](Br)C(=O)O Amb27849000 [0,1,0,0,0,0|2,0,1]=4 1081 B9R0.6 C\C=C\[C@H](C)[C@H](C)C(=O)O Amb27630536 [0,1,0,0,0,0|2,0,1]=4 1082 B9R0.6 NC(C(=O)O)C(O)CCF Amb33196437 [0,1,0,0,0,0|2,0,0]=3 1083 B9R0.6 NCCC(F)C(N)C(=O)O Amb28204060 [0,1,0,0,0,0|2,0,0]=3 1084 B9R0.6 NCCC(N)C(N)C(=O)O Amb27759858 [0,1,0,0,0,0|2,0,0]=3 1085 B9R0.6 NCC[C@@H](F)[C@H](N)C(=O)O Amb27818085 [0,1,0,0,0,0|2,0,0]=3 1086 B9R0.6 NCC[C@@H](O)[C@H](N)C(=O)O Amb27800764 [0,1,0,0,0,0|2,0,0]=3 1087 B9R0.6 NCC[C@H](O)[C@H](N)C(=O)O Amb27263062 [0,1,0,0,0,0|2,0,0]=3 1088 B9R0.7 C=C(C)C(N)CCN(C)C Amb27855433 [0,1,0,0,0,0|3,0,0]=4 1089 B9R0.7 C=C(C)CCC(=C)C(=O)O Amb28047421 [0,1,0,0,0,0|2,0,1]=4 1090 B9R0.7 C=C(C)CCC(C)C(=O)O Amb25809141 [0,1,0,0,0,0|2,0,0]=3 1091 B9R0.7 C=C(C)CCC(C)C(C)=O Amb27753284 [0,1,0,0,0,0|3,0,0]=4 1092 B9R0.7 C=C(C)CCC(N)C(=O)O Amb28121242 [0,1,0,0,0,0|1,0,0]=2 1093 B9R0.7 C=C(C)CCC(N)C(N)=O Amb27188568 [0,1,0,0,0,0|2,0,0]=3 1094 B9R0.7 C=C(C)CCC(O)C(=O)O Amb27436256 [0,1,0,0,0,0|2,0,0]=3 1095 B9R0.7 C=C(C)CC[C@@H](N)C(=O)O Amb25775219 [0,1,0,0,0,0|1,0,0]=2 1096 B9R0.7 C=C(C)CC[C@H](N)C(=O)O Amb25948355 [0,1,0,0,0,0|1,0,0]=2 1097 B9R0.7 C=C(C)CSC(C)C(=O)O Amb6263518 [0,1,0,0,0,0|3,0,0]=4 1098 B9R0.7 C=C(CCN(C)C)C(=O)O Amb28903893 [0,1,0,0,0,0|2,0,1]=4 1099 B9R0.7 C=C(CCN(C)C)C(=O)O Amb32667385 [0,1,0,0,0,0|2,0,1]=4 1100 B9R0.7 C=C(Cl)CCC(N)C(=O)O Amb27424777 [0,1,0,0,0,0|1,0,1]=3 1101 B9R0.7 CC(=O)C(C)CCC(C)O Amb27823560 [0,1,0,0,0,0|3,0,0]=4 1102 B9R0.7 CC(=O)C(C)CCN(C)C Amb27470904 [0,1,0,0,0,0|3,0,0]=4 1103 B9R0.7 CC(=O)C(C)CCS(C)=O Amb27783563 [0,1,0,0,0,0|2,0,1]=4 1104 B9R0.7 CC(=O)C(N)CCC(=O)O Amb27875288 [0,1,0,0,0,0|3,0,0]=4 1105 B9R0.7 CC(=O)CCC(Cl)C(C)=O Amb27444965 [0,1,0,0,0,0|3,0,0]=4 1106 B9R0.7 CC(=O)CCC(N)C(=O)O Amb20669473 [0,1,0,0,0,0|1,0,0]=2 1107 B9R0.7 CC(=O)CCC(N)C(=O)O Amb22157242 [0,1,0,0,0,0|1,0,0]=2 1108 B9R0.7 CC(=O)CCC(N)C(N)=O Amb26649117 [0,1,0,0,0,0|2,0,0]=3 1109 B9R0.7 CC(=O)CC[C@@H](N)C(=O)O Amb26516732 [0,1,0,0,0,0|1,0,0]=2 1110 B9R0.7 CC(=O)CC[C@H](N)C(=O)O Amb25147501 [0,1,0,0,0,0|1,0,0]=2 1111 B9R0.7 CC(=O)CSC(C)C(=O)O Amb17501621 [0,1,0,0,0,0|3,0,0]=4 1112 B9R0.7 CC(=O)NCC(N)C(=O)O Amb26046380 [0,1,0,0,0,0|2,0,0]=3 1113 B9R0.7 CC(=O)NC[C@H](C)C(=O)O Amb27472985 [0,1,0,0,0,0|3,0,0]=4 1114 B9R0.7 CC(=O)OCC(C)C(=O)O Amb28050166 [0,1,0,0,0,0|3,0,0]=4 1115 B9R0.7 CC(=O)OCC(N)C(=O)O Amb17593668 [0,1,0,0,0,0|2,0,0]=3 1116 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O Amb2699176 [0,1,0,0,0,0|2,0,0]=3 1117 B9R0.7 CC(=O)OC[C@@H]([NH3+])C(=O)O Amb3499386 [0,1,0,0,0,0|2,0,1]=4 1118 B9R0.7 CC(=O)OC[C@H](C)C(=O)O Amb28340504 [0,1,0,0,0,0|3,0,0]=4 1119 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb2778750 [0,1,0,0,0,0|2,0,0]=3 1120 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb33757552 [0,1,0,0,0,0|2,0,0]=3 1121 B9R0.7 CC(=O)SCC(C)C(=O)O Amb2732386 [0,1,0,0,0,0|3,0,0]=4 1122 B9R0.7 CC(=O)SCC(N)C(=O)O Amb22490452 [0,1,0,0,0,0|2,0,0]=3 1123 B9R0.7 CC(=O)SCC(O)C(=O)O Amb31030973 [0,1,0,0,0,0|3,0,0]=4 1124 B9R0.7 CC(=O)SC[C@@H](C)C(=O)O Amb8628177 [0,1,0,0,0,0|3,0,0]=4 1125 B9R0.7 CC(C)=CCC(C)C(=O)O Amb18643879 [0,1,0,0,0,0|2,0,1]=4 1126 B9R0.7 CC(C)=CCC(N)C(=O)O Amb6276273 [0,1,0,0,0,0|1,0,1]=3 1127 B9R0.7 CC(C)=CCC(N)C(N)=O Amb24697159 [0,1,0,0,0,0|2,0,1]=4 1128 B9R0.7 CC(C)=CC[C@@H](N)C(=O)O Amb27254062 [0,1,0,0,0,0|1,0,1]=3 1129 B9R0.7 CC(C)=CC[C@H](N)C(=O)O Amb25836895 [0,1,0,0,0,0|1,0,1]=3 1130 B9R0.7 CC(C)CCC(=O)C(=O)O Amb26508699 [0,1,0,0,0,0|2,0,1]=4 1131 B9R0.7 CC(C)CCC(Br)C(=O)O Amb18131059 [0,1,0,0,0,0|2,0,0]=3 1132 B9R0.7 CC(C)CCC(C)C(=O)O Amb19033547 [0,1,0,0,0,0|2,0,0]=3 1133 B9R0.7 CC(C)CCC(F)C(=O)O Amb26612835 [0,1,0,0,0,0|2,0,0]=3 1134 B9R0.7 CC(C)CCC(N)C(=O)Cl Amb27396445 [0,1,0,0,0,0|2,0,0]=3 1135 B9R0.7 CC(C)CCC(N)C(=O)O Amb19269152 [0,1,0,0,0,0|1,0,0]=2 1136 B9R0.7 CC(C)CCC(N)C(=O)O Amb6269218 [0,1,0,0,0,0|1,0,0]=2 1137 B9R0.7 CC(C)CCC(N)C(N)=O Amb27424766 [0,1,0,0,0,0|2,0,0]=3 1138 B9R0.7 CC(C)CCC(O)C(=O)O Amb27788603 [0,1,0,0,0,0|2,0,0]=3 1139 B9R0.7 CC(C)CC[C@@H](C)C(=O)O Amb26983027 [0,1,0,0,0,0|2,0,0]=3 1140 B9R0.7 CC(C)CC[C@@H](Cl)C(=O)Cl Amb27164122 [0,1,0,0,0,0|3,0,0]=4 1141 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb19133196 [0,1,0,0,0,0|1,0,0]=2 1142 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb22899130 [0,1,0,0,0,0|1,0,0]=2 1143 B9R0.7 CC(C)CC[C@@H](O)C(=O)[O-] Amb27218868 [0,1,0,0,0,0|2,0,1]=4 1144 B9R0.7 CC(C)CC[C@H](C)C(=O)O Amb27227250 [0,1,0,0,0,0|2,0,0]=3 1145 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb16183866 [0,1,0,0,0,0|1,0,0]=2 1146 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb33339290 [0,1,0,0,0,0|1,0,0]=2 1147 B9R0.7 CC(C)CC[C@H](N)[C@H](C)O Amb28119956 [0,1,0,0,0,0|2,0,1]=4 1148 B9R0.7 CC(C)CNC(C)C(=O)O Amb9326958 [0,1,0,0,0,0|3,0,0]=4 1149 B9R0.7 CC(C)CN[C@@H](C)C(=O)O Amb27872965 [0,1,0,0,0,0|3,0,0]=4 1150 B9R0.7 CC(C)COC(C)C(=O)O Amb6258223 [0,1,0,0,0,0|3,0,0]=4 1151 B9R0.7 CC(C)COC(F)C(=O)O Amb27825878 [0,1,0,0,0,0|3,0,0]=4 1152 B9R0.7 CC(C)CSC(C)C(=O)O Amb6270237 [0,1,0,0,0,0|3,0,0]=4 1153 B9R0.7 CC(C)NCC(C)C(=O)O Amb9400283 [0,1,0,0,0,0|3,0,0]=4 1154 B9R0.7 CC(C)NCC(N)C(N)=O Amb27812569 [0,1,0,0,0,0|3,0,0]=4 1155 B9R0.7 CC(C)OCC(C)C(=O)O Amb26037515 [0,1,0,0,0,0|3,0,0]=4 1156 B9R0.7 CC(C)OCC(Cl)C(=O)O Amb27770474 [0,1,0,0,0,0|3,0,0]=4 1157 B9R0.7 CC(C)OCC(N)C(=O)O Amb25956723 [0,1,0,0,0,0|2,0,0]=3 1158 B9R0.7 CC(C)OCC(N)C(=O)O Amb32665467 [0,1,0,0,0,0|2,0,0]=3 1159 B9R0.7 CC(C)OCC(N)C(N)=O Amb25104507 [0,1,0,0,0,0|3,0,0]=4 1160 B9R0.7 CC(C)OCC(O)C(=O)O Amb24583914 [0,1,0,0,0,0|3,0,0]=4 1161 B9R0.7 CC(C)OC[C@@H](N)C(=O)O Amb24479342 [0,1,0,0,0,0|2,0,0]=3 1162 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb26960408 [0,1,0,0,0,0|2,0,0]=3 1163 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb32664966 [0,1,0,0,0,0|2,0,0]=3 1164 B9R0.7 CC(C)OC[C@H](N)C(N)=O Amb27184033 [0,1,0,0,0,0|3,0,0]=4 1165 B9R0.7 CC(C)SCC(N)C(=O)O Amb6273927 [0,1,0,0,0,0|2,0,0]=3 1166 B9R0.7 CC(CCC(=O)O)C(=O)O Amb6296609 [0,1,0,0,0,0|3,0,0]=4 1167 B9R0.7 CC(CCC(F)F)C(=O)O Amb32672190 [0,1,0,0,0,0|3,0,0]=4 1168 B9R0.7 CC(CCN(C)C)C(=O)O Amb26502003 [0,1,0,0,0,0|2,0,0]=3 1169 B9R0.7 CC(CCN(C)C)C(=O)O Amb32675008 [0,1,0,0,0,0|2,0,0]=3 1170 B9R0.7 CC(CCS(C)=O)C(=O)O Amb27237254 [0,1,0,0,0,0|1,0,1]=3 1171 B9R0.7 CC(CC[N+](=O)[O-])C(=O)O Amb27425087 [0,1,0,0,0,0|3,0,0]=4 1172 B9R0.7 CC(CNN(C)C)C(=O)O Amb27855116 [0,1,0,0,0,0|3,0,0]=4 1173 B9R0.7 CC(N)CCC(O)C(=O)O Amb28436655 [0,1,0,0,0,0|2,0,0]=3 1174 B9R0.7 CC(NC[C@@H](C)O)C(=O)O Amb27617222 [0,1,0,0,0,0|3,0,0]=4 1175 B9R0.7 CC(NC[C@H](C)O)C(=O)O Amb27248684 [0,1,0,0,0,0|3,0,0]=4 1176 B9R0.7 CC(O)CCC(=O)C(=O)O Amb27799217 [0,1,0,0,0,0|2,0,1]=4 1177 B9R0.7 CC(O)CCC(N)C(=O)O Amb26598749 [0,1,0,0,0,0|1,0,0]=2 1178 B9R0.7 CC(O)CCC(N)C(N)=O Amb33036759 [0,1,0,0,0,0|2,0,0]=3 1179 B9R0.7 CC(O)CC[C@@H](N)C(=O)O Amb28126862 [0,1,0,0,0,0|1,0,0]=2 1180 B9R0.7 CC(O)CC[C@H](N)C(=O)O Amb26346481 [0,1,0,0,0,0|1,0,0]=2 1181 B9R0.7 CC(O)CNC(C)C(=O)O Amb18523859 [0,1,0,0,0,0|3,0,0]=4 1182 B9R0.7 CC(O)CN[C@H](C)C(=O)O Amb28246243 [0,1,0,0,0,0|3,0,0]=4 1183 B9R0.7 CC(O)CO[C@@H](C)C(=O)O Amb27273395 [0,1,0,0,0,0|3,0,0]=4 1184 B9R0.7 CC(O)NC[C@H](N)C(=O)O Amb24575047 [0,1,0,0,0,0|2,0,0]=3 1185 B9R0.7 CC(O)OC[C@@H](N)C(=O)O Amb28348403 [0,1,0,0,0,0|2,0,0]=3 1186 B9R0.7 CN(C)CCC(=O)C(=O)O Amb33272647 [0,1,0,0,0,0|2,0,1]=4 1187 B9R0.7 CN(C)CCC(F)C(=O)O Amb27959150 [0,1,0,0,0,0|2,0,0]=3 1188 B9R0.7 CN(C)CCC(N)C(=O)O Amb32661000 [0,1,0,0,0,0|1,0,0]=2 1189 B9R0.7 CN(C)CCC(N)C(=O)O Amb6259376 [0,1,0,0,0,0|1,0,0]=2 1190 B9R0.7 CN(C)CCC(N)C(N)=O Amb19036813 [0,1,0,0,0,0|2,0,0]=3 1191 B9R0.7 CN(C)CCC(O)C(=O)O Amb26847402 [0,1,0,0,0,0|2,0,0]=3 1192 B9R0.7 CN(C)CC[C@@H](N)C(=O)O Amb26453522 [0,1,0,0,0,0|1,0,0]=2 1193 B9R0.7 CN(C)CC[C@H](N)C(=O)O Amb25108550 [0,1,0,0,0,0|1,0,0]=2 1194 B9R0.7 CN(C)CC[C@H](N)C(N)=O Amb28364893 [0,1,0,0,0,0|2,0,0]=3 1195 B9R0.7 CN(C)NCC(N)C(=O)O Amb28045970 [0,1,0,0,0,0|2,0,0]=3 1196 B9R0.7 CN(O)CC[C@H](N)C(=O)O Amb27640254 [0,1,0,0,0,0|1,0,0]=2 1197 B9R0.7 CS(=N)CCC(N)C(=O)O Amb25243030 [0,1,0,0,0,0|0,0,1]=2 1198 B9R0.7 CS(=O)CCC(N)C(=O)O Amb6336322 [0,1,0,0,0,0|0,0,1]=2 1199 B9R0.7 CS(=O)CCC(N)C(N)=O Amb25869966 [0,1,0,0,0,0|1,0,1]=3 1200 B9R0.7 CS(=O)CCC(O)C(=O)O Amb28118981 [0,1,0,0,0,0|1,0,1]=3 1201 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O Amb19133021 [0,1,0,0,0,0|0,0,1]=2 1202 B9R0.7 CS(=O)CC[C@H](N)C(=O)O Amb6600089 [0,1,0,0,0,0|0,0,1]=2 1203 B9R0.7 CS(=O)NCC(N)C(=O)O Amb28122995 [0,1,0,0,0,0|1,0,1]=3 1204 B9R0.7 C[C@@H](CCC(=O)O)C(=O)O Amb22799543 [0,1,0,0,0,0|3,0,0]=4 1205 B9R0.7 C[C@@H](CC[N+](=O)[O-])C(=O)O Amb24330210 [0,1,0,0,0,0|3,0,0]=4 1206 B9R0.7 C[C@@H](N)CC[C@@H](O)C(=O)O Amb27815031 [0,1,0,0,0,0|2,0,0]=3 1207 B9R0.7 C[C@@H](N)CN[C@H](C)C(=O)O Amb27646700 [0,1,0,0,0,0|3,0,0]=4 1208 B9R0.7 C[C@H](CCC(=O)O)C(=O)O Amb22225175 [0,1,0,0,0,0|3,0,0]=4 1209 B9R0.7 C[C@H](CC[N+](=O)[O-])C(=O)O Amb13883662 [0,1,0,0,0,0|3,0,0]=4 1210 B9R0.7 C[C@H](N)CN[C@H](C)C(=O)O Amb27445282 [0,1,0,0,0,0|3,0,0]=4 1211 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4006595 [0,1,0,0,0,0|0,0,1]=2 1212 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4006626 [0,1,0,0,0,0|0,0,1]=2 1213 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4007490 [0,1,0,0,0,0|0,0,1]=2 1214 B9R0.7 C[S+](C)CCC(O)C(=O)O Amb33482959 [0,1,0,0,0,0|1,0,1]=3 1215 B9R0.7 C[S+](C)CCC(O)C(=O)[O-] Amb28069582 [0,1,0,0,0,0|1,0,2]=4 1216 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O Amb35781977 [0,1,0,0,0,0|0,0,1]=2 1217 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O Amb6336613 [0,1,0,0,0,0|0,0,1]=2 1218 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O Amb10601599 [0,1,0,0,0,0|0,0,1]=2 1219 B9R0.7 C[SH](C)CC[C@H](N)C(=O)O Amb24440849 [0,1,0,0,0,0|0,0,1]=2 1220 B9R0.7 C\C(Cl)=C/CC(Cl)C(=O)O Amb27212547 [0,1,0,0,0,0|2,0,1]=4 1221 B9R0.7 C\C(Cl)=C\CC(Cl)C(=O)O Amb17594711 [0,1,0,0,0,0|2,0,1]=4 1222 B9R0.7 C\C(F)=C/C[C@H](N)C(=O)O Amb27205690 [0,1,0,0,0,0|1,0,1]=3 1223 B9R0.7 N=C(N)CCC(N)C(=O)O Amb28185146 [0,1,0,0,0,0|2,0,0]=3 1224 B9R0.7 N=C(N)NCC(N)C(=O)O Amb22169574 [0,1,0,0,0,0|3,0,0]=4 1225 B9R0.7 N=C(N)NCC(N)C(=O)O Amb9871390 [0,1,0,0,0,0|3,0,0]=4 1226 B9R0.7 N=C(N)NC[C@@H](N)C(=O)O Amb28058768 [0,1,0,0,0,0|3,0,0]=4 1227 B9R0.7 N=C(N)NC[C@@H](N)C(=O)O Amb31292962 [0,1,0,0,0,0|3,0,0]=4 1228 B9R0.7 N=C(N)NC[C@H](N)C(=O)O Amb27230623 [0,1,0,0,0,0|3,0,0]=4 1229 B9R0.7 NC(=O)C(N)CCC(=O)O Amb18644256 [0,1,0,0,0,0|3,0,0]=4 1230 B9R0.7 NC(=O)CCC(Br)C(=O)O Amb27828829 [0,1,0,0,0,0|3,0,0]=4 1231 B9R0.7 NC(=O)CCC(N)C(=O)Cl Amb27793490 [0,1,0,0,0,0|3,0,0]=4 1232 B9R0.7 NC(=O)CCC(N)C(=O)O Amb9702792 [0,1,0,0,0,0|2,0,0]=3 1233 B9R0.7 NC(=O)CCC(N)C(N)=O Amb27175153 [0,1,0,0,0,0|3,0,0]=4 1234 B9R0.7 NC(=O)CC[C@@H](Br)C(=O)O Amb28049993 [0,1,0,0,0,0|3,0,0]=4 1235 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O Amb2688618 [0,1,0,0,0,0|2,0,0]=3 1236 B9R0.7 NC(=O)CC[C@@H](N)C(N)=O Amb22748708 [0,1,0,0,0,0|3,0,0]=4 1237 B9R0.7 NC(=O)CC[C@@H](N)C(N)=O Amb25996678 [0,1,0,0,0,0|3,0,0]=4 1238 B9R0.7 NC(=O)CC[C@H](N)C(=O)O Amb6600045 [0,1,0,0,0,0|2,0,0]=3 1239 B9R0.7 NC(=O)CC[C@H](N)C(N)=O Amb24426852 [0,1,0,0,0,0|3,0,0]=4 1240 B9R0.7 NC(=O)CC[C@H](N)C(N)=O Amb33774694 [0,1,0,0,0,0|3,0,0]=4 1241 B9R0.7 NC(=O)NCC(N)C(=O)O Amb4037018 [0,1,0,0,0,0|3,0,0]=4 1242 B9R0.7 NC(=O)NC[C@@H](N)C(=O)O Amb10068479 [0,1,0,0,0,0|3,0,0]=4 1243 B9R0.7 NC(=O)NC[C@H](N)C(=O)O Amb6298794 [0,1,0,0,0,0|3,0,0]=4 1244 B9R0.7 NC(=O)OCC(N)C(=O)O Amb26968173 [0,1,0,0,0,0|3,0,0]=4 1245 B9R0.7 NC(=O)OC[C@H](N)C(=O)O Amb28126945 [0,1,0,0,0,0|3,0,0]=4 1246 B9R0.7 NC(=O)SCC(N)C(=O)O Amb3993051 [0,1,0,0,0,0|3,0,0]=4 1247 B9R0.7 NC(=O)SC[C@@H](N)C(=O)O Amb10072293 [0,1,0,0,0,0|3,0,0]=4 1248 B9R0.7 NC(=O)SC[C@H](N)C(=O)O Amb22735296 [0,1,0,0,0,0|3,0,0]=4 1249 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O Amb22745051 [0,1,0,0,0,0|3,0,0]=4 1250 B9R0.7 NC(=O)[C@H](N)CCC(=O)O Amb24557281 [0,1,0,0,0,0|3,0,0]=4 1251 B9R0.7 NC(=S)CCC(N)C(=O)O Amb27448533 [0,1,0,0,0,0|2,0,0]=3 1252 B9R0.7 NC(=S)CC[C@H](N)C(=O)O Amb27640783 [0,1,0,0,0,0|2,0,0]=3 1253 B9R0.7 NC(CC=C(Cl)Cl)C(=O)O Amb28239821 [0,1,0,0,0,0|2,0,1]=4 1254 B9R0.7 NC(CCB(O)O)C(=O)O Amb22497480 [0,1,0,0,0,0|2,0,0]=3 1255 B9R0.7 NC(CCC(=O)Cl)C(=O)O Amb27816376 [0,1,0,0,0,0|2,0,0]=3 1256 B9R0.7 NC(CCC(=O)O)C(=O)O Amb8395158 [0,1,0,0,0,0|2,0,0]=3 1257 B9R0.7 NC(CCC(=O)O)C(=O)O Amb9703098 [0,1,0,0,0,0|2,0,0]=3 1258 B9R0.7 NC(CCC(=O)O)C(=O)[O-] Amb4014785 [0,1,0,0,0,0|2,0,1]=4 1259 B9R0.7 NC(CC[N+](=O)[O-])C(=O)O Amb27221965 [0,1,0,0,0,0|2,0,0]=3 1260 B9R0.7 NC(CN[N+](=O)[O-])C(=O)O Amb27857570 [0,1,0,0,0,0|3,0,0]=4 1261 B9R0.7 NC(COC(F)F)C(=O)O Amb27849786 [0,1,0,0,0,0|3,0,0]=4 1262 B9R0.7 NC(CSC(=O)O)C(=O)O Amb27491502 [0,1,0,0,0,0|3,0,0]=4 1263 B9R0.7 N[C@@H](CC=C(Cl)Cl)C(=O)O Amb29866596 [0,1,0,0,0,0|2,0,1]=4 1264 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb34915082 [0,1,0,0,0,0|2,0,0]=3 1265 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb3940322 [0,1,0,0,0,0|2,0,0]=3 1266 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb8513626 [0,1,0,0,0,0|2,0,0]=3 1267 B9R0.7 N[C@@H](CCC(=O)O)C(=O)[O-] Amb22745619 [0,1,0,0,0,0|2,0,1]=4 1268 B9R0.7 N[C@@H](CCC(O)=S)C(=O)O Amb24480492 [0,1,0,0,0,0|2,0,0]=3 1269 B9R0.7 N[C@@H](CCS(=O)O)C(=O)O Amb25972325 [0,1,0,0,0,0|1,0,1]=3 1270 B9R0.7 N[C@@H](CC[PH](=O)O)C(=O)O Amb22904307 [0,1,0,0,0,0|2,0,0]=3 1271 B9R0.7 N[C@@H](CO[N+](=O)[O-])C(=O)O Amb27793180 [0,1,0,0,0,0|3,0,0]=4 1272 B9R0.7 N[C@@H](CSC(=O)O)C(=O)O Amb27666945 [0,1,0,0,0,0|3,0,0]=4 1273 B9R0.7 N[C@H](CC=C(Cl)Cl)C(=O)O Amb29866643 [0,1,0,0,0,0|2,0,1]=4 1274 B9R0.7 N[C@H](CCC(=O)O)C(=O)O Amb2720565 [0,1,0,0,0,0|2,0,0]=3 1275 B9R0.7 N[C@H](COC(F)F)C(=O)O Amb27637675 [0,1,0,0,0,0|3,0,0]=4 1276 B9R0.7 N[C@H](CSC(F)F)C(=O)O Amb28290955 [0,1,0,0,0,0|3,0,0]=4 1277 B9R0.7 O=C(O)CCC(Br)C(=O)O Amb26568399 [0,1,0,0,0,0|3,0,0]=4 1278 B9R0.7 O=C(O)CCC(Cl)C(=O)O Amb17594149 [0,1,0,0,0,0|3,0,0]=4 1279 B9R0.7 O=C(O)CCC(O)C(=O)O Amb18124864 [0,1,0,0,0,0|3,0,0]=4 1280 B9R0.7 O=C(O)CCC(S)C(=O)O Amb27983646 [0,1,0,0,0,0|3,0,0]=4 1281 B9R0.7 O=C(O)CC[C@@H](O)C(=O)O Amb22799690 [0,1,0,0,0,0|3,0,0]=4 1282 B9R0.7 O=C(O)CC[C@H](Br)C(=O)O Amb26885416 [0,1,0,0,0,0|3,0,0]=4 1283 B9R0.7 O=C(O)CC[C@H](Cl)C(=O)O Amb26590823 [0,1,0,0,0,0|3,0,0]=4 1284 B9R0.7 O=C(O)CC[C@H](O)C(=O)O Amb25948742 [0,1,0,0,0,0|3,0,0]=4 1285 B9R0.8 C#CC(=O)C(N)CCOC Amb27404711 [0,1,0,0,0,0|1,1,0]=3 1286 B9R0.8 C#CCCC(N)C(=O)OC Amb28135954 [0,1,0,0,0,0|1,0,1]=3 1287 B9R0.8 C#CCC[C@H](N)C(=O)OC Amb27640594 [0,1,0,0,0,0|1,0,1]=3 1288 B9R0.8 C=C(CO)C(O)CCCC Amb27839533 [0,1,0,0,0,0|3,0,0]=4 1289 B9R0.8 C=C=CCC(N)C(=O)OC Amb28046380 [0,1,0,0,0,0|1,0,2]=4 1290 B9R0.8 C=CC(=O)C(N)CCCC Amb28050432 [0,1,0,0,0,0|2,0,0]=3 1291 B9R0.8 C=CC(=O)C(N)CCOC Amb27252812 [0,1,0,0,0,0|1,1,0]=3 1292 B9R0.8 C=CC(=O)N(C)CCSC Amb27212999 [0,1,0,0,0,0|3,0,0]=4 1293 B9R0.8 C=CCCC(N)C(=O)OC Amb27866671 [0,1,0,0,0,0|1,0,1]=3 1294 B9R0.8 C=CCCC(N)C(=O)OC Amb32794772 [0,1,0,0,0,0|1,0,1]=3 1295 B9R0.8 C=CCCC(O)C(=O)OC Amb27669786 [0,1,0,0,0,0|2,0,1]=4 1296 B9R0.8 C=CCC[C@@H](N)C(=O)OC Amb27389875 [0,1,0,0,0,0|1,0,1]=3 1297 B9R0.8 C=CCC[C@H](N)C(=O)OC Amb28134398 [0,1,0,0,0,0|1,0,1]=3 1298 B9R0.8 CC#CCC(N)C(=O)OC Amb25076019 [0,1,0,0,0,0|1,0,1]=3 1299 B9R0.8 CCC(=O)C(C)CCOC Amb28254753 [0,1,0,0,0,0|2,1,0]=4 1300 B9R0.8 CCC(=O)C(N)CCOC Amb28423088 [0,1,0,0,0,0|1,1,0]=3 1301 B9R0.8 CCCCC(=O)C(=O)OC Amb22755702 [0,1,0,0,0,0|2,0,1]=4 1302 B9R0.8 CCCCC(Br)C(=O)CBr Amb26444150 [0,1,0,0,0,0|3,0,0]=4 1303 B9R0.8 CCCCC(Br)C(=O)OC Amb19514695 [0,1,0,0,0,0|2,0,0]=3 1304 B9R0.8 CCCCC(C)C(=N)NO Amb28388768 [0,1,0,0,0,0|3,0,0]=4 1305 B9R0.8 CCCCC(C)C(=O)CC Amb25359211 [0,1,0,0,0,0|3,0,0]=4 1306 B9R0.8 CCCCC(C)C(=O)NC Amb27627834 [0,1,0,0,0,0|3,0,0]=4 1307 B9R0.8 CCCCC(C)\C(C)=N\O Amb26370042 [0,1,0,0,0,0|3,0,0]=4 1308 B9R0.8 CCCCC(Cl)C(=O)CC Amb28322143 [0,1,0,0,0,0|3,0,0]=4 1309 B9R0.8 CCCCC(Cl)\C(Cl)=N\O Amb27233549 [0,1,0,0,0,0|3,0,0]=4 1310 B9R0.8 CCCCC(F)C(=O)CC Amb27212037 [0,1,0,0,0,0|3,0,0]=4 1311 B9R0.8 CCCCC(N)C(=O)NN Amb27654302 [0,1,0,0,0,0|2,0,0]=3 1312 B9R0.8 CCCCC(N)C(=O)NO Amb22059372 [0,1,0,0,0,0|1,0,0]=2 1313 B9R0.8 CCCCC(N)C(=O)OC Amb9330294 [0,1,0,0,0,0|1,0,0]=2 1314 B9R0.8 CCCCC(N)C(=O)OC Amb9825492 [0,1,0,0,0,0|1,0,0]=2 1315 B9R0.8 CCCCC(N)\C(O)=N\O Amb20669518 [0,1,0,0,0,0|1,0,1]=3 1316 B9R0.8 CCCCC(O)C(=O)CO Amb27434084 [0,1,0,0,0,0|2,0,0]=3 1317 B9R0.8 CCCCC(S)C(=O)OC Amb24745120 [0,1,0,0,0,0|2,0,0]=3 1318 B9R0.8 CCCCN(C)C(=O)CO Amb17334237 [0,1,0,0,0,0|3,0,0]=4 1319 B9R0.8 CCCCN(N)C(=O)CC Amb33191485 [0,1,0,0,0,0|3,0,0]=4 1320 B9R0.8 CCCCN(N)C(=O)OC Amb33191487 [0,1,0,0,0,0|2,0,0]=3 1321 B9R0.8 CCCC[C@@H](C)C(=O)OC Amb27172534 [0,1,0,0,0,0|2,0,0]=3 1322 B9R0.8 CCCC[C@@H](N)C(=O)OC Amb16183949 [0,1,0,0,0,0|1,0,0]=2 1323 B9R0.8 CCCC[C@@H](N)C(=O)OC Amb22745342 [0,1,0,0,0,0|1,0,0]=2 1324 B9R0.8 CCCC[C@H](Cl)C(=O)OC Amb27823590 [0,1,0,0,0,0|2,0,0]=3 1325 B9R0.8 CCCC[C@H](N)C(=O)OC Amb22169631 [0,1,0,0,0,0|1,0,0]=2 1326 B9R0.8 CCCC[C@H](N)C(=O)OC Amb26391986 [0,1,0,0,0,0|1,0,0]=2 1327 B9R0.8 CCCC[C@H](O)C(=O)OC Amb27589932 [0,1,0,0,0,0|2,0,0]=3 1328 B9R0.8 CCCNC(C)C(=O)OC Amb25350065 [0,1,0,0,0,0|3,0,0]=4 1329 B9R0.8 CCCNC(C)C(=O)OC Amb32751764 [0,1,0,0,0,0|3,0,0]=4 1330 B9R0.8 CCCN[C@H](C)C(=O)OC Amb27812247 [0,1,0,0,0,0|3,0,0]=4 1331 B9R0.8 CCCO[C@H](C)C(=O)OC Amb28145144 [0,1,0,0,0,0|3,0,0]=4 1332 B9R0.8 CCNCC(C)C(=O)OC Amb9400286 [0,1,0,0,0,0|3,0,0]=4 1333 B9R0.8 CCNCC(I)C(=O)OC Amb27839610 [0,1,0,0,0,0|3,0,0]=4 1334 B9R0.8 CCOCC(Br)C(=O)OC Amb27443366 [0,1,0,0,0,0|3,0,0]=4 1335 B9R0.8 CCOCC(N)C(=O)OC Amb26578258 [0,1,0,0,0,0|2,0,0]=3 1336 B9R0.8 CCOC[C@@H](N)C(=O)OC Amb24478281 [0,1,0,0,0,0|2,0,0]=3 1337 B9R0.8 CCOC[C@H](N)C(=O)OC Amb26047386 [0,1,0,0,0,0|2,0,0]=3 1338 B9R0.8 CCSCC(Br)C(=O)OC Amb28424307 [0,1,0,0,0,0|3,0,0]=4 1339 B9R0.8 CCSCC(Cl)C(=O)OC Amb27454062 [0,1,0,0,0,0|3,0,0]=4 1340 B9R0.8 CCSCC(N)C(=O)NC Amb27199796 [0,1,0,0,0,0|3,0,0]=4 1341 B9R0.8 CCSCC(N)C(=O)OC Amb18788226 [0,1,0,0,0,0|2,0,0]=3 1342 B9R0.8 CCSCC(O)C(=O)OC Amb27881455 [0,1,0,0,0,0|3,0,0]=4 1343 B9R0.8 CC\C=C\C(N)C(=O)OC Amb33268687 [0,1,0,0,0,0|1,0,2]=4 1344 B9R0.8 CNC(=O)C(N)CCOC Amb18311406 [0,1,0,0,0,0|1,1,0]=3 1345 B9R0.8 CNC(=O)C(N)CCSC Amb23443538 [0,1,0,0,0,0|1,0,0]=2 1346 B9R0.8 CNC(=O)C(N)CCSC Amb32666291 [0,1,0,0,0,0|1,0,0]=2 1347 B9R0.8 CNC(=O)[C@@H](N)CCSC Amb17232422 [0,1,0,0,0,0|1,0,0]=2 1348 B9R0.8 CNC(=O)[C@@H](N)CCSC Amb32653153 [0,1,0,0,0,0|1,0,0]=2 1349 B9R0.8 CNC(=O)[C@H](N)CCSC Amb27600839 [0,1,0,0,0,0|1,0,0]=2 1350 B9R0.8 CNCCC(N)C(=O)OC Amb32993440 [0,1,0,0,0,0|1,0,0]=2 1351 B9R0.8 CNCCN(C)C(=O)OC Amb25853559 [0,1,0,0,0,0|3,0,0]=4 1352 B9R0.8 COC(=O)C(Br)CCCBr Amb10071878 [0,1,0,0,0,0|3,0,0]=4 1353 B9R0.8 COC(=O)C(C)CCCCl Amb27626035 [0,1,0,0,0,0|3,0,0]=4 1354 B9R0.8 COC(=O)C(C)CCCN Amb25904967 [0,1,0,0,0,0|3,0,0]=4 1355 B9R0.8 COC(=O)C(C)CSSC Amb27969893 [0,1,0,0,0,0|2,0,0]=3 1356 B9R0.8 COC(=O)C(Cl)CCSC Amb18327893 [0,1,0,0,0,0|1,0,0]=2 1357 B9R0.8 COC(=O)C(N)CCC#N Amb28076162 [0,1,0,0,0,0|2,0,0]=3 1358 B9R0.8 COC(=O)C(N)CCCF Amb26857313 [0,1,0,0,0,0|2,0,0]=3 1359 B9R0.8 COC(=O)C(N)CCCN Amb9871379 [0,1,0,0,0,0|2,0,0]=3 1360 B9R0.8 COC(=O)C(N)CCCO Amb18644325 [0,1,0,0,0,0|2,0,0]=3 1361 B9R0.8 COC(=O)C(N)CCCS Amb27974600 [0,1,0,0,0,0|2,0,0]=3 1362 B9R0.8 COC(=O)C(N)CCSC Amb1152979 [0,1,0,0,0,0|0,0,0]=1 1363 B9R0.8 COC(=O)C(N)CCSC Amb2720119 [0,1,0,0,0,0|0,0,0]=1 1364 B9R0.8 COC(=O)C(N)CNC=O Amb28077501 [0,1,0,0,0,0|3,0,0]=4 1365 B9R0.8 COC(=O)C(N)CSC#N Amb27799581 [0,1,0,0,0,0|3,0,0]=4 1366 B9R0.8 COC(=O)C(N)C\C=C\Cl Amb33066166 [0,1,0,0,0,0|2,0,1]=4 1367 B9R0.8 COC(=O)C(O)CCCBr Amb24759864 [0,1,0,0,0,0|3,0,0]=4 1368 B9R0.8 COC(=O)C(O)CCCCl Amb24480606 [0,1,0,0,0,0|3,0,0]=4 1369 B9R0.8 COC(=O)C(O)CCCF Amb33196109 [0,1,0,0,0,0|3,0,0]=4 1370 B9R0.8 COC(=O)C(O)CCSC Amb18800831 [0,1,0,0,0,0|1,0,0]=2 1371 B9R0.8 COC(=O)C(S)CCCCl Amb27984780 [0,1,0,0,0,0|3,0,0]=4 1372 B9R0.8 COC(=O)[C@@H](N)CCCN Amb16236222 [0,1,0,0,0,0|2,0,0]=3 1373 B9R0.8 COC(=O)[C@@H](N)CCCO Amb27260220 [0,1,0,0,0,0|2,0,0]=3 1374 B9R0.8 COC(=O)[C@@H](N)CCON Amb27856127 [0,1,0,0,0,0|1,1,0]=3 1375 B9R0.8 COC(=O)[C@@H](N)CCSC Amb533934 [0,1,0,0,0,0|0,0,0]=1 1376 B9R0.8 COC(=O)[C@@H](N)CCSC Amb8390413 [0,1,0,0,0,0|0,0,0]=1 1377 B9R0.8 COC(=O)[C@@H](O)CCSC Amb28066926 [0,1,0,0,0,0|1,0,0]=2 1378 B9R0.8 COC(=O)[C@H](N)CCSC Amb3939028 [0,1,0,0,0,0|0,0,0]=1 1379 B9R0.8 COC(=O)[C@H](N)CCSC Amb9826085 [0,1,0,0,0,0|0,0,0]=1 1380 B9R0.8 COC(=O)[C@H](O)CCCO Amb27766582 [0,1,0,0,0,0|3,0,0]=4 1381 B9R0.8 COC(=O)[C@H](O)CCSC Amb28207376 [0,1,0,0,0,0|1,0,0]=2 1382 B9R0.8 COC(=O)\C(C)=C\CSC Amb28349877 [0,1,0,0,0,0|1,0,2]=4 1383 B9R0.8 COCCC(C)C(O)C=O Amb27167029 [0,1,0,0,0,0|1,1,1]=4 1384 B9R0.8 COCCC(N)C(=O)OC Amb24053179 [0,1,0,0,0,0|0,1,0]=2 1385 B9R0.8 COCCC(N)C(=O)OC Amb28555457 [0,1,0,0,0,0|0,1,0]=2 1386 B9R0.8 COCCC(O)C(=O)OC Amb26933750 [0,1,0,0,0,0|1,1,0]=3 1387 B9R0.8 COCC[C@H](N)C(=O)OC Amb27880632 [0,1,0,0,0,0|0,1,0]=2 1388 B9R0.8 COCNC(C)C(=O)OC Amb27838101 [0,1,0,0,0,0|2,1,0]=4 1389 B9R0.8 COCSC(C)C(=O)OC Amb27204212 [0,1,0,0,0,0|2,1,0]=4 1390 B9R0.8 CONC[C@@H](O)C(=O)OC Amb28078805 [0,1,0,0,0,0|2,1,0]=4 1391 B9R0.8 CSCCC(N)C(=O)NN Amb27982597 [0,1,0,0,0,0|1,0,0]=2 1392 B9R0.8 CSCCC(N)C(=O)NO Amb22349956 [0,1,0,0,0,0|0,0,0]=1 1393 B9R0.8 CSCCC(N)C(=O)[SH]=O Amb27437886 [0,1,0,0,0,0|0,0,1]=2 1394 B9R0.8 CSCCC(O)C(=O)NO Amb28188916 [0,1,0,0,0,0|1,0,0]=2 1395 B9R0.8 CSCCC(O)C(O)CN Amb27169007 [0,1,0,0,0,0|2,0,1]=4 1396 B9R0.8 CSCC[C@@H](N)C(=O)NO Amb27592841 [0,1,0,0,0,0|0,0,0]=1 1397 B9R0.8 CSCC[C@@H](N)C(=O)[SH]=O Amb28291640 [0,1,0,0,0,0|0,0,1]=2 1398 B9R0.8 CSCC[C@H](N)C(=O)NN Amb28290232 [0,1,0,0,0,0|1,0,0]=2 1399 B9R0.8 CSCC[C@H](N)C(=O)NO Amb26846759 [0,1,0,0,0,0|0,0,0]=1 1400 B9R0.8 CSCC[C@H](N)C(=O)O[Zn+] Amb20241025 [0,1,0,0,0,0|0,0,0]=1 1401 B9R0.8 C\C=C\CC(N)C(=O)OC Amb26348150 [0,1,0,0,0,0|1,0,1]=3 1402 B9R0.8 C\C=C\CC(O)C(=O)OC Amb27588872 [0,1,0,0,0,0|2,0,1]=4 1403 B9R0.8 C\C=C\C[C@@H](N)C(=O)OC Amb27169570 [0,1,0,0,0,0|1,0,1]=3 1404 B9R0.8 O=C(CO)[C@H](O)CCCO Amb27427126 [0,1,0,0,0,0|3,0,0]=4 1405 B9R0.13 C#CCCC(C#N)C(=O)O Amb35741467 [0,1,0,0,0,0|1,0,2]=4 1406 B9R0.13 C=C(C)C(CCCC)NC Amb28319659 [0,1,0,0,0,0|3,0,0]=4 1407 B9R0.13 C=C=C(CCCC)C(=O)O Amb27489813 [0,1,0,0,0,0|2,0,1]=4 1408 B9R0.13 C=CC(CCCC)C(=O)O Amb27759693 [0,1,0,0,0,0|2,0,0]=3 1409 B9R0.13 C=CC(CCCCl)C(=O)O Amb28072929 [0,1,0,0,0,0|3,0,0]=4 1410 B9R0.13 C=CC(NCCC)C(=O)O Amb28454234 [0,1,0,0,0,0|3,0,0]=4 1411 B9R0.13 C=CC(SCCC)C(=O)O Amb27207894 [0,1,0,0,0,0|3,0,0]=4 1412 B9R0.13 C=CCCC(CC)C(=O)O Amb28050061 [0,1,0,0,0,0|2,0,1]=4 1413 B9R0.13 C=CCCC(OC)C(=O)O Amb28388453 [0,1,0,0,0,0|2,0,1]=4 1414 B9R0.13 C=CCC[C@@H](CC)C(=O)O Amb27595843 [0,1,0,0,0,0|2,0,1]=4 1415 B9R0.13 C=CCOC(CN)C(=O)O Amb27656801 [0,1,0,0,0,0|2,0,1]=4 1416 B9R0.13 C=C[C@@H](CCCC)C(=O)O Amb28050245 [0,1,0,0,0,0|2,0,0]=3 1417 B9R0.13 C=C[C@H](CCCC)C(=O)O Amb27838910 [0,1,0,0,0,0|2,0,0]=3 1418 B9R0.13 CC#CCC(C#N)C(=O)O Amb35741468 [0,1,0,0,0,0|1,0,2]=4 1419 B9R0.13 CCC(CCC=O)C(=O)O Amb27216961 [0,1,0,0,0,0|3,0,0]=4 1420 B9R0.13 CCC(CCOC)C(=O)O Amb25289946 [0,1,0,0,0,0|1,1,0]=3 1421 B9R0.13 CCC(CCOC)C(C)=O Amb27601590 [0,1,0,0,0,0|2,1,0]=4 1422 B9R0.13 CCC(CCSC)C(=O)O Amb24373794 [0,1,0,0,0,0|1,0,0]=2 1423 B9R0.13 CCC(OCOC)C(=O)O Amb28072710 [0,1,0,0,0,0|2,1,0]=4 1424 B9R0.13 CCCCC(C#N)C(=O)O Amb27202774 [0,1,0,0,0,0|1,0,1]=3 1425 B9R0.13 CCCCC(C#N)C(C)=O Amb24647883 [0,1,0,0,0,0|2,0,1]=4 1426 B9R0.13 CCCCC(C#N)C(N)=O Amb27403940 [0,1,0,0,0,0|2,0,1]=4 1427 B9R0.13 CCCCC(CBr)C(=O)O Amb27799965 [0,1,0,0,0,0|2,0,0]=3 1428 B9R0.13 CCCCC(CC)C(=O)Cl Amb3939067 [0,1,0,0,0,0|3,0,0]=4 1429 B9R0.13 CCCCC(CC)C(=O)O Amb3939821 [0,1,0,0,0,0|2,0,0]=3 1430 B9R0.13 CCCCC(CC)C(=O)[O-] Amb22043361 [0,1,0,0,0,0|2,0,1]=4 1431 B9R0.13 CCCCC(CC)C(=O)[O-] Amb22053863 [0,1,0,0,0,0|2,0,1]=4 1432 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8387188 [0,1,0,0,0,0|2,0,1]=4 1433 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8387190 [0,1,0,0,0,0|2,0,1]=4 1434 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8515519 [0,1,0,0,0,0|2,0,1]=4 1435 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8516528 [0,1,0,0,0,0|2,0,1]=4 1436 B9R0.13 CCCCC(CC)C(N)=O Amb3886579 [0,1,0,0,0,0|3,0,0]=4 1437 B9R0.13 CCCCC(CN)C(=O)O Amb26978768 [0,1,0,0,0,0|1,0,0]=2 1438 B9R0.13 CCCCC(CO)C(=O)O Amb27834958 [0,1,0,0,0,0|2,0,0]=3 1439 B9R0.13 CCCCC(NC)C(=O)O Amb24116642 [0,1,0,0,0,0|1,0,0]=2 1440 B9R0.13 CCCCC(NC)C(N)=O Amb24116641 [0,1,0,0,0,0|2,0,0]=3 1441 B9R0.13 CCCCC(NCl)C(=O)O Amb27863591 [0,1,0,0,0,0|1,0,0]=2 1442 B9R0.13 CCCCC(NN)C(=O)O Amb18644274 [0,1,0,0,0,0|1,0,0]=2 1443 B9R0.13 CCCCC(NO)C(=O)O Amb27619251 [0,1,0,0,0,0|1,0,0]=2 1444 B9R0.13 CCCCC(OC)C(=O)O Amb25889001 [0,1,0,0,0,0|2,0,0]=3 1445 B9R0.13 CCCCC(OC)C(C)=O Amb27465061 [0,1,0,0,0,0|3,0,0]=4 1446 B9R0.13 CCCC[C@@H](CC)C(=O)O Amb28398235 [0,1,0,0,0,0|2,0,0]=3 1447 B9R0.13 CCCC[C@@H](CC)C(C)=O Amb27973070 [0,1,0,0,0,0|3,0,0]=4 1448 B9R0.13 CCCC[C@@H](CN)C(=O)O Amb27812140 [0,1,0,0,0,0|1,0,0]=2 1449 B9R0.13 CCCC[C@@H](NC)C(=O)O Amb22799980 [0,1,0,0,0,0|1,0,0]=2 1450 B9R0.13 CCCC[C@@H](NO)C(=O)O Amb27162541 [0,1,0,0,0,0|1,0,0]=2 1451 B9R0.13 CCCC[C@H](CC)C(=O)O Amb24671282 [0,1,0,0,0,0|2,0,0]=3 1452 B9R0.13 CCCC[C@H](CO)C(=O)O Amb16232529 [0,1,0,0,0,0|2,0,0]=3 1453 B9R0.13 CCCC[C@H](NC)C(=O)O Amb25887554 [0,1,0,0,0,0|1,0,0]=2 1454 B9R0.13 CCCC[C@H](NC)C(N)=O Amb27264530 [0,1,0,0,0,0|2,0,0]=3 1455 B9R0.13 CCCC\C(=N/O)C(=O)O Amb28347572 [0,1,0,0,0,0|1,0,2]=4 1456 B9R0.13 CCCN[C@@H](CS)C(=O)O Amb27645159 [0,1,0,0,0,0|3,0,0]=4 1457 B9R0.13 CCCN[C@H](CO)C(=O)O Amb28125350 [0,1,0,0,0,0|3,0,0]=4 1458 B9R0.13 CCCOC(CC)C(=O)O Amb9675479 [0,1,0,0,0,0|3,0,0]=4 1459 B9R0.13 CCCSC(CC)C(=O)O Amb9675504 [0,1,0,0,0,0|3,0,0]=4 1460 B9R0.13 CCCSC(CN)C(=O)O Amb27233967 [0,1,0,0,0,0|2,0,0]=3 1461 B9R0.13 CCCSC(CO)C(=O)O Amb27629095 [0,1,0,0,0,0|3,0,0]=4 1462 B9R0.13 CCOC[C@H](NC)C(=O)O Amb33347475 [0,1,0,0,0,0|2,0,0]=3 1463 B9R0.13 CCSCC(CC)C(=O)O Amb24482439 [0,1,0,0,0,0|3,0,0]=4 1464 B9R0.13 CCSCC(CN)C(=O)O Amb33324076 [0,1,0,0,0,0|2,0,0]=3 1465 B9R0.13 CC\C=C\C(CN)C(=O)O Amb33268709 [0,1,0,0,0,0|1,0,2]=4 1466 B9R0.13 CNC(CCCN)C(=O)O Amb18644280 [0,1,0,0,0,0|2,0,0]=3 1467 B9R0.13 CNC(CCSC)C(=O)O Amb18792506 [0,1,0,0,0,0|0,0,0]=1 1468 B9R0.13 CNC(CCSC)C(N)=O Amb18792442 [0,1,0,0,0,0|1,0,0]=2 1469 B9R0.13 CN[C@@H](CCOC)C(N)=O Amb27175032 [0,1,0,0,0,0|1,1,0]=3 1470 B9R0.13 CN[C@@H](CCSC)C(=O)O Amb26844419 [0,1,0,0,0,0|0,0,0]=1 1471 B9R0.13 CN[C@@H](CN=[N+]=[N-])C(=O)O Amb28435139 [0,1,0,0,0,0|3,0,0]=4 1472 B9R0.13 CN[C@H](CCCN)C(=O)O Amb28060751 [0,1,0,0,0,0|2,0,0]=3 1473 B9R0.13 CN[C@H](CCSC)C(=O)O Amb27974159 [0,1,0,0,0,0|0,0,0]=1 1474 B9R0.13 COC(CCCF)C(=O)O Amb33196102 [0,1,0,0,0,0|3,0,0]=4 1475 B9R0.13 COC(CCSC)C(=O)O Amb28288804 [0,1,0,0,0,0|1,0,0]=2 1476 B9R0.13 COCCC(CN)C(=O)O Amb24697893 [0,1,0,0,0,0|0,1,0]=2 1477 B9R0.13 COCCC(OC)C(=O)O Amb33428673 [0,1,0,0,0,0|1,1,0]=3 1478 B9R0.13 COCC\C(=N/O)C(=O)O Amb27628764 [0,1,0,0,0,0|0,1,2]=4 1479 B9R0.13 CSCCC(CN)C(=O)O Amb24618199 [0,1,0,0,0,0|0,0,0]=1 1480 B9R0.13 CSCCC(CN)N(C)C Amb2371882 [0,1,0,0,0,0|3,0,0]=4 1481 B9R0.13 CSCCC(NCl)C(=O)O Amb27635192 [0,1,0,0,0,0|0,0,0]=1 1482 B9R0.13 CSCCC(NF)C(=O)O Amb27233599 [0,1,0,0,0,0|0,0,0]=1 1483 B9R0.13 CSCC[C@@H](CN)C(=O)O Amb28458297 [0,1,0,0,0,0|0,0,0]=1 1484 B9R0.13 C\C=C\CC(C#N)C(=O)O Amb35741469 [0,1,0,0,0,0|1,0,2]=4 1485 B9R0.13 C\C=C\CC(CC)C(=O)O Amb18643880 [0,1,0,0,0,0|2,0,1]=4 1486 B9R0.13 C\C=C\CC(OC)C(=O)O Amb18644117 [0,1,0,0,0,0|2,0,1]=4 1487 B9R0.13 C\C=C\C[C@H](OC)C(=O)O Amb27230104 [0,1,0,0,0,0|2,0,1]=4 1488 B9R0.13 N#CCCC(C#N)C(=O)O Amb35621637 [0,1,0,0,0,0|2,0,1]=4 1489 B9R0.13 NCC(NCCF)C(=O)O Amb27246937 [0,1,0,0,0,0|3,0,0]=4 1490 B9R0.13 NCC(SCCO)C(=O)O Amb27233935 [0,1,0,0,0,0|3,0,0]=4 1491 B9R0.13 NCCCC(CS)C(=O)O Amb28458435 [0,1,0,0,0,0|3,0,0]=4 1492 B9R0.13 NCCC[C@@H](NN)C(=O)O Amb27768758 [0,1,0,0,0,0|2,0,0]=3 1493 B9R0.13 NCCNC(CN)C(=O)O Amb28454232 [0,1,0,0,0,0|3,0,0]=4 1494 B9R0.42 C#C[C@@H](O)C[C@@H](N)C(=O)O Amb28321822 [0,1,0,0,0,0|1,0,1]=3 1495 B9R0.42 C=C(C)C(N)CC(C)CC Amb28064517 [0,1,0,0,0,0|3,0,0]=4 1496 B9R0.42 C=C(CC(C)CC)C(=O)O Amb27794839 [0,1,0,0,0,0|2,0,1]=4 1497 B9R0.42 C=C(CC(O)CC)C(=O)O Amb27427164 [0,1,0,0,0,0|2,0,1]=4 1498 B9R0.42 C=C(CC)CC(N)C(=O)O Amb28064280 [0,1,0,0,0,0|1,0,1]=3 1499 B9R0.42 C=C(CC)CC(N)C(N)=O Amb24429018 [0,1,0,0,0,0|2,0,1]=4 1500 B9R0.42 C=C(CC)C[C@@H](N)C(=O)O Amb26340266 [0,1,0,0,0,0|1,0,1]=3 1501 B9R0.42 C=C(CC)C[C@H](N)C(=O)O Amb25694434 [0,1,0,0,0,0|1,0,1]=3 1502 B9R0.42 C=CC(C)C[C@H](C)C(=O)O Amb27788729 [0,1,0,0,0,0|2,0,1]=4 1503 B9R0.42 CC(C#N)CC(N)C(=O)O Amb25262927 [0,1,0,0,0,0|2,0,0]=3 1504 B9R0.42 CC(C#N)CC(N)C(N)=O Amb33035593 [0,1,0,0,0,0|3,0,0]=4 1505 B9R0.42 CC(C#N)C[C@@H](N)C(=O)O Amb33127539 [0,1,0,0,0,0|2,0,0]=3 1506 B9R0.42 CC(C#N)C[C@H](N)C(=O)O Amb33036873 [0,1,0,0,0,0|2,0,0]=3 1507 B9R0.42 CC(CF)CC(N)C(=O)O Amb27838056 [0,1,0,0,0,0|2,0,0]=3 1508 B9R0.42 CC(CO)CC(C)C(=O)O Amb27838009 [0,1,0,0,0,0|3,0,0]=4 1509 B9R0.42 CC(CO)CC(N)C(=O)O Amb25147300 [0,1,0,0,0,0|2,0,0]=3 1510 B9R0.42 CC(CO)CC(N)C(N)=O Amb32787927 [0,1,0,0,0,0|3,0,0]=4 1511 B9R0.42 CC(CO)C[C@@H](N)C(=O)O Amb33036727 [0,1,0,0,0,0|2,0,0]=3 1512 B9R0.42 CC(CO)C[C@H](N)C(=O)O Amb32865934 [0,1,0,0,0,0|2,0,0]=3 1513 B9R0.42 CC(C[C@H](N)CS)C(=O)O Amb27981242 [0,1,0,0,0,0|3,0,0]=4 1514 B9R0.42 CCC(=O)CC(N)C(=O)O Amb22546324 [0,1,0,0,0,0|1,0,1]=3 1515 B9R0.42 CCC(=O)CC(N)C(=O)O Amb24479073 [0,1,0,0,0,0|1,0,1]=3 1516 B9R0.42 CCC(=O)CC(N)C(N)=O Amb25129863 [0,1,0,0,0,0|2,0,1]=4 1517 B9R0.42 CCC(=O)CC(O)C(=O)O Amb27655574 [0,1,0,0,0,0|2,0,1]=4 1518 B9R0.42 CCC(=O)C[C@@H](N)C(=O)O Amb26061186 [0,1,0,0,0,0|1,0,1]=3 1519 B9R0.42 CCC(=O)C[C@H](N)C(=O)O Amb24479266 [0,1,0,0,0,0|1,0,1]=3 1520 B9R0.42 CCC(C)CC(=O)C(=O)O Amb27600368 [0,1,0,0,0,0|2,0,1]=4 1521 B9R0.42 CCC(C)CC(Br)C(C)=O Amb27224857 [0,1,0,0,0,0|3,0,0]=4 1522 B9R0.42 CCC(C)CC(C)C(=O)O Amb22228338 [0,1,0,0,0,0|2,0,0]=3 1523 B9R0.42 CCC(C)CC(Cl)C(=O)O Amb28050903 [0,1,0,0,0,0|2,0,0]=3 1524 B9R0.42 CCC(C)CC(Cl)C(N)=O Amb27669368 [0,1,0,0,0,0|3,0,0]=4 1525 B9R0.42 CCC(C)CC(N)C(=O)O Amb18313985 [0,1,0,0,0,0|1,0,0]=2 1526 B9R0.42 CCC(C)CC(N)C(=O)O Amb20667726 [0,1,0,0,0,0|1,0,0]=2 1527 B9R0.42 CCC(C)CC(N)C(N)=O Amb26989566 [0,1,0,0,0,0|2,0,0]=3 1528 B9R0.42 CCC(C)CC(O)C(=O)O Amb25849308 [0,1,0,0,0,0|2,0,0]=3 1529 B9R0.42 CCC(C)CC(S)C(=O)O Amb18798152 [0,1,0,0,0,0|2,0,0]=3 1530 B9R0.42 CCC(C)C[C@@H](C)C(=O)O Amb33727258 [0,1,0,0,0,0|2,0,0]=3 1531 B9R0.42 CCC(C)C[C@@H](N)C(=O)O Amb25127143 [0,1,0,0,0,0|1,0,0]=2 1532 B9R0.42 CCC(C)C[C@H](C)C(=O)O Amb33743264 [0,1,0,0,0,0|2,0,0]=3 1533 B9R0.42 CCC(C)C[C@H](N)C(=O)O Amb27471067 [0,1,0,0,0,0|1,0,0]=2 1534 B9R0.42 CCC(C)C[C@H](N)C(N)=O Amb27429524 [0,1,0,0,0,0|2,0,0]=3 1535 B9R0.42 CCC(C)N[C@@H](C)C(=O)O Amb25691180 [0,1,0,0,0,0|3,0,0]=4 1536 B9R0.42 CCC(C)O[C@@H](C)C(=O)O Amb27395318 [0,1,0,0,0,0|3,0,0]=4 1537 B9R0.42 CCC(C)O[C@H](C)C(=O)O Amb27495202 [0,1,0,0,0,0|3,0,0]=4 1538 B9R0.42 CCC(C)SC(F)C(=O)O Amb27272834 [0,1,0,0,0,0|3,0,0]=4 1539 B9R0.42 CCC(N)CC(N)C(=O)O Amb27205091 [0,1,0,0,0,0|1,0,0]=2 1540 B9R0.42 CCC(O)CC(C)C(=O)O Amb28348984 [0,1,0,0,0,0|2,0,0]=3 1541 B9R0.42 CCC(O)CC(Cl)C(=O)O Amb28244776 [0,1,0,0,0,0|2,0,0]=3 1542 B9R0.42 CCC(O)CC(N)C(=O)O Amb24117068 [0,1,0,0,0,0|1,0,0]=2 1543 B9R0.42 CCC(O)CC(N)C(N)=O Amb33308821 [0,1,0,0,0,0|2,0,0]=3 1544 B9R0.42 CCC(O)CC(O)C(=O)O Amb28050169 [0,1,0,0,0,0|2,0,0]=3 1545 B9R0.42 CCC(O)C[C@@H](N)C(=O)O Amb33065603 [0,1,0,0,0,0|1,0,0]=2 1546 B9R0.42 CCC(O)C[C@H](N)C(=O)O Amb24759913 [0,1,0,0,0,0|1,0,0]=2 1547 B9R0.42 CCN(C)CC(C)C(=O)O Amb8428202 [0,1,0,0,0,0|3,0,0]=4 1548 B9R0.42 CCN(C)CC(C)C(=O)O Amb9173364 [0,1,0,0,0,0|3,0,0]=4 1549 B9R0.42 CCN(C)CC(N)C(=O)O Amb27478110 [0,1,0,0,0,0|2,0,0]=3 1550 B9R0.42 CCN(C)CC(N)C(N)=O Amb27768725 [0,1,0,0,0,0|3,0,0]=4 1551 B9R0.42 CCS(=O)CC(C)C(=O)O Amb19012076 [0,1,0,0,0,0|3,0,0]=4 1552 B9R0.42 CCS(=O)CC(O)C(=O)O Amb28342085 [0,1,0,0,0,0|3,0,0]=4 1553 B9R0.42 CCS(=O)C[C@H](N)C(=O)O Amb28118843 [0,1,0,0,0,0|2,0,0]=3 1554 B9R0.42 CC[C@@H](C)C[C@@H](C)C(=O)O Amb28248596 [0,1,0,0,0,0|2,0,0]=3 1555 B9R0.42 CC[C@@H](C)C[C@H](O)C(=O)O Amb27770344 [0,1,0,0,0,0|2,0,0]=3 1556 B9R0.42 CC[C@H](C)CC(=O)C(=O)O Amb27473360 [0,1,0,0,0,0|2,0,1]=4 1557 B9R0.42 CC[C@H](C)CC(C)C(=O)O Amb27770364 [0,1,0,0,0,0|2,0,0]=3 1558 B9R0.42 CC[C@H](C)CC(N)C(=O)O Amb28364291 [0,1,0,0,0,0|1,0,0]=2 1559 B9R0.42 CC[C@H](C)C[C@H](C)C(=O)O Amb27472997 [0,1,0,0,0,0|2,0,0]=3 1560 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb25662528 [0,1,0,0,0,0|1,0,0]=2 1561 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb33620552 [0,1,0,0,0,0|1,0,0]=2 1562 B9R0.42 CNC(=O)CC(N)C(=O)O Amb27839034 [0,1,0,0,0,0|1,0,1]=3 1563 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O Amb20240891 [0,1,0,0,0,0|1,0,1]=3 1564 B9R0.42 COC(=O)CC(Br)C(=O)O Amb18656998 [0,1,0,0,0,0|1,1,1]=4 1565 B9R0.42 COC(=O)CC(C)C(=O)O Amb18644239 [0,1,0,0,0,0|1,1,1]=4 1566 B9R0.42 COC(=O)CC(Cl)C(=O)O Amb32941126 [0,1,0,0,0,0|1,1,1]=4 1567 B9R0.42 COC(=O)CC(N)C(=O)O Amb22489498 [0,1,0,0,0,0|0,1,1]=3 1568 B9R0.42 COC(=O)CC(N)C(=O)O Amb7172558 [0,1,0,0,0,0|0,1,1]=3 1569 B9R0.42 COC(=O)CC(N)C(=O)O Amb8390391 [0,1,0,0,0,0|0,1,1]=3 1570 B9R0.42 COC(=O)CC(O)C(=O)O Amb25786182 [0,1,0,0,0,0|1,1,1]=4 1571 B9R0.42 COC(=O)C[C@@H](C)C(=O)O Amb3939892 [0,1,0,0,0,0|1,1,1]=4 1572 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb22745861 [0,1,0,0,0,0|0,1,1]=3 1573 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb8385327 [0,1,0,0,0,0|0,1,1]=3 1574 B9R0.42 COC(=O)C[C@@H](O)C(=O)O Amb23603858 [0,1,0,0,0,0|1,1,1]=4 1575 B9R0.42 COC(=O)C[C@H](Br)C(=O)O Amb26619839 [0,1,0,0,0,0|1,1,1]=4 1576 B9R0.42 COC(=O)C[C@H](C)C(=O)O Amb26967622 [0,1,0,0,0,0|1,1,1]=4 1577 B9R0.42 COC(=O)C[C@H](N)C(=O)O Amb8629121 [0,1,0,0,0,0|0,1,1]=3 1578 B9R0.42 COC(=O)C[C@H](O)C(=O)O Amb25367304 [0,1,0,0,0,0|1,1,1]=4 1579 B9R0.42 COC(C)CC(=O)C(=O)O Amb27614317 [0,1,0,0,0,0|1,1,1]=4 1580 B9R0.42 COC(C)CC(C)C(C)=O Amb27841945 [0,1,0,0,0,0|2,1,0]=4 1581 B9R0.42 COC(C)CC(N)C(=O)O Amb25147752 [0,1,0,0,0,0|0,1,0]=2 1582 B9R0.42 COC(C)CC(N)C(N)=O Amb25349298 [0,1,0,0,0,0|1,1,0]=3 1583 B9R0.42 COC(C)CC(O)C(=O)O Amb33353368 [0,1,0,0,0,0|1,1,0]=3 1584 B9R0.42 COC(C)C[C@@H](N)C(=O)O Amb24412403 [0,1,0,0,0,0|0,1,0]=2 1585 B9R0.42 COC(C)C[C@H](N)C(=O)O Amb27801695 [0,1,0,0,0,0|0,1,0]=2 1586 B9R0.42 CSC(C)C[C@H](N)C(=O)O Amb28208334 [0,1,0,0,0,0|0,0,0]=1 1587 B9R0.42 CS[C@@H](C)C[C@@H](N)C(=O)O Amb27755570 [0,1,0,0,0,0|0,0,0]=1 1588 B9R0.42 C[C@@H](CO)C[C@@H](N)C(=O)O Amb27398331 [0,1,0,0,0,0|2,0,0]=3 1589 B9R0.42 C[C@@H](C[C@@H](O)CN)C(=O)O Amb27768864 [0,1,0,0,0,0|3,0,0]=4 1590 B9R0.42 C[C@H](CO)C[C@H](N)C(=O)O Amb27625117 [0,1,0,0,0,0|2,0,0]=3 1591 B9R0.42 C[C@H](C[C@@H](O)CN)C(=O)O Amb27169198 [0,1,0,0,0,0|3,0,0]=4 1592 B9R0.42 C\C(=C/Cl)CC(N)C(=O)O Amb25934493 [0,1,0,0,0,0|2,0,1]=4 1593 B9R0.42 C\C(=C/Cl)C[C@@H](N)C(=O)O Amb27168937 [0,1,0,0,0,0|2,0,1]=4 1594 B9R0.42 C\C(=C/Cl)C[C@H](N)C(=O)O Amb26888703 [0,1,0,0,0,0|2,0,1]=4 1595 B9R0.42 C\C=C(/C)C[C@H](N)C(=O)O Amb27827659 [0,1,0,0,0,0|1,0,1]=3 1596 B9R0.42 NC(=O)C(N)CC(O)CF Amb33308795 [0,1,0,0,0,0|3,0,0]=4 1597 B9R0.42 NC(=O)C(N)CC(O)CO Amb33066193 [0,1,0,0,0,0|3,0,0]=4 1598 B9R0.42 NC(CC(=O)CI)C(=O)O Amb27803464 [0,1,0,0,0,0|2,0,1]=4 1599 B9R0.42 NC(CC(=O)CO)C(=O)O Amb18644310 [0,1,0,0,0,0|2,0,1]=4 1600 B9R0.42 NC(CC(=O)NO)C(=O)O Amb22349932 [0,1,0,0,0,0|2,0,1]=4 1601 B9R0.42 NC(CC(F)CO)C(=O)O Amb27632459 [0,1,0,0,0,0|2,0,0]=3 1602 B9R0.42 NC(CC(O)C=O)C(=O)O Amb28126784 [0,1,0,0,0,0|2,0,0]=3 1603 B9R0.42 NC(CC(O)CF)C(=O)O Amb33065776 [0,1,0,0,0,0|2,0,0]=3 1604 B9R0.42 NC(CC(O)CO)C(=O)O Amb18644388 [0,1,0,0,0,0|2,0,0]=3 1605 B9R0.42 NC(CC(O)CO)C(=O)O Amb24117285 [0,1,0,0,0,0|2,0,0]=3 1606 B9R0.42 NC(C\C(Cl)=C\Cl)C(=O)O Amb27232854 [0,1,0,0,0,0|2,0,1]=4 1607 B9R0.42 NCC(F)C[C@H](N)C(=O)O Amb28126719 [0,1,0,0,0,0|2,0,0]=3 1608 B9R0.42 NCC(O)CC(N)C(=O)O Amb30988061 [0,1,0,0,0,0|2,0,0]=3 1609 B9R0.42 NCC(O)CC(O)C(=O)O Amb27170737 [0,1,0,0,0,0|3,0,0]=4 1610 B9R0.42 NC[C@H](O)CC(O)C(=O)O Amb27590744 [0,1,0,0,0,0|3,0,0]=4 1611 B9R0.42 NNC(=O)C[C@H](N)C(=O)O Amb24680907 [0,1,0,0,0,0|2,0,1]=4 1612 B9R0.42 N[C@@H](CC(=O)CCl)C(=O)O Amb27168692 [0,1,0,0,0,0|2,0,1]=4 1613 B9R0.42 N[C@@H](CC(=O)CI)C(=O)O Amb27248631 [0,1,0,0,0,0|2,0,1]=4 1614 B9R0.42 N[C@@H](CC(=O)CO)C(=O)O Amb28050099 [0,1,0,0,0,0|2,0,1]=4 1615 B9R0.42 N[C@@H](CC(=O)NO)C(=O)O Amb28320876 [0,1,0,0,0,0|2,0,1]=4 1616 B9R0.42 N[C@@H](CC(O)CCl)C(=O)O Amb27837835 [0,1,0,0,0,0|2,0,0]=3 1617 B9R0.42 N[C@@H](CC(O)CF)C(=O)O Amb33036578 [0,1,0,0,0,0|2,0,0]=3 1618 B9R0.42 N[C@@H](CC(O)CO)C(=O)O Amb25870815 [0,1,0,0,0,0|2,0,0]=3 1619 B9R0.42 N[C@@H](CN(O)N=O)C(=O)O Amb17607759 [0,1,0,0,0,0|3,0,0]=4 1620 B9R0.42 N[C@H](CC(O)CF)C(=O)O Amb32796094 [0,1,0,0,0,0|2,0,0]=3 1621 B9R0.42 N[C@H](CC(O)CO)C(=O)O Amb33036156 [0,1,0,0,0,0|2,0,0]=3 1622 B9R0.42 N[C@H](CN(O)N=O)C(=O)O Amb27976802 [0,1,0,0,0,0|3,0,0]=4 1623 B9R0.42 N\C=C(/N)CC(N)C(=O)O Amb28250396 [0,1,0,0,0,0|2,0,1]=4 1624 B9R0.42 O=C(O)C(Br)CC(Br)CCl Amb28315583 [0,1,0,0,0,0|3,0,0]=4 1625 B9R0.42 O=C(O)C(O)C[C@H](O)CO Amb27984868 [0,1,0,0,0,0|3,0,0]=4 1626 B9R0.47 C#CCCCC(N)C(=O)O Amb27947457 [0,1,0,0,0,0|1,0,1]=3 1627 B9R0.47 C#CCCCC(N)C(=O)O Amb33483976 [0,1,0,0,0,0|1,0,1]=3 1628 B9R0.47 C#CCCCC(N)C(N)=O Amb26967363 [0,1,0,0,0,0|2,0,1]=4 1629 B9R0.47 C#CCCC[C@@H](N)C(=O)O Amb24077358 [0,1,0,0,0,0|1,0,1]=3 1630 B9R0.47 C#CCCC[C@H](N)C(=O)O Amb24088878 [0,1,0,0,0,0|1,0,1]=3 1631 B9R0.47 C#CCCN[C@H](C)C(=O)O Amb27495158 [0,1,0,0,0,0|2,0,1]=4 1632 B9R0.47 C#CCNCC(C)C(=O)O Amb9400290 [0,1,0,0,0,0|2,0,1]=4 1633 B9R0.47 C#CCNCC(O)C(=O)O Amb27486394 [0,1,0,0,0,0|2,0,1]=4 1634 B9R0.47 C#CCNC[C@H](S)C(=O)O Amb28077797 [0,1,0,0,0,0|2,0,1]=4 1635 B9R0.47 C#CCOC[C@H](N)C(=O)O Amb27644036 [0,1,0,0,0,0|1,0,1]=3 1636 B9R0.47 C#CCSCC(N)C(=O)O Amb6275547 [0,1,0,0,0,0|1,0,1]=3 1637 B9R0.47 C#CCSC[C@H](N)C(=O)O Amb17935864 [0,1,0,0,0,0|1,0,1]=3 1638 B9R0.47 C#C\C=C\CC(N)C(=O)O Amb25147384 [0,1,0,0,0,0|1,0,2]=4 1639 B9R0.47 C=C(C)C(N)CCCOC Amb28455830 [0,1,0,0,0,0|2,1,0]=4 1640 B9R0.47 C=C(C)C(O)CCCSC Amb27978956 [0,1,0,0,0,0|3,0,0]=4 1641 B9R0.47 C=C(CCCNC)C(=O)O Amb28050053 [0,1,0,0,0,0|2,0,1]=4 1642 B9R0.47 C=CCCCC(N)C(=O)O Amb22002149 [0,1,0,0,0,0|1,0,1]=3 1643 B9R0.47 C=CCCCC(N)C(=O)O Amb32752542 [0,1,0,0,0,0|1,0,1]=3 1644 B9R0.47 C=CCCCC(N)C(N)=O Amb25988690 [0,1,0,0,0,0|2,0,1]=4 1645 B9R0.47 C=CCCC[C@@H](N)C(=O)O Amb22831130 [0,1,0,0,0,0|1,0,1]=3 1646 B9R0.47 C=CCCC[C@@H](N)C(=O)O Amb32687472 [0,1,0,0,0,0|1,0,1]=3 1647 B9R0.47 C=CCCC[C@H](N)C(=O)O Amb2699129 [0,1,0,0,0,0|1,0,1]=3 1648 B9R0.47 C=CCCOC(C)C(=O)O Amb9208711 [0,1,0,0,0,0|2,0,1]=4 1649 B9R0.47 C=CCCO[C@@H](C)C(=O)O Amb27254188 [0,1,0,0,0,0|2,0,1]=4 1650 B9R0.47 C=CCCO[C@H](C)C(=O)O Amb27976475 [0,1,0,0,0,0|2,0,1]=4 1651 B9R0.47 C=CCNCC(N)C(=O)O Amb27945606 [0,1,0,0,0,0|1,0,1]=3 1652 B9R0.47 C=CCOCC(N)C(=O)O Amb28048879 [0,1,0,0,0,0|1,0,1]=3 1653 B9R0.47 C=CCOCC(N)C(N)=O Amb26499253 [0,1,0,0,0,0|2,0,1]=4 1654 B9R0.47 C=CCOC[C@@H](N)C(=O)O Amb31030961 [0,1,0,0,0,0|1,0,1]=3 1655 B9R0.47 C=CCOC[C@@H](N)C(=O)O Amb32941137 [0,1,0,0,0,0|1,0,1]=3 1656 B9R0.47 C=CCOC[C@H](N)C(=O)O Amb24713287 [0,1,0,0,0,0|1,0,1]=3 1657 B9R0.47 C=CCSCC(C)C(=O)O Amb27813038 [0,1,0,0,0,0|2,0,1]=4 1658 B9R0.47 C=CCSCC(Cl)C(=O)O Amb27635176 [0,1,0,0,0,0|2,0,1]=4 1659 B9R0.47 C=CCSCC(N)C(=O)O Amb6270069 [0,1,0,0,0,0|1,0,1]=3 1660 B9R0.47 C=CCSCC(O)C(=O)O Amb27639084 [0,1,0,0,0,0|2,0,1]=4 1661 B9R0.47 C=CCSC[C@@H](C)C(=O)O Amb27955284 [0,1,0,0,0,0|2,0,1]=4 1662 B9R0.47 C=CCSC[C@@H](N)C(=O)O Amb10843878 [0,1,0,0,0,0|1,0,1]=3 1663 B9R0.47 C=CCSC[C@H](N)C(=O)O Amb22231426 [0,1,0,0,0,0|1,0,1]=3 1664 B9R0.47 C=CCSC[C@H](N)C(N)=O Amb28410940 [0,1,0,0,0,0|2,0,1]=4 1665 B9R0.47 C=CSCCC(N)C(=O)O Amb26658187 [0,1,0,0,0,0|0,0,1]=2 1666 B9R0.47 C=C\C=C\CC(N)C(=O)O Amb18643715 [0,1,0,0,0,0|1,0,2]=4 1667 B9R0.47 CC#CCCC(=O)C(=O)O Amb27867548 [0,1,0,0,0,0|2,0,1]=4 1668 B9R0.47 CC#CCCC(C)C(=O)O Amb27412753 [0,1,0,0,0,0|2,0,0]=3 1669 B9R0.47 CC#CCCC(N)C(=O)O Amb28285646 [0,1,0,0,0,0|1,0,0]=2 1670 B9R0.47 CC#CCCC(N)C(N)=O Amb26893252 [0,1,0,0,0,0|2,0,0]=3 1671 B9R0.47 CC#CCCC(O)C(=O)O Amb27615159 [0,1,0,0,0,0|2,0,0]=3 1672 B9R0.47 CC#CCC[C@@H](N)C(=O)O Amb25835847 [0,1,0,0,0,0|1,0,0]=2 1673 B9R0.47 CC#CCC[C@H](N)C(=O)O Amb28368944 [0,1,0,0,0,0|1,0,0]=2 1674 B9R0.47 CC#CCNC(C)C(=O)O Amb27604977 [0,1,0,0,0,0|2,0,1]=4 1675 B9R0.47 CC(=O)C(C)CCCCO Amb27787398 [0,1,0,0,0,0|3,0,0]=4 1676 B9R0.47 CC(CCCCBr)C(=O)O Amb27790626 [0,1,0,0,0,0|2,0,0]=3 1677 B9R0.47 CC(CCCCF)C(=O)O Amb24370978 [0,1,0,0,0,0|2,0,0]=3 1678 B9R0.47 CC(CCCCN)C(=O)O Amb31031269 [0,1,0,0,0,0|2,0,0]=3 1679 B9R0.47 CC(CCCCO)C(=O)O Amb28040862 [0,1,0,0,0,0|2,0,0]=3 1680 B9R0.47 CC(CCN=C=O)C(=O)O Amb33471413 [0,1,0,0,0,0|2,0,1]=4 1681 B9R0.47 CC(CCN=C=S)C(=O)O Amb33471646 [0,1,0,0,0,0|2,0,1]=4 1682 B9R0.47 CC(CCN=[N+]=[N-])C(=O)O Amb27455144 [0,1,0,0,0,0|3,0,0]=4 1683 B9R0.47 CC(CCNC=O)C(=O)O Amb27474434 [0,1,0,0,0,0|2,0,1]=4 1684 B9R0.47 CC(CNCCCl)C(=O)O Amb27974547 [0,1,0,0,0,0|3,0,0]=4 1685 B9R0.47 CC(CNCCN)C(=O)O Amb27398545 [0,1,0,0,0,0|3,0,0]=4 1686 B9R0.47 CC(CSCC#N)C(=O)O Amb27410286 [0,1,0,0,0,0|3,0,0]=4 1687 B9R0.47 CC(CSCCN)C(=O)O Amb18788221 [0,1,0,0,0,0|3,0,0]=4 1688 B9R0.47 CC(CSCCN)C(=O)O Amb28555435 [0,1,0,0,0,0|3,0,0]=4 1689 B9R0.47 CC(NCCC#N)C(=O)O Amb4019288 [0,1,0,0,0,0|3,0,0]=4 1690 B9R0.47 CC(OCCCN)C(=O)O Amb18111477 [0,1,0,0,0,0|3,0,0]=4 1691 B9R0.47 CC(SCCC#N)C(=O)O Amb17502364 [0,1,0,0,0,0|3,0,0]=4 1692 B9R0.47 CC(SCCCF)C(=O)O Amb28049559 [0,1,0,0,0,0|3,0,0]=4 1693 B9R0.47 CC(SCCCN)C(=O)O Amb17500677 [0,1,0,0,0,0|3,0,0]=4 1694 B9R0.47 CC(SCCCS)C(=O)O Amb18648366 [0,1,0,0,0,0|3,0,0]=4 1695 B9R0.47 CCCCCC(=O)C(=O)O Amb18644122 [0,1,0,0,0,0|2,0,1]=4 1696 B9R0.47 CCCCCC(Br)C(=O)O Amb18130346 [0,1,0,0,0,0|2,0,0]=3 1697 B9R0.47 CCCCCC(Br)C(C)=O Amb26057111 [0,1,0,0,0,0|3,0,0]=4 1698 B9R0.47 CCCCCC(C)C(=O)Cl Amb25127828 [0,1,0,0,0,0|3,0,0]=4 1699 B9R0.47 CCCCCC(Cl)C(=O)Cl Amb27845364 [0,1,0,0,0,0|3,0,0]=4 1700 B9R0.47 CCCCCC(F)C(=O)O Amb17593693 [0,1,0,0,0,0|2,0,0]=3 1701 B9R0.47 CCCCCC(N)C(=O)O Amb4134810 [0,1,0,0,0,0|1,0,0]=2 1702 B9R0.47 CCCCCC(N)C(N)=O Amb25843277 [0,1,0,0,0,0|2,0,0]=3 1703 B9R0.47 CCCCCC(N)[PH](=O)O Amb28421761 [0,1,0,0,0,0|2,0,0]=3 1704 B9R0.47 CCCCCC(O)C(=O)O Amb17778103 [0,1,0,0,0,0|2,0,0]=3 1705 B9R0.47 CCCCCC(O)C(C)=O Amb27658218 [0,1,0,0,0,0|3,0,0]=4 1706 B9R0.47 CCCCCC(S)C(=O)O Amb27657706 [0,1,0,0,0,0|2,0,0]=3 1707 B9R0.47 CCCCC[C@@H](Br)C(=O)O Amb27234856 [0,1,0,0,0,0|2,0,0]=3 1708 B9R0.47 CCCCC[C@@H](C)C(C)=O Amb28202105 [0,1,0,0,0,0|3,0,0]=4 1709 B9R0.47 CCCCC[C@@H](N)C(=O)O Amb22745982 [0,1,0,0,0,0|1,0,0]=2 1710 B9R0.47 CCCCC[C@@H](O)C(=O)O Amb28050131 [0,1,0,0,0,0|2,0,0]=3 1711 B9R0.47 CCCCC[C@@H](O)C(C)=O Amb24480618 [0,1,0,0,0,0|3,0,0]=4 1712 B9R0.47 CCCCC[C@H](Br)C(=O)O Amb28287684 [0,1,0,0,0,0|2,0,0]=3 1713 B9R0.47 CCCCC[C@H](C)C(=O)O Amb10844510 [0,1,0,0,0,0|2,0,0]=3 1714 B9R0.47 CCCCC[C@H](F)C(=O)O Amb27784296 [0,1,0,0,0,0|2,0,0]=3 1715 B9R0.47 CCCCC[C@H](N)C(=O)O Amb17943098 [0,1,0,0,0,0|1,0,0]=2 1716 B9R0.47 CCCCC[C@H](N)[C@H](C)O Amb28250851 [0,1,0,0,0,0|2,0,1]=4 1717 B9R0.47 CCCCNC(=O)C(=O)O Amb9303865 [0,1,0,0,0,0|2,0,1]=4 1718 B9R0.47 CCCCNC(=S)C(=O)O Amb27657804 [0,1,0,0,0,0|2,0,1]=4 1719 B9R0.47 CCCCNC(C)C(=O)O Amb9326961 [0,1,0,0,0,0|2,0,0]=3 1720 B9R0.47 CCCCNC(C)C(N)=O Amb9203273 [0,1,0,0,0,0|3,0,0]=4 1721 B9R0.47 CCCCN[C@@H](C)C(=O)O Amb27192156 [0,1,0,0,0,0|2,0,0]=3 1722 B9R0.47 CCCCN[C@H](C)C(=O)O Amb27461559 [0,1,0,0,0,0|2,0,0]=3 1723 B9R0.47 CCCCOC(=O)C(=O)O Amb26367223 [0,1,0,0,0,0|2,0,1]=4 1724 B9R0.47 CCCCOC(C)C(=O)O Amb8894957 [0,1,0,0,0,0|2,0,0]=3 1725 B9R0.47 CCCCOC(C)C(N)=O Amb27852771 [0,1,0,0,0,0|3,0,0]=4 1726 B9R0.47 CCCCOC(F)C(=O)O Amb27174586 [0,1,0,0,0,0|2,0,0]=3 1727 B9R0.47 CCCCO[C@@H](C)C(=O)O Amb27216767 [0,1,0,0,0,0|2,0,0]=3 1728 B9R0.47 CCCCSC(C)C(=O)O Amb6273551 [0,1,0,0,0,0|2,0,0]=3 1729 B9R0.47 CCCCSC(F)C(=O)O Amb27850941 [0,1,0,0,0,0|2,0,0]=3 1730 B9R0.47 CCCCSC(N)C(=O)O Amb27760526 [0,1,0,0,0,0|1,0,0]=2 1731 B9R0.47 CCCCS[C@@H](C)C(=O)O Amb27408996 [0,1,0,0,0,0|2,0,0]=3 1732 B9R0.47 CCCC\C=C(/Br)C(=O)O Amb27615132 [0,1,0,0,0,0|2,0,1]=4 1733 B9R0.47 CCCC\C=C(\C)C(=O)O Amb27637394 [0,1,0,0,0,0|2,0,1]=4 1734 B9R0.47 CCCC\C=C(\F)C(=O)O Amb28197633 [0,1,0,0,0,0|2,0,1]=4 1735 B9R0.47 CCCC\C=C(\N)C(N)=O Amb27473333 [0,1,0,0,0,0|2,0,1]=4 1736 B9R0.47 CCCNCC(N)C(N)=O Amb27952357 [0,1,0,0,0,0|2,0,0]=3 1737 B9R0.47 CCCNCC(O)C(N)=O Amb27875874 [0,1,0,0,0,0|3,0,0]=4 1738 B9R0.47 CCCOCC(=O)C(=O)O Amb27787004 [0,1,0,0,0,0|2,0,1]=4 1739 B9R0.47 CCCOCC(Br)C(=O)O Amb27625667 [0,1,0,0,0,0|2,0,0]=3 1740 B9R0.47 CCCOCC(N)C(=O)O Amb24621740 [0,1,0,0,0,0|1,0,0]=2 1741 B9R0.47 CCCOCC(N)C(N)=O Amb27155900 [0,1,0,0,0,0|2,0,0]=3 1742 B9R0.47 CCCOC[C@@H](N)C(=O)O Amb27480715 [0,1,0,0,0,0|1,0,0]=2 1743 B9R0.47 CCCOC[C@H](N)C(=O)O Amb27223143 [0,1,0,0,0,0|1,0,0]=2 1744 B9R0.47 CCCSCC(C)C(C)=O Amb27262876 [0,1,0,0,0,0|3,0,0]=4 1745 B9R0.47 CCCSCC(N)C(=O)O Amb6265881 [0,1,0,0,0,0|1,0,0]=2 1746 B9R0.47 CCCSCC(N)C(=O)O Amb9176295 [0,1,0,0,0,0|1,0,0]=2 1747 B9R0.47 CCCSC[C@H](N)C(=O)O Amb27471340 [0,1,0,0,0,0|1,0,0]=2 1748 B9R0.47 CCC\C=C/C(N)C(N)=O Amb28249181 [0,1,0,0,0,0|2,0,1]=4 1749 B9R0.47 CCC\C=C\C(C)C(=O)O Amb33449140 [0,1,0,0,0,0|2,0,1]=4 1750 B9R0.47 CCC\C=C\C(O)C(=O)O Amb32668856 [0,1,0,0,0,0|2,0,1]=4 1751 B9R0.47 CCC\C=C\[C@@H](N)C(=O)O Amb27230868 [0,1,0,0,0,0|1,0,1]=3 1752 B9R0.47 CCNCCC(C)C(=O)O Amb27473572 [0,1,0,0,0,0|2,0,0]=3 1753 B9R0.47 CCNCCC(N)C(=O)O Amb932772 [0,1,0,0,0,0|1,0,0]=2 1754 B9R0.47 CCNCC[C@@H](N)C(=O)O Amb28520031 [0,1,0,0,0,0|1,0,0]=2 1755 B9R0.47 CCOCCC(C)C(C)=O Amb27837597 [0,1,0,0,0,0|2,1,0]=4 1756 B9R0.47 CCOCCC(N)C(=O)O Amb32671298 [0,1,0,0,0,0|0,1,0]=2 1757 B9R0.47 CCOCCC(N)C(=O)O Amb9316664 [0,1,0,0,0,0|0,1,0]=2 1758 B9R0.47 CCOCCC(N)C(C)=O Amb28055992 [0,1,0,0,0,0|1,1,0]=3 1759 B9R0.47 CCOCCC(N)C(N)=O Amb25354003 [0,1,0,0,0,0|1,1,0]=3 1760 B9R0.47 CCOCC[C@@H](N)C(=O)O Amb28187742 [0,1,0,0,0,0|0,1,0]=2 1761 B9R0.47 CCOCC[C@H](N)C(=O)O Amb26612670 [0,1,0,0,0,0|0,1,0]=2 1762 B9R0.47 CCOCOC(C)C(=O)O Amb27426180 [0,1,0,0,0,0|2,1,0]=4 1763 B9R0.47 CCOCO[C@H](C)C(=O)O Amb27765041 [0,1,0,0,0,0|2,1,0]=4 1764 B9R0.47 CCONCC(C)C(=O)O Amb27265783 [0,1,0,0,0,0|2,1,0]=4 1765 B9R0.47 CCONCC(N)C(N)=O Amb28045946 [0,1,0,0,0,0|2,1,0]=4 1766 B9R0.47 CCSCCC(=O)C(=O)O Amb26652044 [0,1,0,0,0,0|1,0,1]=3 1767 B9R0.47 CCSCCC(C)C(=O)O Amb10844082 [0,1,0,0,0,0|1,0,0]=2 1768 B9R0.47 CCSCCC(C)C(C)O Amb27762859 [0,1,0,0,0,0|2,0,1]=4 1769 B9R0.47 CCSCCC(Cl)C(N)=O Amb27614970 [0,1,0,0,0,0|2,0,0]=3 1770 B9R0.47 CCSCCC(N)C(=O)O Amb2137050 [0,1,0,0,0,0|0,0,0]=1 1771 B9R0.47 CCSCCC(N)C(N)=O Amb18177774 [0,1,0,0,0,0|1,0,0]=2 1772 B9R0.47 CCSCCC(O)C(=O)O Amb24482157 [0,1,0,0,0,0|1,0,0]=2 1773 B9R0.47 CCSCCC(O)C(N)=O Amb26926790 [0,1,0,0,0,0|2,0,0]=3 1774 B9R0.47 CCSCC[C@@H](N)C(=O)O Amb17613843 [0,1,0,0,0,0|0,0,0]=1 1775 B9R0.47 CCSCC[C@H](N)C(=O)O Amb17613844 [0,1,0,0,0,0|0,0,0]=1 1776 B9R0.47 CCSSCC(N)C(N)=O Amb27201565 [0,1,0,0,0,0|2,0,0]=3 1777 B9R0.47 CC\C=C\CC(C)C(=O)O Amb27838058 [0,1,0,0,0,0|2,0,1]=4 1778 B9R0.47 CC\C=C\CC(N)C(=O)O Amb25255710 [0,1,0,0,0,0|1,0,1]=3 1779 B9R0.47 CC\C=C\CC(N)C(=O)O Amb30666656 [0,1,0,0,0,0|1,0,1]=3 1780 B9R0.47 CNCCCC(N)C(=O)O Amb18644279 [0,1,0,0,0,0|1,0,0]=2 1781 B9R0.47 CNCCNC(=O)C(=O)O Amb18644254 [0,1,0,0,0,0|2,0,1]=4 1782 B9R0.47 CNCCOC(C)C(=O)O Amb18630742 [0,1,0,0,0,0|2,0,0]=3 1783 B9R0.47 CNCCOC(C)C(C)=O Amb18111841 [0,1,0,0,0,0|3,0,0]=4 1784 B9R0.47 CNOCC[C@H](N)C(=O)O Amb27405026 [0,1,0,0,0,0|0,1,0]=2 1785 B9R0.47 COCCCC(=O)C(=O)O Amb28050154 [0,1,0,0,0,0|1,1,1]=4 1786 B9R0.47 COCCCC(C)C(=O)O Amb26653888 [0,1,0,0,0,0|1,1,0]=3 1787 B9R0.47 COCCCC(C)C(C)=O Amb27657482 [0,1,0,0,0,0|2,1,0]=4 1788 B9R0.47 COCCCC(C)C(N)=O Amb28190149 [0,1,0,0,0,0|2,1,0]=4 1789 B9R0.47 COCCCC(N)C(=O)O Amb22058809 [0,1,0,0,0,0|0,1,0]=2 1790 B9R0.47 COCCCC(N)C(=O)O Amb33549526 [0,1,0,0,0,0|0,1,0]=2 1791 B9R0.47 COCCCC(N)C(N)=O Amb26331697 [0,1,0,0,0,0|1,1,0]=3 1792 B9R0.47 COCCCC(O)C(=O)O Amb28050541 [0,1,0,0,0,0|1,1,0]=3 1793 B9R0.47 COCCC[C@@H](N)C(=O)O Amb25081508 [0,1,0,0,0,0|0,1,0]=2 1794 B9R0.47 COCCC[C@H](N)C(=O)O Amb25378737 [0,1,0,0,0,0|0,1,0]=2 1795 B9R0.47 COCCNC(=O)C(=O)O Amb9303795 [0,1,0,0,0,0|1,1,1]=4 1796 B9R0.47 COCCNC(C)C(=O)O Amb33069032 [0,1,0,0,0,0|1,1,0]=3 1797 B9R0.47 COCCNC(C)C(=O)O Amb9326996 [0,1,0,0,0,0|1,1,0]=3 1798 B9R0.47 COCCNC(C)C(N)=O Amb19222868 [0,1,0,0,0,0|2,1,0]=4 1799 B9R0.47 COCCNC(C)C(N)=O Amb9203267 [0,1,0,0,0,0|2,1,0]=4 1800 B9R0.47 COCCN[C@@H](C)C(=O)O Amb27164971 [0,1,0,0,0,0|1,1,0]=3 1801 B9R0.47 COCCN[C@H](C)C(=O)O Amb27454332 [0,1,0,0,0,0|1,1,0]=3 1802 B9R0.47 COCCOC(C)C(=O)O Amb9719532 [0,1,0,0,0,0|1,1,0]=3 1803 B9R0.47 COCCO[C@H](C)C(=O)O Amb27783895 [0,1,0,0,0,0|1,1,0]=3 1804 B9R0.47 COCOCC(C)C(=O)O Amb27667113 [0,1,0,0,0,0|1,1,0]=3 1805 B9R0.47 COCSCC(C)C(=O)O Amb27474867 [0,1,0,0,0,0|1,1,0]=3 1806 B9R0.47 CONCC[C@H](N)C(=O)O Amb27623933 [0,1,0,0,0,0|0,1,0]=2 1807 B9R0.47 CO\C=C\CC(O)C(=O)O Amb28050044 [0,1,0,0,0,0|1,1,1]=4 1808 B9R0.47 CSCCCC(=O)C(=O)O Amb27490899 [0,1,0,0,0,0|1,0,1]=3 1809 B9R0.47 CSCCCC(C)C(=O)O Amb25888073 [0,1,0,0,0,0|1,0,0]=2 1810 B9R0.47 CSCCCC(C)C(C)=O Amb27841950 [0,1,0,0,0,0|2,0,0]=3 1811 B9R0.47 CSCCCC(Cl)C(N)=O Amb27588927 [0,1,0,0,0,0|2,0,0]=3 1812 B9R0.47 CSCCCC(N)C(=O)O Amb17594057 [0,1,0,0,0,0|0,0,0]=1 1813 B9R0.47 CSCCCC(N)C(=O)O Amb35789017 [0,1,0,0,0,0|0,0,0]=1 1814 B9R0.47 CSCCCC(N)C(C)C Amb27494428 [0,1,0,0,0,0|2,0,1]=4 1815 B9R0.47 CSCCCC(N)C(N)=O Amb27770389 [0,1,0,0,0,0|1,0,0]=2 1816 B9R0.47 CSCCCC(O)C(=O)O Amb25169340 [0,1,0,0,0,0|1,0,0]=2 1817 B9R0.47 CSCCCC(O)C(N)=O Amb27197765 [0,1,0,0,0,0|2,0,0]=3 1818 B9R0.47 CSCCC[C@@H](N)C(=O)O Amb27233529 [0,1,0,0,0,0|0,0,0]=1 1819 B9R0.47 CSCCC[C@H](N)C(=O)O Amb27858783 [0,1,0,0,0,0|0,0,0]=1 1820 B9R0.47 CSCCNC(=O)C(=O)O Amb27402874 [0,1,0,0,0,0|1,0,1]=3 1821 B9R0.47 CSCCNC(C)C(C)O Amb27405157 [0,1,0,0,0,0|2,0,1]=4 1822 B9R0.47 CSCCNC(C)C(N)=O Amb27400757 [0,1,0,0,0,0|2,0,0]=3 1823 B9R0.47 CSCCOC(C)C(=O)O Amb24482366 [0,1,0,0,0,0|1,0,0]=2 1824 B9R0.47 CSCCO[C@H](C)C(=O)O Amb27865202 [0,1,0,0,0,0|1,0,0]=2 1825 B9R0.47 CSCCSC(C)C(=O)O Amb28291750 [0,1,0,0,0,0|1,0,0]=2 1826 B9R0.47 CSCC\C=C(\C)C(=O)O Amb27449576 [0,1,0,0,0,0|1,0,1]=3 1827 B9R0.47 CSCSC[C@H](N)C(=O)O Amb26874540 [0,1,0,0,0,0|0,0,0]=1 1828 B9R0.47 CSSCCC(N)C(=O)O Amb28456103 [0,1,0,0,0,0|0,0,0]=1 1829 B9R0.47 C[C@@H](CCCCBr)C(=O)O Amb27794794 [0,1,0,0,0,0|2,0,0]=3 1830 B9R0.47 C[C@@H](NCCC#N)C(=O)O Amb27445400 [0,1,0,0,0,0|3,0,0]=4 1831 B9R0.47 C[C@@H](NCCCN)C(=O)O Amb25710680 [0,1,0,0,0,0|3,0,0]=4 1832 B9R0.47 C[C@@H](OCCCN)C(=O)O Amb27465122 [0,1,0,0,0,0|3,0,0]=4 1833 B9R0.47 C[C@H](NCCCO)C(=O)O Amb27454333 [0,1,0,0,0,0|3,0,0]=4 1834 B9R0.47 C\C=C\CCC(C)C(=O)O Amb27461427 [0,1,0,0,0,0|2,0,0]=3 1835 B9R0.47 C\C=C\CCC(N)C(=O)O Amb27770583 [0,1,0,0,0,0|1,0,0]=2 1836 B9R0.47 C\C=C\CN[C@@H](C)C(=O)O Amb27601181 [0,1,0,0,0,0|2,0,1]=4 1837 B9R0.47 C\C=C\CN[C@H](C)C(=O)O Amb27440981 [0,1,0,0,0,0|2,0,1]=4 1838 B9R0.47 C\C=C\CO[C@@H](C)C(=O)O Amb27426114 [0,1,0,0,0,0|2,0,1]=4 1839 B9R0.47 C\C=C\CO[C@H](C)C(=O)O Amb28384040 [0,1,0,0,0,0|2,0,1]=4 1840 B9R0.47 N#CCCCC(Cl)C(=O)O Amb17594023 [0,1,0,0,0,0|2,0,1]=4 1841 B9R0.47 N#CCCCC(N)C(=O)O Amb25242567 [0,1,0,0,0,0|1,0,1]=3 1842 B9R0.47 N#CCCCC(N)C(N)=O Amb33308858 [0,1,0,0,0,0|2,0,1]=4 1843 B9R0.47 N#CCCC[C@@H](N)C(=O)O Amb28349132 [0,1,0,0,0,0|1,0,1]=3 1844 B9R0.47 N#CCCC[C@H](N)C(=O)O Amb26043277 [0,1,0,0,0,0|1,0,1]=3 1845 B9R0.47 N#CCSC[C@H](N)C(=O)O Amb18179968 [0,1,0,0,0,0|2,0,0]=3 1846 B9R0.47 N#CNCCC(N)C(=O)O Amb27180972 [0,1,0,0,0,0|1,0,1]=3 1847 B9R0.47 N#CSCCC(N)C(=O)O Amb27984671 [0,1,0,0,0,0|0,0,1]=2 1848 B9R0.47 N#CSSCC(N)C(=O)O Amb27232837 [0,1,0,0,0,0|1,0,1]=3 1849 B9R0.47 NC(=O)C(N)CCCCBr Amb28313246 [0,1,0,0,0,0|2,0,0]=3 1850 B9R0.47 NC(=O)C(N)CCCCF Amb27977425 [0,1,0,0,0,0|2,0,0]=3 1851 B9R0.47 NC(=O)C(N)CCCCO Amb33065912 [0,1,0,0,0,0|2,0,0]=3 1852 B9R0.47 NC(CC#CCCl)C(=O)O Amb28123330 [0,1,0,0,0,0|1,0,1]=3 1853 B9R0.47 NC(CCCCF)C(=O)O Amb28193271 [0,1,0,0,0,0|1,0,0]=2 1854 B9R0.47 NC(CCCCO)C(=O)O Amb2699159 [0,1,0,0,0,0|1,0,0]=2 1855 B9R0.47 NC(CCSN=O)C(=O)O Amb26516416 [0,1,0,0,0,0|1,0,0]=2 1856 B9R0.47 NC(COCCCl)C(=O)O Amb18126477 [0,1,0,0,0,0|2,0,0]=3 1857 B9R0.47 NC(CSCCO)C(=O)O Amb6262852 [0,1,0,0,0,0|2,0,0]=3 1858 B9R0.47 NC(CSCCS)C(=O)O Amb27837996 [0,1,0,0,0,0|2,0,0]=3 1859 B9R0.47 NC(CS\C=C\Cl)C(=O)O Amb28325993 [0,1,0,0,0,0|2,0,1]=4 1860 B9R0.47 NC(C\C=C/CO)C(=O)O Amb28046143 [0,1,0,0,0,0|1,0,1]=3 1861 B9R0.47 NCC#CCC(N)C(=O)O Amb25369913 [0,1,0,0,0,0|1,0,1]=3 1862 B9R0.47 NCC#CCC(N)C(=O)O Amb28555546 [0,1,0,0,0,0|1,0,1]=3 1863 B9R0.47 NCC#CC[C@@H](N)C(=O)O Amb24118079 [0,1,0,0,0,0|1,0,1]=3 1864 B9R0.47 NCC#CC[C@H](N)C(=O)O Amb28134098 [0,1,0,0,0,0|1,0,1]=3 1865 B9R0.47 NCCCCC(=O)C(=O)O Amb33756866 [0,1,0,0,0,0|2,0,1]=4 1866 B9R0.47 NCCCCC(N)C(=O)O Amb22349470 [0,1,0,0,0,0|1,0,0]=2 1867 B9R0.47 NCCCCC(N)C(=O)O Amb22489521 [0,1,0,0,0,0|1,0,0]=2 1868 B9R0.47 NCCCCC(N)C(=O)O Amb3940540 [0,1,0,0,0,0|1,0,0]=2 1869 B9R0.47 NCCCCC(N)C(=O)O Amb8516470 [0,1,0,0,0,0|1,0,0]=2 1870 B9R0.47 NCCCCC(N)C(=O)O Amb8516682 [0,1,0,0,0,0|1,0,0]=2 1871 B9R0.47 NCCCCC(N)C(N)=O Amb17593646 [0,1,0,0,0,0|2,0,0]=3 1872 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb22750565 [0,1,0,0,0,0|1,0,0]=2 1873 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb2720180 [0,1,0,0,0,0|1,0,0]=2 1874 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb30621835 [0,1,0,0,0,0|1,0,0]=2 1875 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb3940874 [0,1,0,0,0,0|1,0,0]=2 1876 B9R0.47 NCCCC[C@@H](N)C(N)=O Amb27404620 [0,1,0,0,0,0|2,0,0]=3 1877 B9R0.47 NCCCC[C@H](N)C(=O)O Amb2720055 [0,1,0,0,0,0|1,0,0]=2 1878 B9R0.47 NCCCC[C@H](N)C(=O)O Amb3940762 [0,1,0,0,0,0|1,0,0]=2 1879 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8395455 [0,1,0,0,0,0|1,0,0]=2 1880 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8513720 [0,1,0,0,0,0|1,0,0]=2 1881 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8628529 [0,1,0,0,0,0|1,0,0]=2 1882 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8628598 [0,1,0,0,0,0|1,0,0]=2 1883 B9R0.47 NCCCC[C@H](N)C(N)=O Amb33757921 [0,1,0,0,0,0|2,0,0]=3 1884 B9R0.47 NCCCOC(N)C(=O)O Amb27838076 [0,1,0,0,0,0|2,0,0]=3 1885 B9R0.47 NCCCS[C@H](N)C(=O)O Amb27410557 [0,1,0,0,0,0|2,0,0]=3 1886 B9R0.47 NCCOCC(N)C(=O)O Amb27224745 [0,1,0,0,0,0|2,0,0]=3 1887 B9R0.47 NCCOC[C@H](N)C(=O)O Amb26844671 [0,1,0,0,0,0|2,0,0]=3 1888 B9R0.47 NCCSCC(O)C(=O)O Amb27789579 [0,1,0,0,0,0|3,0,0]=4 1889 B9R0.47 NCCSC[C@@H](N)C(=O)O Amb27945627 [0,1,0,0,0,0|2,0,0]=3 1890 B9R0.47 NCCSC[C@H](N)C(=O)O Amb22362775 [0,1,0,0,0,0|2,0,0]=3 1891 B9R0.47 NCCSC[C@H](N)C(=O)O Amb25887551 [0,1,0,0,0,0|2,0,0]=3 1892 B9R0.47 NCSCCC(N)C(=O)O Amb27468506 [0,1,0,0,0,0|0,0,0]=1 1893 B9R0.47 NCSCC[C@H](N)C(=O)O Amb27425090 [0,1,0,0,0,0|0,0,0]=1 1894 B9R0.47 NC\C=C\CC(N)C(=O)O Amb22800680 [0,1,0,0,0,0|1,0,1]=3 1895 B9R0.47 NOCCCC(N)C(=O)O Amb24117962 [0,1,0,0,0,0|1,1,0]=3 1896 B9R0.47 NOCCCC(N)C(=O)O Amb27222313 [0,1,0,0,0,0|1,1,0]=3 1897 B9R0.47 NOCCC[C@H](N)C(=O)O Amb28397870 [0,1,0,0,0,0|1,1,0]=3 1898 B9R0.47 N[C@@H](CCCC=O)C(=O)O Amb2695588 [0,1,0,0,0,0|1,0,1]=3 1899 B9R0.47 N[C@@H](CCCCBr)C(=O)O Amb28208462 [0,1,0,0,0,0|1,0,0]=2 1900 B9R0.47 N[C@@H](CCCCCl)C(=O)O Amb27267870 [0,1,0,0,0,0|1,0,0]=2 1901 B9R0.47 N[C@@H](CCCCF)C(=O)O Amb27945388 [0,1,0,0,0,0|1,0,0]=2 1902 B9R0.47 N[C@@H](CCCCO)C(=O)O Amb2695139 [0,1,0,0,0,0|1,0,0]=2 1903 B9R0.47 N[C@@H](CCCCS)C(=O)O Amb25729289 [0,1,0,0,0,0|1,0,0]=2 1904 B9R0.47 N[C@@H](CCCNO)C(=O)O Amb29083430 [0,1,0,0,0,0|2,0,0]=3 1905 B9R0.47 N[C@@H](CCCNO)C(=O)O Amb30666629 [0,1,0,0,0,0|2,0,0]=3 1906 B9R0.47 N[C@@H](CCSN=O)C(=O)O Amb24665147 [0,1,0,0,0,0|1,0,0]=2 1907 B9R0.47 N[C@@H](CNCCO)C(=O)O Amb25146307 [0,1,0,0,0,0|2,0,0]=3 1908 B9R0.47 N[C@@H](COCCCl)C(=O)O Amb28134274 [0,1,0,0,0,0|2,0,0]=3 1909 B9R0.47 N[C@@H](CSCCCl)C(=O)O Amb25887675 [0,1,0,0,0,0|2,0,0]=3 1910 B9R0.47 N[C@@H](CSCCF)C(=O)O Amb27837852 [0,1,0,0,0,0|2,0,0]=3 1911 B9R0.47 N[C@@H](CSCCO)C(=O)O Amb2695551 [0,1,0,0,0,0|2,0,0]=3 1912 B9R0.47 N[C@H](CC#CCO)C(=O)O Amb27391610 [0,1,0,0,0,0|1,0,1]=3 1913 B9R0.47 N[C@H](CCCC=O)C(=O)O Amb27272621 [0,1,0,0,0,0|1,0,1]=3 1914 B9R0.47 N[C@H](CCCCF)C(=O)O Amb26370180 [0,1,0,0,0,0|1,0,0]=2 1915 B9R0.47 N[C@H](CCCCO)C(=O)O Amb26969244 [0,1,0,0,0,0|1,0,0]=2 1916 B9R0.47 N[C@H](CSCCO)C(=O)O Amb8629048 [0,1,0,0,0,0|2,0,0]=3 1917 B9R0.47 N[C@H](\C=C\CCO)C(=O)O Amb24603441 [0,1,0,0,0,0|1,0,2]=4 1918 B9R0.47 O=C(O)C(=O)CCCCBr Amb27654991 [0,1,0,0,0,0|2,0,1]=4 1919 B9R0.47 O=C(O)C(=O)CCCCO Amb27626027 [0,1,0,0,0,0|2,0,1]=4 1920 B9R0.47 O=C(O)C(Cl)CC\C=C\Cl Amb27984937 [0,1,0,0,0,0|2,0,1]=4 1921 B9R0.47 O=C(O)C(Cl)CSCCCl Amb27949681 [0,1,0,0,0,0|3,0,0]=4 1922 B9R0.47 O=C(O)C(O)CCCCO Amb18644356 [0,1,0,0,0,0|2,0,0]=3 1923 B9R0.47 O=C(O)C(O)CNCCO Amb27456529 [0,1,0,0,0,0|3,0,0]=4 1924 B9R0.47 [N-]=[N+]=NCCC(N)C(=O)O Amb25766449 [0,1,0,0,0,0|2,0,0]=3 1925 B9R0.47 [N-]=[N+]=NCC[C@@H](N)C(=O)O Amb19130389 [0,1,0,0,0,0|2,0,0]=3 1926 B9R0.47 [N-]=[N+]=NCC[C@H](N)C(=O)O Amb16183915 [0,1,0,0,0,0|2,0,0]=3 1927 B9R0.47 [N-]=[N+]=NCC[C@H](N)C(=O)O Amb30586484 [0,1,0,0,0,0|2,0,0]=3 1928 B9R0.47 [N-]=[N+]=NCC[C@H](O)C(=O)O Amb27238260 [0,1,0,0,0,0|3,0,0]=4 1929 B9R0.51 C=CCCC(C)(C)C(=O)O Amb22228237 [0,1,0,0,0,0|2,0,1]=4 1930 B9R0.51 C=CCCC(C)(N)C(=O)O Amb24524526 [0,1,0,0,0,0|1,0,1]=3 1931 B9R0.51 C=CCCC(C)(O)C(=O)O Amb28074348 [0,1,0,0,0,0|2,0,1]=4 1932 B9R0.51 C=CCCC(F)(F)C(=O)O Amb28325401 [0,1,0,0,0,0|2,0,1]=4 1933 B9R0.51 C=CCC[C@](C)(N)C(=O)O Amb24478852 [0,1,0,0,0,0|1,0,1]=3 1934 B9R0.51 CC(C)(CCC#N)C(=O)O Amb27615050 [0,1,0,0,0,0|3,0,0]=4 1935 B9R0.51 CC(C)(CCCCl)C(=O)O Amb27601953 [0,1,0,0,0,0|3,0,0]=4 1936 B9R0.51 CC(C)(CCCF)C(=O)O Amb28049560 [0,1,0,0,0,0|3,0,0]=4 1937 B9R0.51 CC(C)(CCCN)C(=O)O Amb26855022 [0,1,0,0,0,0|3,0,0]=4 1938 B9R0.51 CC(C)(CCCN)C(=O)O Amb27601033 [0,1,0,0,0,0|3,0,0]=4 1939 B9R0.51 CC(C)(CCCO)C(=O)O Amb28410873 [0,1,0,0,0,0|3,0,0]=4 1940 B9R0.51 CC(C)(CCNO)C(=O)O Amb28320464 [0,1,0,0,0,0|3,0,0]=4 1941 B9R0.51 CC(C)(CCON)C(=O)O Amb28254746 [0,1,0,0,0,0|2,1,0]=4 1942 B9R0.51 CC(N)(CCCF)C(=O)O Amb32670154 [0,1,0,0,0,0|2,0,0]=3 1943 B9R0.51 CC(N)(CCCN)C(=O)O Amb18644277 [0,1,0,0,0,0|2,0,0]=3 1944 B9R0.51 CC(N)(CCCN)C(=O)O Amb2697838 [0,1,0,0,0,0|2,0,0]=3 1945 B9R0.51 CC(N)(CN=[N+]=[N-])C(=O)O Amb27411824 [0,1,0,0,0,0|3,0,0]=4 1946 B9R0.51 CC(O)(CCCF)C(=O)O Amb33196095 [0,1,0,0,0,0|3,0,0]=4 1947 B9R0.51 CCCCC(C)(Br)C(=O)O Amb28198025 [0,1,0,0,0,0|2,0,0]=3 1948 B9R0.51 CCCCC(C)(C)C(=O)Cl Amb24705541 [0,1,0,0,0,0|3,0,0]=4 1949 B9R0.51 CCCCC(C)(C)C(=O)O Amb2687527 [0,1,0,0,0,0|2,0,0]=3 1950 B9R0.51 CCCCC(C)(F)C(=O)O Amb24444856 [0,1,0,0,0,0|2,0,0]=3 1951 B9R0.51 CCCCC(C)(N)C(=O)O Amb33743440 [0,1,0,0,0,0|1,0,0]=2 1952 B9R0.51 CCCCC(C)(N)C(=O)O Amb4134834 [0,1,0,0,0,0|1,0,0]=2 1953 B9R0.51 CCCCC(C)(O)C(=O)O Amb17593657 [0,1,0,0,0,0|2,0,0]=3 1954 B9R0.51 CCCCC(C)(O)C(C)=O Amb27621354 [0,1,0,0,0,0|3,0,0]=4 1955 B9R0.51 CCCCC(Cl)(Cl)C(=O)O Amb2720177 [0,1,0,0,0,0|2,0,0]=3 1956 B9R0.51 CCCCC(F)(F)C(=O)O Amb19929267 [0,1,0,0,0,0|2,0,0]=3 1957 B9R0.51 CCCCC(O)(O)C(=O)O Amb28059576 [0,1,0,0,0,0|2,0,0]=3 1958 B9R0.51 CCCC[C@@](C)(N)C(=O)O Amb26346904 [0,1,0,0,0,0|1,0,0]=2 1959 B9R0.51 CCCC[C@@](C)(O)C(=O)O Amb27221053 [0,1,0,0,0,0|2,0,0]=3 1960 B9R0.51 CCCC[C@](C)(N)C(=O)O Amb25961122 [0,1,0,0,0,0|1,0,0]=2 1961 B9R0.51 CCCC[C@](C)(O)C(=O)O Amb27615053 [0,1,0,0,0,0|2,0,0]=3 1962 B9R0.51 CCCNC(C)(C)C(=O)O Amb9620095 [0,1,0,0,0,0|3,0,0]=4 1963 B9R0.51 CCCSC(C)(C)C(=O)O Amb17501481 [0,1,0,0,0,0|3,0,0]=4 1964 B9R0.51 CCCSC(F)(F)C(=O)O Amb27483837 [0,1,0,0,0,0|3,0,0]=4 1965 B9R0.51 CCNCC(F)(F)C(=O)O Amb33170567 [0,1,0,0,0,0|3,0,0]=4 1966 B9R0.51 CCOCC(C)(C)C(=O)O Amb27810825 [0,1,0,0,0,0|3,0,0]=4 1967 B9R0.51 CCOCC(C)(N)C(=O)O Amb27404396 [0,1,0,0,0,0|2,0,0]=3 1968 B9R0.51 CCOCC(C)(N)C(N)=O Amb27253744 [0,1,0,0,0,0|3,0,0]=4 1969 B9R0.51 CCOCC(C)(O)C(=O)O Amb27949919 [0,1,0,0,0,0|3,0,0]=4 1970 B9R0.51 CCOCC(F)(F)C(=O)O Amb33171237 [0,1,0,0,0,0|3,0,0]=4 1971 B9R0.51 CCSCC(C)(C)C(=O)O Amb26439975 [0,1,0,0,0,0|3,0,0]=4 1972 B9R0.51 CCSCC(C)(N)C(=O)O Amb18788224 [0,1,0,0,0,0|2,0,0]=3 1973 B9R0.51 CCSCC(F)(F)C(=O)O Amb33171137 [0,1,0,0,0,0|3,0,0]=4 1974 B9R0.51 COCCC(C)(C)C(=O)O Amb19029437 [0,1,0,0,0,0|1,1,0]=3 1975 B9R0.51 COCCC(C)(Cl)C(=O)O Amb27878699 [0,1,0,0,0,0|1,1,0]=3 1976 B9R0.51 COCCC(C)(O)C(=O)O Amb23454643 [0,1,0,0,0,0|1,1,0]=3 1977 B9R0.51 COCCC(F)(F)C(=O)O Amb33476906 [0,1,0,0,0,0|1,1,0]=3 1978 B9R0.51 COCC[C@](C)(N)C(=O)O Amb27425033 [0,1,0,0,0,0|0,1,0]=2 1979 B9R0.51 CONCC(F)(F)C(=O)O Amb33170282 [0,1,0,0,0,0|2,1,0]=4 1980 B9R0.51 CSCCC(C)(C)C(=O)O Amb10844081 [0,1,0,0,0,0|1,0,0]=2 1981 B9R0.51 CSCCC(C)(N)C(F)F Amb33010128 [0,1,0,0,0,0|2,0,1]=4 1982 B9R0.51 CSCCC(C)(N)[PH](=O)O Amb27394208 [0,1,0,0,0,0|1,0,0]=2 1983 B9R0.51 CSCCC(C)(O)C(=O)O Amb33271718 [0,1,0,0,0,0|1,0,0]=2 1984 B9R0.51 CSCCC(F)(F)C(=O)O Amb33010112 [0,1,0,0,0,0|1,0,0]=2 1985 B9R0.51 CSCC[C@@](C)(N)C(=O)O Amb24482190 [0,1,0,0,0,0|0,0,0]=1 1986 B9R0.51 CS\C=C\C(C)(C)C(=O)O Amb27983718 [0,1,0,0,0,0|1,0,2]=4 1987 B9R0.51 C[C@@](N)(CCCN)C(=O)O Amb27468967 [0,1,0,0,0,0|2,0,0]=3 1988 B9R0.51 C[C@](O)(CCCO)C(=O)O Amb27252130 [0,1,0,0,0,0|3,0,0]=4 1989 B9R0.51 C\C=C\CC(C)(C)C(=O)O Amb18643881 [0,1,0,0,0,0|2,0,1]=4 1990 B9R0.51 C\C=C\CC(C)(N)C(=O)O Amb27591750 [0,1,0,0,0,0|1,0,1]=3 1991 B9R0.51 C\C=C\CC(F)(Cl)C(=O)O Amb25780002 [0,1,0,0,0,0|2,0,1]=4 1992 B9R0.51 C\C=C\C[C@@](C)(F)C(=O)O Amb28050047 [0,1,0,0,0,0|2,0,1]=4 1993 B9R0.51 NCCCC(Cl)(Cl)C(=O)O Amb17594797 [0,1,0,0,0,0|3,0,0]=4 1994 B9R0.51 O=C(O)C(F)(F)CCCF Amb33482365 [0,1,0,0,0,0|3,0,0]=4 1995 B9R0.51 O=C(O)C(F)(F)CCCO Amb24652882 [0,1,0,0,0,0|3,0,0]=4 1996 B9R1.5 CC1CCCCCC1=O Amb26348270 [0,0,0,1,0,0|3,0,0]=4 1997 B9R1.5 CC1CCNCCC1=O Amb22886271 [0,0,0,1,0,0|3,0,0]=4 1998 B9R1.5 C[C@@H]1CCCCNC1=O Amb28072473 [0,0,0,1,0,0|3,0,0]=4 1999 B9R1.5 NC1CCCCC=C1Br Amb27747172 [0,0,0,1,0,0|3,0,0]=4 2000 B9R1.5 NC1CCCCCC1=O Amb18276126 [0,0,0,1,0,0|2,0,0]=3 2001 B9R1.5 NC1CCCCCC1=O Amb28934932 [0,0,0,1,0,0|2,0,0]=3 2002 B9R1.5 NC1CCCCCC1O Amb8855257 [0,0,0,1,0,0|2,0,1]=4 2003 B9R1.5 NC1CCCCNC1=O Amb19958477 [0,0,0,1,0,0|2,0,0]=3 2004 B9R1.5 NC1CCCCNC1=O Amb9721937 [0,0,0,1,0,0|2,0,0]=3 2005 B9R1.5 NC1CSCCNC1=O Amb25336468 [0,0,0,1,0,0|3,0,0]=4 2006 B9R1.5 NC1CSCCNC1=O Amb32412582 [0,0,0,1,0,0|3,0,0]=4 2007 B9R1.5 NN1CCCCCC1=O Amb22495331 [0,0,0,1,0,0|3,0,0]=4 2008 B9R1.5 N[C@@H]1CCCCC[C@@H]1O Amb1994010 [0,0,0,1,0,0|2,0,1]=4 2009 B9R1.5 N[C@@H]1CCCCC[C@H]1O Amb1994009 [0,0,0,1,0,0|2,0,1]=4 2010 B9R1.5 N[C@@H]1CCCCNC1=O Amb10608775 [0,0,0,1,0,0|2,0,0]=3 2011 B9R1.5 N[C@@H]1CCCCNC1=O Amb20670688 [0,0,0,1,0,0|2,0,0]=3 2012 B9R1.5 N[C@@H]1CSCCNC1=O Amb19374458 [0,0,0,1,0,0|3,0,0]=4 2013 B9R1.5 N[C@@H]1CSCCNC1=O Amb32414615 [0,0,0,1,0,0|3,0,0]=4 2014 B9R1.5 N[C@H]1CCCCC[C@@H]1O Amb26551623 [0,0,0,1,0,0|2,0,1]=4 2015 B9R1.5 N[C@H]1CCCCNC1=O Amb19929579 [0,0,0,1,0,0|2,0,0]=3 2016 B9R1.5 N[C@H]1CCCCNC1=O Amb532926 [0,0,0,1,0,0|2,0,0]=3 2017 B9R1.5 N[C@H]1COCCNC1=O Amb27234381 [0,0,0,1,0,0|3,0,0]=4 2018 B9R1.5 N[C@H]1CSCCNC1=O Amb10067826 [0,0,0,1,0,0|3,0,0]=4 2019 B9R1.5 O=C1CCCCCC1Br Amb18325296 [0,0,0,1,0,0|3,0,0]=4 2020 B9R1.5 O=C1CCCCCC1Cl Amb6892055 [0,0,0,1,0,0|3,0,0]=4 2021 B9R1.5 O=C1CCCCCC1F Amb21965071 [0,0,0,1,0,0|3,0,0]=4 2022 B9R1.5 O=C1CCCCCC1O Amb25284997 [0,0,0,1,0,0|3,0,0]=4 2023 B9R1.5 O=C1CCCCCC1S Amb28199868 [0,0,0,1,0,0|3,0,0]=4 2024 B9R1.5 O=C1CCCCOC1=O Amb27227093 [0,0,0,1,0,0|2,0,1]=4 2025 B9R1.5 O=C1CCNCCC1Br Amb27201712 [0,0,0,1,0,0|3,0,0]=4 2026 B9R1.5 O=C1CCNCCC1Br Amb33621267 [0,0,0,1,0,0|3,0,0]=4 2027 B9R1.5 O=C1CCNCCC1F Amb22886247 [0,0,0,1,0,0|3,0,0]=4 2028 B9R1.5 O=C1CCSCCC1=O Amb32642055 [0,0,0,1,0,0|2,0,1]=4 2029 B9R1.5 O=C1NCCCCC1Br Amb9781677 [0,0,0,1,0,0|3,0,0]=4 2030 B9R1.5 O=C1NCCCCC1Cl Amb27815034 [0,0,0,1,0,0|3,0,0]=4 2031 B9R1.5 O=C1NCCCCC1I Amb35751097 [0,0,0,1,0,0|3,0,0]=4 2032 B9R1.6 C=C(C)C1CCCCN1 Amb23536631 [0,0,0,1,0,0|3,0,0]=4 2033 B9R1.6 C=C(O)C1CNCCN1 Amb28286928 [0,0,0,1,0,0|3,0,0]=4 2034 B9R1.6 C=C(O)C1CNCCN1 Amb30594212 [0,0,0,1,0,0|3,0,0]=4 2035 B9R1.6 CC(=O)C1CCC=CN1 Amb25094747 [0,0,0,1,0,0|2,0,1]=4 2036 B9R1.6 CC(=O)C1CCCCC1 Amb4037310 [0,0,0,1,0,0|3,0,0]=4 2037 B9R1.6 CC(=O)C1CCCCN1 Amb21962174 [0,0,0,1,0,0|2,0,0]=3 2038 B9R1.6 CC(=O)C1CCCCN1 Amb2700057 [0,0,0,1,0,0|2,0,0]=3 2039 B9R1.6 CC(=O)C1CCCCO1 Amb23585662 [0,0,0,1,0,0|3,0,0]=4 2040 B9R1.6 CC(=O)C1CCCCS1 Amb23568664 [0,0,0,1,0,0|3,0,0]=4 2041 B9R1.6 CC(=O)C1CCNCC1 Amb10603454 [0,0,0,1,0,0|3,0,0]=4 2042 B9R1.6 CC(=O)C1CCNCC1 Amb19958038 [0,0,0,1,0,0|3,0,0]=4 2043 B9R1.6 CC(=O)C1CCOCC1 Amb16231304 [0,0,0,1,0,0|2,1,0]=4 2044 B9R1.6 CC(=O)C1CCSCC1 Amb24748894 [0,0,0,1,0,0|2,0,0]=3 2045 B9R1.6 CC(=O)C1COCCN1 Amb24761214 [0,0,0,1,0,0|3,0,0]=4 2046 B9R1.6 CC(=O)C1CSCCN1 Amb25305093 [0,0,0,1,0,0|3,0,0]=4 2047 B9R1.6 CC(=O)[C@@H]1CCCCN1 Amb26891406 [0,0,0,1,0,0|2,0,0]=3 2048 B9R1.6 CC(=O)[C@@H]1CCCCN1 Amb28555630 [0,0,0,1,0,0|2,0,0]=3 2049 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb25072730 [0,0,0,1,0,0|2,0,0]=3 2050 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb28935031 [0,0,0,1,0,0|2,0,0]=3 2051 B9R1.6 CC(O)C1CCCCN1 Amb18642713 [0,0,0,1,0,0|2,0,1]=4 2052 B9R1.6 CC(O)C1CCSCC1 Amb35698333 [0,0,0,1,0,0|2,0,1]=4 2053 B9R1.6 CC(O)[C@@H]1CCCCN1 Amb35737461 [0,0,0,1,0,0|2,0,1]=4 2054 B9R1.6 CC(O)[C@H]1CCCCN1 Amb35617462 [0,0,0,1,0,0|2,0,1]=4 2055 B9R1.6 N=C(N)C1CCCCN1 Amb24659758 [0,0,0,1,0,0|3,0,0]=4 2056 B9R1.6 N=C(N)C1CCCCN1 Amb8630661 [0,0,0,1,0,0|3,0,0]=4 2057 B9R1.6 N=C(N)C1CCSCC1 Amb25992613 [0,0,0,1,0,0|3,0,0]=4 2058 B9R1.6 NC(=O)C1CC=CCN1 Amb31030970 [0,0,0,1,0,0|2,0,1]=4 2059 B9R1.6 NC(=O)C1CCCCC1 Amb6335833 [0,0,0,1,0,0|3,0,0]=4 2060 B9R1.6 NC(=O)C1CCCCN1 Amb2370929 [0,0,0,1,0,0|2,0,0]=3 2061 B9R1.6 NC(=O)C1CCCCN1 Amb433771 [0,0,0,1,0,0|2,0,0]=3 2062 B9R1.6 NC(=O)C1CCCCS1 Amb26316109 [0,0,0,1,0,0|3,0,0]=4 2063 B9R1.6 NC(=O)C1CCNCC1 Amb21957241 [0,0,0,1,0,0|3,0,0]=4 2064 B9R1.6 NC(=O)C1CCNCC1 Amb2720321 [0,0,0,1,0,0|3,0,0]=4 2065 B9R1.6 NC(=O)C1CCOCC1 Amb7990052 [0,0,0,1,0,0|2,1,0]=4 2066 B9R1.6 NC(=O)C1CCSCC1 Amb27252383 [0,0,0,1,0,0|2,0,0]=3 2067 B9R1.6 NC(=O)C1CNCCN1 Amb1158016 [0,0,0,1,0,0|3,0,0]=4 2068 B9R1.6 NC(=O)C1COCCN1 Amb22059486 [0,0,0,1,0,0|3,0,0]=4 2069 B9R1.6 NC(=O)C1COCCN1 Amb31308018 [0,0,0,1,0,0|3,0,0]=4 2070 B9R1.6 NC(=O)C1CSCCN1 Amb4004499 [0,0,0,1,0,0|3,0,0]=4 2071 B9R1.6 NC(=O)[C@@H]1CCCCN1 Amb25315367 [0,0,0,1,0,0|2,0,0]=3 2072 B9R1.6 NC(=O)[C@@H]1CNCCN1 Amb24183728 [0,0,0,1,0,0|3,0,0]=4 2073 B9R1.6 NC(=O)[C@@H]1CSCCN1 Amb27950510 [0,0,0,1,0,0|3,0,0]=4 2074 B9R1.6 NC(=O)[C@H]1CCCCN1 Amb27490731 [0,0,0,1,0,0|2,0,0]=3 2075 B9R1.6 NC(=O)[C@H]1CCSCN1 Amb27613173 [0,0,0,1,0,0|1,0,0]=2 2076 B9R1.6 NC(=O)[C@H]1CNCCN1 Amb27355135 [0,0,0,1,0,0|3,0,0]=4 2077 B9R1.6 NC(=O)[C@H]1CNCCN1 Amb8420820 [0,0,0,1,0,0|3,0,0]=4 2078 B9R1.6 NC(=O)[C@H]1COCCN1 Amb27591943 [0,0,0,1,0,0|3,0,0]=4 2079 B9R1.6 NC(=O)[C@H]1COCCN1 Amb27838503 [0,0,0,1,0,0|3,0,0]=4 2080 B9R1.6 NC(=S)C1CCCCN1 Amb19148045 [0,0,0,1,0,0|2,1,0]=4 2081 B9R1.6 O=C(Cl)C1CCCCC1 Amb2792904 [0,0,0,1,0,0|3,0,0]=4 2082 B9R1.6 O=C(Cl)C1CCCCO1 Amb2723690 [0,0,0,1,0,0|3,0,0]=4 2083 B9R1.6 O=C(Cl)C1CCCCS1 Amb27658766 [0,0,0,1,0,0|3,0,0]=4 2084 B9R1.6 O=C(Cl)C1CCOCC1 Amb2723452 [0,0,0,1,0,0|2,1,0]=4 2085 B9R1.6 O=C(Cl)C1CCSCC1 Amb6572254 [0,0,0,1,0,0|2,0,0]=3 2086 B9R1.6 O=C(Cl)N1CCSCC1 Amb25328755 [0,0,0,1,0,0|3,0,0]=4 2087 B9R1.6 O=C(Cl)[C@H]1CCCCO1 Amb24478586 [0,0,0,1,0,0|3,0,0]=4 2088 B9R1.6 O=C(O)C1=CCCCC1 Amb2720517 [0,0,0,1,0,0|2,0,1]=4 2089 B9R1.6 O=C(O)C1=CCCCN1 Amb23585365 [0,0,0,1,0,0|1,0,2]=4 2090 B9R1.6 O=C(O)C1=CCNCC1 Amb10843904 [0,0,0,1,0,0|2,0,1]=4 2091 B9R1.6 O=C(O)C1=CCNCC1 Amb2698151 [0,0,0,1,0,0|2,0,1]=4 2092 B9R1.6 O=C(O)C1=CCOCC1 Amb18642574 [0,0,0,1,0,0|1,1,1]=4 2093 B9R1.6 O=C(O)C1=NCCCC1 Amb24597785 [0,0,0,1,0,0|1,0,2]=4 2094 B9R1.6 O=C(O)C1=NCCCN1 Amb25379456 [0,0,0,1,0,0|2,0,1]=4 2095 B9R1.6 O=C(O)C1C=CCCC1 Amb18642396 [0,0,0,1,0,0|2,0,1]=4 2096 B9R1.6 O=C(O)C1C=CCCN1 Amb25145978 [0,0,0,1,0,0|1,0,2]=4 2097 B9R1.6 O=C(O)C1C=CCCN1 Amb35750834 [0,0,0,1,0,0|1,0,2]=4 2098 B9R1.6 O=C(O)C1C=CSCN1 Amb26922618 [0,0,0,1,0,0|0,0,2]=3 2099 B9R1.6 O=C(O)C1CC=CCC1 Amb2695197 [0,0,0,1,0,0|2,0,1]=4 2100 B9R1.6 O=C(O)C1CC=CCN1 Amb2698158 [0,0,0,1,0,0|1,0,1]=3 2101 B9R1.6 O=C(O)C1CC=CCO1 Amb18642584 [0,0,0,1,0,0|2,0,1]=4 2102 B9R1.6 O=C(O)C1CCCCC1 Amb2721294 [0,0,0,1,0,0|2,0,0]=3 2103 B9R1.6 O=C(O)C1CCCCN1 Amb6754083 [0,0,0,1,0,0|1,0,0]=2 2104 B9R1.6 O=C(O)C1CCCCN1 Amb9703161 [0,0,0,1,0,0|1,0,0]=2 2105 B9R1.6 O=C(O)C1CCCCO1 Amb2723689 [0,0,0,1,0,0|2,0,0]=3 2106 B9R1.6 O=C(O)C1CCCCS1 Amb18202314 [0,0,0,1,0,0|2,0,0]=3 2107 B9R1.6 O=C(O)C1CCCNC1 Amb6239367 [0,0,0,1,0,0|3,0,0]=4 2108 B9R1.6 O=C(O)C1CCCNC1 Amb9703145 [0,0,0,1,0,0|3,0,0]=4 2109 B9R1.6 O=C(O)C1CCCOC1 Amb1102367 [0,0,0,1,0,0|3,0,0]=4 2110 B9R1.6 O=C(O)C1CCCSC1 Amb33545067 [0,0,0,1,0,0|3,0,0]=4 2111 B9R1.6 O=C(O)C1CCCSS1 Amb24480090 [0,0,0,1,0,0|3,0,0]=4 2112 B9R1.6 O=C(O)C1CCNC=N1 Amb27873650 [0,0,0,1,0,0|1,0,2]=4 2113 B9R1.6 O=C(O)C1CCNC=N1 Amb28935010 [0,0,0,1,0,0|1,0,2]=4 2114 B9R1.6 O=C(O)C1CCNCC1 Amb2720245 [0,0,0,1,0,0|2,0,0]=3 2115 B9R1.6 O=C(O)C1CCNCC1 Amb932842 [0,0,0,1,0,0|2,0,0]=3 2116 B9R1.6 O=C(O)C1CCOCC1 Amb426862 [0,0,0,1,0,0|1,1,0]=3 2117 B9R1.6 O=C(O)C1CCOCN1 Amb28042897 [0,0,0,1,0,0|0,1,0]=2 2118 B9R1.6 O=C(O)C1CCSCC1 Amb6572253 [0,0,0,1,0,0|1,0,0]=2 2119 B9R1.6 O=C(O)C1CCSCN1 Amb1102215 [0,0,0,1,0,0|0,0,0]=1 2120 B9R1.6 O=C(O)C1CCSCN1 Amb22284134 [0,0,0,1,0,0|0,0,0]=1 2121 B9R1.6 O=C(O)C1CCSSC1 Amb26422767 [0,0,0,1,0,0|2,0,0]=3 2122 B9R1.6 O=C(O)C1CNCCN1 Amb22490977 [0,0,0,1,0,0|2,0,0]=3 2123 B9R1.6 O=C(O)C1CNCCN1 Amb2690349 [0,0,0,1,0,0|2,0,0]=3 2124 B9R1.6 O=C(O)C1CNCCN1 Amb2720318 [0,0,0,1,0,0|2,0,0]=3 2125 B9R1.6 O=C(O)C1CNCCO1 Amb16232076 [0,0,0,1,0,0|3,0,0]=4 2126 B9R1.6 O=C(O)C1CNCCO1 Amb2696640 [0,0,0,1,0,0|3,0,0]=4 2127 B9R1.6 O=C(O)C1CNCCS1 Amb8631056 [0,0,0,1,0,0|3,0,0]=4 2128 B9R1.6 O=C(O)C1COCCN1 Amb10607157 [0,0,0,1,0,0|2,0,0]=3 2129 B9R1.6 O=C(O)C1COCCN1 Amb2694767 [0,0,0,1,0,0|2,0,0]=3 2130 B9R1.6 O=C(O)C1COCCO1 Amb5399760 [0,0,0,1,0,0|3,0,0]=4 2131 B9R1.6 O=C(O)C1CSCCN1 Amb19888398 [0,0,0,1,0,0|2,0,0]=3 2132 B9R1.6 O=C(O)C1CSCCN1 Amb2695006 [0,0,0,1,0,0|2,0,0]=3 2133 B9R1.6 O=C(O)C1CSCCS1 Amb20622962 [0,0,0,1,0,0|3,0,0]=4 2134 B9R1.6 O=C(O)C1C[NH2+]CC[NH2+]1 Amb5722241 [0,0,0,1,0,0|2,0,1]=4 2135 B9R1.6 O=C(O)C1NCCCN1 Amb27473323 [0,0,0,1,0,0|2,0,0]=3 2136 B9R1.6 O=C(O)C1NCCCO1 Amb33193117 [0,0,0,1,0,0|2,0,0]=3 2137 B9R1.6 O=C(O)C1NCCCS1 Amb22899084 [0,0,0,1,0,0|2,0,0]=3 2138 B9R1.6 O=C(O)C1OCCCO1 Amb24715581 [0,0,0,1,0,0|3,0,0]=4 2139 B9R1.6 O=C(O)C1SCCCS1 Amb22167283 [0,0,0,1,0,0|3,0,0]=4 2140 B9R1.6 O=C(O)C1SCSCS1 Amb1233865 [0,0,0,1,0,0|2,0,0]=3 2141 B9R1.6 O=C(O)N1CCCCC1 Amb20242677 [0,0,0,1,0,0|3,0,0]=4 2142 B9R1.6 O=C(O)N1CCCCC1 Amb35825557 [0,0,0,1,0,0|3,0,0]=4 2143 B9R1.6 O=C(O)N1CCSCC1 Amb24099831 [0,0,0,1,0,0|2,0,0]=3 2144 B9R1.6 O=C(O)[C@@H]1CC=CCC1 Amb19131346 [0,0,0,1,0,0|2,0,1]=4 2145 B9R1.6 O=C(O)[C@@H]1CCC=CN1 Amb19888332 [0,0,0,1,0,0|1,0,1]=3 2146 B9R1.6 O=C(O)[C@@H]1CCC=NN1 Amb27468483 [0,0,0,1,0,0|2,0,0]=3 2147 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb2690345 [0,0,0,1,0,0|1,0,0]=2 2148 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb8384272 [0,0,0,1,0,0|1,0,0]=2 2149 B9R1.6 O=C(O)[C@@H]1CCCCO1 Amb22746821 [0,0,0,1,0,0|2,0,0]=3 2150 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb16232354 [0,0,0,1,0,0|3,0,0]=4 2151 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb8628966 [0,0,0,1,0,0|3,0,0]=4 2152 B9R1.6 O=C(O)[C@@H]1CCCNN1 Amb30666630 [0,0,0,1,0,0|2,0,0]=3 2153 B9R1.6 O=C(O)[C@@H]1CCCOC1 Amb26885613 [0,0,0,1,0,0|3,0,0]=4 2154 B9R1.6 O=C(O)[C@@H]1CCCSC1 Amb27826589 [0,0,0,1,0,0|3,0,0]=4 2155 B9R1.6 O=C(O)[C@@H]1CNCCN1 Amb6307277 [0,0,0,1,0,0|2,0,0]=3 2156 B9R1.6 O=C(O)[C@@H]1CNCCN1 Amb6307319 [0,0,0,1,0,0|2,0,0]=3 2157 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb22737231 [0,0,0,1,0,0|3,0,0]=4 2158 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb8631069 [0,0,0,1,0,0|3,0,0]=4 2159 B9R1.6 O=C(O)[C@@H]1COCCN1 Amb10576585 [0,0,0,1,0,0|2,0,0]=3 2160 B9R1.6 O=C(O)[C@@H]1COCCN1 Amb2696709 [0,0,0,1,0,0|2,0,0]=3 2161 B9R1.6 O=C(O)[C@@H]1COCCO1 Amb23438856 [0,0,0,1,0,0|3,0,0]=4 2162 B9R1.6 O=C(O)[C@@H]1CSCCN1 Amb22386830 [0,0,0,1,0,0|2,0,0]=3 2163 B9R1.6 O=C(O)[C@@H]1CSCCN1 Amb8630483 [0,0,0,1,0,0|2,0,0]=3 2164 B9R1.6 O=C(O)[C@H]1CC=CCC1 Amb17611453 [0,0,0,1,0,0|2,0,1]=4 2165 B9R1.6 O=C(O)[C@H]1CCC=CO1 Amb28070479 [0,0,0,1,0,0|2,0,1]=4 2166 B9R1.6 O=C(O)[C@H]1CCC=NN1 Amb27596226 [0,0,0,1,0,0|2,0,0]=3 2167 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb2700060 [0,0,0,1,0,0|1,0,0]=2 2168 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb8515100 [0,0,0,1,0,0|1,0,0]=2 2169 B9R1.6 O=C(O)[C@H]1CCCCO1 Amb26865454 [0,0,0,1,0,0|2,0,0]=3 2170 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8384271 [0,0,0,1,0,0|3,0,0]=4 2171 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8389307 [0,0,0,1,0,0|3,0,0]=4 2172 B9R1.6 O=C(O)[C@H]1CCCNN1 Amb27154761 [0,0,0,1,0,0|2,0,0]=3 2173 B9R1.6 O=C(O)[C@H]1CCCSC1 Amb27809148 [0,0,0,1,0,0|3,0,0]=4 2174 B9R1.6 O=C(O)[C@H]1CCSCN1 Amb25773953 [0,0,0,1,0,0|0,0,0]=1 2175 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb20241207 [0,0,0,1,0,0|2,0,0]=3 2176 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb2694998 [0,0,0,1,0,0|2,0,0]=3 2177 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb8628465 [0,0,0,1,0,0|2,0,0]=3 2178 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb10067023 [0,0,0,1,0,0|3,0,0]=4 2179 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb22737232 [0,0,0,1,0,0|3,0,0]=4 2180 B9R1.6 O=C(O)[C@H]1COCCN1 Amb16232575 [0,0,0,1,0,0|2,0,0]=3 2181 B9R1.6 O=C(O)[C@H]1COCCN1 Amb2696766 [0,0,0,1,0,0|2,0,0]=3 2182 B9R1.6 O=C(O)[C@H]1COCCO1 Amb26430807 [0,0,0,1,0,0|3,0,0]=4 2183 B9R1.6 O=C(O)[C@H]1CSCCN1 Amb2700568 [0,0,0,1,0,0|2,0,0]=3 2184 B9R1.6 O=S(O)C1CCCCC1 Amb24603074 [0,0,0,1,0,0|3,0,0]=4 2185 B9R1.6 O=[N+]([O-])C1CCSCC1 Amb33299033 [0,0,0,1,0,0|2,0,1]=4 2186 B9R1.6 O=[PH](O)C1CCCCN1 Amb28131021 [0,0,0,1,0,0|2,0,0]=3 2187 B9R1.6 OB(O)C1CCSCC1 Amb32643927 [0,0,0,1,0,0|2,0,1]=4 2188 B9R1.23 C=C1CC(CC)OC1=O Amb8389609 [0,0,0,1,0,0|2,0,1]=4 2189 B9R1.23 C=C[C@@H]1C[C@H](O)C(=O)O1 Amb27853704 [0,0,0,1,0,0|2,0,1]=4 2190 B9R1.23 C=C[C@H]1C[C@@H](O)C(=O)O1 Amb27852773 [0,0,0,1,0,0|2,0,1]=4 2191 B9R1.23 CC1CC(C=O)OC1=O Amb28253804 [0,0,0,1,0,0|3,0,0]=4 2192 B9R1.23 CCC1CC(=O)C(=O)O1 Amb27838789 [0,0,0,1,0,0|2,0,1]=4 2193 B9R1.23 CCC1CC(C)C(=O)N1 Amb20623299 [0,0,0,1,0,0|3,0,0]=4 2194 B9R1.23 CCC1CC(N)C(=O)O1 Amb27647519 [0,0,0,1,0,0|1,0,0]=2 2195 B9R1.23 CCC1CC(O)C(=O)O1 Amb28049114 [0,0,0,1,0,0|2,0,0]=3 2196 B9R1.23 CCC1OC(=O)C(F)S1 Amb27232508 [0,0,0,1,0,0|3,0,0]=4 2197 B9R1.23 CC[C@@H]1C[C@@H](O)C(=O)O1 Amb27472678 [0,0,0,1,0,0|2,0,0]=3 2198 B9R1.23 CC[C@@H]1C[C@H](O)C(=O)O1 Amb27184446 [0,0,0,1,0,0|2,0,0]=3 2199 B9R1.23 CC[C@@H]1OC(=O)[C@@H](F)S1 Amb28123499 [0,0,0,1,0,0|3,0,0]=4 2200 B9R1.23 CC[C@H]1C[C@@H](O)C(=O)O1 Amb27428268 [0,0,0,1,0,0|2,0,0]=3 2201 B9R1.23 CC[C@H]1OC(=O)[C@@H](F)S1 Amb24514953 [0,0,0,1,0,0|3,0,0]=4 2202 B9R1.23 C[C@@H]1C[C@@H](CN)OC1=O Amb27440489 [0,0,0,1,0,0|3,0,0]=4 2203 B9R1.23 C[C@H]1C[C@@H](CO)OC1=O Amb28429767 [0,0,0,1,0,0|3,0,0]=4 2204 B9R1.23 NC1CC(CO)OC1=O Amb18642829 [0,0,0,1,0,0|2,0,0]=3 2205 B9R1.23 NC[C@@H]1C[C@H](N)C(=O)O1 Amb27851651 [0,0,0,1,0,0|2,0,0]=3 2206 B9R1.23 N[C@H]1C[C@@H](CO)OC1=O Amb28059280 [0,0,0,1,0,0|2,0,0]=3 2207 B9R1.23 N[C@H]1C[C@H](CBr)OC1=O Amb27233512 [0,0,0,1,0,0|2,0,0]=3 2208 B9R1.23 O=C1OC(CBr)CC1O Amb27760415 [0,0,0,1,0,0|3,0,0]=4 2209 B9R1.23 O=C1OC(CCl)CC1O Amb27841626 [0,0,0,1,0,0|3,0,0]=4 2210 B9R1.23 O=C1O[C@@H](CO)C[C@@H]1O Amb27783829 [0,0,0,1,0,0|3,0,0]=4 2211 B9R1.23 O=CC1CC(O)C(=O)O1 Amb27838700 [0,0,0,1,0,0|3,0,0]=4 2212 B9R1.35 C=C1CCC(C(=O)O)C1 Amb28369274 [0,0,0,1,0,0|2,0,1]=4 2213 B9R1.35 CC(=O)C1C=C(C)CC1 Amb28137737 [0,0,0,1,0,0|3,0,0]=4 2214 B9R1.35 CC(=O)C1CCN(C)C1 Amb27829019 [0,0,0,1,0,0|3,0,0]=4 2215 B9R1.35 CC(=O)C1CC[C@@H](C)O1 Amb33423868 [0,0,0,1,0,0|3,0,0]=4 2216 B9R1.35 CC(=O)C1CC[C@H](C)C1 Amb27261938 [0,0,0,1,0,0|3,0,0]=4 2217 B9R1.35 CC(=O)[C@@H]1CCC(=O)N1 Amb27167616 [0,0,0,1,0,0|3,0,0]=4 2218 B9R1.35 CC(=O)[C@@H]1CC[C@@H](C)C1 Amb27861348 [0,0,0,1,0,0|3,0,0]=4 2219 B9R1.35 CC(=O)[C@@H]1CC[C@H](C)C1 Amb27861349 [0,0,0,1,0,0|3,0,0]=4 2220 B9R1.35 CC(=O)[C@@H]1CC[C@H](C)O1 Amb26958731 [0,0,0,1,0,0|3,0,0]=4 2221 B9R1.35 CC(=O)[C@H]1CCC(=O)N1 Amb27877407 [0,0,0,1,0,0|3,0,0]=4 2222 B9R1.35 CC1=CC(C(=O)O)NC1 Amb27751727 [0,0,0,1,0,0|3,0,0]=4 2223 B9R1.35 CC1=CC(C(=O)O)SC1 Amb10809142 [0,0,0,1,0,0|3,0,0]=4 2224 B9R1.35 CC1=NC(C(=O)O)CC1 Amb23438203 [0,0,0,1,0,0|1,0,1]=3 2225 B9R1.35 CC1=NC(C(=O)O)CC1 Amb32409643 [0,0,0,1,0,0|1,0,1]=3 2226 B9R1.35 CC1=NC(C(=O)O)CO1 Amb20621597 [0,0,0,1,0,0|2,0,1]=4 2227 B9R1.35 CC1=NC(C(=O)O)CS1 Amb18124720 [0,0,0,1,0,0|2,0,1]=4 2228 B9R1.35 CC1=NCC(C(=O)O)N1 Amb24599993 [0,0,0,1,0,0|2,0,0]=3 2229 B9R1.35 CC1=NCC(C(=O)O)S1 Amb27958674 [0,0,0,1,0,0|3,0,0]=4 2230 B9R1.35 CC1=NC[C@H](C(=O)O)N1 Amb27827434 [0,0,0,1,0,0|2,0,0]=3 2231 B9R1.35 CC1=N[C@@H](C(=O)O)CS1 Amb32676192 [0,0,0,1,0,0|2,0,1]=4 2232 B9R1.35 CC1=N[C@H](C(=O)O)CC1 Amb27455557 [0,0,0,1,0,0|1,0,1]=3 2233 B9R1.35 CC1=N[C@H](C(=O)O)CS1 Amb35648200 [0,0,0,1,0,0|2,0,1]=4 2234 B9R1.35 CC1C=C(C(=O)O)CC1 Amb18642397 [0,0,0,1,0,0|2,0,1]=4 2235 B9R1.35 CC1CC(C(=O)O)CN1 Amb18832566 [0,0,0,1,0,0|3,0,0]=4 2236 B9R1.35 CC1CC(C(=O)O)CO1 Amb25922998 [0,0,0,1,0,0|3,0,0]=4 2237 B9R1.35 CC1CCC(C(=O)Cl)O1 Amb27424709 [0,0,0,1,0,0|3,0,0]=4 2238 B9R1.35 CC1CCC(C(=O)O)C1 Amb18642624 [0,0,0,1,0,0|2,0,0]=3 2239 B9R1.35 CC1CCC(C(=O)O)N1 Amb18832572 [0,0,0,1,0,0|1,0,0]=2 2240 B9R1.35 CC1CCC(C(=O)O)N1 Amb32652343 [0,0,0,1,0,0|1,0,0]=2 2241 B9R1.35 CC1CCC(C(=O)O)O1 Amb17593370 [0,0,0,1,0,0|2,0,0]=3 2242 B9R1.35 CC1CCC(C(=O)O)S1 Amb25719281 [0,0,0,1,0,0|2,0,0]=3 2243 B9R1.35 CC1CCC(C(N)=O)O1 Amb27838521 [0,0,0,1,0,0|3,0,0]=4 2244 B9R1.35 CC1CC[C@H](C(=O)O)N1 Amb22748252 [0,0,0,1,0,0|1,0,0]=2 2245 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb33756822 [0,0,0,1,0,0|3,0,0]=4 2246 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb8386516 [0,0,0,1,0,0|3,0,0]=4 2247 B9R1.35 CC1COC(C(=O)O)C1 Amb32679237 [0,0,0,1,0,0|3,0,0]=4 2248 B9R1.35 CC1NC(C(=O)O)CS1 Amb9718451 [0,0,0,1,0,0|2,0,0]=3 2249 B9R1.35 CC1NC(C(N)=O)CS1 Amb28194888 [0,0,0,1,0,0|3,0,0]=4 2250 B9R1.35 CC1N[C@H](C(=O)O)CS1 Amb16203706 [0,0,0,1,0,0|2,0,0]=3 2251 B9R1.35 CN1CCC(C(=O)O)C1 Amb3941190 [0,0,0,1,0,0|2,0,0]=3 2252 B9R1.35 CN1CCC(C(=O)O)C1 Amb9154860 [0,0,0,1,0,0|2,0,0]=3 2253 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22746030 [0,0,0,1,0,0|2,0,0]=3 2254 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22756448 [0,0,0,1,0,0|2,0,0]=3 2255 B9R1.35 CN1CC[C@H](C(=O)O)C1 Amb26635487 [0,0,0,1,0,0|2,0,0]=3 2256 B9R1.35 C[C@@H]1CCC(C(=O)O)O1 Amb33423875 [0,0,0,1,0,0|2,0,0]=3 2257 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)C1 Amb28429501 [0,0,0,1,0,0|2,0,0]=3 2258 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 Amb31308105 [0,0,0,1,0,0|1,0,0]=2 2259 B9R1.35 C[C@@H]1CC[C@@H](C(N)=O)N1 Amb28456271 [0,0,0,1,0,0|2,0,0]=3 2260 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)C1 Amb10843961 [0,0,0,1,0,0|2,0,0]=3 2261 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb24399449 [0,0,0,1,0,0|1,0,0]=2 2262 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb32652487 [0,0,0,1,0,0|1,0,0]=2 2263 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)O1 Amb22886534 [0,0,0,1,0,0|2,0,0]=3 2264 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb19888348 [0,0,0,1,0,0|3,0,0]=4 2265 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb33812626 [0,0,0,1,0,0|3,0,0]=4 2266 B9R1.35 C[C@@H]1C[C@H](C(=O)O)CO1 Amb27961253 [0,0,0,1,0,0|3,0,0]=4 2267 B9R1.35 C[C@@H]1O[C@H](C(=O)O)CS1 Amb26951854 [0,0,0,1,0,0|3,0,0]=4 2268 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb24598417 [0,0,0,1,0,0|1,0,0]=2 2269 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb35745779 [0,0,0,1,0,0|1,0,0]=2 2270 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)O1 Amb24651587 [0,0,0,1,0,0|2,0,0]=3 2271 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)C1 Amb27630457 [0,0,0,1,0,0|3,0,0]=4 2272 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)N1 Amb28059269 [0,0,0,1,0,0|2,0,0]=3 2273 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)O1 Amb27390111 [0,0,0,1,0,0|3,0,0]=4 2274 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 Amb33871500 [0,0,0,1,0,0|1,0,0]=2 2275 B9R1.35 C[C@H]1CC[C@H](C(N)=O)N1 Amb27204783 [0,0,0,1,0,0|2,0,0]=3 2276 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb19887682 [0,0,0,1,0,0|3,0,0]=4 2277 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb23439040 [0,0,0,1,0,0|3,0,0]=4 2278 B9R1.35 C[C@H]1N[C@@H](C(=O)O)CS1 Amb28198473 [0,0,0,1,0,0|2,0,0]=3 2279 B9R1.35 C[C@H]1O[C@H](C(=O)O)CS1 Amb27252305 [0,0,0,1,0,0|3,0,0]=4 2280 B9R1.35 NC(=O)C1CCC(=O)N1 Amb17142856 [0,0,0,1,0,0|3,0,0]=4 2281 B9R1.35 NC(=O)[C@@H]1CCC(=O)N1 Amb4018786 [0,0,0,1,0,0|3,0,0]=4 2282 B9R1.35 NC(=O)[C@H]1CCC(=O)N1 Amb27961076 [0,0,0,1,0,0|3,0,0]=4 2283 B9R1.35 NC1=NC(C(=O)O)CC1 Amb32718833 [0,0,0,1,0,0|2,0,1]=4 2284 B9R1.35 NC1=N[C@@H](C(=O)O)CC1 Amb27202599 [0,0,0,1,0,0|2,0,1]=4 2285 B9R1.35 NC1CCC(C(=O)O)C1 Amb10066880 [0,0,0,1,0,0|3,0,0]=4 2286 B9R1.35 NC1CCC(C(=O)O)C1 Amb2694935 [0,0,0,1,0,0|3,0,0]=4 2287 B9R1.35 N[C@@H]1CCC(C(=O)O)C1 Amb27263056 [0,0,0,1,0,0|3,0,0]=4 2288 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb10066881 [0,0,0,1,0,0|3,0,0]=4 2289 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb33801942 [0,0,0,1,0,0|3,0,0]=4 2290 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb33801272 [0,0,0,1,0,0|3,0,0]=4 2291 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb8516357 [0,0,0,1,0,0|3,0,0]=4 2292 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb22746692 [0,0,0,1,0,0|3,0,0]=4 2293 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb8516356 [0,0,0,1,0,0|3,0,0]=4 2294 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb10066883 [0,0,0,1,0,0|3,0,0]=4 2295 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb22756038 [0,0,0,1,0,0|3,0,0]=4 2296 B9R1.35 O=C(O)C1CCC(Br)C1 Amb2695404 [0,0,0,1,0,0|3,0,0]=4 2297 B9R1.35 O=C(O)C1CCC(F)C1 Amb22886545 [0,0,0,1,0,0|3,0,0]=4 2298 B9R1.35 O=C(O)C1CCC(I)C1 Amb23456141 [0,0,0,1,0,0|3,0,0]=4 2299 B9R1.35 O=C(O)C1CCC(O)C1 Amb21963572 [0,0,0,1,0,0|3,0,0]=4 2300 B9R1.35 O=C(O)C1CCC(S)C1 Amb27403449 [0,0,0,1,0,0|3,0,0]=4 2301 B9R1.35 O=C(O)C1CSC(=S)N1 Amb7089160 [0,0,0,1,0,0|3,0,0]=4 2302 B9R1.35 O=C(O)C1NC(O)CS1 Amb26536906 [0,0,0,1,0,0|3,0,0]=4 2303 B9R1.35 O=C(O)[C@@H]1CCC(=S)N1 Amb26857015 [0,0,0,1,0,0|2,0,0]=3 2304 B9R1.35 O=C(O)[C@@H]1CC[C@@H](O)C1 Amb22746558 [0,0,0,1,0,0|3,0,0]=4 2305 B9R1.35 O=C(O)[C@@H]1CC[C@H](O)C1 Amb27784295 [0,0,0,1,0,0|3,0,0]=4 2306 B9R1.35 O=C(O)[C@@H]1CC[C@H](S)C1 Amb26438302 [0,0,0,1,0,0|3,0,0]=4 2307 B9R1.35 O=C(O)[C@@H]1CSC(=S)N1 Amb9809722 [0,0,0,1,0,0|3,0,0]=4 2308 B9R1.35 O=C(O)[C@H]1CC[C@H](O)C1 Amb26960428 [0,0,0,1,0,0|3,0,0]=4 2309 B9R1.35 O=C(O)[C@H]1CC[C@H](O)N1 Amb27421972 [0,0,0,1,0,0|2,0,0]=3 2310 B9R1.35 O=C1CCC(C(=O)Cl)N1 Amb17142869 [0,0,0,1,0,0|3,0,0]=4 2311 B9R1.35 O=C1CCC(C(=O)O)C1 Amb2695400 [0,0,0,1,0,0|3,0,0]=4 2312 B9R1.35 O=C1CCC(C(=O)O)N1 Amb9703102 [0,0,0,1,0,0|2,0,0]=3 2313 B9R1.35 O=C1CCC(C(=O)O)O1 Amb20623076 [0,0,0,1,0,0|3,0,0]=4 2314 B9R1.35 O=C1CCC(C(=O)O)S1 Amb23439315 [0,0,0,1,0,0|3,0,0]=4 2315 B9R1.35 O=C1CCC(C(=O)[O-])N1 Amb8514777 [0,0,0,1,0,0|2,0,1]=4 2316 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 Amb27254141 [0,0,0,1,0,0|3,0,0]=4 2317 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 Amb1995036 [0,0,0,1,0,0|2,0,0]=3 2318 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 Amb24099403 [0,0,0,1,0,0|2,0,0]=3 2319 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 Amb2722887 [0,0,0,1,0,0|3,0,0]=4 2320 B9R1.35 O=C1CC[C@@H](C(=O)[O-])N1 Amb8395173 [0,0,0,1,0,0|2,0,1]=4 2321 B9R1.35 O=C1CC[C@H](C(=O)O)C1 Amb22746923 [0,0,0,1,0,0|3,0,0]=4 2322 B9R1.35 O=C1CC[C@H](C(=O)O)N1 Amb2694994 [0,0,0,1,0,0|2,0,0]=3 2323 B9R1.35 O=C1CC[C@H](C(=O)O)O1 Amb2720513 [0,0,0,1,0,0|3,0,0]=4 2324 B9R1.35 O=C1NC(C(=O)O)CO1 Amb15701690 [0,0,0,1,0,0|3,0,0]=4 2325 B9R1.35 O=C1NC(C(=O)O)CS1 Amb3319393 [0,0,0,1,0,0|3,0,0]=4 2326 B9R1.35 O=C1NCC(C(=O)O)N1 Amb2780032 [0,0,0,1,0,0|3,0,0]=4 2327 B9R1.35 O=C1NC[C@@H](C(=O)O)N1 Amb3997304 [0,0,0,1,0,0|3,0,0]=4 2328 B9R1.35 O=C1NC[C@H](C(=O)O)N1 Amb24079612 [0,0,0,1,0,0|3,0,0]=4 2329 B9R1.35 O=C1N[C@@H](C(=O)O)CO1 Amb24340149 [0,0,0,1,0,0|3,0,0]=4 2330 B9R1.35 O=C1N[C@@H](C(=O)O)CS1 Amb537246 [0,0,0,1,0,0|3,0,0]=4 2331 B9R1.35 O=C1N[C@H](C(=O)O)CO1 Amb19517080 [0,0,0,1,0,0|3,0,0]=4 2332 B9R1.35 O=C1N[C@H](C(=O)O)CS1 Amb1157856 [0,0,0,1,0,0|3,0,0]=4 2333 B9R1.40 CC1(C)CSCCC1N Amb27963147 [0,0,0,1,0,0|2,0,1]=4 2334 B9R1.40 CC1(O)CCCCC1N Amb25709525 [0,0,0,1,0,0|2,0,1]=4 2335 B9R1.40 C[C@@]1(O)CCCC[C@@H]1N Amb28134269 [0,0,0,1,0,0|2,0,1]=4 2336 B9R1.40 C[C@@]1(O)CCCC[C@H]1N Amb24382560 [0,0,0,1,0,0|2,0,1]=4 2337 B9R1.40 C[C@]1(O)COCC[C@@H]1N Amb27627376 [0,0,0,1,0,0|1,1,1]=4 2338 B9R1.45 C=C(C(=O)O)C1CC1C Amb33144231 [0,0,0,1,0,0|2,0,1]=4 2339 B9R1.45 C=C1CC1C(N)C(=O)O Amb24117258 [0,0,0,1,0,0|1,0,1]=3 2340 B9R1.45 C=C1CC1C(N)C(=O)O Amb27489118 [0,0,0,1,0,0|1,0,1]=3 2341 B9R1.45 C=C1CC1C(O)C(=O)O Amb27816361 [0,0,0,1,0,0|2,0,1]=4 2342 B9R1.45 C=C1C[C@@H]1C(O)C(=O)O Amb28410295 [0,0,0,1,0,0|2,0,1]=4 2343 B9R1.45 C=C1C[C@@H]1[C@H](N)C(=O)O Amb28349320 [0,0,0,1,0,0|1,0,1]=3 2344 B9R1.45 CC1CC1C(=O)C(=O)O Amb24760671 [0,0,0,1,0,0|2,0,1]=4 2345 B9R1.45 CC1CC1C(C)C(=O)O Amb25708709 [0,0,0,1,0,0|2,0,0]=3 2346 B9R1.45 CC1CC1C(N)C(=O)O Amb33359576 [0,0,0,1,0,0|1,0,0]=2 2347 B9R1.45 CC1CC1C(O)C(=O)O Amb33474336 [0,0,0,1,0,0|2,0,0]=3 2348 B9R1.59 CC#CC1CC1C(=O)O Amb27406350 [0,0,0,1,0,0|2,0,1]=4 2349 B9R1.59 CC#C[C@@H]1C[C@H]1C(=O)O Amb27789635 [0,0,0,1,0,0|2,0,1]=4 2350 B9R1.59 CCCC1CC1C(=O)O Amb19001459 [0,0,0,1,0,0|2,0,0]=3 2351 B9R1.59 CCCC1OC1C(=O)O Amb24561183 [0,0,0,1,0,0|2,0,0]=3 2352 B9R1.59 CCCC1OC1C(C)=O Amb25888683 [0,0,0,1,0,0|3,0,0]=4 2353 B9R1.59 CCC[C@@H]1C[C@@H]1C(=O)O Amb9901777 [0,0,0,1,0,0|2,0,0]=3 2354 B9R1.59 CCC[C@@H]1C[C@H]1C(=O)O Amb25368727 [0,0,0,1,0,0|2,0,0]=3 2355 B9R1.59 CCC[C@@H]1C[C@H]1C(N)=O Amb27837259 [0,0,0,1,0,0|3,0,0]=4 2356 B9R1.59 CCC[C@@H]1O[C@H]1C(=O)O Amb27422047 [0,0,0,1,0,0|2,0,0]=3 2357 B9R1.59 CCC[C@@H]1O[C@H]1C(C)=O Amb24366229 [0,0,0,1,0,0|3,0,0]=4 2358 B9R1.59 CCC[C@H]1C[C@H]1C(=O)O Amb27782329 [0,0,0,1,0,0|2,0,0]=3 2359 B9R1.59 CCC[C@H]1O[C@@H]1C(=O)O Amb27625884 [0,0,0,1,0,0|2,0,0]=3 2360 B9R1.59 CCC[C@H]1O[C@@H]1C(C)=O Amb28325243 [0,0,0,1,0,0|3,0,0]=4 2361 B9R1.59 CCOC1CC1C(=O)O Amb9677563 [0,0,0,1,0,0|3,0,0]=4 2362 B9R1.59 CCO[C@@H]1C[C@@H]1C(=O)O Amb27818165 [0,0,0,1,0,0|3,0,0]=4 2363 B9R1.59 CCO[C@@H]1C[C@H]1C(=O)O Amb25959626 [0,0,0,1,0,0|3,0,0]=4 2364 B9R1.59 COCC1CC1C(=O)O Amb27404704 [0,0,0,1,0,0|1,1,0]=3 2365 B9R1.59 COC[C@@H]1C[C@H]1C(=O)O Amb33098418 [0,0,0,1,0,0|1,1,0]=3 2366 B9R1.59 COC[C@H]1C[C@H]1C(=O)O Amb33098416 [0,0,0,1,0,0|1,1,0]=3 2367 B9R1.59 CSCC1CC1C(=O)O Amb33272939 [0,0,0,1,0,0|1,0,0]=2 2368 B9R1.59 CSC[C@@H]1C[C@H]1C(=O)O Amb33272937 [0,0,0,1,0,0|1,0,0]=2 2369 B9R1.59 C\C=C\C1CC1C(=O)O Amb27169581 [0,0,0,1,0,0|2,0,1]=4 2370 B9R1.59 C\C=C\[C@@H]1C[C@H]1C(=O)O Amb27771439 [0,0,0,1,0,0|2,0,1]=4 2371 B9R1.59 O=C(O)C1CC1CCF Amb33196442 [0,0,0,1,0,0|3,0,0]=4 2372 B9R1.59 O=C(O)[C@@H]1C[C@H]1CCF Amb33196453 [0,0,0,1,0,0|3,0,0]=4 2373 B9R1.69 CC1=CC(=O)C(C)CC1 Amb28323862 [0,0,0,1,0,0|3,0,0]=4 2374 B9R1.69 CC1=CC(=O)C(O)CC1 Amb27838713 [0,0,0,1,0,0|3,0,0]=4 2375 B9R1.69 CC1=CC(=O)[C@H](C)CC1 Amb27598775 [0,0,0,1,0,0|3,0,0]=4 2376 B9R1.69 CC1=CCC(C)C(=O)O1 Amb6600560 [0,0,0,1,0,0|2,0,1]=4 2377 B9R1.69 CC1CCC(=O)OC1=O Amb24117247 [0,0,0,1,0,0|3,0,0]=4 2378 B9R1.69 CC1CCC(Br)C(=O)C1 Amb27666885 [0,0,0,1,0,0|3,0,0]=4 2379 B9R1.69 CC1CCC(C)C(=O)C1 Amb22228357 [0,0,0,1,0,0|3,0,0]=4 2380 B9R1.69 CC1CCC(C)C(=O)N1 Amb25692572 [0,0,0,1,0,0|3,0,0]=4 2381 B9R1.69 CC1CCC(Cl)C(=O)C1 Amb28195532 [0,0,0,1,0,0|3,0,0]=4 2382 B9R1.69 CC1CCC(F)C(=O)C1 Amb27836782 [0,0,0,1,0,0|3,0,0]=4 2383 B9R1.69 CC1CCC(N)C(=O)N1 Amb26015847 [0,0,0,1,0,0|2,0,0]=3 2384 B9R1.69 CC1CCC(O)C(=O)O1 Amb28285159 [0,0,0,1,0,0|2,0,0]=3 2385 B9R1.69 CC1CCN(C)CC1=O Amb27861305 [0,0,0,1,0,0|3,0,0]=4 2386 B9R1.69 CC1CCN(N)C(=O)N1 Amb25917643 [0,0,0,1,0,0|3,0,0]=4 2387 B9R1.69 CN1CCC(N)C(O)C1 Amb18832535 [0,0,0,1,0,0|2,0,1]=4 2388 B9R1.69 CN1CC[C@@H](N)[C@H](O)C1 Amb27422334 [0,0,0,1,0,0|2,0,1]=4 2389 B9R1.69 C[C@@H]1CC[C@H](F)C(=O)C1 Amb28246572 [0,0,0,1,0,0|3,0,0]=4 2390 B9R1.69 C[C@@H]1O[C@H](C)CC[C@@H]1N Amb27202482 [0,0,0,1,0,0|2,0,1]=4 2391 B9R1.69 C[C@H]1CC[C@H](Br)C(=O)C1 Amb23592295 [0,0,0,1,0,0|3,0,0]=4 2392 B9R1.69 C[C@H]1CC[C@H](Cl)C(=O)C1 Amb28245372 [0,0,0,1,0,0|3,0,0]=4 2393 B9R1.69 NC1CCC(=O)NC1=O Amb16233835 [0,0,0,1,0,0|3,0,0]=4 2394 B9R1.69 NC1CCC(=O)NC1=O Amb20620338 [0,0,0,1,0,0|3,0,0]=4 2395 B9R1.69 NC1CCC(=O)NC1=O Amb22640986 [0,0,0,1,0,0|3,0,0]=4 2396 B9R1.69 NC1CCC(=O)NC1=O Amb30982658 [0,0,0,1,0,0|3,0,0]=4 2397 B9R1.69 NC1CCC(=O)OC1=O Amb27838431 [0,0,0,1,0,0|2,0,0]=3 2398 B9R1.69 N[C@@H]1CCC(=O)NC1=O Amb18536900 [0,0,0,1,0,0|3,0,0]=4 2399 B9R1.69 N[C@@H]1CCC(=O)NC1=O Amb31291118 [0,0,0,1,0,0|3,0,0]=4 2400 B9R1.69 N[C@H]1CCC(O)NC1=O Amb26317903 [0,0,0,1,0,0|3,0,0]=4 2401 B9R1.69 O=C1CCC(Br)C(=O)O1 Amb25680134 [0,0,0,1,0,0|3,0,0]=4 2402 B9R1.93 C#CC1CC1(N)C(=O)O Amb23456002 [0,0,0,1,0,0|1,0,1]=3 2403 B9R1.93 C=CC1CC1(N)C(=O)O Amb10068409 [0,0,0,1,0,0|1,0,1]=3 2404 B9R1.93 C=CC1CC1(N)[PH](=O)O Amb27970647 [0,0,0,1,0,0|2,0,1]=4 2405 B9R1.93 C=C[C@@H]1C[C@@]1(N)C(=O)O Amb26958678 [0,0,0,1,0,0|1,0,1]=3 2406 B9R1.93 C=C[C@@H]1C[C@]1(N)[PH](=O)O Amb27421893 [0,0,0,1,0,0|2,0,1]=4 2407 B9R1.93 C=C[C@H]1C[C@@]1(N)C(=O)O Amb27221097 [0,0,0,1,0,0|1,0,1]=3 2408 B9R1.93 C=C[C@H]1C[C@]1(N)C(=O)O Amb25105090 [0,0,0,1,0,0|1,0,1]=3 2409 B9R1.93 CC1(C(=O)O)CC1C#N Amb28397281 [0,0,0,1,0,0|3,0,0]=4 2410 B9R1.93 CC1(C(=O)O)CC1CO Amb24559345 [0,0,0,1,0,0|3,0,0]=4 2411 B9R1.93 CCC1CC1(N)C(=O)O Amb24655862 [0,0,0,1,0,0|1,0,0]=2 2412 B9R1.93 CCC1CC1(O)C(=O)O Amb27607715 [0,0,0,1,0,0|2,0,0]=3 2413 B9R1.93 CC[C@@H]1CC1(N)C(=O)O Amb25104706 [0,0,0,1,0,0|1,0,0]=2 2414 B9R1.93 CC[C@@H]1C[C@@]1(C)C(=O)O Amb33098402 [0,0,0,1,0,0|2,0,0]=3 2415 B9R1.93 CC[C@@H]1C[C@@]1(N)C(=O)O Amb23452849 [0,0,0,1,0,0|1,0,0]=2 2416 B9R1.93 CC[C@@H]1C[C@@]1(N)C(N)=O Amb27215769 [0,0,0,1,0,0|2,0,0]=3 2417 B9R1.93 CC[C@H]1CC1(N)C(=O)O Amb26556180 [0,0,0,1,0,0|1,0,0]=2 2418 B9R1.93 CC[C@H]1C[C@@]1(C)C(=O)O Amb33098405 [0,0,0,1,0,0|2,0,0]=3 2419 B9R1.93 CC[C@H]1C[C@@]1(N)C(N)=O Amb28286397 [0,0,0,1,0,0|2,0,0]=3 2420 B9R1.93 CC[C@H]1C[C@]1(N)C(=O)O Amb27961471 [0,0,0,1,0,0|1,0,0]=2 2421 B9R1.93 CC[C@H]1C[C@]1(N)C(N)=O Amb28286982 [0,0,0,1,0,0|2,0,0]=3 2422 B9R1.93 C[C@@]1(C(=O)O)C[C@@H]1CO Amb33098403 [0,0,0,1,0,0|3,0,0]=4 2423 B9R1.93 C[C@@]1(C(=O)O)C[C@H]1CO Amb33098404 [0,0,0,1,0,0|3,0,0]=4 2424 B9R1.93 C[C@]1(C(=O)O)C[C@@H]1CF Amb33098429 [0,0,0,1,0,0|3,0,0]=4 2425 B9R1.93 C[C@]1(C(=O)O)C[C@@H]1CO Amb33098423 [0,0,0,1,0,0|3,0,0]=4 2426 B9R1.93 NC1(C(=O)O)CC1CO Amb25828351 [0,0,0,1,0,0|2,0,0]=3 2427 B9R1.93 NCC1CC1(N)C(=O)O Amb27873291 [0,0,0,1,0,0|2,0,0]=3 2428 B9R1.93 NC[C@@H]1C[C@@]1(N)C(=O)O Amb24763621 [0,0,0,1,0,0|2,0,0]=3 2429 B9R1.93 N[C@@]1(C(=O)O)C[C@H]1CO Amb26405303 [0,0,0,1,0,0|2,0,0]=3 2430 B9R1.93 N[C@]1(C(=O)O)C[C@@H]1CO Amb2694928 [0,0,0,1,0,0|2,0,0]=3 2431 B9R1.93 N[C@]1(C(=O)O)C[C@H]1CO Amb25101898 [0,0,0,1,0,0|2,0,0]=3 2432 B9R1.93 O=C(O)C1(Cl)CC1CCl Amb24404084 [0,0,0,1,0,0|3,0,0]=4 2433 B9R1.95 C#CC1CC(C(=O)O)C1 Amb27168169 [0,0,0,1,0,0|2,0,1]=4 2434 B9R1.95 CCC1CC(C(=O)Cl)C1 Amb25791521 [0,0,0,1,0,0|3,0,0]=4 2435 B9R1.95 CCC1CC(C(=O)O)C1 Amb23456004 [0,0,0,1,0,0|2,0,0]=3 2436 B9R1.95 CCN1CC(C(=O)O)C1 Amb24117130 [0,0,0,1,0,0|3,0,0]=4 2437 B9R1.95 CC[C@H]1C[C@@H](C(N)=O)C1 Amb27168704 [0,0,0,1,0,0|3,0,0]=4 2438 B9R1.95 CNC1CC(C(=O)O)C1 Amb20622656 [0,0,0,1,0,0|2,0,0]=3 2439 B9R1.95 CNC1CC(C(=O)O)C1 Amb32668940 [0,0,0,1,0,0|2,0,0]=3 2440 B9R1.95 CNC1CC(C(C)=O)C1 Amb30032621 [0,0,0,1,0,0|3,0,0]=4 2441 B9R1.95 CNC1CC(C(N)=O)C1 Amb32670672 [0,0,0,1,0,0|3,0,0]=4 2442 B9R1.95 CNC1CC(C(N)=O)C1 Amb32670673 [0,0,0,1,0,0|3,0,0]=4 2443 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb28903920 [0,0,0,1,0,0|2,0,0]=3 2444 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb32667482 [0,0,0,1,0,0|2,0,0]=3 2445 B9R1.95 CN[C@H]1C[C@@H](C(N)=O)C1 Amb32670695 [0,0,0,1,0,0|3,0,0]=4 2446 B9R1.95 CN[C@H]1C[C@@H](C(N)=O)C1 Amb32670696 [0,0,0,1,0,0|3,0,0]=4 2447 B9R1.95 COC1CC(C(=O)O)C1 Amb8011538 [0,0,0,1,0,0|1,1,0]=3 2448 B9R1.95 COC1CC(C(C)=O)C1 Amb24595933 [0,0,0,1,0,0|2,1,0]=4 2449 B9R1.95 CO[C@H]1C[C@@H](C(=O)O)C1 Amb23440276 [0,0,0,1,0,0|1,1,0]=3 2450 B9R1.95 CO[C@H]1C[C@H](C(=O)O)C1 Amb23440277 [0,0,0,1,0,0|1,1,0]=3 2451 B9R1.95 N#CC1CC(C(=O)O)C1 Amb26049887 [0,0,0,1,0,0|3,0,0]=4 2452 B9R1.95 NCC1CC(C(=O)O)C1 Amb26631130 [0,0,0,1,0,0|3,0,0]=4 2453 B9R1.95 NCC1CC(C(=O)O)C1 Amb31307793 [0,0,0,1,0,0|3,0,0]=4 2454 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34136858 [0,0,0,1,0,0|3,0,0]=4 2455 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34148892 [0,0,0,1,0,0|3,0,0]=4 2456 B9R1.95 NC[C@H]1C[C@H](C(=O)O)C1 Amb33715808 [0,0,0,1,0,0|3,0,0]=4 2457 B9R1.95 O=C(O)C1CC(CBr)C1 Amb19958667 [0,0,0,1,0,0|3,0,0]=4 2458 B9R1.95 O=C(O)C1CC(CF)C1 Amb27186059 [0,0,0,1,0,0|3,0,0]=4 2459 B9R1.95 O=C(O)C1CC(CO)C1 Amb22002175 [0,0,0,1,0,0|3,0,0]=4 2460 B9R1.95 O=C(O)[C@H]1C[C@H](CO)C1 Amb34162163 [0,0,0,1,0,0|3,0,0]=4 2461 B9R1.95 O=C[C@H]1C[C@@H](C(=O)O)C1 Amb33309677 [0,0,0,1,0,0|3,0,0]=4 2462 B9R1.110 C=C(C(=O)O)C1CCC1 Amb26589067 [0,0,0,1,0,0|2,0,1]=4 2463 B9R1.110 C=C(C)C(N)C1CSC1 Amb35697083 [0,0,0,1,0,0|2,0,0]=3 2464 B9R1.110 C=C(C)C(O)C1CSC1 Amb35711351 [0,0,0,1,0,0|3,0,0]=4 2465 B9R1.110 CC(=O)C(C)C1CCC1 Amb35603891 [0,0,0,1,0,0|3,0,0]=4 2466 B9R1.110 CC(=O)C(C)C1CNC1 Amb24673466 [0,0,0,1,0,0|3,0,0]=4 2467 B9R1.110 CC(=O)C(N)C1CCC1 Amb25062195 [0,0,0,1,0,0|2,0,0]=3 2468 B9R1.110 CC(C(=O)Cl)C1CCC1 Amb29849535 [0,0,0,1,0,0|3,0,0]=4 2469 B9R1.110 CC(C(=O)O)C1CCC1 Amb33543919 [0,0,0,1,0,0|2,0,0]=3 2470 B9R1.110 CC(C(=O)O)C1CCO1 Amb26595674 [0,0,0,1,0,0|3,0,0]=4 2471 B9R1.110 CC(C(=O)O)C1CNC1 Amb26649377 [0,0,0,1,0,0|2,0,0]=3 2472 B9R1.110 CC(C(=O)O)C1CNC1 Amb28555391 [0,0,0,1,0,0|2,0,0]=3 2473 B9R1.110 CC(C(=O)O)C1COC1 Amb33313543 [0,0,0,1,0,0|1,1,0]=3 2474 B9R1.110 CC(C(=O)O)N1CCC1 Amb24178905 [0,0,0,1,0,0|3,0,0]=4 2475 B9R1.110 CC(C(=O)O)N1CCC1 Amb33329262 [0,0,0,1,0,0|3,0,0]=4 2476 B9R1.110 CC(C(=O)[O-])C1COC1 Amb35752725 [0,0,0,1,0,0|1,1,1]=4 2477 B9R1.110 CC(C(N)=O)C1CCC1 Amb30008333 [0,0,0,1,0,0|3,0,0]=4 2478 B9R1.110 CC(C(N)=O)C1CNC1 Amb27593677 [0,0,0,1,0,0|3,0,0]=4 2479 B9R1.110 CC(C(O)O)C1CSC1 Amb27438638 [0,0,0,1,0,0|1,0,2]=4 2480 B9R1.110 C[C@@H](C(=O)O)C1COC1 Amb33727764 [0,0,0,1,0,0|1,1,0]=3 2481 B9R1.110 C[C@@H](O)[C@H](N)C1CCC1 Amb27787967 [0,0,0,1,0,0|2,0,1]=4 2482 B9R1.110 C[C@H](C(=O)O)C1COC1 Amb33749535 [0,0,0,1,0,0|1,1,0]=3 2483 B9R1.110 NC(=O)C(F)C1CNC1 Amb28288969 [0,0,0,1,0,0|3,0,0]=4 2484 B9R1.110 NC(=O)C(N)C1CCC1 Amb27237393 [0,0,0,1,0,0|2,0,0]=3 2485 B9R1.110 NC(=O)C(N)C1COC1 Amb33065789 [0,0,0,1,0,0|1,1,0]=3 2486 B9R1.110 NC(C(=O)O)C1=CCC1 Amb27792901 [0,0,0,1,0,0|1,0,2]=4 2487 B9R1.110 NC(C(=O)O)C1CCC1 Amb19149365 [0,0,0,1,0,0|1,0,0]=2 2488 B9R1.110 NC(C(=O)O)C1CNC1 Amb30040080 [0,0,0,1,0,0|1,0,0]=2 2489 B9R1.110 NC(C(=O)O)C1COC1 Amb22405987 [0,0,0,1,0,0|0,1,0]=2 2490 B9R1.110 NC(C(=O)O)C1CSC1 Amb27844776 [0,0,0,1,0,0|0,0,0]=1 2491 B9R1.110 N[C@@H](C(=O)O)C1CCC1 Amb8395977 [0,0,0,1,0,0|1,0,0]=2 2492 B9R1.110 N[C@@H](C(=O)O)C1COC1 Amb22737550 [0,0,0,1,0,0|0,1,0]=2 2493 B9R1.110 N[C@H](C(=O)O)C1CCC1 Amb30633821 [0,0,0,1,0,0|1,0,0]=2 2494 B9R1.110 N[C@H](C(=O)O)C1CCC1 Amb8395976 [0,0,0,1,0,0|1,0,0]=2 2495 B9R1.110 N[C@H](C(=O)O)C1COC1 Amb22737551 [0,0,0,1,0,0|0,1,0]=2 2496 B9R1.110 O=C(O)C(F)C1CCC1 Amb27760713 [0,0,0,1,0,0|2,0,0]=3 2497 B9R1.110 O=C(O)C(F)C1COC1 Amb33165607 [0,0,0,1,0,0|1,1,0]=3 2498 B9R1.110 O=C(O)C(O)C1CCC1 Amb24426901 [0,0,0,1,0,0|2,0,0]=3 2499 B9R1.110 O=C(O)C(O)C1COC1 Amb26860151 [0,0,0,1,0,0|1,1,0]=3 2500 B9R1.110 O=C(O)[C@@H](O)C1CCC1 Amb34164748 [0,0,0,1,0,0|2,0,0]=3 2501 B9R1.110 O=C(O)[C@H](O)C1CCC1 Amb34165382 [0,0,0,1,0,0|2,0,0]=3 2502 B9R1.110 O=C([O-])C(O)C1COC1 Amb32650165 [0,0,0,1,0,0|1,1,1]=4 2503 B9R1.112 C=C(C)C(N)CC1CC1 Amb28313656 [0,0,0,1,0,0|3,0,0]=4 2504 B9R1.112 CC(=O)C(N)CC1CC1 Amb33132583 [0,0,0,1,0,0|2,0,0]=3 2505 B9R1.112 CC(CC1CC1)C(=O)O Amb28075498 [0,0,0,1,0,0|2,0,0]=3 2506 B9R1.112 CC(CC1CC1)C(N)=O Amb33495655 [0,0,0,1,0,0|3,0,0]=4 2507 B9R1.112 CC(NC1CC1)C(=O)O Amb9620653 [0,0,0,1,0,0|3,0,0]=4 2508 B9R1.112 CC(OC1CC1)C(=O)O Amb27667232 [0,0,0,1,0,0|3,0,0]=4 2509 B9R1.112 C[C@@H](CC1CC1)C(=O)O Amb10844014 [0,0,0,1,0,0|2,0,0]=3 2510 B9R1.112 C[C@@H](NC1CC1)C(=O)O Amb24398132 [0,0,0,1,0,0|3,0,0]=4 2511 B9R1.112 C[C@H](CC1CC1)C(=O)O Amb33749387 [0,0,0,1,0,0|2,0,0]=3 2512 B9R1.112 NC(=O)C(N)CC1CC1 Amb25767604 [0,0,0,1,0,0|2,0,0]=3 2513 B9R1.112 NC(=O)C(N)CC1CC1 Amb34199787 [0,0,0,1,0,0|2,0,0]=3 2514 B9R1.112 NC(CC1CC1)C(=O)O Amb23399727 [0,0,0,1,0,0|1,0,0]=2 2515 B9R1.112 NC(CC1CC1)C(=O)O Amb4019455 [0,0,0,1,0,0|1,0,0]=2 2516 B9R1.112 N[C@@H](CC1CC1)C(=O)O Amb24329024 [0,0,0,1,0,0|1,0,0]=2 2517 B9R1.112 N[C@@H](C[C@H]1CO1)C(=O)O Amb28252257 [0,0,0,1,0,0|0,1,0]=2 2518 B9R1.112 N[C@H](CC1CC1)C(=O)O Amb2699114 [0,0,0,1,0,0|1,0,0]=2 2519 B9R1.112 O=C(O)C(=O)CC1CC1 Amb18988329 [0,0,0,1,0,0|2,0,1]=4 2520 B9R1.112 O=C(O)C(F)CC1CC1 Amb27838541 [0,0,0,1,0,0|2,0,0]=3 2521 B9R1.112 O=C(O)C(O)CC1CC1 Amb25082516 [0,0,0,1,0,0|2,0,0]=3 2522 B9R1.112 O=C(O)C(S)CC1CC1 Amb18296302 [0,0,0,1,0,0|2,0,0]=3 2523 B9R1.112 O=C(O)[C@@H](O)CC1CC1 Amb23401512 [0,0,0,1,0,0|2,0,0]=3 2524 B9R1.112 O=C(O)[C@H](O)CC1CC1 Amb26014645 [0,0,0,1,0,0|2,0,0]=3 2525 B9R1.135 CCCC1NC(=O)C1C Amb27193222 [0,0,0,1,0,0|3,0,0]=4 2526 B9R1.135 CCC[C@@H]1NC(=O)[C@@H]1C Amb28320522 [0,0,0,1,0,0|3,0,0]=4 2527 B9R1.135 CCC[C@@H]1NC(=O)[C@H]1C Amb27229291 [0,0,0,1,0,0|3,0,0]=4 2528 B9R1.135 COC[C@@H]1NC(=O)[C@@H]1O Amb27451137 [0,0,0,1,0,0|2,1,0]=4 2529 B9R1.155 CSCC1C(N)C1(C)C Amb33271713 [0,0,0,1,0,0|2,0,1]=4 2530 B9R1.155 CSC[C@H]1[C@H](N)C1(C)C Amb33271706 [0,0,0,1,0,0|2,0,1]=4 2531 B9R1.159 CC1(C(=O)O)CCC1N Amb28397422 [0,0,0,1,0,0|3,0,0]=4 2532 B9R1.159 CC1CCC1(C)C(=O)O Amb28397417 [0,0,0,1,0,0|2,0,0]=3 2533 B9R1.159 CC1CCC1(N)C(=O)O Amb23456072 [0,0,0,1,0,0|1,0,0]=2 2534 B9R1.159 C[C@@H]1CC[C@@]1(C)C(=O)O Amb27655982 [0,0,0,1,0,0|2,0,0]=3 2535 B9R1.159 C[C@@H]1CC[C@@]1(N)C(=O)O Amb26027352 [0,0,0,1,0,0|1,0,0]=2 2536 B9R1.159 C[C@@H]1CC[C@@]1(N)C(N)=O Amb28346845 [0,0,0,1,0,0|2,0,0]=3 2537 B9R1.159 C[C@@H]1CC[C@]1(N)C(=O)O Amb24586126 [0,0,0,1,0,0|1,0,0]=2 2538 B9R1.159 C[C@H]1CC[C@@]1(N)C(=O)O Amb28056437 [0,0,0,1,0,0|1,0,0]=2 2539 B9R1.159 C[C@]1(C(=O)O)CC[C@H]1N Amb27961498 [0,0,0,1,0,0|3,0,0]=4 2540 B9R1.159 NC1(C(=O)O)CCC1O Amb27482724 [0,0,0,1,0,0|2,0,0]=3 2541 B9R1.159 NC1CCC1(F)C(=O)O Amb27768660 [0,0,0,1,0,0|3,0,0]=4 2542 B9R1.159 N[C@@H]1CC[C@]1(F)C(=O)O Amb27188263 [0,0,0,1,0,0|3,0,0]=4 2543 B9R1.159 N[C@H]1CC[C@@]1(N)C(=O)O Amb27216513 [0,0,0,1,0,0|2,0,0]=3 2544 B9R1.159 N[C@]1(C(=O)O)CC[C@@H]1O Amb28058284 [0,0,0,1,0,0|2,0,0]=3 2545 B9R1.159 O=C(O)C1(O)CCC1Br Amb28137512 [0,0,0,1,0,0|3,0,0]=4 2546 B9R1.163 C=C(C)C1(N)CCCC1 Amb33201934 [0,0,0,1,0,0|3,0,0]=4 2547 B9R1.163 CC(=O)C1(C)CCCC1 Amb17593318 [0,0,0,1,0,0|3,0,0]=4 2548 B9R1.163 CC(=O)C1(C)CCNC1 Amb25698020 [0,0,0,1,0,0|3,0,0]=4 2549 B9R1.163 CC(=O)C1(Cl)CCCC1 Amb27950094 [0,0,0,1,0,0|3,0,0]=4 2550 B9R1.163 CC(=O)C1(N)CCCC1 Amb1091405 [0,0,0,1,0,0|2,0,0]=3 2551 B9R1.163 CC(=O)C1(N)CCCC1 Amb22283948 [0,0,0,1,0,0|2,0,0]=3 2552 B9R1.163 CC(=O)C1(N)CCOC1 Amb24427660 [0,0,0,1,0,0|1,1,0]=3 2553 B9R1.163 CC(=O)C1(O)CCCC1 Amb17593345 [0,0,0,1,0,0|3,0,0]=4 2554 B9R1.163 CC(O)C1(N)CCOC1 Amb35622640 [0,0,0,1,0,0|1,1,1]=4 2555 B9R1.163 CC1(C(=O)Cl)CCCC1 Amb24476587 [0,0,0,1,0,0|3,0,0]=4 2556 B9R1.163 CC1(C(=O)O)C=CCC1 Amb18642405 [0,0,0,1,0,0|2,0,1]=4 2557 B9R1.163 CC1(C(=O)O)CC=CC1 Amb27882689 [0,0,0,1,0,0|2,0,1]=4 2558 B9R1.163 CC1(C(=O)O)CCCC1 Amb482493 [0,0,0,1,0,0|2,0,0]=3 2559 B9R1.163 CC1(C(=O)O)CCCN1 Amb15701407 [0,0,0,1,0,0|3,0,0]=4 2560 B9R1.163 CC1(C(=O)O)CCCN1 Amb22587331 [0,0,0,1,0,0|3,0,0]=4 2561 B9R1.163 CC1(C(=O)O)CCCO1 Amb1088877 [0,0,0,1,0,0|3,0,0]=4 2562 B9R1.163 CC1(C(=O)O)CCCS1 Amb20623191 [0,0,0,1,0,0|3,0,0]=4 2563 B9R1.163 CC1(C(=O)O)CCNC1 Amb20634439 [0,0,0,1,0,0|2,0,0]=3 2564 B9R1.163 CC1(C(=O)O)CCNC1 Amb2683246 [0,0,0,1,0,0|2,0,0]=3 2565 B9R1.163 CC1(C(=O)O)CCNO1 Amb27972280 [0,0,0,1,0,0|3,0,0]=4 2566 B9R1.163 CC1(C(=O)O)CCOC1 Amb18280535 [0,0,0,1,0,0|1,1,0]=3 2567 B9R1.163 CC1(C(=O)O)CCSC1 Amb27782020 [0,0,0,1,0,0|1,0,0]=2 2568 B9R1.163 CC1(C(=O)O)CNCO1 Amb32672096 [0,0,0,1,0,0|3,0,0]=4 2569 B9R1.163 CC1(C(N)=O)CCCC1 Amb4018896 [0,0,0,1,0,0|3,0,0]=4 2570 B9R1.163 CC1(C(N)=O)CCNC1 Amb27474417 [0,0,0,1,0,0|3,0,0]=4 2571 B9R1.163 CC1(C(N)=O)CSSC1 Amb10068414 [0,0,0,1,0,0|3,0,0]=4 2572 B9R1.163 C[C@@]1(C(=O)O)CCCN1 Amb10603262 [0,0,0,1,0,0|3,0,0]=4 2573 B9R1.163 C[C@@]1(C(=O)O)CCCN1 Amb22405952 [0,0,0,1,0,0|3,0,0]=4 2574 B9R1.163 C[C@@]1(C(=O)O)CCCO1 Amb27600317 [0,0,0,1,0,0|3,0,0]=4 2575 B9R1.163 C[C@@]1(C(=O)O)CCNC1 Amb26869183 [0,0,0,1,0,0|2,0,0]=3 2576 B9R1.163 C[C@]1(C(=O)O)CCCN1 Amb22406107 [0,0,0,1,0,0|3,0,0]=4 2577 B9R1.163 C[C@]1(C(=O)O)CCCN1 Amb8630480 [0,0,0,1,0,0|3,0,0]=4 2578 B9R1.163 C[C@]1(C(=O)O)CCCO1 Amb24117235 [0,0,0,1,0,0|3,0,0]=4 2579 B9R1.163 C[C@]1(C(=O)O)CCNC1 Amb24346794 [0,0,0,1,0,0|2,0,0]=3 2580 B9R1.163 N=C(N)C1(N)CCCC1 Amb25260496 [0,0,0,1,0,0|3,0,0]=4 2581 B9R1.163 N=C(N)C1(N)CCCC1 Amb32718824 [0,0,0,1,0,0|3,0,0]=4 2582 B9R1.163 NC(=O)C1(Cl)CCCC1 Amb27879093 [0,0,0,1,0,0|3,0,0]=4 2583 B9R1.163 NC(=O)C1(F)CCCC1 Amb28193242 [0,0,0,1,0,0|3,0,0]=4 2584 B9R1.163 NC(=O)C1(F)CCNC1 Amb24759688 [0,0,0,1,0,0|3,0,0]=4 2585 B9R1.163 NC(=O)C1(F)CCNC1 Amb28049785 [0,0,0,1,0,0|3,0,0]=4 2586 B9R1.163 NC(=O)C1(N)CCCC1 Amb19265774 [0,0,0,1,0,0|2,0,0]=3 2587 B9R1.163 NC(=O)C1(N)CCCC1 Amb8628017 [0,0,0,1,0,0|2,0,0]=3 2588 B9R1.163 NC(=O)C1(N)CCNC1 Amb27874404 [0,0,0,1,0,0|2,0,0]=3 2589 B9R1.163 NC(=O)C1(N)CCOC1 Amb25835775 [0,0,0,1,0,0|1,1,0]=3 2590 B9R1.163 NC(=O)C1(N)CCOC1 Amb32708549 [0,0,0,1,0,0|1,1,0]=3 2591 B9R1.163 NC(=O)C1(N)CCSC1 Amb18279185 [0,0,0,1,0,0|1,0,0]=2 2592 B9R1.163 NC(=O)C1(O)CCCC1 Amb33529797 [0,0,0,1,0,0|3,0,0]=4 2593 B9R1.163 NC(=O)C1(O)CCNC1 Amb23515119 [0,0,0,1,0,0|3,0,0]=4 2594 B9R1.163 NC(=O)C1(O)CCNC1 Amb28555395 [0,0,0,1,0,0|3,0,0]=4 2595 B9R1.163 NC(=O)C1(O)CCSC1 Amb24116837 [0,0,0,1,0,0|2,0,0]=3 2596 B9R1.163 NC(=S)C1(N)CCCC1 Amb19374908 [0,0,0,1,0,0|2,1,0]=4 2597 B9R1.163 NC1(C(=O)Cl)CCCC1 Amb27236109 [0,0,0,1,0,0|2,0,0]=3 2598 B9R1.163 NC1(C(=O)O)CC=CC1 Amb2683267 [0,0,0,1,0,0|1,0,1]=3 2599 B9R1.163 NC1(C(=O)O)CCCC1 Amb1838882 [0,0,0,1,0,0|1,0,0]=2 2600 B9R1.163 NC1(C(=O)O)CCNC1 Amb8630265 [0,0,0,1,0,0|1,0,0]=2 2601 B9R1.163 NC1(C(=O)O)CCOC1 Amb16232669 [0,0,0,1,0,0|0,1,0]=2 2602 B9R1.163 NC1(C(=O)O)CCOC1 Amb22274600 [0,0,0,1,0,0|0,1,0]=2 2603 B9R1.163 NC1(C(=O)O)CCSC1 Amb9724111 [0,0,0,1,0,0|0,0,0]=1 2604 B9R1.163 NC1(C(=O)O)OCCO1 Amb25887263 [0,0,0,1,0,0|3,0,0]=4 2605 B9R1.163 NC1(P(O)O)CCCC1 Amb28423400 [0,0,0,1,0,0|2,0,1]=4 2606 B9R1.163 N[C@@]1(C(=O)O)CCNC1 Amb6893795 [0,0,0,1,0,0|1,0,0]=2 2607 B9R1.163 N[C@@]1(C(=O)O)CCOC1 Amb20241211 [0,0,0,1,0,0|0,1,0]=2 2608 B9R1.163 N[C@@]1(C(=O)O)CCSC1 Amb27972704 [0,0,0,1,0,0|0,0,0]=1 2609 B9R1.163 N[C@]1(C(=O)O)CCNC1 Amb6893796 [0,0,0,1,0,0|1,0,0]=2 2610 B9R1.163 N[C@]1(C(=O)O)CCOC1 Amb20241209 [0,0,0,1,0,0|0,1,0]=2 2611 B9R1.163 O=C(Cl)C1(Br)CCCC1 Amb25888908 [0,0,0,1,0,0|3,0,0]=4 2612 B9R1.163 O=C(Cl)C1(Cl)CCCC1 Amb25106802 [0,0,0,1,0,0|3,0,0]=4 2613 B9R1.163 O=C(Cl)C1(Cl)CCOC1 Amb33127959 [0,0,0,1,0,0|2,1,0]=4 2614 B9R1.163 O=C(O)C1(Br)CCCC1 Amb17595053 [0,0,0,1,0,0|2,0,0]=3 2615 B9R1.163 O=C(O)C1(Cl)CCCC1 Amb32716554 [0,0,0,1,0,0|2,0,0]=3 2616 B9R1.163 O=C(O)C1(Cl)CCOC1 Amb33127967 [0,0,0,1,0,0|1,1,0]=3 2617 B9R1.163 O=C(O)C1(F)CC=CC1 Amb35789531 [0,0,0,1,0,0|2,0,1]=4 2618 B9R1.163 O=C(O)C1(F)CCCC1 Amb26957187 [0,0,0,1,0,0|2,0,0]=3 2619 B9R1.163 O=C(O)C1(F)CCNC1 Amb24120613 [0,0,0,1,0,0|2,0,0]=3 2620 B9R1.163 O=C(O)C1(F)CCNC1 Amb32992647 [0,0,0,1,0,0|2,0,0]=3 2621 B9R1.163 O=C(O)C1(F)CCOC1 Amb24420228 [0,0,0,1,0,0|1,1,0]=3 2622 B9R1.163 O=C(O)C1(O)CCCC1 Amb1159211 [0,0,0,1,0,0|2,0,0]=3 2623 B9R1.163 O=C(O)C1(O)CCNC1 Amb22500918 [0,0,0,1,0,0|2,0,0]=3 2624 B9R1.163 O=C(O)C1(O)CCNC1 Amb22899772 [0,0,0,1,0,0|2,0,0]=3 2625 B9R1.163 O=C(O)C1(O)CCOC1 Amb26332318 [0,0,0,1,0,0|1,1,0]=3 2626 B9R1.163 O=C(O)C1(O)CCSC1 Amb18944714 [0,0,0,1,0,0|1,0,0]=2 2627 B9R1.163 O=C(O)C1(S)CCCC1 Amb27185727 [0,0,0,1,0,0|2,0,0]=3 2628 B9R1.163 O=C(O)C1(S)CCCN1 Amb28383197 [0,0,0,1,0,0|3,0,0]=4 2629 B9R1.163 O=C(O)[C@@]1(F)CCCN1 Amb22748241 [0,0,0,1,0,0|3,0,0]=4 2630 B9R1.163 O=C(O)[C@@]1(O)CCSC1 Amb28119971 [0,0,0,1,0,0|1,0,0]=2 2631 B9R1.163 O=C(O)[C@]1(F)CCCN1 Amb27216006 [0,0,0,1,0,0|3,0,0]=4 2632 B9R1.163 O=[N+]([O-])C1(Br)CCSC1 Amb33298989 [0,0,0,1,0,0|2,0,1]=4 2633 B9R1.163 [NH3+]C1(C(=O)O)CC[NH2+]C1 Amb22583868 [0,0,0,1,0,0|1,0,1]=3 2634 B9R1.163 [NH3+]C1(C(=O)[O-])CCNC1 Amb22231944 [0,0,0,1,0,0|1,0,2]=4 2635 B9R0.4 C=C(C)CC(N)CCSC Amb27779574 [0,0,0,0,0,1|2,0,0]=3 2636 B9R0.4 C=C(C)CC(O)CCSC Amb27805568 [0,0,0,0,0,1|3,0,0]=4 2637 B9R0.4 C=C(CCCC)CC(=O)O Amb18643896 [0,0,0,0,0,1|2,0,1]=4 2638 B9R0.4 C=CCCC(N)CC(=O)O Amb22641959 [0,0,0,0,0,1|1,0,1]=3 2639 B9R0.4 C=CCCC(N)CC(=O)O Amb31307612 [0,0,0,0,0,1|1,0,1]=3 2640 B9R0.4 C=CCCC(N)CC(N)=O Amb25367476 [0,0,0,0,0,1|2,0,1]=4 2641 B9R0.4 C=CCC[C@@H](C)CC(=O)O Amb27390713 [0,0,0,0,0,1|2,0,1]=4 2642 B9R0.4 C=CCC[C@H](N)CC(=O)O Amb10066917 [0,0,0,0,0,1|1,0,1]=3 2643 B9R0.4 CC(CCC=O)CC(=O)O Amb28251065 [0,0,0,0,0,1|3,0,0]=4 2644 B9R0.4 CC(CCCCl)CC(=O)O Amb18646190 [0,0,0,0,0,1|3,0,0]=4 2645 B9R0.4 CC(CCCO)CC(=O)O Amb28050163 [0,0,0,0,0,1|3,0,0]=4 2646 B9R0.4 CC(CCCS)CC(=O)O Amb27443015 [0,0,0,0,0,1|3,0,0]=4 2647 B9R0.4 CCCCC(C)CC(=O)O Amb6740296 [0,0,0,0,0,1|2,0,0]=3 2648 B9R0.4 CCCCC(C)CC(N)=O Amb24761512 [0,0,0,0,0,1|3,0,0]=4 2649 B9R0.4 CCCCC(C)NC(C)=O Amb27487886 [0,0,0,0,0,1|3,0,0]=4 2650 B9R0.4 CCCCC(C)OC(=O)Cl Amb32654980 [0,0,0,0,0,1|3,0,0]=4 2651 B9R0.4 CCCCC(C)OC(C)=O Amb27594424 [0,0,0,0,0,1|3,0,0]=4 2652 B9R0.4 CCCCC(C)OC(N)=O Amb28050035 [0,0,0,0,0,1|3,0,0]=4 2653 B9R0.4 CCCCC(N)C=C(C)C Amb27486513 [0,0,0,0,0,1|3,0,0]=4 2654 B9R0.4 CCCCC(N)CC(=O)O Amb1993866 [0,0,0,0,0,1|1,0,0]=2 2655 B9R0.4 CCCCC(N)CC(=O)O Amb31307613 [0,0,0,0,0,1|1,0,0]=2 2656 B9R0.4 CCCCC(N)CC(N)=O Amb24638916 [0,0,0,0,0,1|2,0,0]=3 2657 B9R0.4 CCCCC(O)CC(=O)O Amb22388888 [0,0,0,0,0,1|2,0,0]=3 2658 B9R0.4 CCCCC(O)CC(C)=O Amb28325992 [0,0,0,0,0,1|3,0,0]=4 2659 B9R0.4 CCCCN(C)CC(=O)O Amb5774355 [0,0,0,0,0,1|3,0,0]=4 2660 B9R0.4 CCCCS(=O)CC(=O)O Amb18792577 [0,0,0,0,0,1|3,0,0]=4 2661 B9R0.4 CCCC[C@@H](C)CC(=O)O Amb25887593 [0,0,0,0,0,1|2,0,0]=3 2662 B9R0.4 CCCC[C@@H](C)CC(C)=O Amb27589814 [0,0,0,0,0,1|3,0,0]=4 2663 B9R0.4 CCCC[C@@H](N)CC(=O)O Amb26612752 [0,0,0,0,0,1|1,0,0]=2 2664 B9R0.4 CCCC[C@@H](N)CC(=O)O Amb32663769 [0,0,0,0,0,1|1,0,0]=2 2665 B9R0.4 CCCC[C@@H](O)CC(=O)O Amb24350627 [0,0,0,0,0,1|2,0,0]=3 2666 B9R0.4 CCCC[C@H](C)CC(=O)O Amb27424971 [0,0,0,0,0,1|2,0,0]=3 2667 B9R0.4 CCCC[C@H](C)CC(C)=O Amb28253626 [0,0,0,0,0,1|3,0,0]=4 2668 B9R0.4 CCCC[C@H](C)CC(N)=O Amb28461273 [0,0,0,0,0,1|3,0,0]=4 2669 B9R0.4 CCCC[C@H](C)NC(C)=O Amb27173638 [0,0,0,0,0,1|3,0,0]=4 2670 B9R0.4 CCCC[C@H](N)CC(=O)O Amb27154618 [0,0,0,0,0,1|1,0,0]=2 2671 B9R0.4 CCCC\C(Br)=C/C(=O)O Amb27622154 [0,0,0,0,0,1|2,0,1]=4 2672 B9R0.4 CCCC\C(C)=C\C(=O)O Amb25929028 [0,0,0,0,0,1|2,0,1]=4 2673 B9R0.4 CCNCC(C)CC(=O)O Amb27602707 [0,0,0,0,0,1|3,0,0]=4 2674 B9R0.4 CCOCC(O)CC(=O)O Amb28340917 [0,0,0,0,0,1|3,0,0]=4 2675 B9R0.4 CCSCC(C)CC(=O)O Amb33324046 [0,0,0,0,0,1|3,0,0]=4 2676 B9R0.4 CCSCC(N)CC(=O)O Amb27233388 [0,0,0,0,0,1|2,0,0]=3 2677 B9R0.4 CCSCC(O)CC(=O)O Amb26062529 [0,0,0,0,0,1|3,0,0]=4 2678 B9R0.4 CCSC[C@@H](O)CC(=O)O Amb33324012 [0,0,0,0,0,1|3,0,0]=4 2679 B9R0.4 CCSC[C@H](O)CC(=O)O Amb33324011 [0,0,0,0,0,1|3,0,0]=4 2680 B9R0.4 CC\C=C\C(N)CC(=O)O Amb25843767 [0,0,0,0,0,1|1,0,2]=4 2681 B9R0.4 CNCC[C@@H](N)CC(=O)O Amb24117036 [0,0,0,0,0,1|1,0,0]=2 2682 B9R0.4 COCCC(C)CC(=O)O Amb27973352 [0,0,0,0,0,1|1,1,0]=3 2683 B9R0.4 COCCC(C)OC(=O)Cl Amb32656123 [0,0,0,0,0,1|2,1,0]=4 2684 B9R0.4 COCCC(N)CC(=O)O Amb32687893 [0,0,0,0,0,1|0,1,0]=2 2685 B9R0.4 COCCC(O)CC(=O)O Amb33377806 [0,0,0,0,0,1|1,1,0]=3 2686 B9R0.4 COCCN(C)CC(=O)O Amb22587006 [0,0,0,0,0,1|2,1,0]=4 2687 B9R0.4 COCCN(C)CC(=O)O Amb22587626 [0,0,0,0,0,1|2,1,0]=4 2688 B9R0.4 COCCN(C)CC(=O)O Amb9173718 [0,0,0,0,0,1|2,1,0]=4 2689 B9R0.4 COCCS(=O)CC(=O)O Amb18792760 [0,0,0,0,0,1|2,1,0]=4 2690 B9R0.4 COCC[C@@H](O)CC(=O)O Amb33377805 [0,0,0,0,0,1|1,1,0]=3 2691 B9R0.4 COCC[C@H](O)CC(=O)O Amb33377804 [0,0,0,0,0,1|1,1,0]=3 2692 B9R0.4 COCOC(C)CC(=O)O Amb28141098 [0,0,0,0,0,1|2,1,0]=4 2693 B9R0.4 CONCC(O)CC(=O)O Amb28071252 [0,0,0,0,0,1|2,1,0]=4 2694 B9R0.4 CSCCC(C)CC(=O)O Amb26651819 [0,0,0,0,0,1|1,0,0]=2 2695 B9R0.4 CSCCC(C)NC(=N)N Amb27615988 [0,0,0,0,0,1|3,0,0]=4 2696 B9R0.4 CSCCC(C)NC(C)=O Amb27868995 [0,0,0,0,0,1|2,0,0]=3 2697 B9R0.4 CSCCC(N)C=C(C)C Amb28130951 [0,0,0,0,0,1|2,0,0]=3 2698 B9R0.4 CSCCC(N)CC(=O)O Amb22353181 [0,0,0,0,0,1|0,0,0]=1 2699 B9R0.4 CSCCC(N)CC(=O)O Amb30666600 [0,0,0,0,0,1|0,0,0]=1 2700 B9R0.4 CSCCC(N)CC(N)=O Amb26023351 [0,0,0,0,0,1|1,0,0]=2 2701 B9R0.4 CSCCC(O)CC(=O)O Amb18798349 [0,0,0,0,0,1|1,0,0]=2 2702 B9R0.4 CSCCN(C)CC(=O)O Amb27448940 [0,0,0,0,0,1|2,0,0]=3 2703 B9R0.4 CSCCN(C)CC(C)=O Amb27880841 [0,0,0,0,0,1|3,0,0]=4 2704 B9R0.4 CSCCN(C)CC(N)=O Amb27944587 [0,0,0,0,0,1|3,0,0]=4 2705 B9R0.4 CSCC[C@@H](N)CC(=O)O Amb26930581 [0,0,0,0,0,1|0,0,0]=1 2706 B9R0.4 CSCC[C@@H](N)CN(C)C Amb27806419 [0,0,0,0,0,1|3,0,0]=4 2707 B9R0.4 CSCC[C@@H](O)CC(=O)O Amb33198734 [0,0,0,0,0,1|1,0,0]=2 2708 B9R0.4 CSCC[C@H](N)CC(=O)O Amb16184019 [0,0,0,0,0,1|0,0,0]=1 2709 B9R0.4 CSCC[C@H](O)CC(=O)O Amb33198733 [0,0,0,0,0,1|1,0,0]=2 2710 B9R0.4 CSC\C=C(\C)CC(=O)O Amb24726319 [0,0,0,0,0,1|1,0,2]=4 2711 B9R0.4 C[C@@H](CCC=O)CC(=O)O Amb27614920 [0,0,0,0,0,1|3,0,0]=4 2712 B9R0.4 C\C=C/C[C@@H](O)CC(=O)O Amb28050083 [0,0,0,0,0,1|2,0,1]=4 2713 B9R0.4 NCCCC(N)CC(=O)O Amb18644278 [0,0,0,0,0,1|2,0,0]=3 2714 B9R0.4 NCCCC(N)CC(=O)O Amb32753541 [0,0,0,0,0,1|2,0,0]=3 2715 B9R0.4 NCCC[C@@H](N)CC(=O)O Amb24117039 [0,0,0,0,0,1|2,0,0]=3 2716 B9R0.4 NCCC[C@@H](N)CC(=O)O Amb24117927 [0,0,0,0,0,1|2,0,0]=3 2717 B9R0.4 NCCC[C@H](N)CC(=O)O Amb25757485 [0,0,0,0,0,1|2,0,0]=3 2718 B9R0.4 NCCC[C@H](N)CC(=O)O Amb32684506 [0,0,0,0,0,1|2,0,0]=3 2719 B6R0.1 C#CC(N)CCC Amb27392611 [2,0,0,0,0,0|1,0,1]=4 2720 B6R0.1 C#CC(N)CCC Amb33329330 [2,0,0,0,0,0|1,0,1]=4 2721 B6R0.1 C#CC(N)CSC Amb26867955 [2,0,0,0,0,0|1,0,1]=4 2722 B6R0.1 C#C[C@@H](N)CCC Amb27467403 [2,0,0,0,0,0|1,0,1]=4 2723 B6R0.1 C=CC(C)CCC Amb4019542 [2,0,0,0,0,0|2,0,0]=4 2724 B6R0.1 C=CC(N)CCC Amb27814468 [2,0,0,0,0,0|1,0,0]=3 2725 B6R0.1 C=CC(N)CCO Amb22496689 [2,0,0,0,0,0|1,1,0]=4 2726 B6R0.1 C=CC(N)COC Amb25252949 [2,0,0,0,0,0|1,1,0]=4 2727 B6R0.1 C=CC(O)CCC Amb22002474 [2,0,0,0,0,0|2,0,0]=4 2728 B6R0.1 C=CC(O)CSC Amb25969067 [2,0,0,0,0,0|2,0,0]=4 2729 B6R0.1 C=C[C@H](N)COC Amb28069182 [2,0,0,0,0,0|1,1,0]=4 2730 B6R0.1 CC(C=O)CCBr Amb18126359 [2,0,0,0,0,0|2,0,0]=4 2731 B6R0.1 CC(C=O)CCF Amb33196124 [2,0,0,0,0,0|2,0,0]=4 2732 B6R0.1 CC(C=O)CCO Amb28208492 [2,0,0,0,0,0|1,1,0]=4 2733 B6R0.1 CCC(N)CSC Amb17485955 [2,0,0,0,0,0|1,0,1]=4 2734 B6R0.1 CCCC(C)C=O Amb3939898 [2,0,0,0,0,0|1,0,0]=3 2735 B6R0.1 CCCC(C)CO Amb8999036 [2,0,0,0,0,0|1,0,1]=4 2736 B6R0.1 CCCC(Cl)C=O Amb18124277 [2,0,0,0,0,0|1,0,0]=3 2737 B6R0.1 CCCC(Cl)CO Amb25950697 [2,0,0,0,0,0|1,0,1]=4 2738 B6R0.1 CCCC(I)CO Amb27268581 [2,0,0,0,0,0|1,0,1]=4 2739 B6R0.1 CCCC(N)C#N Amb1130677 [2,0,0,0,0,0|1,0,1]=4 2740 B6R0.1 CCCC(N)C#N Amb7969786 [2,0,0,0,0,0|1,0,1]=4 2741 B6R0.1 CCCC(N)CC Amb13951437 [2,0,0,0,0,0|1,0,1]=4 2742 B6R0.1 CCCC(N)CC Amb8869707 [2,0,0,0,0,0|1,0,1]=4 2743 B6R0.1 CCCC(N)CN Amb9380663 [2,0,0,0,0,0|1,0,1]=4 2744 B6R0.1 CCCC(N)CO Amb3940003 [2,0,0,0,0,0|0,0,1]=3 2745 B6R0.1 CCCC(O)CO Amb8385613 [2,0,0,0,0,0|1,0,1]=4 2746 B6R0.1 CCCN(N)C=O Amb18121867 [2,0,0,0,0,0|1,0,0]=3 2747 B6R0.1 CCC[C@@H](C)CO Amb22823174 [2,0,0,0,0,0|1,0,1]=4 2748 B6R0.1 CCC[C@@H](N)CF Amb33624250 [2,0,0,0,0,0|1,0,1]=4 2749 B6R0.1 CCC[C@@H](N)CO Amb22756532 [2,0,0,0,0,0|0,0,1]=3 2750 B6R0.1 CCC[C@@H](N)CO Amb3941479 [2,0,0,0,0,0|0,0,1]=3 2751 B6R0.1 CCC[C@H](C)C=O Amb28248332 [2,0,0,0,0,0|1,0,0]=3 2752 B6R0.1 CCC[C@H](C)CO Amb27423081 [2,0,0,0,0,0|1,0,1]=4 2753 B6R0.1 CCC[C@H](F)C=O Amb27644096 [2,0,0,0,0,0|1,0,0]=3 2754 B6R0.1 CCC[C@H](N)C=O Amb27488589 [2,0,0,0,0,0|0,0,0]=2 2755 B6R0.1 CCC[C@H](N)CF Amb27430280 [2,0,0,0,0,0|1,0,1]=4 2756 B6R0.1 CCC[C@H](N)CO Amb33869036 [2,0,0,0,0,0|0,0,1]=3 2757 B6R0.1 CCC[C@H](N)CO Amb3941480 [2,0,0,0,0,0|0,0,1]=3 2758 B6R0.1 CCC\C(N)=N\O Amb19890174 [2,0,0,0,0,0|1,0,1]=4 2759 B6R0.1 CCC\C(N)=N\O Amb2724965 [2,0,0,0,0,0|1,0,1]=4 2760 B6R0.1 CCSC(C)C=O Amb28050282 [2,0,0,0,0,0|2,0,0]=4 2761 B6R0.1 CC[C@H](N)CSC Amb27248591 [2,0,0,0,0,0|1,0,1]=4 2762 B6R0.1 COCC(C)C=O Amb33545315 [2,0,0,0,0,0|1,1,0]=4 2763 B6R0.1 COCC(N)CO Amb28827629 [2,0,0,0,0,0|0,1,1]=4 2764 B6R0.1 COCC(N)CO Amb8630413 [2,0,0,0,0,0|0,1,1]=4 2765 B6R0.1 COC[C@@H](N)CO Amb31291244 [2,0,0,0,0,0|0,1,1]=4 2766 B6R0.1 COC[C@@H](N)CO Amb8385867 [2,0,0,0,0,0|0,1,1]=4 2767 B6R0.1 COC[C@@H](O)C=O Amb28132745 [2,0,0,0,0,0|1,1,0]=4 2768 B6R0.1 COC[C@H](N)CO Amb26597391 [2,0,0,0,0,0|0,1,1]=4 2769 B6R0.1 COC[C@H](O)C=O Amb27838256 [2,0,0,0,0,0|1,1,0]=4 2770 B6R0.1 CSCC(C)C=O Amb20621025 [2,0,0,0,0,0|1,0,0]=3 2771 B6R0.1 CSCC(C)CO Amb33530103 [2,0,0,0,0,0|1,0,1]=4 2772 B6R0.1 CSCC(N)CO Amb18642038 [2,0,0,0,0,0|0,0,1]=3 2773 B6R0.1 CSCC(O)C=O Amb27438538 [2,0,0,0,0,0|1,0,0]=3 2774 B6R0.1 CSCC(O)CO Amb26908305 [2,0,0,0,0,0|1,0,1]=4 2775 B6R0.1 CSCC(S)CO Amb35752151 [2,0,0,0,0,0|1,0,1]=4 2776 B6R0.1 CSC[C@@H](N)CO Amb24479894 [2,0,0,0,0,0|0,0,1]=3 2777 B6R0.1 CSC[C@H](N)CO Amb27229163 [2,0,0,0,0,0|0,0,1]=3 2778 B6R0.1 CSC\C(N)=N\O Amb8385720 [2,0,0,0,0,0|1,0,1]=4 2779 B6R0.1 C[C@@H](C=O)CCO Amb27394744 [2,0,0,0,0,0|1,1,0]=4 2780 B6R0.1 C[C@H](C=O)CCCl Amb28252660 [2,0,0,0,0,0|2,0,0]=4 2781 B6R0.1 C[C@H](C=O)CCO Amb27260814 [2,0,0,0,0,0|1,1,0]=4 2782 B6R0.1 NC(C=O)CC=O Amb27872844 [2,0,0,0,0,0|0,1,1]=4 2783 B6R0.1 NC(CO)CCCl Amb28072241 [2,0,0,0,0,0|1,0,1]=4 2784 B6R0.1 NC(CO)CCF Amb25259782 [2,0,0,0,0,0|1,0,1]=4 2785 B6R0.1 NC(CO)CCF Amb33204436 [2,0,0,0,0,0|1,0,1]=4 2786 B6R0.1 NC(CO)CCO Amb27948796 [2,0,0,0,0,0|0,1,1]=4 2787 B6R0.1 NC(CO)CCO Amb32666185 [2,0,0,0,0,0|0,1,1]=4 2788 B6R0.1 NC(CO)CCP Amb27838196 [2,0,0,0,0,0|1,0,1]=4 2789 B6R0.1 NCCC(O)C=O Amb25682881 [2,0,0,0,0,0|2,0,0]=4 2790 B6R0.1 N[C@@H](CO)CCF Amb33196431 [2,0,0,0,0,0|1,0,1]=4 2791 B6R0.1 N[C@@H](CO)CCO Amb26855089 [2,0,0,0,0,0|0,1,1]=4 2792 B6R0.1 N[C@H](CO)CCF Amb33196432 [2,0,0,0,0,0|1,0,1]=4 2793 B6R0.1 N[C@H](CO)CCO Amb33362376 [2,0,0,0,0,0|0,1,1]=4 2794 B6R0.1 N[C@H](CO)CCO Amb6893747 [2,0,0,0,0,0|0,1,1]=4 2795 B6R0.1 N[C@H](CS)CCS Amb27145708 [2,0,0,0,0,0|0,1,1]=4 2796 B6R0.1 O=CC(Br)CCO Amb28206552 [2,0,0,0,0,0|1,1,0]=4 2797 B6R0.1 O=CC(O)CCBr Amb27838276 [2,0,0,0,0,0|2,0,0]=4 2798 B6R0.1 O=CC(O)CCO Amb27955546 [2,0,0,0,0,0|1,1,0]=4 2799 B6R0.1 O=C[C@H](O)CCBr Amb28399793 [2,0,0,0,0,0|2,0,0]=4 2800 B6R0.1 OCC(S)CCS Amb28065143 [2,0,0,0,0,0|1,0,1]=4 2801 B6R0.4 C#CCCC(=O)O Amb33532622 [2,0,0,0,0,0|0,0,2]=4 2802 B6R0.4 C=C(C)CCCC Amb2721685 [2,0,0,0,0,0|2,0,0]=4 2803 B6R0.4 C=C(C)CCCS Amb33198962 [2,0,0,0,0,0|2,0,0]=4 2804 B6R0.4 C=C(C)CCSC Amb28400079 [2,0,0,0,0,0|1,0,1]=4 2805 B6R0.4 C=CCCC(=O)O Amb3940112 [2,0,0,0,0,0|0,0,2]=4 2806 B6R0.4 CC#CCC(=O)O Amb17939740 [2,0,0,0,0,0|0,0,2]=4 2807 B6R0.4 CC(=O)CCCBr Amb8394105 [2,0,0,0,0,0|2,0,0]=4 2808 B6R0.4 CC(=O)CCCCl Amb3940272 [2,0,0,0,0,0|2,0,0]=4 2809 B6R0.4 CC(=O)CCCF Amb25068187 [2,0,0,0,0,0|2,0,0]=4 2810 B6R0.4 CC(=O)CCCN Amb18121547 [2,0,0,0,0,0|2,0,0]=4 2811 B6R0.4 CC(=O)CCCN Amb32661221 [2,0,0,0,0,0|2,0,0]=4 2812 B6R0.4 CC(=O)CCCN Amb32661286 [2,0,0,0,0,0|2,0,0]=4 2813 B6R0.4 CC(=O)CCCO Amb3940340 [2,0,0,0,0,0|1,1,0]=4 2814 B6R0.4 CC(=O)NCCS Amb22230992 [2,0,0,0,0,0|2,0,0]=4 2815 B6R0.4 CCC#CC(=O)O Amb6336503 [2,0,0,0,0,0|0,0,2]=4 2816 B6R0.4 CCCCB(O)O Amb2447142 [2,0,0,0,0,0|1,0,1]=4 2817 B6R0.4 CCCCC(=N)N Amb10066937 [2,0,0,0,0,0|2,0,0]=4 2818 B6R0.4 CCCCC(=N)N Amb2696360 [2,0,0,0,0,0|2,0,0]=4 2819 B6R0.4 CCCCC(=O)Cl Amb3939066 [2,0,0,0,0,0|1,0,0]=3 2820 B6R0.4 CCCCC(=O)O Amb3939877 [2,0,0,0,0,0|0,0,0]=2 2821 B6R0.4 CCCCC(=O)[O-] Amb22056343 [2,0,0,0,0,0|0,0,1]=3 2822 B6R0.4 CCCCC(=S)S Amb27195855 [2,0,0,0,0,0|0,2,0]=4 2823 B6R0.4 CCCCC(C)=O Amb6608652 [2,0,0,0,0,0|1,0,0]=3 2824 B6R0.4 CCCCC(C)N Amb33527132 [2,0,0,0,0,0|1,0,1]=4 2825 B6R0.4 CCCCC(C)N Amb33532410 [2,0,0,0,0,0|1,0,1]=4 2826 B6R0.4 CCCCC(C)O Amb4605977 [2,0,0,0,0,0|1,0,1]=4 2827 B6R0.4 CCCCC(N)=O Amb6891958 [2,0,0,0,0,0|1,0,0]=3 2828 B6R0.4 CCCCC(N)=S Amb6249558 [2,0,0,0,0,0|1,1,0]=4 2829 B6R0.4 CCCCN(C)O Amb33204268 [2,0,0,0,0,0|2,0,0]=4 2830 B6R0.4 CCCCS(=O)Cl Amb24551332 [2,0,0,0,0,0|2,0,0]=4 2831 B6R0.4 CCCCS(=O)[O-] Amb19889352 [2,0,0,0,0,0|1,0,1]=4 2832 B6R0.4 CCCCS(N)=O Amb32720302 [2,0,0,0,0,0|2,0,0]=4 2833 B6R0.4 CCCC[C@@H](C)N Amb20242479 [2,0,0,0,0,0|1,0,1]=4 2834 B6R0.4 CCCC[C@@H](C)O Amb19929139 [2,0,0,0,0,0|1,0,1]=4 2835 B6R0.4 CCCC[C@H](C)N Amb20242478 [2,0,0,0,0,0|1,0,1]=4 2836 B6R0.4 CCCC[C@H](C)O Amb8515092 [2,0,0,0,0,0|1,0,1]=4 2837 B6R0.4 CCCC[N+](=O)[O-] Amb6298783 [2,0,0,0,0,0|1,0,1]=4 2838 B6R0.4 CCCC[PH](=O)O Amb8391286 [2,0,0,0,0,0|1,0,0]=3 2839 B6R0.4 CCCNC(=O)Cl Amb25688616 [2,0,0,0,0,0|2,0,0]=4 2840 B6R0.4 CCCNC(C)=O Amb5835710 [2,0,0,0,0,0|2,0,0]=4 2841 B6R0.4 CCCNC(N)=O Amb1152241 [2,0,0,0,0,0|2,0,0]=4 2842 B6R0.4 CCCOC(=O)Cl Amb10604123 [2,0,0,0,0,0|2,0,0]=4 2843 B6R0.4 CCCOC(=O)F Amb32667886 [2,0,0,0,0,0|2,0,0]=4 2844 B6R0.4 CCCOC(N)=O Amb6334809 [2,0,0,0,0,0|2,0,0]=4 2845 B6R0.4 CCCSC(C)=O Amb22043301 [2,0,0,0,0,0|2,0,0]=4 2846 B6R0.4 CCCSC(N)=O Amb27167907 [2,0,0,0,0,0|2,0,0]=4 2847 B6R0.4 CCNCC(=O)Cl Amb27948279 [2,0,0,0,0,0|2,0,0]=4 2848 B6R0.4 CCNCC(=O)O Amb10609667 [2,0,0,0,0,0|1,0,0]=3 2849 B6R0.4 CCNCC(=O)O Amb7764661 [2,0,0,0,0,0|1,0,0]=3 2850 B6R0.4 CCNCC(C)=O Amb24545893 [2,0,0,0,0,0|2,0,0]=4 2851 B6R0.4 CCNCC(C)=O Amb32661185 [2,0,0,0,0,0|2,0,0]=4 2852 B6R0.4 CCNCC(N)=O Amb1128676 [2,0,0,0,0,0|2,0,0]=4 2853 B6R0.4 CCNCC(N)=O Amb4035424 [2,0,0,0,0,0|2,0,0]=4 2854 B6R0.4 CCOCC(=O)Cl Amb33528415 [2,0,0,0,0,0|2,0,0]=4 2855 B6R0.4 CCOCC(=O)O Amb3939880 [2,0,0,0,0,0|1,0,0]=3 2856 B6R0.4 CCOCC(=O)S Amb27813482 [2,0,0,0,0,0|1,1,0]=4 2857 B6R0.4 CCOCC(C)=O Amb9666086 [2,0,0,0,0,0|2,0,0]=4 2858 B6R0.4 CCPCC(=O)O Amb28321137 [2,0,0,0,0,0|1,0,0]=3 2859 B6R0.4 CCSCC(=O)O Amb1125185 [2,0,0,0,0,0|1,0,0]=3 2860 B6R0.4 CCSCC(C)=O Amb4018179 [2,0,0,0,0,0|2,0,0]=4 2861 B6R0.4 CC\C=C/C(=O)O Amb28429841 [2,0,0,0,0,0|0,0,2]=4 2862 B6R0.4 CC\C=C\C(=O)O Amb6608967 [2,0,0,0,0,0|0,0,2]=4 2863 B6R0.4 CC\N=C\C(=O)O Amb28041425 [2,0,0,0,0,0|1,0,1]=4 2864 B6R0.4 CNCCC(=O)Cl Amb27422890 [2,0,0,0,0,0|2,0,0]=4 2865 B6R0.4 CNCCC(=O)O Amb10609760 [2,0,0,0,0,0|1,0,0]=3 2866 B6R0.4 CNCCC(=O)O Amb7766400 [2,0,0,0,0,0|1,0,0]=3 2867 B6R0.4 CNCCC(C)=O Amb24560306 [2,0,0,0,0,0|2,0,0]=4 2868 B6R0.4 CNCCC(C)=O Amb28827637 [2,0,0,0,0,0|2,0,0]=4 2869 B6R0.4 CNCCC(C)N Amb18288833 [2,0,0,0,0,0|1,0,1]=4 2870 B6R0.4 CNCCC(C)O Amb17569889 [2,0,0,0,0,0|2,0,0]=4 2871 B6R0.4 CNCCC(C)O Amb34141241 [2,0,0,0,0,0|2,0,0]=4 2872 B6R0.4 CNCCC(N)=O Amb19959913 [2,0,0,0,0,0|1,0,1]=4 2873 B6R0.4 CNCCC(N)=O Amb33538309 [2,0,0,0,0,0|1,0,1]=4 2874 B6R0.4 CNCC[C@@H](C)N Amb28429755 [2,0,0,0,0,0|1,0,1]=4 2875 B6R0.4 CNCC[C@H](C)O Amb27801301 [2,0,0,0,0,0|2,0,0]=4 2876 B6R0.4 COCCC(=O)Cl Amb2689274 [2,0,0,0,0,0|1,1,0]=4 2877 B6R0.4 COCCC(=O)O Amb3938990 [2,0,0,0,0,0|0,1,0]=3 2878 B6R0.4 COCCC(C)=O Amb7764907 [2,0,0,0,0,0|1,1,0]=4 2879 B6R0.4 COCCC(C)N Amb7772188 [2,0,0,0,0,0|0,1,1]=4 2880 B6R0.4 COCCC(C)O Amb20621489 [2,0,0,0,0,0|1,1,0]=4 2881 B6R0.4 COCCC(N)=O Amb33538943 [2,0,0,0,0,0|0,1,1]=4 2882 B6R0.4 COCCC(O)Br Amb20242943 [2,0,0,0,0,0|1,1,0]=4 2883 B6R0.4 COCCC(O)O Amb28410462 [2,0,0,0,0,0|1,1,0]=4 2884 B6R0.4 COCCS(N)=O Amb32720336 [2,0,0,0,0,0|1,1,0]=4 2885 B6R0.4 COCC[C@@H](C)N Amb25934655 [2,0,0,0,0,0|0,1,1]=4 2886 B6R0.4 COCC[C@@H](C)N Amb33620890 [2,0,0,0,0,0|0,1,1]=4 2887 B6R0.4 COCC[C@@H](C)O Amb27237141 [2,0,0,0,0,0|1,1,0]=4 2888 B6R0.4 COCC[C@H](C)N Amb25888528 [2,0,0,0,0,0|0,1,1]=4 2889 B6R0.4 COCC[C@H](C)N Amb33741910 [2,0,0,0,0,0|0,1,1]=4 2890 B6R0.4 COCC[C@H](C)O Amb26559043 [2,0,0,0,0,0|1,1,0]=4 2891 B6R0.4 CSC#CC(=O)O Amb33309663 [2,0,0,0,0,0|0,0,2]=4 2892 B6R0.4 CSCCC(=N)N Amb19373501 [2,0,0,0,0,0|1,0,1]=4 2893 B6R0.4 CSCCC(=N)N Amb19516878 [2,0,0,0,0,0|1,0,1]=4 2894 B6R0.4 CSCCC(=O)O Amb3939879 [2,0,0,0,0,0|0,0,0]=2 2895 B6R0.4 CSCCC(C)=O Amb8392858 [2,0,0,0,0,0|1,0,0]=3 2896 B6R0.4 CSCCC(C)Br Amb33007127 [2,0,0,0,0,0|1,0,1]=4 2897 B6R0.4 CSCCC(C)C Amb4016370 [2,0,0,0,0,0|1,0,1]=4 2898 B6R0.4 CSCCC(C)N Amb19515505 [2,0,0,0,0,0|0,0,1]=3 2899 B6R0.4 CSCCC(C)O Amb27860401 [2,0,0,0,0,0|1,0,0]=3 2900 B6R0.4 CSCCC(N)=S Amb17307559 [2,0,0,0,0,0|0,1,1]=4 2901 B6R0.4 CSCCN(=O)=O Amb24179458 [2,0,0,0,0,0|1,0,1]=4 2902 B6R0.4 CSCCN(C)O Amb33272058 [2,0,0,0,0,0|2,0,0]=4 2903 B6R0.4 CSCC[C@@H](C)N Amb33200180 [2,0,0,0,0,0|0,0,1]=3 2904 B6R0.4 CSCC[C@@H](C)O Amb33198759 [2,0,0,0,0,0|1,0,0]=3 2905 B6R0.4 CSCC[C@H](C)N Amb33200178 [2,0,0,0,0,0|0,0,1]=3 2906 B6R0.4 CSCC[C@H](C)O Amb33198747 [2,0,0,0,0,0|1,0,0]=3 2907 B6R0.4 CSCSC(C)=O Amb27876851 [2,0,0,0,0,0|2,0,0]=4 2908 B6R0.4 CSSCC(=O)O Amb25378801 [2,0,0,0,0,0|1,0,0]=3 2909 B6R0.4 CSSCC(C)N Amb27480762 [2,0,0,0,0,0|1,0,1]=4 2910 B6R0.4 CS\C=C\C(=O)O Amb30584688 [2,0,0,0,0,0|0,0,2]=4 2911 B6R0.4 C\C=C\CC(=O)O Amb3941538 [2,0,0,0,0,0|0,0,2]=4 2912 B6R0.4 N#CCCC(=O)O Amb2694975 [2,0,0,0,0,0|1,0,1]=4 2913 B6R0.4 NC(=O)CCCCl Amb1138237 [2,0,0,0,0,0|2,0,0]=4 2914 B6R0.4 NC(=O)CCCF Amb28073400 [2,0,0,0,0,0|2,0,0]=4 2915 B6R0.4 NC(=O)CCCO Amb20623438 [2,0,0,0,0,0|1,1,0]=4 2916 B6R0.4 NC(=O)CCCS Amb27174778 [2,0,0,0,0,0|1,0,0]=3 2917 B6R0.4 NCCCC(=O)Cl Amb1935063 [2,0,0,0,0,0|2,0,0]=4 2918 B6R0.4 NCCCC(=O)O Amb1935210 [2,0,0,0,0,0|1,0,0]=3 2919 B6R0.4 NCCCC(N)=O Amb2099583 [2,0,0,0,0,0|2,0,0]=4 2920 B6R0.4 NCCCC(N)=O Amb6543438 [2,0,0,0,0,0|2,0,0]=4 2921 B6R0.4 NCCCS(=O)O Amb25185942 [2,0,0,0,0,0|2,0,0]=4 2922 B6R0.4 NCCC[PH](=O)O Amb22370049 [2,0,0,0,0,0|2,0,0]=4 2923 B6R0.4 NNCCC(=O)O Amb33756816 [2,0,0,0,0,0|2,0,0]=4 2924 B6R0.4 NOCCC(=O)O Amb17569891 [2,0,0,0,0,0|1,1,0]=4 2925 B6R0.4 NOCCC(=O)O Amb32693437 [2,0,0,0,0,0|1,1,0]=4 2926 B6R0.4 O=C(Br)CCCBr Amb25724818 [2,0,0,0,0,0|2,0,0]=4 2927 B6R0.4 O=C(Cl)CCCBr Amb3940241 [2,0,0,0,0,0|2,0,0]=4 2928 B6R0.4 O=C(Cl)CCCCl Amb6608638 [2,0,0,0,0,0|2,0,0]=4 2929 B6R0.4 O=C(O)CCCBr Amb8393276 [2,0,0,0,0,0|1,0,0]=3 2930 B6R0.4 O=C(O)CCCCl Amb3940333 [2,0,0,0,0,0|1,0,0]=3 2931 B6R0.4 O=C(O)CCCF Amb17593104 [2,0,0,0,0,0|1,0,0]=3 2932 B6R0.4 O=C(O)CCCI Amb22295911 [2,0,0,0,0,0|1,0,0]=3 2933 B6R0.4 O=C(O)CCCO Amb18640332 [2,0,0,0,0,0|0,1,0]=3 2934 B6R0.4 O=C(O)CCCS Amb16185429 [2,0,0,0,0,0|0,0,0]=2 2935 B6R0.4 O=C(O)CCNO Amb28067767 [2,0,0,0,0,0|1,1,0]=4 2936 B6R0.4 O=C(O)CCSCl Amb28387511 [2,0,0,0,0,0|1,0,0]=3 2937 B6R0.4 O=C(O)COCF Amb33378705 [2,0,0,0,0,0|2,0,0]=4 2938 B6R0.4 O=C(O)CPCO Amb28340565 [2,0,0,0,0,0|1,1,0]=4 2939 B6R0.4 O=C(O)CSSCl Amb27477882 [2,0,0,0,0,0|2,0,0]=4 2940 B6R0.4 O=C([O-])CCCO Amb3429667 [2,0,0,0,0,0|0,1,1]=4 2941 B6R0.4 O=CCCC(=O)O Amb17673897 [2,0,0,0,0,0|0,1,1]=4 2942 B6R0.4 O=[PH](O)CCCO Amb28345330 [2,0,0,0,0,0|1,1,0]=4 2943 B6R0.6 C#CCCCC=O Amb17593060 [2,0,0,0,0,0|1,0,1]=4 2944 B6R0.6 C#CCCCSC Amb26996684 [2,0,0,0,0,0|1,0,1]=4 2945 B6R0.6 C=CCCCC=O Amb13883672 [2,0,0,0,0,0|1,0,1]=4 2946 B6R0.6 C=CCCCCC Amb3940498 [2,0,0,0,0,0|2,0,0]=4 2947 B6R0.6 C=CCCCNC Amb18523846 [2,0,0,0,0,0|2,0,0]=4 2948 B6R0.6 C=CCCCNC Amb32651835 [2,0,0,0,0,0|2,0,0]=4 2949 B6R0.6 C=CCCCOC Amb24432882 [2,0,0,0,0,0|1,1,0]=4 2950 B6R0.6 CCCCCC=O Amb3939522 [2,0,0,0,0,0|1,0,0]=3 2951 B6R0.6 CCCCCCO Amb3941500 [2,0,0,0,0,0|1,0,1]=4 2952 B6R0.6 CCCCCNO Amb25067859 [2,0,0,0,0,0|2,0,0]=4 2953 B6R0.6 CCCCCSC Amb21618865 [2,0,0,0,0,0|1,0,1]=4 2954 B6R0.6 CCCCNC=O Amb4017838 [2,0,0,0,0,0|2,0,0]=4 2955 B6R0.6 CCCCOC=O Amb6608882 [2,0,0,0,0,0|2,0,0]=4 2956 B6R0.6 CCOCCC=O Amb25688261 [2,0,0,0,0,0|2,0,0]=4 2957 B6R0.6 CCSCCC=O Amb27254551 [2,0,0,0,0,0|2,0,0]=4 2958 B6R0.6 CNCCCCO Amb33539277 [2,0,0,0,0,0|1,0,1]=4 2959 B6R0.6 CNCCCSC Amb6718995 [2,0,0,0,0,0|2,0,0]=4 2960 B6R0.6 COCCCC=O Amb33530955 [2,0,0,0,0,0|0,1,0]=3 2961 B6R0.6 COCCCCO Amb17666901 [2,0,0,0,0,0|0,1,1]=4 2962 B6R0.6 COCCCNO Amb33378127 [2,0,0,0,0,0|1,1,0]=4 2963 B6R0.6 COCCCSC Amb28139052 [2,0,0,0,0,0|2,0,0]=4 2964 B6R0.6 COCCNC=O Amb24334241 [2,0,0,0,0,0|1,1,0]=4 2965 B6R0.6 COCOCC=O Amb27409311 [2,0,0,0,0,0|1,1,0]=4 2966 B6R0.6 CSCCCC#N Amb17504231 [2,0,0,0,0,0|1,0,1]=4 2967 B6R0.6 CSCCCC=O Amb25992553 [2,0,0,0,0,0|0,0,0]=2 2968 B6R0.6 CSCCCCBr Amb19054837 [2,0,0,0,0,0|1,0,1]=4 2969 B6R0.6 CSCCCCCl Amb25240444 [2,0,0,0,0,0|1,0,1]=4 2970 B6R0.6 CSCCCCF Amb27620229 [2,0,0,0,0,0|1,0,1]=4 2971 B6R0.6 CSCCCCN Amb17500948 [2,0,0,0,0,0|1,0,1]=4 2972 B6R0.6 CSCCCCO Amb9825911 [2,0,0,0,0,0|0,0,1]=3 2973 B6R0.6 CSCCCCS Amb27461555 [2,0,0,0,0,0|0,1,1]=4 2974 B6R0.6 CSCCCNN Amb24093854 [2,0,0,0,0,0|2,0,0]=4 2975 B6R0.6 CSCCCNO Amb27948053 [2,0,0,0,0,0|1,0,0]=3 2976 B6R0.6 CSCCCON Amb27947150 [2,0,0,0,0,0|2,0,0]=4 2977 B6R0.6 CSCCCSC Amb22043311 [2,0,0,0,0,0|2,0,0]=4 2978 B6R0.6 CSCCN=C=O Amb19889355 [2,0,0,0,0,0|1,0,1]=4 2979 B6R0.6 CSCCNC=O Amb28437305 [2,0,0,0,0,0|1,0,0]=3 2980 B6R0.6 CSC\C=C\C=O Amb33271737 [2,0,0,0,0,0|0,0,2]=4 2981 B6R0.6 C\C=C/CCC=O Amb28202620 [2,0,0,0,0,0|1,0,1]=4 2982 B6R0.6 C\C=C\CCC=O Amb17593074 [2,0,0,0,0,0|1,0,1]=4 2983 B6R0.6 N#CCCCC=O Amb18120556 [2,0,0,0,0,0|2,0,0]=4 2984 B6R0.6 NCCCCC=O Amb26627836 [2,0,0,0,0,0|2,0,0]=4 2985 B6R0.6 O=CCCCC=O Amb6600455 [2,0,0,0,0,0|2,0,0]=4 2986 B6R0.6 O=CCCCCBr Amb18126353 [2,0,0,0,0,0|2,0,0]=4 2987 B6R0.6 O=CCCCCCl Amb18123550 [2,0,0,0,0,0|2,0,0]=4 2988 B6R0.6 O=CCCCCO Amb10603837 [2,0,0,0,0,0|2,0,0]=4 2989 B6R0.6 O=CCCCN=O Amb27838215 [2,0,0,0,0,0|2,0,0]=4 2990 B6R0.6 [C-]#[N+]CCCSC Amb33198739 [2,0,0,0,0,0|2,0,0]=4 2991 B6R0.3 C#CC(N)C(=O)O Amb28282694 [2,0,0,0,0,0|0,0,2]=4 2992 B6R0.3 C=C(CC)C(=O)O Amb18639591 [2,0,0,0,0,0|1,0,1]=4 2993 B6R0.3 C=C(CS)C(=O)O Amb27263242 [2,0,0,0,0,0|1,0,1]=4 2994 B6R0.3 C=C(SC)C(=O)O Amb27882690 [2,0,0,0,0,0|1,0,1]=4 2995 B6R0.3 C=CC(N)C(=O)O Amb20240543 [2,0,0,0,0,0|0,0,2]=4 2996 B6R0.3 C=C[C@@H](N)C(=O)O Amb22756048 [2,0,0,0,0,0|0,0,2]=4 2997 B6R0.3 C=C[C@H](N)C(=O)O Amb2699113 [2,0,0,0,0,0|0,0,2]=4 2998 B6R0.3 CC(=O)[C@H](N)CO Amb27451047 [2,0,0,0,0,0|1,1,0]=4 2999 B6R0.3 CC(CBr)C(=O)O Amb22002601 [2,0,0,0,0,0|2,0,0]=4 3000 B6R0.3 CC(CCl)C(=O)O Amb18522181 [2,0,0,0,0,0|2,0,0]=4 3001 B6R0.3 CC(CF)C(=O)O Amb24432331 [2,0,0,0,0,0|2,0,0]=4 3002 B6R0.3 CC(CN)C(=O)O Amb2699128 [2,0,0,0,0,0|2,0,0]=4 3003 B6R0.3 CC(CN)C(=O)O Amb6773978 [2,0,0,0,0,0|2,0,0]=4 3004 B6R0.3 CC(CN)C(=O)O Amb8631418 [2,0,0,0,0,0|2,0,0]=4 3005 B6R0.3 CC(CO)C(=O)O Amb8011522 [2,0,0,0,0,0|1,1,0]=4 3006 B6R0.3 CCC(=O)C(=O)O Amb3940359 [2,0,0,0,0,0|1,0,1]=4 3007 B6R0.3 CCC(=S)C(=O)O Amb27872099 [2,0,0,0,0,0|1,0,1]=4 3008 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [2,0,0,0,0,0|2,0,0]=4 3009 B6R0.3 CCC(Br)C(=O)Cl Amb17666758 [2,0,0,0,0,0|2,0,0]=4 3010 B6R0.3 CCC(Br)C(=O)O Amb5716858 [2,0,0,0,0,0|1,0,0]=3 3011 B6R0.3 CCC(Br)C(C)=O Amb24615269 [2,0,0,0,0,0|2,0,0]=4 3012 B6R0.3 CCC(Br)C(N)=O Amb13952819 [2,0,0,0,0,0|2,0,0]=4 3013 B6R0.3 CCC(C)C(=O)Cl Amb3939259 [2,0,0,0,0,0|2,0,0]=4 3014 B6R0.3 CCC(C)C(=O)O Amb9703224 [2,0,0,0,0,0|1,0,0]=3 3015 B6R0.3 CCC(C)C(C)=O Amb4605996 [2,0,0,0,0,0|2,0,0]=4 3016 B6R0.3 CCC(C)C(N)=O Amb33548100 [2,0,0,0,0,0|2,0,0]=4 3017 B6R0.3 CCC(Cl)C(=O)Br Amb28384077 [2,0,0,0,0,0|2,0,0]=4 3018 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [2,0,0,0,0,0|2,0,0]=4 3019 B6R0.3 CCC(Cl)C(=O)O Amb4017887 [2,0,0,0,0,0|1,0,0]=3 3020 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [2,0,0,0,0,0|2,0,0]=4 3021 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [2,0,0,0,0,0|2,0,0]=4 3022 B6R0.3 CCC(F)C(=O)O Amb25716167 [2,0,0,0,0,0|1,0,0]=3 3023 B6R0.3 CCC(N)B(O)O Amb28367684 [2,0,0,0,0,0|1,0,1]=4 3024 B6R0.3 CCC(N)C(=O)Cl Amb17593240 [2,0,0,0,0,0|1,0,0]=3 3025 B6R0.3 CCC(N)C(=O)O Amb9729506 [2,0,0,0,0,0|0,0,0]=2 3026 B6R0.3 CCC(N)C(C)O Amb32662794 [2,0,0,0,0,0|1,0,1]=4 3027 B6R0.3 CCC(N)C(C)O Amb8855230 [2,0,0,0,0,0|1,0,1]=4 3028 B6R0.3 CCC(N)C(N)=O Amb1914080 [2,0,0,0,0,0|1,0,0]=3 3029 B6R0.3 CCC(N)C(N)=O Amb33528521 [2,0,0,0,0,0|1,0,0]=3 3030 B6R0.3 CCC(N)C(N)O Amb28348585 [2,0,0,0,0,0|1,0,1]=4 3031 B6R0.3 CCC(N)P(=O)=O Amb27786328 [2,0,0,0,0,0|1,0,1]=4 3032 B6R0.3 CCC(O)C(=O)O Amb6609018 [2,0,0,0,0,0|1,0,0]=3 3033 B6R0.3 CCC(O)C(=O)[O-] Amb17943026 [2,0,0,0,0,0|1,0,1]=4 3034 B6R0.3 CCC(O)C(C)=O Amb25336501 [2,0,0,0,0,0|2,0,0]=4 3035 B6R0.3 CCC(O)C(N)=O Amb24116514 [2,0,0,0,0,0|2,0,0]=4 3036 B6R0.3 CCC(S)C(=O)O Amb17501370 [2,0,0,0,0,0|1,0,0]=3 3037 B6R0.3 CCC(S)C(C)=O Amb8393170 [2,0,0,0,0,0|2,0,0]=4 3038 B6R0.3 CCN(N)C(C)=O Amb18639976 [2,0,0,0,0,0|2,0,0]=4 3039 B6R0.3 CCN(N)C(N)=O Amb28184355 [2,0,0,0,0,0|2,0,0]=4 3040 B6R0.3 CC[C@@H](Br)C(=O)O Amb9785161 [2,0,0,0,0,0|1,0,0]=3 3041 B6R0.3 CC[C@@H](C)C(=O)O Amb8384578 [2,0,0,0,0,0|1,0,0]=3 3042 B6R0.3 CC[C@@H](C)C(C)=O Amb28283799 [2,0,0,0,0,0|2,0,0]=4 3043 B6R0.3 CC[C@@H](Cl)C(=O)Cl Amb27985877 [2,0,0,0,0,0|2,0,0]=4 3044 B6R0.3 CC[C@@H](Cl)C(=O)O Amb22800493 [2,0,0,0,0,0|1,0,0]=3 3045 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [2,0,0,0,0,0|2,0,0]=4 3046 B6R0.3 CC[C@@H](N)C(=O)O Amb16233349 [2,0,0,0,0,0|0,0,0]=2 3047 B6R0.3 CC[C@@H](N)C(=O)O Amb3940761 [2,0,0,0,0,0|0,0,0]=2 3048 B6R0.3 CC[C@@H](N)C(C)=O Amb35594875 [2,0,0,0,0,0|1,0,0]=3 3049 B6R0.3 CC[C@@H](N)C(C)O Amb28280672 [2,0,0,0,0,0|1,0,1]=4 3050 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [2,0,0,0,0,0|1,0,0]=3 3051 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [2,0,0,0,0,0|1,0,0]=3 3052 B6R0.3 CC[C@@H](N)[C@@H](C)O Amb24117050 [2,0,0,0,0,0|1,0,1]=4 3053 B6R0.3 CC[C@@H](O)C(=O)O Amb22369401 [2,0,0,0,0,0|1,0,0]=3 3054 B6R0.3 CC[C@@H](O)C(N)=O Amb27792606 [2,0,0,0,0,0|2,0,0]=4 3055 B6R0.3 CC[C@H](Br)C(=O)O Amb20242441 [2,0,0,0,0,0|1,0,0]=3 3056 B6R0.3 CC[C@H](C)C(=O)Cl Amb26463969 [2,0,0,0,0,0|2,0,0]=4 3057 B6R0.3 CC[C@H](C)C(=O)O Amb8514667 [2,0,0,0,0,0|1,0,0]=3 3058 B6R0.3 CC[C@H](C)C(N)=O Amb27440802 [2,0,0,0,0,0|2,0,0]=4 3059 B6R0.3 CC[C@H](Cl)C(=O)O Amb25190040 [2,0,0,0,0,0|1,0,0]=3 3060 B6R0.3 CC[C@H](N)C(=O)O Amb2694208 [2,0,0,0,0,0|0,0,0]=2 3061 B6R0.3 CC[C@H](N)C(=O)O Amb8631089 [2,0,0,0,0,0|0,0,0]=2 3062 B6R0.3 CC[C@H](N)C(C)=O Amb29849605 [2,0,0,0,0,0|1,0,0]=3 3063 B6R0.3 CC[C@H](N)C(N)=O Amb8387112 [2,0,0,0,0,0|1,0,0]=3 3064 B6R0.3 CC[C@H](N)C(N)=O Amb8395789 [2,0,0,0,0,0|1,0,0]=3 3065 B6R0.3 CC[C@H](N)[C@@H](C)O Amb24117049 [2,0,0,0,0,0|1,0,1]=4 3066 B6R0.3 CC[C@H](O)C(=O)O Amb4166324 [2,0,0,0,0,0|1,0,0]=3 3067 B6R0.3 CC[C@H](S)C(=O)O Amb9785162 [2,0,0,0,0,0|1,0,0]=3 3068 B6R0.3 CNC(C)C(=O)O Amb19373699 [2,0,0,0,0,0|2,0,0]=4 3069 B6R0.3 CNC(C)C(=O)O Amb9271766 [2,0,0,0,0,0|2,0,0]=4 3070 B6R0.3 CNC(O)C(=O)O Amb27229907 [2,0,0,0,0,0|2,0,0]=4 3071 B6R0.3 CN[C@@H](C)C(=O)O Amb16233347 [2,0,0,0,0,0|2,0,0]=4 3072 B6R0.3 CN[C@@H](C)C(=O)O Amb16233348 [2,0,0,0,0,0|2,0,0]=4 3073 B6R0.3 CN[C@H](C)C(=O)O Amb10844859 [2,0,0,0,0,0|2,0,0]=4 3074 B6R0.3 COC(Br)C(=O)O Amb27439128 [2,0,0,0,0,0|1,1,0]=4 3075 B6R0.3 COC(C)C(=O)O Amb9729215 [2,0,0,0,0,0|1,1,0]=4 3076 B6R0.3 COC(Cl)C(=O)O Amb28280799 [2,0,0,0,0,0|1,1,0]=4 3077 B6R0.3 COC(F)C(=O)O Amb27764863 [2,0,0,0,0,0|1,1,0]=4 3078 B6R0.3 CO[C@@H](C)C(=O)O Amb8515766 [2,0,0,0,0,0|1,1,0]=4 3079 B6R0.3 CO[C@H](C)C(=O)O Amb8515771 [2,0,0,0,0,0|1,1,0]=4 3080 B6R0.3 CSC(C)C(=O)O Amb6274567 [2,0,0,0,0,0|1,0,0]=3 3081 B6R0.3 CSC(C)C(N)=O Amb28047863 [2,0,0,0,0,0|2,0,0]=4 3082 B6R0.3 CSC(Cl)C(=O)Cl Amb27392297 [2,0,0,0,0,0|2,0,0]=4 3083 B6R0.3 CSC(N)C(=O)O Amb28383509 [2,0,0,0,0,0|0,0,0]=2 3084 B6R0.3 CS[C@H](C)C(=O)O Amb26611205 [2,0,0,0,0,0|1,0,0]=3 3085 B6R0.3 C[C@@H](CF)C(=O)O Amb33743265 [2,0,0,0,0,0|2,0,0]=4 3086 B6R0.3 C[C@@H](CI)C(=O)O Amb28322539 [2,0,0,0,0,0|2,0,0]=4 3087 B6R0.3 C[C@@H](CN)C(=O)O Amb22756746 [2,0,0,0,0,0|2,0,0]=4 3088 B6R0.3 C[C@@H](CN)C(=O)O Amb6600138 [2,0,0,0,0,0|2,0,0]=4 3089 B6R0.3 C[C@@H](CO)C(=O)O Amb10844567 [2,0,0,0,0,0|1,1,0]=4 3090 B6R0.3 C[C@H](CBr)C(=O)O Amb27975404 [2,0,0,0,0,0|2,0,0]=4 3091 B6R0.3 C[C@H](CF)C(=O)O Amb33727262 [2,0,0,0,0,0|2,0,0]=4 3092 B6R0.3 C[C@H](CN)C(=O)O Amb10844022 [2,0,0,0,0,0|2,0,0]=4 3093 B6R0.3 C[C@H](CN)C(=O)O Amb24117452 [2,0,0,0,0,0|2,0,0]=4 3094 B6R0.3 C[C@H](CO)C(=O)O Amb10844554 [2,0,0,0,0,0|1,1,0]=4 3095 B6R0.3 N#CC(N)C(=O)O Amb25328320 [2,0,0,0,0,0|1,0,1]=4 3096 B6R0.3 NC(=O)C(N)CO Amb17593097 [2,0,0,0,0,0|1,1,0]=4 3097 B6R0.3 NC(=O)C(N)CO Amb2720301 [2,0,0,0,0,0|1,1,0]=4 3098 B6R0.3 NC(=O)C(N)CS Amb18641990 [2,0,0,0,0,0|1,0,0]=3 3099 B6R0.3 NC(=O)C(N)CS Amb33330875 [2,0,0,0,0,0|1,0,0]=3 3100 B6R0.3 NC(=O)[C@@H](N)CO Amb6336612 [2,0,0,0,0,0|1,1,0]=4 3101 B6R0.3 NC(=O)[C@@H](N)CO Amb8387630 [2,0,0,0,0,0|1,1,0]=4 3102 B6R0.3 NC(=O)[C@@H](N)CS Amb23437751 [2,0,0,0,0,0|1,0,0]=3 3103 B6R0.3 NC(=O)[C@H](N)CO Amb22886957 [2,0,0,0,0,0|1,1,0]=4 3104 B6R0.3 NC(=O)[C@H](N)CO Amb26505098 [2,0,0,0,0,0|1,1,0]=4 3105 B6R0.3 NC(CCl)C(=O)O Amb19651457 [2,0,0,0,0,0|1,0,0]=3 3106 B6R0.3 NC(CCl)C(=O)O Amb21961077 [2,0,0,0,0,0|1,0,0]=3 3107 B6R0.3 NC(CF)C(=O)O Amb10839589 [2,0,0,0,0,0|1,0,0]=3 3108 B6R0.3 NC(CO)C(=O)O Amb9702805 [2,0,0,0,0,0|0,1,0]=3 3109 B6R0.3 NC(CP)C(=O)O Amb27234251 [2,0,0,0,0,0|1,0,0]=3 3110 B6R0.3 NC(CS)C(=O)Cl Amb28050358 [2,0,0,0,0,0|1,0,0]=3 3111 B6R0.3 NC(CS)C(=O)O Amb13961966 [2,0,0,0,0,0|0,0,0]=2 3112 B6R0.3 NC(CS)C(=O)O Amb22489523 [2,0,0,0,0,0|0,0,0]=2 3113 B6R0.3 NC(CS)C(=O)O Amb6537913 [2,0,0,0,0,0|0,0,0]=2 3114 B6R0.3 NC(CS)C(=O)O Amb6537914 [2,0,0,0,0,0|0,0,0]=2 3115 B6R0.3 NC(CS)C(=O)S Amb27838279 [2,0,0,0,0,0|0,1,0]=3 3116 B6R0.3 NC(CS)S(=O)O Amb27238568 [2,0,0,0,0,0|1,0,0]=3 3117 B6R0.3 NC(C[NH3+])C(=O)O Amb4004471 [2,0,0,0,0,0|1,0,0]=3 3118 B6R0.3 NCC(Br)C(=O)O Amb28385732 [2,0,0,0,0,0|2,0,0]=4 3119 B6R0.3 NCC(Cl)C(=O)O Amb17593263 [2,0,0,0,0,0|2,0,0]=4 3120 B6R0.3 NCC(F)C(=O)O Amb22733051 [2,0,0,0,0,0|2,0,0]=4 3121 B6R0.3 NCC(F)C(=O)O Amb2688010 [2,0,0,0,0,0|2,0,0]=4 3122 B6R0.3 NCC(N)C(=O)O Amb22899095 [2,0,0,0,0,0|1,0,0]=3 3123 B6R0.3 NCC(N)C(=O)O Amb2697095 [2,0,0,0,0,0|1,0,0]=3 3124 B6R0.3 NCC(N)C(=O)O Amb8514284 [2,0,0,0,0,0|1,0,0]=3 3125 B6R0.3 NCC(O)C(=O)O Amb8517492 [2,0,0,0,0,0|2,0,0]=4 3126 B6R0.3 NCC(S)C(=O)O Amb17593238 [2,0,0,0,0,0|2,0,0]=4 3127 B6R0.3 NC[C@@H](F)C(=O)O Amb25824168 [2,0,0,0,0,0|2,0,0]=4 3128 B6R0.3 NC[C@@H](F)C(=O)O Amb31291438 [2,0,0,0,0,0|2,0,0]=4 3129 B6R0.3 NC[C@@H](N)C(=O)O Amb22745957 [2,0,0,0,0,0|1,0,0]=3 3130 B6R0.3 NC[C@@H](N)C(=O)O Amb8515776 [2,0,0,0,0,0|1,0,0]=3 3131 B6R0.3 NC[C@@H](N)C(N)=O Amb27981260 [2,0,0,0,0,0|2,0,0]=4 3132 B6R0.3 NC[C@@H](O)C(=O)O Amb22169412 [2,0,0,0,0,0|2,0,0]=4 3133 B6R0.3 NC[C@H](F)C(=O)O Amb27254153 [2,0,0,0,0,0|2,0,0]=4 3134 B6R0.3 NC[C@H](F)C(=O)O Amb31291433 [2,0,0,0,0,0|2,0,0]=4 3135 B6R0.3 NC[C@H](N)C(=O)O Amb16183820 [2,0,0,0,0,0|1,0,0]=3 3136 B6R0.3 NC[C@H](N)C(=O)O Amb33842544 [2,0,0,0,0,0|1,0,0]=3 3137 B6R0.3 NC[C@H](N)C(=O)O Amb8515775 [2,0,0,0,0,0|1,0,0]=3 3138 B6R0.3 NC[C@H](O)C(=O)O Amb4166313 [2,0,0,0,0,0|2,0,0]=4 3139 B6R0.3 N[C@@H](C=S)C(=O)O Amb27838199 [2,0,0,0,0,0|0,0,2]=4 3140 B6R0.3 N[C@@H](CBr)C(=O)O Amb27188433 [2,0,0,0,0,0|1,0,0]=3 3141 B6R0.3 N[C@@H](CCl)C(=O)O Amb22232860 [2,0,0,0,0,0|1,0,0]=3 3142 B6R0.3 N[C@@H](CCl)C(=O)O Amb8515277 [2,0,0,0,0,0|1,0,0]=3 3143 B6R0.3 N[C@@H](CO)C(=O)O Amb22351170 [2,0,0,0,0,0|0,1,0]=3 3144 B6R0.3 N[C@@H](CO)C(=O)O Amb8387621 [2,0,0,0,0,0|0,1,0]=3 3145 B6R0.3 N[C@@H](CS)C(=O)O Amb3940755 [2,0,0,0,0,0|0,0,0]=2 3146 B6R0.3 N[C@@H](CS)C(=O)O Amb8385453 [2,0,0,0,0,0|0,0,0]=2 3147 B6R0.3 N[C@@H](CS)C(=O)O Amb9826090 [2,0,0,0,0,0|0,0,0]=2 3148 B6R0.3 N[C@@H](CS)S(=O)O Amb27391675 [2,0,0,0,0,0|1,0,0]=3 3149 B6R0.3 N[C@@H](C[SeH])C(=O)O Amb31031035 [2,0,0,0,0,0|0,1,0]=3 3150 B6R0.3 N[C@H](CCl)C(=O)Cl Amb28143184 [2,0,0,0,0,0|2,0,0]=4 3151 B6R0.3 N[C@H](CCl)C(=O)O Amb2699111 [2,0,0,0,0,0|1,0,0]=3 3152 B6R0.3 N[C@H](CCl)C(=O)O Amb9813688 [2,0,0,0,0,0|1,0,0]=3 3153 B6R0.3 N[C@H](CO)C(=O)Cl Amb28058341 [2,0,0,0,0,0|1,1,0]=4 3154 B6R0.3 N[C@H](CO)C(=O)O Amb2690463 [2,0,0,0,0,0|0,1,0]=3 3155 B6R0.3 N[C@H](CS)C(=O)Cl Amb27166396 [2,0,0,0,0,0|1,0,0]=3 3156 B6R0.3 N[C@H](CS)C(=O)O Amb17942912 [2,0,0,0,0,0|0,0,0]=2 3157 B6R0.3 N[C@H](CS)C(=O)O Amb8394603 [2,0,0,0,0,0|0,0,0]=2 3158 B6R0.3 N[C@H](CS)C(=O)O Amb8628479 [2,0,0,0,0,0|0,0,0]=2 3159 B6R0.3 O=C(O)C(=O)CS Amb6600041 [2,0,0,0,0,0|1,0,1]=4 3160 B6R0.3 O=C(O)C(Br)CBr Amb8513574 [2,0,0,0,0,0|2,0,0]=4 3161 B6R0.3 O=C(O)C(Br)CF Amb10605519 [2,0,0,0,0,0|2,0,0]=4 3162 B6R0.3 O=C(O)C(Br)CO Amb18126327 [2,0,0,0,0,0|1,1,0]=4 3163 B6R0.3 O=C(O)C(Cl)CCl Amb22228245 [2,0,0,0,0,0|2,0,0]=4 3164 B6R0.3 O=C(O)C(Cl)CO Amb18124304 [2,0,0,0,0,0|1,1,0]=4 3165 B6R0.3 O=C(O)C(Cl)CS Amb18643661 [2,0,0,0,0,0|1,0,0]=3 3166 B6R0.3 O=C(O)C(F)CO Amb17593117 [2,0,0,0,0,0|1,1,0]=4 3167 B6R0.3 O=C(O)C(O)CBr Amb24061932 [2,0,0,0,0,0|2,0,0]=4 3168 B6R0.3 O=C(O)C(O)CCl Amb6371692 [2,0,0,0,0,0|2,0,0]=4 3169 B6R0.3 O=C(O)C(O)CF Amb27476477 [2,0,0,0,0,0|2,0,0]=4 3170 B6R0.3 O=C(O)C(O)CO Amb17593103 [2,0,0,0,0,0|1,1,0]=4 3171 B6R0.3 O=C(O)C(O)CS Amb18642053 [2,0,0,0,0,0|1,0,0]=3 3172 B6R0.3 O=C(O)C(S)CS Amb18643295 [2,0,0,0,0,0|1,0,0]=3 3173 B6R0.3 O=C(O)[C@@H](Br)CO Amb10601700 [2,0,0,0,0,0|1,1,0]=4 3174 B6R0.3 O=C(O)[C@@H](Cl)CO Amb27968485 [2,0,0,0,0,0|1,1,0]=4 3175 B6R0.3 O=C(O)[C@@H](O)CBr Amb27858794 [2,0,0,0,0,0|2,0,0]=4 3176 B6R0.3 O=C(O)[C@@H](O)CCl Amb22225325 [2,0,0,0,0,0|2,0,0]=4 3177 B6R0.3 O=C(O)[C@@H](O)CF Amb24117272 [2,0,0,0,0,0|2,0,0]=4 3178 B6R0.3 O=C(O)[C@@H](O)CO Amb22226732 [2,0,0,0,0,0|1,1,0]=4 3179 B6R0.3 O=C(O)[C@H](Cl)CO Amb27759746 [2,0,0,0,0,0|1,1,0]=4 3180 B6R0.3 O=C(O)[C@H](O)CBr Amb28137021 [2,0,0,0,0,0|2,0,0]=4 3181 B6R0.3 O=C(O)[C@H](O)CF Amb27467272 [2,0,0,0,0,0|2,0,0]=4 3182 B6R0.3 O=C(O)[C@H](O)CO Amb4166319 [2,0,0,0,0,0|1,1,0]=4 3183 B8R0.1 C=CCC(N)CCOC Amb28195821 [1,1,0,0,0,0|1,1,0]=4 3184 B8R0.1 CCCCC(C)CC=O Amb18642676 [1,1,0,0,0,0|2,0,0]=4 3185 B8R0.1 CCCCC(N)CCO Amb18642854 [1,1,0,0,0,0|1,0,1]=4 3186 B8R0.1 CCCCC(N)CCO Amb24117271 [1,1,0,0,0,0|1,0,1]=4 3187 B8R0.1 CCCCC(N)COC Amb19374470 [1,1,0,0,0,0|1,0,1]=4 3188 B8R0.1 CCCC[C@@H](N)CCO Amb22748774 [1,1,0,0,0,0|1,0,1]=4 3189 B8R0.1 CCCC[C@H](N)CCO Amb27947953 [1,1,0,0,0,0|1,0,1]=4 3190 B8R0.1 CNC[C@H](N)CCSC Amb27768459 [1,1,0,0,0,0|1,0,1]=4 3191 B8R0.1 COCCC(N)CCO Amb32946713 [1,1,0,0,0,0|0,1,1]=4 3192 B8R0.1 COCCC(N)COC Amb25101769 [1,1,0,0,0,0|0,1,1]=4 3193 B8R0.1 CSCCC(C)CON Amb33198298 [1,1,0,0,0,0|1,0,1]=4 3194 B8R0.1 CSCCC(C)N=C=O Amb26074987 [1,1,0,0,0,0|1,0,1]=4 3195 B8R0.1 CSCCC(C)NC=O Amb27591673 [1,1,0,0,0,0|1,0,0]=3 3196 B8R0.1 CSCCC(N)CCO Amb27455675 [1,1,0,0,0,0|0,0,1]=3 3197 B8R0.1 CSCCC(N)NC=O Amb27875790 [1,1,0,0,0,0|0,0,0]=2 3198 B8R0.1 CSCC[C@@H](N)CCO Amb27950118 [1,1,0,0,0,0|0,0,1]=3 3199 B8R0.1 CSCC[C@H](N)CCO Amb27236737 [1,1,0,0,0,0|0,0,1]=3 3200 B8R0.1 CSCO[C@@H](C)CC=O Amb28387873 [1,1,0,0,0,0|2,0,0]=4 3201 B8R0.1 CSCO[C@H](C)CC=O Amb27268451 [1,1,0,0,0,0|2,0,0]=4 3202 B8R0.3 C=CC(N)C(C)CCC Amb28323909 [1,1,0,0,0,0|2,0,0]=4 3203 B8R0.3 C=CC(N)C(C)CSC Amb27598652 [1,1,0,0,0,0|1,0,0]=3 3204 B8R0.3 C=CC(O)C(C)CSC Amb28189720 [1,1,0,0,0,0|2,0,0]=4 3205 B8R0.3 CCC(N)C(C)CSC Amb28063291 [1,1,0,0,0,0|1,0,1]=4 3206 B8R0.3 CCCC(C)C(C)C=O Amb26004179 [1,1,0,0,0,0|2,0,0]=4 3207 B8R0.3 CCCC(C)C(Cl)C=O Amb18643960 [1,1,0,0,0,0|2,0,0]=4 3208 B8R0.3 CCCC(C)C(N)CO Amb27944873 [1,1,0,0,0,0|1,0,1]=4 3209 B8R0.3 CCCC(C)C(N)CO Amb28934959 [1,1,0,0,0,0|1,0,1]=4 3210 B8R0.3 CCCC(C)[C@@H](N)CO Amb33223654 [1,1,0,0,0,0|1,0,1]=4 3211 B8R0.3 CCCC(C)[C@H](N)CO Amb33322325 [1,1,0,0,0,0|1,0,1]=4 3212 B8R0.3 CCCC(O)C(N)CO Amb24478778 [1,1,0,0,0,0|1,0,1]=4 3213 B8R0.3 CCC[C@H](O)[C@@H](N)CO Amb28455449 [1,1,0,0,0,0|1,0,1]=4 3214 B8R0.3 COCC(C)C(C)C=O Amb24340214 [1,1,0,0,0,0|1,1,0]=4 3215 B8R0.3 COCC(C)C(N)CO Amb27954927 [1,1,0,0,0,0|0,1,1]=4 3216 B8R0.3 COCC(O)C(N)CO Amb28285279 [1,1,0,0,0,0|0,1,1]=4 3217 B8R0.3 COC[C@@H](O)[C@H](O)C=O Amb28121213 [1,1,0,0,0,0|1,1,0]=4 3218 B8R0.3 CSCC(C)C(O)CO Amb28064153 [1,1,0,0,0,0|1,0,1]=4 3219 B8R0.3 CSCC(C)N(C)C=O Amb27406085 [1,1,0,0,0,0|2,0,0]=4 3220 B8R0.3 CSCC(C)\C(N)=N\O Amb27217313 [1,1,0,0,0,0|1,0,1]=4 3221 B8R0.6 C=CC(N)CCCOC Amb28124519 [1,1,0,0,0,0|1,1,0]=4 3222 B8R0.6 CC#CCCC(O)C=O Amb27219115 [1,1,0,0,0,0|2,0,0]=4 3223 B8R0.6 CCCCCC(Cl)C=O Amb18643792 [1,1,0,0,0,0|2,0,0]=4 3224 B8R0.6 CCCCCC(N)CO Amb24524295 [1,1,0,0,0,0|1,0,1]=4 3225 B8R0.6 CCCCCC(O)C=O Amb18642802 [1,1,0,0,0,0|2,0,0]=4 3226 B8R0.6 CCCCC[C@@H](C)C=O Amb28351479 [1,1,0,0,0,0|2,0,0]=4 3227 B8R0.6 CCCCC[C@H](Cl)C=O Amb28400198 [1,1,0,0,0,0|2,0,0]=4 3228 B8R0.6 CCCCC[C@H](O)C=O Amb28198840 [1,1,0,0,0,0|2,0,0]=4 3229 B8R0.6 CCCOCC(C)C=O Amb28241425 [1,1,0,0,0,0|2,0,0]=4 3230 B8R0.6 CCCSCC(N)CO Amb28364274 [1,1,0,0,0,0|1,0,1]=4 3231 B8R0.6 CCOCC[C@H](N)CO Amb27488751 [1,1,0,0,0,0|0,1,1]=4 3232 B8R0.6 CCSCCC(N)C#N Amb19036835 [1,1,0,0,0,0|1,0,1]=4 3233 B8R0.6 CCSCCC(N)CN Amb27392673 [1,1,0,0,0,0|1,0,1]=4 3234 B8R0.6 CCSCCC(N)CO Amb25820753 [1,1,0,0,0,0|0,0,1]=3 3235 B8R0.6 CCSCC\C(N)=N\O Amb6680782 [1,1,0,0,0,0|1,0,1]=4 3236 B8R0.6 COCCCC(C)C=O Amb28118341 [1,1,0,0,0,0|1,1,0]=4 3237 B8R0.6 COCCCC(Cl)C=O Amb28146758 [1,1,0,0,0,0|1,1,0]=4 3238 B8R0.6 COCCCC(N)CO Amb26550641 [1,1,0,0,0,0|0,1,1]=4 3239 B8R0.6 COCOCC(C)C=O Amb27185793 [1,1,0,0,0,0|1,1,0]=4 3240 B8R0.6 COCOCC(N)CO Amb27601063 [1,1,0,0,0,0|0,1,1]=4 3241 B8R0.6 CSCCCC(C)C=O Amb27973193 [1,1,0,0,0,0|1,0,0]=3 3242 B8R0.6 CSCCCC(N)C#N Amb27202675 [1,1,0,0,0,0|1,0,1]=4 3243 B8R0.6 CSCCCC(N)CO Amb25888586 [1,1,0,0,0,0|0,0,1]=3 3244 B8R0.6 CSCCC\C(N)=N\O Amb25324485 [1,1,0,0,0,0|1,0,1]=4 3245 B8R0.6 CSCCNC(C)CO Amb27654830 [1,1,0,0,0,0|1,0,1]=4 3246 B8R0.6 CSCCOC(=O)C=O Amb27645544 [1,1,0,0,0,0|1,0,1]=4 3247 B8R0.6 CSCSCC(O)CO Amb27212112 [1,1,0,0,0,0|1,0,1]=4 3248 B8R0.6 C\C=C/CCC(C)C=O Amb27798224 [1,1,0,0,0,0|2,0,0]=4 3249 B8R0.6 NCCCCC(N)CO Amb27403112 [1,1,0,0,0,0|1,0,1]=4 3250 B8R0.6 NCCCC[C@H](N)C=O Amb27230236 [1,1,0,0,0,0|1,0,0]=3 3251 B8R0.6 NCCCC[C@H](N)CO Amb25883920 [1,1,0,0,0,0|1,0,1]=4 3252 B8R0.6 NCCCC[C@H](N)CO Amb33801813 [1,1,0,0,0,0|1,0,1]=4 3253 B8R0.9 CC(=O)CCC(C)C=O Amb18642612 [1,1,0,0,0,0|2,0,0]=4 3254 B8R0.9 CC(C)CCC(N)CO Amb18832528 [1,1,0,0,0,0|1,0,1]=4 3255 B8R0.9 CC(C)CCC(N)CO Amb28960290 [1,1,0,0,0,0|1,0,1]=4 3256 B8R0.9 CC(C=O)CCN(C)C Amb26582309 [1,1,0,0,0,0|2,0,0]=4 3257 B8R0.9 CN(C)CCC(N)CO Amb26847148 [1,1,0,0,0,0|1,0,1]=4 3258 B8R0.9 CN(C)CCC(N)CO Amb33329311 [1,1,0,0,0,0|1,0,1]=4 3259 B8R0.9 CN(C)CC[C@@H](N)CO Amb33272271 [1,1,0,0,0,0|1,0,1]=4 3260 B8R0.9 CN(C)CC[C@H](N)CO Amb33272272 [1,1,0,0,0,0|1,0,1]=4 3261 B8R0.9 CS(=O)CCC(N)CO Amb27867840 [1,1,0,0,0,0|0,0,2]=4 3262 B8R0.11 C#CC(CCSC)NC Amb27478406 [1,1,0,0,0,0|1,0,1]=4 3263 B8R0.11 C=CC(CCCC)NC Amb27173429 [1,1,0,0,0,0|2,0,0]=4 3264 B8R0.11 C=CC(CCSC)NC Amb27978153 [1,1,0,0,0,0|1,0,0]=3 3265 B8R0.11 CCC(CO)CCSC Amb28283745 [1,1,0,0,0,0|1,0,1]=4 3266 B8R0.11 CCCCC(C#N)C=O Amb27775574 [1,1,0,0,0,0|1,0,1]=4 3267 B8R0.11 CCCCC(C=O)C=O Amb24365233 [1,1,0,0,0,0|2,0,0]=4 3268 B8R0.11 CCCCC(C=O)CC Amb534281 [1,1,0,0,0,0|2,0,0]=4 3269 B8R0.11 CCCCC(C=O)CO Amb28144205 [1,1,0,0,0,0|2,0,0]=4 3270 B8R0.11 CCCCC(C=O)CS Amb27256571 [1,1,0,0,0,0|2,0,0]=4 3271 B8R0.11 CCCCC(C=O)SC Amb18124546 [1,1,0,0,0,0|2,0,0]=4 3272 B8R0.11 CCCCC(CN)CO Amb27255723 [1,1,0,0,0,0|1,0,1]=4 3273 B8R0.11 CCCCC(CO)NC Amb24120141 [1,1,0,0,0,0|1,0,1]=4 3274 B8R0.11 CCCC[C@@H](CO)NC Amb27596040 [1,1,0,0,0,0|1,0,1]=4 3275 B8R0.11 CCCC[C@H](C=O)CC Amb27412091 [1,1,0,0,0,0|2,0,0]=4 3276 B8R0.11 CCCC\C(C=O)=C/N Amb27778578 [1,1,0,0,0,0|1,0,1]=4 3277 B8R0.11 CCCC\C(C=O)=C\N Amb27389633 [1,1,0,0,0,0|1,0,1]=4 3278 B8R0.11 CNC(CO)CCOC Amb27423510 [1,1,0,0,0,0|0,1,1]=4 3279 B8R0.11 COC(CN)CCSC Amb24685780 [1,1,0,0,0,0|2,0,0]=4 3280 B8R0.11 COCCC(CN)CO Amb26986134 [1,1,0,0,0,0|0,1,1]=4 3281 B8R0.11 CSCCC(CN)CO Amb27262205 [1,1,0,0,0,0|0,0,1]=3 3282 B8R0.19 CCC(C)CC(N)CO Amb24721873 [1,1,0,0,0,0|1,0,1]=4 3283 B8R0.19 CCC(C)CC(N)CO Amb28960291 [1,1,0,0,0,0|1,0,1]=4 3284 B8R0.19 CC[C@@H](C)C[C@@H](C)C=O Amb27798245 [1,1,0,0,0,0|2,0,0]=4 3285 B8R0.19 CC[C@H](C)CC(C)C=O Amb27257883 [1,1,0,0,0,0|2,0,0]=4 3286 B8R0.19 COC(C)CC(N)CO Amb28365968 [1,1,0,0,0,0|0,1,1]=4 3287 B8R0.19 CSC(C)C\C(N)=N\O Amb27236765 [1,1,0,0,0,0|1,0,1]=4 3288 B8R0.25 CCCCC(C)(C)C=O Amb18642677 [1,1,0,0,0,0|2,0,0]=4 3289 B8R0.25 CCCCC(C)(N)CO Amb27152411 [1,1,0,0,0,0|1,0,1]=4 3290 B8R0.25 CCCCC(C)(N)CO Amb28555376 [1,1,0,0,0,0|1,0,1]=4 3291 B8R0.25 CCCCC(Cl)(Cl)C=O Amb2720226 [1,1,0,0,0,0|2,0,0]=4 3292 B8R0.25 CCCC[C@@](C)(O)C=O Amb27614157 [1,1,0,0,0,0|2,0,0]=4 3293 B8R0.25 COCCC(C)(C)C=O Amb25124218 [1,1,0,0,0,0|1,1,0]=4 3294 B8R0.25 COCCC(C)(N)CO Amb24119980 [1,1,0,0,0,0|0,1,1]=4 3295 B8R0.25 CSCCC(C)(C)C=O Amb25162052 [1,1,0,0,0,0|1,0,0]=3 3296 B8R0.25 CSCCC(C)(C)CO Amb26022885 [1,1,0,0,0,0|1,0,1]=4 3297 B8R0.25 CSCCC(C)(N)C#N Amb18294426 [1,1,0,0,0,0|1,0,1]=4 3298 B8R0.25 CSCCC(C)(N)C#N Amb28934958 [1,1,0,0,0,0|1,0,1]=4 3299 B8R0.25 CSCCC(C)(N)CO Amb24645461 [1,1,0,0,0,0|0,0,1]=3 3300 B8R0.25 CSCCC(F)(F)CO Amb33010109 [1,1,0,0,0,0|1,0,1]=4 3301 B8R0.5 C#CCC(N)CC(=O)O Amb26909337 [1,1,0,0,0,0|1,0,1]=4 3302 B8R0.5 C#CC[C@@H](N)CC(=O)O Amb22746284 [1,1,0,0,0,0|1,0,1]=4 3303 B8R0.5 C#CC[C@@H](N)CC(=O)O Amb24539924 [1,1,0,0,0,0|1,0,1]=4 3304 B8R0.5 C=C(C)CC(N)CSC Amb27794207 [1,1,0,0,0,0|2,0,0]=4 3305 B8R0.5 C=C(C)CC(O)CSC Amb28313018 [1,1,0,0,0,0|2,0,0]=4 3306 B8R0.5 C=CCC(C)CC(=O)O Amb18642628 [1,1,0,0,0,0|1,0,1]=4 3307 B8R0.5 C=CCC(N)CC(=O)O Amb22641964 [1,1,0,0,0,0|1,0,1]=4 3308 B8R0.5 C=CCC(N)CC(=O)O Amb31307622 [1,1,0,0,0,0|1,0,1]=4 3309 B8R0.5 C=CCC(O)CC(=O)O Amb18642785 [1,1,0,0,0,0|1,0,1]=4 3310 B8R0.5 C=CC[C@@H](N)CC(=O)O Amb22746166 [1,1,0,0,0,0|1,0,1]=4 3311 B8R0.5 C=CC[C@@H](N)CC(=O)O Amb2699117 [1,1,0,0,0,0|1,0,1]=4 3312 B8R0.5 C=CC[C@@H](O)CC(=O)O Amb28073530 [1,1,0,0,0,0|1,0,1]=4 3313 B8R0.5 C=CC[C@H](N)CC(=O)O Amb2699116 [1,1,0,0,0,0|1,0,1]=4 3314 B8R0.5 C=CC[C@H](N)CC(=O)O Amb33726074 [1,1,0,0,0,0|1,0,1]=4 3315 B8R0.5 C=CC[C@H](O)CC(=O)O Amb28345940 [1,1,0,0,0,0|1,0,1]=4 3316 B8R0.5 CC(CC#N)CC(=O)O Amb18642506 [1,1,0,0,0,0|2,0,0]=4 3317 B8R0.5 CC(CCF)CC(=O)O Amb24477914 [1,1,0,0,0,0|2,0,0]=4 3318 B8R0.5 CC(CCN)CC(=O)O Amb20667689 [1,1,0,0,0,0|2,0,0]=4 3319 B8R0.5 CC(CCN)CC(=O)O Amb24376646 [1,1,0,0,0,0|2,0,0]=4 3320 B8R0.5 CC(CCO)CC(=O)O Amb18642882 [1,1,0,0,0,0|2,0,0]=4 3321 B8R0.5 CCCC(Br)CC(C)=O Amb27974270 [1,1,0,0,0,0|2,0,0]=4 3322 B8R0.5 CCCC(C)CC(=O)O Amb6749227 [1,1,0,0,0,0|1,0,0]=3 3323 B8R0.5 CCCC(C)CC(C)=O Amb22229841 [1,1,0,0,0,0|2,0,0]=4 3324 B8R0.5 CCCC(C)CC(N)=O Amb25146057 [1,1,0,0,0,0|2,0,0]=4 3325 B8R0.5 CCCC(N)CC(=O)O Amb1993864 [1,1,0,0,0,0|1,0,0]=3 3326 B8R0.5 CCCC(N)CC(C)=O Amb28069229 [1,1,0,0,0,0|2,0,0]=4 3327 B8R0.5 CCCC(N)CC(N)=O Amb25128031 [1,1,0,0,0,0|2,0,0]=4 3328 B8R0.5 CCCC(O)CC(=O)O Amb2699832 [1,1,0,0,0,0|1,0,0]=3 3329 B8R0.5 CCCC(O)CC(C)=O Amb17593376 [1,1,0,0,0,0|2,0,0]=4 3330 B8R0.5 CCCN(C)CC(=O)O Amb19373314 [1,1,0,0,0,0|2,0,0]=4 3331 B8R0.5 CCCN(C)CC(=O)O Amb8899167 [1,1,0,0,0,0|2,0,0]=4 3332 B8R0.5 CCCN(O)CC(=O)O Amb27850231 [1,1,0,0,0,0|2,0,0]=4 3333 B8R0.5 CCCS(=O)CC(=O)O Amb10608037 [1,1,0,0,0,0|2,0,0]=4 3334 B8R0.5 CCC[C@@H](N)CC(=O)O Amb22225223 [1,1,0,0,0,0|1,0,0]=3 3335 B8R0.5 CCC[C@@H](N)CC(=O)O Amb24739278 [1,1,0,0,0,0|1,0,0]=3 3336 B8R0.5 CCC[C@@H](O)CC(=O)O Amb25188904 [1,1,0,0,0,0|1,0,0]=3 3337 B8R0.5 CCC[C@@H](O)CC(C)=O Amb25190233 [1,1,0,0,0,0|2,0,0]=4 3338 B8R0.5 CCC[C@H](C)CC(=O)O Amb10844381 [1,1,0,0,0,0|1,0,0]=3 3339 B8R0.5 CCC[C@H](N)CC(=O)O Amb22226359 [1,1,0,0,0,0|1,0,0]=3 3340 B8R0.5 CCC[C@H](N)CC(=O)O Amb27464904 [1,1,0,0,0,0|1,0,0]=3 3341 B8R0.5 CCC[C@H](O)CC(=O)O Amb25367955 [1,1,0,0,0,0|1,0,0]=3 3342 B8R0.5 CCNC(C)CC(=O)O Amb13952759 [1,1,0,0,0,0|2,0,0]=4 3343 B8R0.5 CCNC(C)CC(=O)O Amb9398369 [1,1,0,0,0,0|2,0,0]=4 3344 B8R0.5 CCOC(C)CC(=O)O Amb9397849 [1,1,0,0,0,0|2,0,0]=4 3345 B8R0.5 CCSC(C)CC(=O)O Amb9398136 [1,1,0,0,0,0|2,0,0]=4 3346 B8R0.5 CNCC(O)CC(=O)O Amb28423259 [1,1,0,0,0,0|1,0,0]=3 3347 B8R0.5 CNCC(O)CC(=O)O Amb32661843 [1,1,0,0,0,0|1,0,0]=3 3348 B8R0.5 CNC[C@H](N)CC(=O)O Amb27798881 [1,1,0,0,0,0|1,0,0]=3 3349 B8R0.5 COCC(=O)CC(=O)O Amb24093174 [1,1,0,0,0,0|0,1,1]=4 3350 B8R0.5 COCC(C)CC(=O)O Amb19024342 [1,1,0,0,0,0|0,1,0]=3 3351 B8R0.5 COCC(C)CC(C)=O Amb27464321 [1,1,0,0,0,0|1,1,0]=4 3352 B8R0.5 COCC(C)CC(N)=O Amb27860801 [1,1,0,0,0,0|1,1,0]=4 3353 B8R0.5 COCC(N)CC(=O)O Amb26641146 [1,1,0,0,0,0|0,1,0]=3 3354 B8R0.5 COCC(N)CC(N)=O Amb33308419 [1,1,0,0,0,0|1,1,0]=4 3355 B8R0.5 COCC(O)CC(=O)O Amb18832518 [1,1,0,0,0,0|0,1,0]=3 3356 B8R0.5 COC[C@@H](O)CC(=O)O Amb33428853 [1,1,0,0,0,0|0,1,0]=3 3357 B8R0.5 COC[C@H](N)CC(=O)O Amb33038388 [1,1,0,0,0,0|0,1,0]=3 3358 B8R0.5 COC[C@H](N)CC(=O)O Amb33330661 [1,1,0,0,0,0|0,1,0]=3 3359 B8R0.5 COC[C@H](O)CC(=O)O Amb33428852 [1,1,0,0,0,0|0,1,0]=3 3360 B8R0.5 CONC(C)CC(=O)O Amb26844930 [1,1,0,0,0,0|1,1,0]=4 3361 B8R0.5 CPCC(N)CC(=O)O Amb27184896 [1,1,0,0,0,0|1,0,0]=3 3362 B8R0.5 CSCC(C)CC(=O)O Amb33273729 [1,1,0,0,0,0|0,0,0]=2 3363 B8R0.5 CSCC(C)NC(=O)Cl Amb35633391 [1,1,0,0,0,0|2,0,0]=4 3364 B8R0.5 CSCC(C)OC(C)=O Amb24450062 [1,1,0,0,0,0|2,0,0]=4 3365 B8R0.5 CSCC(N)CC(=O)O Amb25960719 [1,1,0,0,0,0|0,0,0]=2 3366 B8R0.5 CSCC(O)CC(=O)O Amb24621046 [1,1,0,0,0,0|0,0,0]=2 3367 B8R0.5 CSC[C@@H](N)CC(=O)O Amb27961000 [1,1,0,0,0,0|0,0,0]=2 3368 B8R0.5 CSC[C@@H](O)CC(=O)O Amb33271747 [1,1,0,0,0,0|0,0,0]=2 3369 B8R0.5 CSC[C@H](O)CC(=O)O Amb33271746 [1,1,0,0,0,0|0,0,0]=2 3370 B8R0.5 C[C@H](CCO)CC(=O)O Amb27461411 [1,1,0,0,0,0|2,0,0]=4 3371 B8R0.5 C\C=C\C(N)CC(=O)O Amb25975538 [1,1,0,0,0,0|1,0,1]=4 3372 B8R0.5 C\C=C\C(O)CC(=O)O Amb8398291 [1,1,0,0,0,0|1,0,1]=4 3373 B8R0.5 C\C=C\[C@H](C)CC(=O)O Amb28047718 [1,1,0,0,0,0|1,0,1]=4 3374 B8R0.5 N#CCC(O)CC(=O)O Amb27249794 [1,1,0,0,0,0|2,0,0]=4 3375 B8R0.5 NC(CCF)CC(=O)O Amb33038391 [1,1,0,0,0,0|2,0,0]=4 3376 B8R0.5 NCCC(N)CC(=O)O Amb26043872 [1,1,0,0,0,0|2,0,0]=4 3377 B8R0.5 NCCC(O)CC(=O)O Amb27882021 [1,1,0,0,0,0|2,0,0]=4 3378 B8R0.5 NCCC(O)CC(=O)O Amb31031000 [1,1,0,0,0,0|2,0,0]=4 3379 B8R0.5 NCC[C@H](N)CC(=O)O Amb10067021 [1,1,0,0,0,0|2,0,0]=4 3380 B8R0.5 NCC[C@H](N)CC(=O)O Amb35750363 [1,1,0,0,0,0|2,0,0]=4 3381 B8R0.5 N[C@H](CCO)CC(=O)O Amb27169169 [1,1,0,0,0,0|2,0,0]=4 3382 B8R0.5 O=C(O)CC(O)CCF Amb33196428 [1,1,0,0,0,0|2,0,0]=4 3383 B8R0.5 O=C(O)CC(O)CCO Amb31031042 [1,1,0,0,0,0|2,0,0]=4 3384 B8R0.5 O=C(O)CC(O)CNO Amb28044304 [1,1,0,0,0,0|2,0,0]=4 3385 B8R0.5 O=C(O)C[C@@H](O)CCF Amb33196426 [1,1,0,0,0,0|2,0,0]=4 3386 B8R0.5 O=C(O)C[C@H](O)CCF Amb33196427 [1,1,0,0,0,0|2,0,0]=4 3387 B8R0.7 C#CCCCCC(=O)O Amb2721485 [1,1,0,0,0,0|1,0,1]=4 3388 B8R0.7 C#CCCOCC(=O)O Amb28118359 [1,1,0,0,0,0|1,0,1]=4 3389 B8R0.7 C#CCOCCC(=O)O Amb9208654 [1,1,0,0,0,0|1,0,1]=4 3390 B8R0.7 C=C(Cl)CNCCSC Amb27783779 [1,1,0,0,0,0|2,0,0]=4 3391 B8R0.7 C=CCCCCC(=O)O Amb6299578 [1,1,0,0,0,0|1,0,1]=4 3392 B8R0.7 C=CCCOCC(=O)O Amb7793843 [1,1,0,0,0,0|1,0,1]=4 3393 B8R0.7 C=CCCSCC(=O)O Amb27810806 [1,1,0,0,0,0|1,0,1]=4 3394 B8R0.7 C=CCNCCC(=O)O Amb33527032 [1,1,0,0,0,0|1,0,1]=4 3395 B8R0.7 C=CCNCCC(=O)O Amb7755724 [1,1,0,0,0,0|1,0,1]=4 3396 B8R0.7 CC#CCCCC(=O)O Amb28046337 [1,1,0,0,0,0|1,0,0]=3 3397 B8R0.7 CC#CCCCC(N)=O Amb27853693 [1,1,0,0,0,0|2,0,0]=4 3398 B8R0.7 CC#CCNCC(=O)O Amb28410306 [1,1,0,0,0,0|1,0,1]=4 3399 B8R0.7 CC(=O)CCCCCBr Amb27401578 [1,1,0,0,0,0|2,0,0]=4 3400 B8R0.7 CC(=O)CCCCCCl Amb26591097 [1,1,0,0,0,0|2,0,0]=4 3401 B8R0.7 CC(=O)CCCCCN Amb22641918 [1,1,0,0,0,0|2,0,0]=4 3402 B8R0.7 CC(=O)CCCCCN Amb24113384 [1,1,0,0,0,0|2,0,0]=4 3403 B8R0.7 CC(=O)CCCCCO Amb27237283 [1,1,0,0,0,0|2,0,0]=4 3404 B8R0.7 CC(=O)CCCSC#N Amb26984900 [1,1,0,0,0,0|1,0,1]=4 3405 B8R0.7 CC(=O)OCCSCCl Amb28122692 [1,1,0,0,0,0|2,0,0]=4 3406 B8R0.7 CCC#CCCC(=O)O Amb28046178 [1,1,0,0,0,0|1,0,1]=4 3407 B8R0.7 CCCC#CCC(=O)O Amb17593307 [1,1,0,0,0,0|1,0,1]=4 3408 B8R0.7 CCCCC#CC(=O)O Amb2721486 [1,1,0,0,0,0|1,0,1]=4 3409 B8R0.7 CCCCCCC(=O)Cl Amb3940244 [1,1,0,0,0,0|2,0,0]=4 3410 B8R0.7 CCCCCCC(=O)O Amb34915914 [1,1,0,0,0,0|1,0,0]=3 3411 B8R0.7 CCCCCCC(=O)O Amb3499439 [1,1,0,0,0,0|1,0,0]=3 3412 B8R0.7 CCCCCCC(=O)[O-] Amb22729026 [1,1,0,0,0,0|1,0,1]=4 3413 B8R0.7 CCCCCCC(C)=O Amb6891961 [1,1,0,0,0,0|2,0,0]=4 3414 B8R0.7 CCCCCCC(N)=O Amb8858816 [1,1,0,0,0,0|2,0,0]=4 3415 B8R0.7 CCCCCNC(N)=O Amb6246936 [1,1,0,0,0,0|2,0,0]=4 3416 B8R0.7 CCCCCOC(=O)Cl Amb10844803 [1,1,0,0,0,0|2,0,0]=4 3417 B8R0.7 CCCCCOC(N)=O Amb27655610 [1,1,0,0,0,0|2,0,0]=4 3418 B8R0.7 CCCCNCC(=O)Cl Amb27189998 [1,1,0,0,0,0|2,0,0]=4 3419 B8R0.7 CCCCNCC(=O)O Amb7766471 [1,1,0,0,0,0|1,0,0]=3 3420 B8R0.7 CCCCNCC(N)=O Amb1126543 [1,1,0,0,0,0|2,0,0]=4 3421 B8R0.7 CCCCNCC(N)=O Amb7969721 [1,1,0,0,0,0|2,0,0]=4 3422 B8R0.7 CCCCOCC(=O)O Amb8514871 [1,1,0,0,0,0|1,0,0]=3 3423 B8R0.7 CCCCOCC(N)=O Amb27855875 [1,1,0,0,0,0|2,0,0]=4 3424 B8R0.7 CCCCSCC(=O)O Amb1138789 [1,1,0,0,0,0|1,0,0]=3 3425 B8R0.7 CCCC\C=C\C(=O)O Amb17778752 [1,1,0,0,0,0|1,0,1]=4 3426 B8R0.7 CCCNCCC(=O)O Amb18633174 [1,1,0,0,0,0|1,0,0]=3 3427 B8R0.7 CCCNCCC(=O)O Amb2372065 [1,1,0,0,0,0|1,0,0]=3 3428 B8R0.7 CCCNCCC(C)=O Amb24700442 [1,1,0,0,0,0|2,0,0]=4 3429 B8R0.7 CCCNCC[PH](=O)O Amb28056179 [1,1,0,0,0,0|2,0,0]=4 3430 B8R0.7 CCCOCCC(=O)O Amb8874502 [1,1,0,0,0,0|1,0,0]=3 3431 B8R0.7 CCCOCCC(C)=O Amb8874915 [1,1,0,0,0,0|2,0,0]=4 3432 B8R0.7 CCCONCC(=O)O Amb27401902 [1,1,0,0,0,0|2,0,0]=4 3433 B8R0.7 CCC\C=C\CC(=O)O Amb18642602 [1,1,0,0,0,0|1,0,1]=4 3434 B8R0.7 CCNCCCC(=O)O Amb30585148 [1,1,0,0,0,0|1,0,0]=3 3435 B8R0.7 CCNCCCC(=O)O Amb6253896 [1,1,0,0,0,0|1,0,0]=3 3436 B8R0.7 CCNCCCC(N)=O Amb24709859 [1,1,0,0,0,0|2,0,0]=4 3437 B8R0.7 CCOCCCC(=O)O Amb6257602 [1,1,0,0,0,0|0,1,0]=3 3438 B8R0.7 CCSCCCB(O)O Amb24351131 [1,1,0,0,0,0|1,0,1]=4 3439 B8R0.7 CCSCCCC(=N)N Amb28934927 [1,1,0,0,0,0|2,0,0]=4 3440 B8R0.7 CCSCCCC(=O)O Amb6680204 [1,1,0,0,0,0|0,0,0]=2 3441 B8R0.7 CCSCCCC(C)=O Amb9660283 [1,1,0,0,0,0|1,0,0]=3 3442 B8R0.7 CCSCCCC(C)O Amb26319707 [1,1,0,0,0,0|1,0,1]=4 3443 B8R0.7 CCSCCCC(N)=S Amb28285187 [1,1,0,0,0,0|1,1,0]=4 3444 B8R0.7 CCSCCC[C@@H](C)O Amb33323738 [1,1,0,0,0,0|1,0,1]=4 3445 B8R0.7 CCSCCC[C@H](C)O Amb33323739 [1,1,0,0,0,0|1,0,1]=4 3446 B8R0.7 CCSCCC[N+](=O)[O-] Amb33323726 [1,1,0,0,0,0|1,0,1]=4 3447 B8R0.7 CCSCCNC(C)=O Amb27848944 [1,1,0,0,0,0|2,0,0]=4 3448 B8R0.7 CCSCCNC(N)=O Amb27639100 [1,1,0,0,0,0|2,0,0]=4 3449 B8R0.7 CCSC\C=C\C(=O)O Amb33449652 [1,1,0,0,0,0|0,0,2]=4 3450 B8R0.7 CCSSCCC(=O)O Amb27837279 [1,1,0,0,0,0|1,0,0]=3 3451 B8R0.7 CC\C=C/CCC(=O)O Amb25831265 [1,1,0,0,0,0|1,0,1]=4 3452 B8R0.7 CC\C=C\CCC(=O)O Amb18642608 [1,1,0,0,0,0|1,0,1]=4 3453 B8R0.7 CNCCCCC(=O)O Amb10605773 [1,1,0,0,0,0|1,0,0]=3 3454 B8R0.7 CNCCCCC(=O)O Amb24340485 [1,1,0,0,0,0|1,0,0]=3 3455 B8R0.7 CNCCCCC(N)=O Amb27780478 [1,1,0,0,0,0|2,0,0]=4 3456 B8R0.7 CNCCCNC(C)=O Amb33547919 [1,1,0,0,0,0|2,0,0]=4 3457 B8R0.7 CNCCCNC(C)=O Amb34913785 [1,1,0,0,0,0|2,0,0]=4 3458 B8R0.7 CNCCCNC(C)=O Amb9464418 [1,1,0,0,0,0|2,0,0]=4 3459 B8R0.7 CNCCOCC(=O)O Amb18630741 [1,1,0,0,0,0|1,0,0]=3 3460 B8R0.7 CNCCOCC(C)=O Amb18111838 [1,1,0,0,0,0|2,0,0]=4 3461 B8R0.7 CNCCOCC(N)=O Amb27447982 [1,1,0,0,0,0|2,0,0]=4 3462 B8R0.7 COCC#CCC(=O)O Amb27663198 [1,1,0,0,0,0|0,1,1]=4 3463 B8R0.7 COCCC#CC(=O)O Amb27392974 [1,1,0,0,0,0|0,1,1]=4 3464 B8R0.7 COCCCCC(=O)O Amb9207785 [1,1,0,0,0,0|0,1,0]=3 3465 B8R0.7 COCCCCC(C)=O Amb9659801 [1,1,0,0,0,0|1,1,0]=4 3466 B8R0.7 COCCCNC(=O)Cl Amb27791959 [1,1,0,0,0,0|1,1,0]=4 3467 B8R0.7 COCCCNC(C)=O Amb3358083 [1,1,0,0,0,0|1,1,0]=4 3468 B8R0.7 COCCCNC(N)=O Amb1105274 [1,1,0,0,0,0|1,1,0]=4 3469 B8R0.7 COCCCOC(C)=O Amb22732978 [1,1,0,0,0,0|1,1,0]=4 3470 B8R0.7 COCCNCC(=O)O Amb19514667 [1,1,0,0,0,0|0,1,0]=3 3471 B8R0.7 COCCNCC(=O)O Amb7766415 [1,1,0,0,0,0|0,1,0]=3 3472 B8R0.7 COCCNCC(N)=O Amb13951972 [1,1,0,0,0,0|1,1,0]=4 3473 B8R0.7 COCCNCC(N)=O Amb6707121 [1,1,0,0,0,0|1,1,0]=4 3474 B8R0.7 COCCOCC(=O)O Amb2721259 [1,1,0,0,0,0|0,1,0]=3 3475 B8R0.7 COCCOCC(C)=O Amb9665444 [1,1,0,0,0,0|1,1,0]=4 3476 B8R0.7 COCCSCC(=O)O Amb6245777 [1,1,0,0,0,0|0,1,0]=3 3477 B8R0.7 COCC\C=C\C(=O)O Amb33080389 [1,1,0,0,0,0|0,1,1]=4 3478 B8R0.7 COCOCCC(=O)O Amb27784860 [1,1,0,0,0,0|0,1,0]=3 3479 B8R0.7 COCSCCC(=O)O Amb27263382 [1,1,0,0,0,0|0,1,0]=3 3480 B8R0.7 CSCCCCC(=O)O Amb17503764 [1,1,0,0,0,0|0,0,0]=2 3481 B8R0.7 CSCCCCC(C)=O Amb27815140 [1,1,0,0,0,0|1,0,0]=3 3482 B8R0.7 CSCCCCC(C)O Amb27863049 [1,1,0,0,0,0|1,0,1]=4 3483 B8R0.7 CSCCCCC(N)=O Amb27662727 [1,1,0,0,0,0|1,0,0]=3 3484 B8R0.7 CSCCCC[C@@H](C)O Amb33198291 [1,1,0,0,0,0|1,0,1]=4 3485 B8R0.7 CSCCCC[C@H](C)O Amb33198292 [1,1,0,0,0,0|1,0,1]=4 3486 B8R0.7 CSCCCC[N+](=O)[O-] Amb33198277 [1,1,0,0,0,0|1,0,1]=4 3487 B8R0.7 CSCCCOC(C)=O Amb8392861 [1,1,0,0,0,0|1,0,0]=3 3488 B8R0.7 CSCCNCC(=O)O Amb24401934 [1,1,0,0,0,0|0,0,0]=2 3489 B8R0.7 CSCCNCC(=O)O Amb28934977 [1,1,0,0,0,0|0,0,0]=2 3490 B8R0.7 CSCCNCC(N)=O Amb27850987 [1,1,0,0,0,0|1,0,0]=3 3491 B8R0.7 CSCCNC[C@@H](C)O Amb27785175 [1,1,0,0,0,0|1,0,1]=4 3492 B8R0.7 CSCCOCC(=O)O Amb27392229 [1,1,0,0,0,0|0,0,0]=2 3493 B8R0.7 CSCCONC(C)=O Amb27247630 [1,1,0,0,0,0|2,0,0]=4 3494 B8R0.7 CSCCSCC(=O)O Amb27964765 [1,1,0,0,0,0|0,0,0]=2 3495 B8R0.7 CSCC\C=C\C(=O)O Amb33475293 [1,1,0,0,0,0|0,0,1]=3 3496 B8R0.7 CSCC\C=C\C(C)=O Amb33197615 [1,1,0,0,0,0|1,0,1]=4 3497 B8R0.7 CSC\C=C\CC(=O)O Amb28072070 [1,1,0,0,0,0|0,0,1]=3 3498 B8R0.7 CSSCCCC(=O)O Amb25269470 [1,1,0,0,0,0|0,0,0]=2 3499 B8R0.7 CSSCCNC(C)=O Amb27805193 [1,1,0,0,0,0|2,0,0]=4 3500 B8R0.7 C\C=C\CCCC(=O)O Amb18642615 [1,1,0,0,0,0|1,0,0]=3 3501 B8R0.7 C\C=C\CCCC(C)=O Amb24466633 [1,1,0,0,0,0|2,0,0]=4 3502 B8R0.7 C\C=C\CSCC(=O)O Amb9727556 [1,1,0,0,0,0|1,0,1]=4 3503 B8R0.7 N#CCCCCC(=O)O Amb17593332 [1,1,0,0,0,0|1,0,1]=4 3504 B8R0.7 N#CCCNCC(=O)O Amb2720474 [1,1,0,0,0,0|2,0,0]=4 3505 B8R0.7 N#CCCSCC(=O)O Amb17502363 [1,1,0,0,0,0|2,0,0]=4 3506 B8R0.7 N#CCSCCC(=O)O Amb6277440 [1,1,0,0,0,0|2,0,0]=4 3507 B8R0.7 NC(=O)CCCCCBr Amb2685265 [1,1,0,0,0,0|2,0,0]=4 3508 B8R0.7 NC(=O)CCCCCCl Amb27392074 [1,1,0,0,0,0|2,0,0]=4 3509 B8R0.7 NC(=O)CCCCCF Amb27837777 [1,1,0,0,0,0|2,0,0]=4 3510 B8R0.7 NC(=O)CCCCCO Amb22524369 [1,1,0,0,0,0|2,0,0]=4 3511 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [1,1,0,0,0,0|2,0,0]=4 3512 B8R0.7 NCCCCCC(=O)O Amb17607928 [1,1,0,0,0,0|1,0,0]=3 3513 B8R0.7 NCCCCCC(=O)O Amb1905625 [1,1,0,0,0,0|1,0,0]=3 3514 B8R0.7 NCCCCCC(=O)[O-] Amb28990947 [1,1,0,0,0,0|1,0,1]=4 3515 B8R0.7 NCCCOCC(=O)O Amb18111435 [1,1,0,0,0,0|2,0,0]=4 3516 B8R0.7 NCCCOCC(=O)O Amb31217489 [1,1,0,0,0,0|2,0,0]=4 3517 B8R0.7 NCCCSCC(=O)O Amb17500676 [1,1,0,0,0,0|2,0,0]=4 3518 B8R0.7 NCCNCCC(=O)O Amb20668304 [1,1,0,0,0,0|2,0,0]=4 3519 B8R0.7 NCCNCCC(=O)O Amb22058790 [1,1,0,0,0,0|2,0,0]=4 3520 B8R0.7 NCCOCCC(=O)O Amb18630461 [1,1,0,0,0,0|2,0,0]=4 3521 B8R0.7 NCCOCCC(=O)O Amb33330744 [1,1,0,0,0,0|2,0,0]=4 3522 B8R0.7 NCCSCCC(=O)O Amb21988844 [1,1,0,0,0,0|2,0,0]=4 3523 B8R0.7 NOCCCCC(=O)O Amb27596055 [1,1,0,0,0,0|1,1,0]=4 3524 B8R0.7 O=C(Cl)CCCCCBr Amb2685267 [1,1,0,0,0,0|2,0,0]=4 3525 B8R0.7 O=C(Cl)CCCCCCl Amb10844967 [1,1,0,0,0,0|2,0,0]=4 3526 B8R0.7 O=C(Cl)CCCCCO Amb28056558 [1,1,0,0,0,0|2,0,0]=4 3527 B8R0.7 O=C(F)CCCCCCl Amb27173031 [1,1,0,0,0,0|2,0,0]=4 3528 B8R0.7 O=C(O)CCC#CCO Amb27949900 [1,1,0,0,0,0|1,0,1]=4 3529 B8R0.7 O=C(O)CCCCCBr Amb2081955 [1,1,0,0,0,0|1,0,0]=3 3530 B8R0.7 O=C(O)CCCCCCl Amb18796646 [1,1,0,0,0,0|1,0,0]=3 3531 B8R0.7 O=C(O)CCCCCF Amb26063796 [1,1,0,0,0,0|1,0,0]=3 3532 B8R0.7 O=C(O)CCCCCI Amb22736492 [1,1,0,0,0,0|1,0,0]=3 3533 B8R0.7 O=C(O)CCCCCO Amb8515991 [1,1,0,0,0,0|1,0,0]=3 3534 B8R0.7 O=C(O)CCCCNO Amb28410171 [1,1,0,0,0,0|2,0,0]=4 3535 B8R0.7 O=C(O)CCCN=C=S Amb26330552 [1,1,0,0,0,0|1,0,1]=4 3536 B8R0.7 O=C(O)CCNCCF Amb27954272 [1,1,0,0,0,0|2,0,0]=4 3537 B8R0.7 O=C(O)CCNCCO Amb1110010 [1,1,0,0,0,0|2,0,0]=4 3538 B8R0.7 O=C(O)CCNCCS Amb28285239 [1,1,0,0,0,0|2,0,0]=4 3539 B8R0.7 O=C(O)CCOCCBr Amb24057757 [1,1,0,0,0,0|2,0,0]=4 3540 B8R0.7 O=C(O)CCOCCF Amb27807548 [1,1,0,0,0,0|2,0,0]=4 3541 B8R0.7 O=C(O)CCOCCO Amb6680916 [1,1,0,0,0,0|2,0,0]=4 3542 B8R0.7 O=C(O)CCOCCS Amb27226892 [1,1,0,0,0,0|2,0,0]=4 3543 B8R0.7 O=C(O)CCSCCBr Amb27468126 [1,1,0,0,0,0|2,0,0]=4 3544 B8R0.7 O=C(O)CCSCCF Amb27172860 [1,1,0,0,0,0|2,0,0]=4 3545 B8R0.7 O=C(O)CCSCCS Amb18126456 [1,1,0,0,0,0|2,0,0]=4 3546 B8R0.7 O=C(O)CNCCCCl Amb28055692 [1,1,0,0,0,0|2,0,0]=4 3547 B8R0.7 O=C(O)CNCCCF Amb27649256 [1,1,0,0,0,0|2,0,0]=4 3548 B8R0.7 O=C(O)CNCCCO Amb9325805 [1,1,0,0,0,0|2,0,0]=4 3549 B8R0.7 O=C(O)COCCCO Amb28288633 [1,1,0,0,0,0|2,0,0]=4 3550 B8R0.7 O=C([O-])CCCCCO Amb22491268 [1,1,0,0,0,0|1,0,1]=4 3551 B8R0.7 O=C=NCCCC(=O)O Amb26014000 [1,1,0,0,0,0|1,0,1]=4 3552 B8R0.7 O=CCCCCC(=O)O Amb18642763 [1,1,0,0,0,0|1,0,1]=4 3553 B8R0.7 O=CNCCCC(=O)O Amb18305404 [1,1,0,0,0,0|1,0,1]=4 3554 B8R0.7 O=COCCCC(=O)O Amb27217713 [1,1,0,0,0,0|0,1,1]=4 3555 B8R0.7 [N-]=[N+]=NCCCC(=O)O Amb10575820 [1,1,0,0,0,0|2,0,0]=4 3556 B8R0.21 CCCCCS(=O)(=O)O Amb10844728 [1,1,0,0,0,0|2,0,0]=4 3557 B8R0.21 COCCCS(=O)(=O)O Amb22523485 [1,1,0,0,0,0|1,1,0]=4 3558 B8R0.21 CSCCCC(C)(C)O Amb33198744 [1,1,0,0,0,0|1,0,1]=4 3559 B8R0.21 CSCCCS(=O)(=O)Cl Amb25922338 [1,1,0,0,0,0|1,0,1]=4 3560 B8R0.21 CSCCCS(=O)(=O)F Amb33076644 [1,1,0,0,0,0|1,0,1]=4 3561 B8R0.21 CSCCCS(C)(=O)=O Amb27838088 [1,1,0,0,0,0|1,0,1]=4 3562 B8R0.21 CSCCCS(N)(=O)=O Amb25032148 [1,1,0,0,0,0|1,0,1]=4 3563 B8R0.28 C=C(C)CCCC(=O)O Amb2699907 [1,1,0,0,0,0|1,0,0]=3 3564 B8R0.28 C=C(C)CCCC(C)=O Amb17739959 [1,1,0,0,0,0|2,0,0]=4 3565 B8R0.28 C=C(C)CCCC(N)=O Amb27837767 [1,1,0,0,0,0|2,0,0]=4 3566 B8R0.28 C=C(C)CSCC(=O)O Amb6280447 [1,1,0,0,0,0|2,0,0]=4 3567 B8R0.28 C=C(F)CCCC(=O)O Amb22641515 [1,1,0,0,0,0|1,0,1]=4 3568 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [1,1,0,0,0,0|1,0,0]=3 3569 B8R0.28 CC(=O)CCCC(C)=O Amb24093532 [1,1,0,0,0,0|2,0,0]=4 3570 B8R0.28 CC(=O)CCCC(C)C Amb33532191 [1,1,0,0,0,0|2,0,0]=4 3571 B8R0.28 CC(=O)CCCC(C)N Amb27483216 [1,1,0,0,0,0|2,0,0]=4 3572 B8R0.28 CC(=O)CCCC(N)=O Amb25259665 [1,1,0,0,0,0|2,0,0]=4 3573 B8R0.28 CC(=O)CCCN(C)C Amb2778944 [1,1,0,0,0,0|2,0,0]=4 3574 B8R0.28 CC(=O)CSCC(=O)O Amb26415891 [1,1,0,0,0,0|2,0,0]=4 3575 B8R0.28 CC(=O)NCCC(=O)O Amb1104704 [1,1,0,0,0,0|2,0,0]=4 3576 B8R0.28 CC(=O)OCCC(=O)O Amb18642866 [1,1,0,0,0,0|2,0,0]=4 3577 B8R0.28 CC(=O)SCCC(=O)O Amb17607685 [1,1,0,0,0,0|2,0,0]=4 3578 B8R0.28 CC(C)=CCCC(=O)O Amb10601609 [1,1,0,0,0,0|1,0,1]=4 3579 B8R0.28 CC(C)CCCC(=O)O Amb3941255 [1,1,0,0,0,0|1,0,0]=3 3580 B8R0.28 CC(C)CNCC(=O)O Amb19373106 [1,1,0,0,0,0|2,0,0]=4 3581 B8R0.28 CC(C)CNCC(=O)O Amb7766417 [1,1,0,0,0,0|2,0,0]=4 3582 B8R0.28 CC(C)COCC(=O)O Amb2608476 [1,1,0,0,0,0|2,0,0]=4 3583 B8R0.28 CC(C)CSCC(=O)O Amb1134811 [1,1,0,0,0,0|2,0,0]=4 3584 B8R0.28 CC(C)NCCC(=O)O Amb1106349 [1,1,0,0,0,0|2,0,0]=4 3585 B8R0.28 CC(C)NCCC(=O)O Amb528114 [1,1,0,0,0,0|2,0,0]=4 3586 B8R0.28 CC(C)OCCC(=O)O Amb6260272 [1,1,0,0,0,0|2,0,0]=4 3587 B8R0.28 CC(C)SCCC(=O)O Amb6267279 [1,1,0,0,0,0|2,0,0]=4 3588 B8R0.28 CC(Cl)CCCC(=O)Cl Amb26491427 [1,1,0,0,0,0|2,0,0]=4 3589 B8R0.28 CC(Cl)CCCC(N)=O Amb27869185 [1,1,0,0,0,0|2,0,0]=4 3590 B8R0.28 CC(F)CCCC(=O)O Amb28144031 [1,1,0,0,0,0|1,0,0]=3 3591 B8R0.28 CC(N)CCCC(=O)O Amb22059416 [1,1,0,0,0,0|1,0,0]=3 3592 B8R0.28 CC(N)CCCC(=O)O Amb28934990 [1,1,0,0,0,0|1,0,0]=3 3593 B8R0.28 CC(N)CSCC(=O)O Amb27221487 [1,1,0,0,0,0|2,0,0]=4 3594 B8R0.28 CC(O)CCCC(=O)O Amb2371277 [1,1,0,0,0,0|1,0,0]=3 3595 B8R0.28 CC(O)CCCC(=O)[O-] Amb17615415 [1,1,0,0,0,0|1,0,1]=4 3596 B8R0.28 CC(O)CNCC(=O)O Amb9359979 [1,1,0,0,0,0|2,0,0]=4 3597 B8R0.28 CC(O)COCC(=O)O Amb27968624 [1,1,0,0,0,0|2,0,0]=4 3598 B8R0.28 CC(O)CSCC(=O)O Amb19005278 [1,1,0,0,0,0|2,0,0]=4 3599 B8R0.28 CN(C)CCCC(=O)Cl Amb27450969 [1,1,0,0,0,0|2,0,0]=4 3600 B8R0.28 CN(C)CCCC(=O)Cl Amb32409435 [1,1,0,0,0,0|2,0,0]=4 3601 B8R0.28 CN(C)CCCC(=O)O Amb2716225 [1,1,0,0,0,0|1,0,0]=3 3602 B8R0.28 CN(C)CCCC(=O)O Amb9176338 [1,1,0,0,0,0|1,0,0]=3 3603 B8R0.28 CN(C)CCCC(N)=O Amb25887462 [1,1,0,0,0,0|2,0,0]=4 3604 B8R0.28 C[NH+](C)CCCC(=O)O Amb9786711 [1,1,0,0,0,0|1,0,0]=3 3605 B8R0.28 NC(=O)CCCC(=O)O Amb5718388 [1,1,0,0,0,0|2,0,0]=4 3606 B8R0.28 NC(=S)CCCC(=O)O Amb27956588 [1,1,0,0,0,0|2,0,0]=4 3607 B8R0.28 O=C(O)CCCC(=O)O Amb4037276 [1,1,0,0,0,0|2,0,0]=4 3608 B8R0.28 O=C(O)CCCC(F)F Amb24117996 [1,1,0,0,0,0|2,0,0]=4 3609 B8R0.28 O=C(O)CCCN(Cl)Cl Amb28313437 [1,1,0,0,0,0|2,0,0]=4 3610 B8R0.28 O=C(O)CCC[N+](=O)[O-] Amb24711043 [1,1,0,0,0,0|2,0,0]=4 3611 B8R0.2 C=C(C(=O)O)C(C)CC Amb18642655 [1,1,0,0,0,0|1,0,1]=4 3612 B8R0.2 C=C(C(=O)O)[C@@H](O)CC Amb28253249 [1,1,0,0,0,0|1,0,1]=4 3613 B8R0.2 C=C(C)C(N)C(C)CC Amb27760262 [1,1,0,0,0,0|2,0,0]=4 3614 B8R0.2 C=CC(C)C(N)C(=O)O Amb18989861 [1,1,0,0,0,0|0,0,2]=4 3615 B8R0.2 C=CC(C)[C@@H](N)C(=O)O Amb25889532 [1,1,0,0,0,0|0,0,2]=4 3616 B8R0.2 C=CC(C)[C@H](N)C(=O)O Amb27761345 [1,1,0,0,0,0|0,0,2]=4 3617 B8R0.2 C=CC(O)C(N)C(=O)O Amb18642830 [1,1,0,0,0,0|0,0,2]=4 3618 B8R0.2 C=CC(O)[C@H](N)C(=O)O Amb28429839 [1,1,0,0,0,0|0,0,2]=4 3619 B8R0.2 C=C[C@@H](C)[C@H](N)C(=O)O Amb28129785 [1,1,0,0,0,0|0,0,2]=4 3620 B8R0.2 C=C[C@H](C)[C@@H](N)C(=O)O Amb28067623 [1,1,0,0,0,0|0,0,2]=4 3621 B8R0.2 C=C[C@H](O)[C@@H](N)C(=O)O Amb27236340 [1,1,0,0,0,0|0,0,2]=4 3622 B8R0.2 CC(C#N)C(N)C(=O)O Amb33065998 [1,1,0,0,0,0|1,0,1]=4 3623 B8R0.2 CC(C#N)[C@@H](N)C(=O)O Amb33308709 [1,1,0,0,0,0|1,0,1]=4 3624 B8R0.2 CC(C#N)[C@H](N)C(=O)O Amb33308645 [1,1,0,0,0,0|1,0,1]=4 3625 B8R0.2 CC(C(=O)O)C(N)CN Amb24532823 [1,1,0,0,0,0|2,0,0]=4 3626 B8R0.2 CC(CCl)C(N)C(=O)O Amb27470876 [1,1,0,0,0,0|1,0,0]=3 3627 B8R0.2 CC(CN)C(C)C(=O)O Amb27217450 [1,1,0,0,0,0|2,0,0]=4 3628 B8R0.2 CC(CN)C(F)C(=O)O Amb35750952 [1,1,0,0,0,0|2,0,0]=4 3629 B8R0.2 CC(CN)C(F)C(=O)O Amb35751592 [1,1,0,0,0,0|2,0,0]=4 3630 B8R0.2 CC(CN)C(O)C(=O)O Amb18642919 [1,1,0,0,0,0|2,0,0]=4 3631 B8R0.2 CC(CO)C(C)C(=O)O Amb27255789 [1,1,0,0,0,0|1,1,0]=4 3632 B8R0.2 CC(CO)C(N)C(=O)O Amb27629815 [1,1,0,0,0,0|0,1,0]=3 3633 B8R0.2 CC(CO)C(N)C(N)=O Amb33308985 [1,1,0,0,0,0|1,1,0]=4 3634 B8R0.2 CC(CO)[C@@H](N)C(=O)O Amb33308939 [1,1,0,0,0,0|0,1,0]=3 3635 B8R0.2 CC(CO)[C@H](N)C(=O)O Amb25918803 [1,1,0,0,0,0|0,1,0]=3 3636 B8R0.2 CC(CS)C(C)C(=O)O Amb17593702 [1,1,0,0,0,0|1,0,0]=3 3637 B8R0.2 CCC(=S)[C@H](N)C(=O)O Amb25111086 [1,1,0,0,0,0|0,0,1]=3 3638 B8R0.2 CCC(Br)C(=O)C(=O)O Amb27232743 [1,1,0,0,0,0|1,0,1]=4 3639 B8R0.2 CCC(C)C(=O)C(=O)O Amb2695339 [1,1,0,0,0,0|1,0,1]=4 3640 B8R0.2 CCC(C)C(Br)C(=O)O Amb4015586 [1,1,0,0,0,0|1,0,0]=3 3641 B8R0.2 CCC(C)C(Br)C(N)=O Amb27472685 [1,1,0,0,0,0|2,0,0]=4 3642 B8R0.2 CCC(C)C(C)C(=O)O Amb18290719 [1,1,0,0,0,0|1,0,0]=3 3643 B8R0.2 CCC(C)C(C)C(C)=O Amb4035878 [1,1,0,0,0,0|2,0,0]=4 3644 B8R0.2 CCC(C)C(Cl)C(=O)O Amb17593752 [1,1,0,0,0,0|1,0,0]=3 3645 B8R0.2 CCC(C)C(Cl)C(N)=O Amb27771780 [1,1,0,0,0,0|2,0,0]=4 3646 B8R0.2 CCC(C)C(N)C(=O)O Amb9702778 [1,1,0,0,0,0|0,0,0]=2 3647 B8R0.2 CCC(C)C(N)C(C)O Amb18832525 [1,1,0,0,0,0|1,0,1]=4 3648 B8R0.2 CCC(C)C(N)C(N)=O Amb1105283 [1,1,0,0,0,0|1,0,0]=3 3649 B8R0.2 CCC(C)C(N)C(N)=O Amb1152621 [1,1,0,0,0,0|1,0,0]=3 3650 B8R0.2 CCC(C)C(N)C(N)=O Amb33551930 [1,1,0,0,0,0|1,0,0]=3 3651 B8R0.2 CCC(C)C(N)C(N)=S Amb19374909 [1,1,0,0,0,0|1,1,0]=4 3652 B8R0.2 CCC(C)C(O)C(=O)O Amb18288809 [1,1,0,0,0,0|1,0,0]=3 3653 B8R0.2 CCC(C)C(O)C(N)=O Amb24112761 [1,1,0,0,0,0|2,0,0]=4 3654 B8R0.2 CCC(C)C(S)C(=O)O Amb27667077 [1,1,0,0,0,0|1,0,0]=3 3655 B8R0.2 CCC(C)[C@@H](C)C(=O)O Amb10844494 [1,1,0,0,0,0|1,0,0]=3 3656 B8R0.2 CCC(C)[C@@H](N)C(=O)O Amb10844500 [1,1,0,0,0,0|0,0,0]=2 3657 B8R0.2 CCC(C)[C@H](Br)C(=O)Cl Amb27166137 [1,1,0,0,0,0|2,0,0]=4 3658 B8R0.2 CCC(C)[C@H](Br)C(=O)O Amb28183049 [1,1,0,0,0,0|1,0,0]=3 3659 B8R0.2 CCC(C)[C@H](C)C(=O)O Amb10844495 [1,1,0,0,0,0|1,0,0]=3 3660 B8R0.2 CCC(C)[C@H](Cl)C(=O)O Amb28314442 [1,1,0,0,0,0|1,0,0]=3 3661 B8R0.2 CCC(C)[C@H](N)C(=O)O Amb10844501 [1,1,0,0,0,0|0,0,0]=2 3662 B8R0.2 CCC(C)[C@H](N)C(C)=O Amb35617474 [1,1,0,0,0,0|1,0,0]=3 3663 B8R0.2 CCC(C)[C@H](N)C(C)O Amb35588414 [1,1,0,0,0,0|1,0,1]=4 3664 B8R0.2 CCC(Cl)C(C)C(C)=O Amb27983787 [1,1,0,0,0,0|2,0,0]=4 3665 B8R0.2 CCC(F)C(=O)C(=O)O Amb27489910 [1,1,0,0,0,0|1,0,1]=4 3666 B8R0.2 CCC(F)C(Br)C(=O)O Amb27858717 [1,1,0,0,0,0|1,0,0]=3 3667 B8R0.2 CCC(N)C(F)C(=O)O Amb33036406 [1,1,0,0,0,0|1,0,0]=3 3668 B8R0.2 CCC(N)C(O)C(N)=O Amb28055940 [1,1,0,0,0,0|2,0,0]=4 3669 B8R0.2 CCC(O)C(C)C(=O)O Amb10844267 [1,1,0,0,0,0|1,0,0]=3 3670 B8R0.2 CCC(O)C(C)C(C)=O Amb26336386 [1,1,0,0,0,0|2,0,0]=4 3671 B8R0.2 CCC(O)C(F)C(=O)O Amb33136388 [1,1,0,0,0,0|1,0,0]=3 3672 B8R0.2 CCC(O)C(N)C(=O)O Amb18203168 [1,1,0,0,0,0|0,0,0]=2 3673 B8R0.2 CCC(O)[C@H](N)C(=O)O Amb24364655 [1,1,0,0,0,0|0,0,0]=2 3674 B8R0.2 CCN(C)C(C)C(=O)O Amb8890967 [1,1,0,0,0,0|2,0,0]=4 3675 B8R0.2 CCN(C)[C@@H](C)C(=O)O Amb27228167 [1,1,0,0,0,0|2,0,0]=4 3676 B8R0.2 CCN(N)C(C)C(=O)O Amb27655613 [1,1,0,0,0,0|2,0,0]=4 3677 B8R0.2 CC[C@@H](C)C(Cl)C(=O)O Amb27472040 [1,1,0,0,0,0|1,0,0]=3 3678 B8R0.2 CC[C@@H](C)[C@@H](Br)C(=O)Cl Amb27194351 [1,1,0,0,0,0|2,0,0]=4 3679 B8R0.2 CC[C@@H](C)[C@@H](C)C(C)=O Amb27949165 [1,1,0,0,0,0|2,0,0]=4 3680 B8R0.2 CC[C@@H](C)[C@@H](C)C(N)=O Amb28049888 [1,1,0,0,0,0|2,0,0]=4 3681 B8R0.2 CC[C@@H](C)[C@@H](Cl)C(=O)O Amb28130604 [1,1,0,0,0,0|1,0,0]=3 3682 B8R0.2 CC[C@@H](C)[C@@H](F)C(=O)O Amb28347222 [1,1,0,0,0,0|1,0,0]=3 3683 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O Amb8513329 [1,1,0,0,0,0|0,0,0]=2 3684 B8R0.2 CC[C@@H](C)[C@@H](O)C(=O)O Amb26063750 [1,1,0,0,0,0|1,0,0]=3 3685 B8R0.2 CC[C@@H](C)[C@H](Br)C(=O)O Amb26866576 [1,1,0,0,0,0|1,0,0]=3 3686 B8R0.2 CC[C@@H](C)[C@H](C)C(C)=O Amb25024740 [1,1,0,0,0,0|2,0,0]=4 3687 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O Amb10068321 [1,1,0,0,0,0|0,0,0]=2 3688 B8R0.2 CC[C@@H](O)[C@@H](C)C(=O)O Amb27879857 [1,1,0,0,0,0|1,0,0]=3 3689 B8R0.2 CC[C@@H](O)[C@@H](C)C(C)=O Amb26600956 [1,1,0,0,0,0|2,0,0]=4 3690 B8R0.2 CC[C@@H](O)[C@H](O)C(C)=O Amb27861441 [1,1,0,0,0,0|2,0,0]=4 3691 B8R0.2 CC[C@H](Br)[C@H](Br)C(=O)O Amb16233350 [1,1,0,0,0,0|1,0,0]=3 3692 B8R0.2 CC[C@H](C)C(=O)C(=O)O Amb28075584 [1,1,0,0,0,0|1,0,1]=4 3693 B8R0.2 CC[C@H](C)C(C)C(=O)O Amb27950556 [1,1,0,0,0,0|1,0,0]=3 3694 B8R0.2 CC[C@H](C)C(C)C(N)=O Amb28049537 [1,1,0,0,0,0|2,0,0]=4 3695 B8R0.2 CC[C@H](C)C(N)C(=O)O Amb27209489 [1,1,0,0,0,0|0,0,0]=2 3696 B8R0.2 CC[C@H](C)[C@@H](Br)C(=O)O Amb23401386 [1,1,0,0,0,0|1,0,0]=3 3697 B8R0.2 CC[C@H](C)[C@@H](C)C(C)=O Amb27250604 [1,1,0,0,0,0|2,0,0]=4 3698 B8R0.2 CC[C@H](C)[C@@H](F)C(=O)O Amb27954743 [1,1,0,0,0,0|1,0,0]=3 3699 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O Amb8516280 [1,1,0,0,0,0|0,0,0]=2 3700 B8R0.2 CC[C@H](C)[C@H](Br)C(N)=O Amb27235575 [1,1,0,0,0,0|2,0,0]=4 3701 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)Cl Amb27768651 [1,1,0,0,0,0|2,0,0]=4 3702 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O Amb22388560 [1,1,0,0,0,0|1,0,0]=3 3703 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O Amb3940753 [1,1,0,0,0,0|0,0,0]=2 3704 B8R0.2 CC[C@H](C)[C@H](N)C(C)O Amb35737490 [1,1,0,0,0,0|1,0,1]=4 3705 B8R0.2 CC[C@H](C)[C@H](N)C(N)=O Amb10878815 [1,1,0,0,0,0|1,0,0]=3 3706 B8R0.2 CC[C@H](C)[C@H](N)C(N)=O Amb9813724 [1,1,0,0,0,0|1,0,0]=3 3707 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O Amb2694797 [1,1,0,0,0,0|1,0,0]=3 3708 B8R0.2 CC[C@H](N)[C@H](C)C(=O)O Amb27779460 [1,1,0,0,0,0|1,0,0]=3 3709 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O Amb26981388 [1,1,0,0,0,0|0,0,0]=2 3710 B8R0.2 CC[C@H](O)[C@H](Br)C(=O)O Amb28285137 [1,1,0,0,0,0|1,0,0]=3 3711 B8R0.2 CC[C@H](O)[C@H](C)C(C)=O Amb27590145 [1,1,0,0,0,0|2,0,0]=4 3712 B8R0.2 CC[C@H](O)[C@H](N)C(=O)O Amb26024594 [1,1,0,0,0,0|0,0,0]=2 3713 B8R0.2 CNC(C)C(N)C(=O)O Amb18642890 [1,1,0,0,0,0|1,0,0]=3 3714 B8R0.2 COC(=O)C(N)C(=O)O Amb27487566 [1,1,0,0,0,0|0,1,1]=4 3715 B8R0.2 COC(C)C(Br)C(=O)O Amb16233352 [1,1,0,0,0,0|1,1,0]=4 3716 B8R0.2 COC(C)C(C)C(=O)O Amb10844268 [1,1,0,0,0,0|1,1,0]=4 3717 B8R0.2 COC(C)C(N)C(=O)O Amb17938689 [1,1,0,0,0,0|0,1,0]=3 3718 B8R0.2 COC(C)C(N)C(N)=O Amb27195568 [1,1,0,0,0,0|1,1,0]=4 3719 B8R0.2 COC(C)C(O)C(=O)O Amb27816478 [1,1,0,0,0,0|1,1,0]=4 3720 B8R0.2 COC(C)[C@@H](C)C(=O)O Amb33729616 [1,1,0,0,0,0|1,1,0]=4 3721 B8R0.2 COC(C)[C@@H](N)C(=O)O Amb25733335 [1,1,0,0,0,0|0,1,0]=3 3722 B8R0.2 COC(C)[C@H](C)C(=O)O Amb25722336 [1,1,0,0,0,0|1,1,0]=4 3723 B8R0.2 COC(C)[C@H](N)C(=O)O Amb25881538 [1,1,0,0,0,0|0,1,0]=3 3724 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O Amb26036938 [1,1,0,0,0,0|0,1,0]=3 3725 B8R0.2 CO[C@@H](C)[C@H](N)C(=O)O Amb8390422 [1,1,0,0,0,0|0,1,0]=3 3726 B8R0.2 CO[C@H](C)[C@@H](Br)C(=O)O Amb27392325 [1,1,0,0,0,0|1,1,0]=4 3727 B8R0.2 CO[C@H](C)[C@@H](Cl)C(=O)O Amb27424722 [1,1,0,0,0,0|1,1,0]=4 3728 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O Amb16183892 [1,1,0,0,0,0|0,1,0]=3 3729 B8R0.2 CO[C@H](C)[C@H](N)C(N)=O Amb32723110 [1,1,0,0,0,0|1,1,0]=4 3730 B8R0.2 CO[C@H](C)[C@H](O)C(=O)O Amb25316180 [1,1,0,0,0,0|1,1,0]=4 3731 B8R0.2 CSC(C)C(Cl)C(=O)Cl Amb28352236 [1,1,0,0,0,0|2,0,0]=4 3732 B8R0.2 CSC(C)C(N)C(N)=O Amb30035540 [1,1,0,0,0,0|1,0,0]=3 3733 B8R0.2 CS[C@H](C)[C@H](N)C(=O)O Amb27771288 [1,1,0,0,0,0|0,0,0]=2 3734 B8R0.2 C[C@@H](CO)[C@@H](N)C(=O)O Amb24117487 [1,1,0,0,0,0|0,1,0]=3 3735 B8R0.2 C[C@@H](CO)[C@@H](N)C(=O)O Amb27828649 [1,1,0,0,0,0|0,1,0]=3 3736 B8R0.2 C[C@@H](CO)[C@H](N)C(=O)O Amb24117488 [1,1,0,0,0,0|0,1,0]=3 3737 B8R0.2 C[C@H](C(=O)O)[C@@H](O)CN Amb28056248 [1,1,0,0,0,0|2,0,0]=4 3738 B8R0.2 C[C@H](CN)[C@@H](O)C(=O)O Amb27455474 [1,1,0,0,0,0|2,0,0]=4 3739 B8R0.2 C\C=C(/C)C(N)C(=O)O Amb18642706 [1,1,0,0,0,0|0,0,2]=4 3740 B8R0.2 C\C=C(\C)C(N)C(=O)O Amb27634383 [1,1,0,0,0,0|0,0,2]=4 3741 B8R0.2 C\C=C(\C)[C@H](N)C(=O)O Amb28424373 [1,1,0,0,0,0|0,0,2]=4 3742 B8R0.2 NC(C(=O)O)C(F)CO Amb27950986 [1,1,0,0,0,0|0,1,0]=3 3743 B8R0.2 NC(C(=O)O)C(O)CCl Amb27846402 [1,1,0,0,0,0|1,0,0]=3 3744 B8R0.2 NC(C(=O)O)C(O)CF Amb27592597 [1,1,0,0,0,0|1,0,0]=3 3745 B8R0.2 NC(C(=O)O)C(S)CO Amb27199680 [1,1,0,0,0,0|0,1,0]=3 3746 B8R0.2 NC(CO)C(N)C(=O)O Amb28208230 [1,1,0,0,0,0|0,1,0]=3 3747 B8R0.2 NCC(O)C(N)C(=O)O Amb27876292 [1,1,0,0,0,0|1,0,0]=3 3748 B8R0.2 NCC(O)C(O)C(=O)O Amb27830532 [1,1,0,0,0,0|2,0,0]=4 3749 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb27945588 [1,1,0,0,0,0|2,0,0]=4 3750 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb33209939 [1,1,0,0,0,0|2,0,0]=4 3751 B8R0.2 NC[C@@H](O)[C@H](N)C(=O)O Amb30884414 [1,1,0,0,0,0|1,0,0]=3 3752 B8R0.2 NC[C@H](F)[C@H](F)C(=O)O Amb27224824 [1,1,0,0,0,0|2,0,0]=4 3753 B8R0.2 N[C@@H](C(=O)O)C(O)CBr Amb28245344 [1,1,0,0,0,0|1,0,0]=3 3754 B8R0.2 N[C@@H](C(=O)O)C(S)CO Amb27233478 [1,1,0,0,0,0|0,1,0]=3 3755 B8R0.2 N[C@@H](C(=O)O)[C@H](O)CO Amb24671346 [1,1,0,0,0,0|0,1,0]=3 3756 B8R0.2 N[C@H](C(=O)O)C(O)CCl Amb27212707 [1,1,0,0,0,0|1,0,0]=3 3757 B8R0.2 N[C@H](C(=O)O)C(O)CO Amb28255690 [1,1,0,0,0,0|0,1,0]=3 3758 B8R0.2 N[C@H](C(=O)O)[C@@H](O)CO Amb25678241 [1,1,0,0,0,0|0,1,0]=3 3759 B8R0.2 O=C(O)C(Br)C(Br)CBr Amb22347644 [1,1,0,0,0,0|2,0,0]=4 3760 B8R0.2 O=C(O)C(O)C(O)CO Amb22495524 [1,1,0,0,0,0|1,1,0]=4 3761 B8R0.2 O=C(O)[C@@H](F)[C@H](O)CO Amb27195151 [1,1,0,0,0,0|1,1,0]=4 3762 B8R0.2 O=C(O)[C@H](O)C(O)CO Amb27229496 [1,1,0,0,0,0|1,1,0]=4 3763 B8R0.2 O=C(O)[C@H](O)[C@@H](O)CO Amb27849401 [1,1,0,0,0,0|1,1,0]=4 3764 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO Amb32644462 [1,1,0,0,0,0|1,1,0]=4 3765 B8R0.12 C#CC[C@](C)(N)C(=O)O Amb16183909 [1,1,0,0,0,0|0,0,2]=4 3766 B8R0.12 C=CC[C@@](C)(N)C(=O)O Amb8389450 [1,1,0,0,0,0|0,0,2]=4 3767 B8R0.12 C=CC[C@](C)(N)C(=O)O Amb8514992 [1,1,0,0,0,0|0,0,2]=4 3768 B8R0.12 CC(C)(CCCl)C(=O)O Amb27953901 [1,1,0,0,0,0|2,0,0]=4 3769 B8R0.12 CC(C)(CCF)C(=O)O Amb27838513 [1,1,0,0,0,0|2,0,0]=4 3770 B8R0.12 CC(C)(CCN)C(=O)O Amb2694929 [1,1,0,0,0,0|2,0,0]=4 3771 B8R0.12 CC(C)(CCN)C(=O)O Amb8630069 [1,1,0,0,0,0|2,0,0]=4 3772 B8R0.12 CC(C)(CCO)C(=O)O Amb24763728 [1,1,0,0,0,0|1,1,0]=4 3773 B8R0.12 CC(N)(CCCl)C(N)=O Amb25887461 [1,1,0,0,0,0|2,0,0]=4 3774 B8R0.12 CC(N)(CCF)C(=O)O Amb27961476 [1,1,0,0,0,0|1,0,0]=3 3775 B8R0.12 CC(N)(CCF)C(=O)O Amb28934998 [1,1,0,0,0,0|1,0,0]=3 3776 B8R0.12 CC(N)(CCO)C(N)=O Amb30013972 [1,1,0,0,0,0|1,1,0]=4 3777 B8R0.12 CC(O)(CCF)C(=O)O Amb33379277 [1,1,0,0,0,0|2,0,0]=4 3778 B8R0.12 CCCC(C)(Br)C(N)=O Amb28292478 [1,1,0,0,0,0|2,0,0]=4 3779 B8R0.12 CCCC(C)(C)C(=O)Cl Amb22168276 [1,1,0,0,0,0|2,0,0]=4 3780 B8R0.12 CCCC(C)(C)C(=O)O Amb2720786 [1,1,0,0,0,0|1,0,0]=3 3781 B8R0.12 CCCC(C)(C)C(C)=O Amb26026773 [1,1,0,0,0,0|2,0,0]=4 3782 B8R0.12 CCCC(C)(C)C(N)=O Amb25887199 [1,1,0,0,0,0|2,0,0]=4 3783 B8R0.12 CCCC(C)(Cl)C(=O)O Amb17593751 [1,1,0,0,0,0|1,0,0]=3 3784 B8R0.12 CCCC(C)(F)C(=O)O Amb27797327 [1,1,0,0,0,0|1,0,0]=3 3785 B8R0.12 CCCC(C)(N)C(=O)O Amb9720287 [1,1,0,0,0,0|0,0,0]=2 3786 B8R0.12 CCCC(C)(N)C(C)O Amb35583755 [1,1,0,0,0,0|1,0,1]=4 3787 B8R0.12 CCCC(C)(N)C(N)=S Amb19148046 [1,1,0,0,0,0|1,1,0]=4 3788 B8R0.12 CCCC(C)(O)C(=O)O Amb18288835 [1,1,0,0,0,0|1,0,0]=3 3789 B8R0.12 CCCC(C)(O)C(C)=O Amb26490520 [1,1,0,0,0,0|2,0,0]=4 3790 B8R0.12 CCCC(C)(O)C(N)=O Amb24116806 [1,1,0,0,0,0|2,0,0]=4 3791 B8R0.12 CCCC(Cl)(Cl)C(=O)O Amb2720219 [1,1,0,0,0,0|1,0,0]=3 3792 B8R0.12 CCCC(Cl)(Cl)C(C)=O Amb26875052 [1,1,0,0,0,0|2,0,0]=4 3793 B8R0.12 CCCC(F)(F)C(=O)Cl Amb27420905 [1,1,0,0,0,0|2,0,0]=4 3794 B8R0.12 CCCC(F)(F)C(=O)O Amb19929277 [1,1,0,0,0,0|1,0,0]=3 3795 B8R0.12 CCC[C@@](C)(N)C(=O)O Amb2699127 [1,1,0,0,0,0|0,0,0]=2 3796 B8R0.12 CCC[C@](C)(N)C(=O)O Amb16232632 [1,1,0,0,0,0|0,0,0]=2 3797 B8R0.12 CCNC(C)(C)C(=O)O Amb13952777 [1,1,0,0,0,0|2,0,0]=4 3798 B8R0.12 CCNC(C)(C)C(=O)O Amb9619876 [1,1,0,0,0,0|2,0,0]=4 3799 B8R0.12 CCOC(C)(C)C(=O)O Amb18976723 [1,1,0,0,0,0|2,0,0]=4 3800 B8R0.12 CCOC(Cl)(Cl)C(=O)O Amb27422864 [1,1,0,0,0,0|2,0,0]=4 3801 B8R0.12 CCSC(C)(C)C(=O)O Amb17501487 [1,1,0,0,0,0|2,0,0]=4 3802 B8R0.12 CCSC(F)(F)C(=O)O Amb28182780 [1,1,0,0,0,0|2,0,0]=4 3803 B8R0.12 CNCC(C)(C)C(=O)O Amb26557784 [1,1,0,0,0,0|2,0,0]=4 3804 B8R0.12 CNCC(C)(C)C(=O)O Amb33249638 [1,1,0,0,0,0|2,0,0]=4 3805 B8R0.12 CNCC(C)(O)C(=O)O Amb27478763 [1,1,0,0,0,0|2,0,0]=4 3806 B8R0.12 CNCC(F)(F)C(=O)O Amb22497225 [1,1,0,0,0,0|2,0,0]=4 3807 B8R0.12 CNCC(F)(F)C(=O)O Amb22523480 [1,1,0,0,0,0|2,0,0]=4 3808 B8R0.12 CNC[C@@](C)(N)C(=O)O Amb27975719 [1,1,0,0,0,0|1,0,0]=3 3809 B8R0.12 CNC[C@](C)(N)C(=O)O Amb25882845 [1,1,0,0,0,0|1,0,0]=3 3810 B8R0.12 COCC(C)(C)C(=O)O Amb10608195 [1,1,0,0,0,0|1,1,0]=4 3811 B8R0.12 COCC(C)(N)C(=O)O Amb18990135 [1,1,0,0,0,0|0,1,0]=3 3812 B8R0.12 COCC(C)(N)C(=O)O Amb20622455 [1,1,0,0,0,0|0,1,0]=3 3813 B8R0.12 COCC(C)(N)C(N)=O Amb18298766 [1,1,0,0,0,0|1,1,0]=4 3814 B8R0.12 COCC(C)(N)C(N)=O Amb19515079 [1,1,0,0,0,0|1,1,0]=4 3815 B8R0.12 COCC(C)(O)C(=O)O Amb18992608 [1,1,0,0,0,0|1,1,0]=4 3816 B8R0.12 COCC(F)(F)C(=O)O Amb24518571 [1,1,0,0,0,0|1,1,0]=4 3817 B8R0.12 COC[C@](C)(N)C(=O)O Amb24568285 [1,1,0,0,0,0|0,1,0]=3 3818 B8R0.12 CSCC(C)(C)C(=O)O Amb18124874 [1,1,0,0,0,0|1,0,0]=3 3819 B8R0.12 CSCC(C)(N)C(=O)O Amb18294541 [1,1,0,0,0,0|0,0,0]=2 3820 B8R0.12 CSCC(F)(F)C(=O)O Amb23590987 [1,1,0,0,0,0|1,0,0]=3 3821 B8R0.12 CSCC(F)(F)C(N)=O Amb23590988 [1,1,0,0,0,0|2,0,0]=4 3822 B8R0.12 C[C@@](N)(CCO)C(=O)O Amb28048736 [1,1,0,0,0,0|0,1,0]=3 3823 B8R0.12 C[C@](N)(CCN)C(=O)O Amb25348479 [1,1,0,0,0,0|1,0,0]=3 3824 B8R0.12 C\C=C\C(C)(N)C(=O)O Amb24671255 [1,1,0,0,0,0|0,0,2]=4 3825 B8R0.12 NCCC(F)(F)C(=O)O Amb2697352 [1,1,0,0,0,0|2,0,0]=4 3826 B8R0.12 NCCC(F)(F)C(=O)O Amb31378944 [1,1,0,0,0,0|2,0,0]=4 3827 B8R0.12 O=C(O)C(F)(F)CCF Amb32811300 [1,1,0,0,0,0|2,0,0]=4 3828 B8R0.14 CCCC(N)C(C)(C)O Amb33214879 [1,1,0,0,0,0|1,0,1]=4 3829 B8R0.14 CCCC(N)P(=O)(O)O Amb8516011 [1,1,0,0,0,0|1,0,0]=3 3830 B8R0.14 CCCC(N)S(=O)(=O)O Amb28075743 [1,1,0,0,0,0|1,0,0]=3 3831 B8R0.14 CCCC(O)P(=O)(O)O Amb26480670 [1,1,0,0,0,0|2,0,0]=4 3832 B8R0.14 CCCC(O)P(C)(=O)O Amb28315561 [1,1,0,0,0,0|2,0,0]=4 3833 B8R0.14 CCC[C@@H](O)P(=O)(O)O Amb27172583 [1,1,0,0,0,0|2,0,0]=4 3834 B8R0.14 N[C@@H](CCO)P(=O)(O)O Amb27424703 [1,1,0,0,0,0|1,1,0]=4 3835 B8R0.15 C=C(C)C(CCC)NC Amb27667465 [1,1,0,0,0,0|2,0,0]=4 3836 B8R0.15 C=C(C)C(CCC)NN Amb27603084 [1,1,0,0,0,0|2,0,0]=4 3837 B8R0.15 C=C(C)C(CSC)NC Amb28241108 [1,1,0,0,0,0|2,0,0]=4 3838 B8R0.15 C=C(C)C(CSC)NN Amb27855873 [1,1,0,0,0,0|2,0,0]=4 3839 B8R0.15 C=C=C(CCC)C(=O)O Amb28045352 [1,1,0,0,0,0|1,0,1]=4 3840 B8R0.15 C=CC(SCC)C(=O)O Amb27757608 [1,1,0,0,0,0|2,0,0]=4 3841 B8R0.15 C=CCC(NO)C(=O)O Amb27768789 [1,1,0,0,0,0|0,0,2]=4 3842 B8R0.15 C=C[C@@H](CCC)C(=O)O Amb27658640 [1,1,0,0,0,0|1,0,0]=3 3843 B8R0.15 CCC(CCF)C(=O)O Amb26321627 [1,1,0,0,0,0|2,0,0]=4 3844 B8R0.15 CCC(CCN)C(=O)O Amb24699884 [1,1,0,0,0,0|2,0,0]=4 3845 B8R0.15 CCC(CCN)C(=O)O Amb32662662 [1,1,0,0,0,0|2,0,0]=4 3846 B8R0.15 CCC(CCO)C(=O)O Amb18642884 [1,1,0,0,0,0|1,1,0]=4 3847 B8R0.15 CCC(COC)C(=O)O Amb18124352 [1,1,0,0,0,0|1,1,0]=4 3848 B8R0.15 CCC(CSC)C(=O)O Amb33272061 [1,1,0,0,0,0|1,0,0]=3 3849 B8R0.15 CCC(SSC)C(=O)O Amb27236075 [1,1,0,0,0,0|2,0,0]=4 3850 B8R0.15 CCCC(C#N)C(C)=O Amb24053569 [1,1,0,0,0,0|1,0,1]=4 3851 B8R0.15 CCCC(C=O)C(=O)O Amb27464964 [1,1,0,0,0,0|1,0,0]=3 3852 B8R0.15 CCCC(CBr)C(=O)Cl Amb27639323 [1,1,0,0,0,0|2,0,0]=4 3853 B8R0.15 CCCC(CC)C(=O)O Amb19009626 [1,1,0,0,0,0|1,0,0]=3 3854 B8R0.15 CCCC(CF)C(=O)O Amb27186472 [1,1,0,0,0,0|1,0,0]=3 3855 B8R0.15 CCCC(CN)C(=O)O Amb19373497 [1,1,0,0,0,0|0,0,0]=2 3856 B8R0.15 CCCC(CN)C(C)O Amb27253919 [1,1,0,0,0,0|1,0,1]=4 3857 B8R0.15 CCCC(CO)C(=O)O Amb25881510 [1,1,0,0,0,0|1,0,0]=3 3858 B8R0.15 CCCC(NC)C(=O)O Amb21961534 [1,1,0,0,0,0|0,0,0]=2 3859 B8R0.15 CCCC(NC)C(=O)O Amb22587444 [1,1,0,0,0,0|0,0,0]=2 3860 B8R0.15 CCCC(NC)C(=O)O Amb9496293 [1,1,0,0,0,0|0,0,0]=2 3861 B8R0.15 CCCC(NC)C(N)=O Amb19006602 [1,1,0,0,0,0|1,0,0]=3 3862 B8R0.15 CCCC(NO)C(=O)O Amb22372057 [1,1,0,0,0,0|0,0,0]=2 3863 B8R0.15 CCCC(OC)C(=O)O Amb8455302 [1,1,0,0,0,0|1,0,0]=3 3864 B8R0.15 CCCC(OC)C(C)=O Amb27207958 [1,1,0,0,0,0|2,0,0]=4 3865 B8R0.15 CCCC(SC)C(=O)O Amb28289849 [1,1,0,0,0,0|1,0,0]=3 3866 B8R0.15 CCC[C@@H](CO)C(=O)O Amb24571859 [1,1,0,0,0,0|1,0,0]=3 3867 B8R0.15 CCC[C@@H](NC)C(=O)O Amb25771939 [1,1,0,0,0,0|0,0,0]=2 3868 B8R0.15 CCC[C@@H](NC)C(=O)O Amb33801471 [1,1,0,0,0,0|0,0,0]=2 3869 B8R0.15 CCC[C@H](CN)C(=O)O Amb27460612 [1,1,0,0,0,0|0,0,0]=2 3870 B8R0.15 CCC[C@H](CO)C(=O)O Amb25063310 [1,1,0,0,0,0|1,0,0]=3 3871 B8R0.15 CCC[C@H](NC)C(=O)O Amb25062610 [1,1,0,0,0,0|0,0,0]=2 3872 B8R0.15 CCC[C@H](NC)C(=O)O Amb33456398 [1,1,0,0,0,0|0,0,0]=2 3873 B8R0.15 CCC[C@H](NC)C(N)=O Amb27475077 [1,1,0,0,0,0|1,0,0]=3 3874 B8R0.15 CCNC(CC)C(=O)O Amb33339265 [1,1,0,0,0,0|2,0,0]=4 3875 B8R0.15 CCNC(CC)C(=O)O Amb9620054 [1,1,0,0,0,0|2,0,0]=4 3876 B8R0.15 CCN[C@@H](CC)C(=O)O Amb26019582 [1,1,0,0,0,0|2,0,0]=4 3877 B8R0.15 CCN[C@H](CC)C(=O)O Amb33347493 [1,1,0,0,0,0|2,0,0]=4 3878 B8R0.15 CCOC(CC)C(=O)O Amb9675410 [1,1,0,0,0,0|2,0,0]=4 3879 B8R0.15 CCOC(CS)C(=O)O Amb19037339 [1,1,0,0,0,0|2,0,0]=4 3880 B8R0.15 CCSC(CC)C(=O)O Amb9675503 [1,1,0,0,0,0|2,0,0]=4 3881 B8R0.15 CC[C@H](CCN)C(=O)O Amb27754665 [1,1,0,0,0,0|2,0,0]=4 3882 B8R0.15 CNC(CCO)C(=O)O Amb27390592 [1,1,0,0,0,0|0,1,0]=3 3883 B8R0.15 CNC(COC)C(=O)O Amb19304133 [1,1,0,0,0,0|0,1,0]=3 3884 B8R0.15 CNC(COC)C(=O)O Amb22059040 [1,1,0,0,0,0|0,1,0]=3 3885 B8R0.15 CNC(COC)C(N)=O Amb24120142 [1,1,0,0,0,0|1,1,0]=4 3886 B8R0.15 CNC(COC)C(N)=O Amb32666305 [1,1,0,0,0,0|1,1,0]=4 3887 B8R0.15 CNCC(C#N)C(=O)O Amb25756304 [1,1,0,0,0,0|1,0,1]=4 3888 B8R0.15 CNCC(CO)C(=O)O Amb26352745 [1,1,0,0,0,0|2,0,0]=4 3889 B8R0.15 CNCC(CO)C(=O)O Amb32661056 [1,1,0,0,0,0|2,0,0]=4 3890 B8R0.15 CN[C@@H](COC)C(N)=O Amb26458948 [1,1,0,0,0,0|1,1,0]=4 3891 B8R0.15 CN[C@@H](COC)C(N)=O Amb28935003 [1,1,0,0,0,0|1,1,0]=4 3892 B8R0.15 CN[C@H](COC)C(=O)O Amb33347473 [1,1,0,0,0,0|0,1,0]=3 3893 B8R0.15 CN[C@H](COC)C(N)=O Amb26507221 [1,1,0,0,0,0|1,1,0]=4 3894 B8R0.15 CN[C@H](COC)C(N)=O Amb32661128 [1,1,0,0,0,0|1,1,0]=4 3895 B8R0.15 COC(CCF)C(=O)O Amb33379286 [1,1,0,0,0,0|2,0,0]=4 3896 B8R0.15 COC(CCN)C(=O)O Amb26631814 [1,1,0,0,0,0|2,0,0]=4 3897 B8R0.15 COC(CCN)C(=O)O Amb32661022 [1,1,0,0,0,0|2,0,0]=4 3898 B8R0.15 COCC(CN)C(=O)O Amb27219429 [1,1,0,0,0,0|0,1,0]=3 3899 B8R0.15 COCC(NO)C(=O)O Amb27247213 [1,1,0,0,0,0|0,1,0]=3 3900 B8R0.15 COCC(OC)C(=O)O Amb26627988 [1,1,0,0,0,0|1,1,0]=4 3901 B8R0.15 COCC(ON)C(=O)O Amb27251693 [1,1,0,0,0,0|0,1,0]=3 3902 B8R0.15 COCC(ON)C(=O)O Amb32670944 [1,1,0,0,0,0|0,1,0]=3 3903 B8R0.15 COCC(SC)C(=O)O Amb28046503 [1,1,0,0,0,0|1,1,0]=4 3904 B8R0.15 CSCC(CN)C(=O)O Amb33272062 [1,1,0,0,0,0|0,0,0]=2 3905 B8R0.15 N#CC(CCF)C(=O)O Amb35741465 [1,1,0,0,0,0|1,0,1]=4 3906 B8R0.15 N#CC(CCO)C(=O)O Amb35741464 [1,1,0,0,0,0|0,1,1]=4 3907 B8R0.15 NCC(CCF)C(=O)O Amb33196465 [1,1,0,0,0,0|1,0,0]=3 3908 B8R0.15 O=C(O)C(CO)CCF Amb27876842 [1,1,0,0,0,0|2,0,0]=4 3909 B8R0.15 O=C(O)C(CS)CCS Amb27477377 [1,1,0,0,0,0|1,0,0]=3 3910 B8R0.23 C=C(Br)CC(N)C(=O)O Amb24557771 [1,1,0,0,0,0|0,0,2]=4 3911 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O Amb22746251 [1,1,0,0,0,0|0,0,2]=4 3912 B8R0.23 C=C(Br)C[C@H](N)C(=O)O Amb25918807 [1,1,0,0,0,0|0,0,2]=4 3913 B8R0.23 C=C(C)CC(C)C(=O)O Amb24471924 [1,1,0,0,0,0|1,0,1]=4 3914 B8R0.23 C=C(C)CC(N)C(=O)O Amb6280366 [1,1,0,0,0,0|0,0,1]=3 3915 B8R0.23 C=C(C)CC(N)C(N)=O Amb26326676 [1,1,0,0,0,0|1,0,1]=4 3916 B8R0.23 C=C(C)CC(O)C(=O)O Amb24534477 [1,1,0,0,0,0|1,0,1]=4 3917 B8R0.23 C=C(C)C[C@@H](C)C(=O)O Amb24340253 [1,1,0,0,0,0|1,0,1]=4 3918 B8R0.23 C=C(C)C[C@@H](N)C(=O)O Amb22801689 [1,1,0,0,0,0|0,0,1]=3 3919 B8R0.23 C=C(C)C[C@H](C)C(=O)O Amb10843988 [1,1,0,0,0,0|1,0,1]=4 3920 B8R0.23 C=C(C)C[C@H](N)C(=O)O Amb25757900 [1,1,0,0,0,0|0,0,1]=3 3921 B8R0.23 C=C(CC(C)C)C(=O)O Amb33542856 [1,1,0,0,0,0|1,0,1]=4 3922 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb24411473 [1,1,0,0,0,0|0,0,2]=4 3923 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb28935021 [1,1,0,0,0,0|0,0,2]=4 3924 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660529 [1,1,0,0,0,0|0,0,2]=4 3925 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660530 [1,1,0,0,0,0|0,0,2]=4 3926 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb28059492 [1,1,0,0,0,0|0,0,2]=4 3927 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb32656263 [1,1,0,0,0,0|0,0,2]=4 3928 B8R0.23 C=C(F)C[C@@H](N)C(=O)O Amb27771842 [1,1,0,0,0,0|0,0,2]=4 3929 B8R0.23 CC(=O)C(C)CC(C)C Amb24640121 [1,1,0,0,0,0|2,0,0]=4 3930 B8R0.23 CC(=O)C(Cl)CC(C)O Amb27454439 [1,1,0,0,0,0|2,0,0]=4 3931 B8R0.23 CC(=O)C(O)CC(C)C Amb26845888 [1,1,0,0,0,0|2,0,0]=4 3932 B8R0.23 CC(=O)CC(C)C(=O)O Amb3939893 [1,1,0,0,0,0|1,0,1]=4 3933 B8R0.23 CC(=O)CC(N)C(=O)O Amb18832532 [1,1,0,0,0,0|0,0,1]=3 3934 B8R0.23 CC(=O)CC(N)C(=O)O Amb22546289 [1,1,0,0,0,0|0,0,1]=3 3935 B8R0.23 CC(=O)CC(N)C(N)=O Amb27485103 [1,1,0,0,0,0|1,0,1]=4 3936 B8R0.23 CC(=O)CC(O)C(=O)O Amb22500917 [1,1,0,0,0,0|1,0,1]=4 3937 B8R0.23 CC(=O)C[C@@H](N)C(=O)O Amb22745939 [1,1,0,0,0,0|0,0,1]=3 3938 B8R0.23 CC(=O)C[C@@H](O)C(=O)O Amb26845481 [1,1,0,0,0,0|1,0,1]=4 3939 B8R0.23 CC(=O)C[C@H](C)C(=O)O Amb26318005 [1,1,0,0,0,0|1,0,1]=4 3940 B8R0.23 CC(=O)C[C@H](N)C(=O)O Amb27832342 [1,1,0,0,0,0|0,0,1]=3 3941 B8R0.23 CC(=O)C[C@H](O)C(=O)O Amb24358758 [1,1,0,0,0,0|1,0,1]=4 3942 B8R0.23 CC(=O)[C@@H](N)CC(C)C Amb28344512 [1,1,0,0,0,0|1,0,0]=3 3943 B8R0.23 CC(=O)[C@@H](O)CC(C)C Amb28202353 [1,1,0,0,0,0|2,0,0]=4 3944 B8R0.23 CC(=O)[C@H](N)CC(C)C Amb27490707 [1,1,0,0,0,0|1,0,0]=3 3945 B8R0.23 CC(Br)CC(=O)C(=O)O Amb28146183 [1,1,0,0,0,0|1,0,1]=4 3946 B8R0.23 CC(Br)CC(C)C(=O)O Amb27760411 [1,1,0,0,0,0|1,0,0]=3 3947 B8R0.23 CC(C)CC(=N)C(=O)O Amb27268516 [1,1,0,0,0,0|0,0,2]=4 3948 B8R0.23 CC(C)CC(=O)C(=O)O Amb8387123 [1,1,0,0,0,0|1,0,1]=4 3949 B8R0.23 CC(C)CC(Br)C(=O)Cl Amb26515942 [1,1,0,0,0,0|2,0,0]=4 3950 B8R0.23 CC(C)CC(Br)C(=O)O Amb16233356 [1,1,0,0,0,0|1,0,0]=3 3951 B8R0.23 CC(C)CC(C)C(=O)O Amb18975244 [1,1,0,0,0,0|1,0,0]=3 3952 B8R0.23 CC(C)CC(Cl)C(=O)Cl Amb27400431 [1,1,0,0,0,0|2,0,0]=4 3953 B8R0.23 CC(C)CC(Cl)C(=O)O Amb17593753 [1,1,0,0,0,0|1,0,0]=3 3954 B8R0.23 CC(C)CC(F)C(=O)O Amb24565634 [1,1,0,0,0,0|1,0,0]=3 3955 B8R0.23 CC(C)CC(N)C(=O)O Amb9703094 [1,1,0,0,0,0|0,0,0]=2 3956 B8R0.23 CC(C)CC(N)C(C)O Amb18642850 [1,1,0,0,0,0|1,0,1]=4 3957 B8R0.23 CC(C)CC(N)C(N)=O Amb6334827 [1,1,0,0,0,0|1,0,0]=3 3958 B8R0.23 CC(C)CC(N)C(N)=O Amb9729639 [1,1,0,0,0,0|1,0,0]=3 3959 B8R0.23 CC(C)CC(N)C(N)=S Amb28292675 [1,1,0,0,0,0|1,1,0]=4 3960 B8R0.23 CC(C)CC(N)C(O)O Amb27970496 [1,1,0,0,0,0|0,0,2]=4 3961 B8R0.23 CC(C)CC(N)P(O)O Amb27231724 [1,1,0,0,0,0|1,0,1]=4 3962 B8R0.23 CC(C)CC(N)[PH](=O)O Amb27831348 [1,1,0,0,0,0|1,0,0]=3 3963 B8R0.23 CC(C)CC(O)C(=O)O Amb2694726 [1,1,0,0,0,0|1,0,0]=3 3964 B8R0.23 CC(C)CC(O)C(=O)[O-] Amb33872314 [1,1,0,0,0,0|1,0,1]=4 3965 B8R0.23 CC(C)CC(O)[PH](=O)O Amb27255267 [1,1,0,0,0,0|2,0,0]=4 3966 B8R0.23 CC(C)CC(S)C(=O)O Amb18296292 [1,1,0,0,0,0|1,0,0]=3 3967 B8R0.23 CC(C)CN(N)C(N)=O Amb27624191 [1,1,0,0,0,0|2,0,0]=4 3968 B8R0.23 CC(C)C[C@@H](C)C(=O)O Amb10844070 [1,1,0,0,0,0|1,0,0]=3 3969 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O Amb22800398 [1,1,0,0,0,0|1,0,0]=3 3970 B8R0.23 CC(C)C[C@@H](F)C(=O)O Amb24616998 [1,1,0,0,0,0|1,0,0]=3 3971 B8R0.23 CC(C)C[C@@H](N)B(O)O Amb27978098 [1,1,0,0,0,0|1,0,1]=4 3972 B8R0.23 CC(C)C[C@@H](N)C(=O)O Amb2720579 [1,1,0,0,0,0|0,0,0]=2 3973 B8R0.23 CC(C)C[C@@H](N)C(C)O Amb28201191 [1,1,0,0,0,0|1,0,1]=4 3974 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb16183944 [1,1,0,0,0,0|1,0,0]=3 3975 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [1,1,0,0,0,0|1,0,0]=3 3976 B8R0.23 CC(C)C[C@@H](N)C(N)=S Amb27450783 [1,1,0,0,0,0|1,1,0]=4 3977 B8R0.23 CC(C)C[C@@H](N)[C@@H](C)O Amb27593782 [1,1,0,0,0,0|1,0,1]=4 3978 B8R0.23 CC(C)C[C@@H](O)C(=O)O Amb8630052 [1,1,0,0,0,0|1,0,0]=3 3979 B8R0.23 CC(C)C[C@@H](S)C(=O)O Amb27786874 [1,1,0,0,0,0|1,0,0]=3 3980 B8R0.23 CC(C)C[C@H](Br)C(=O)O Amb22226489 [1,1,0,0,0,0|1,0,0]=3 3981 B8R0.23 CC(C)C[C@H](Br)C(N)=O Amb28197754 [1,1,0,0,0,0|2,0,0]=4 3982 B8R0.23 CC(C)C[C@H](C)C(=O)O Amb10844071 [1,1,0,0,0,0|1,0,0]=3 3983 B8R0.23 CC(C)C[C@H](Cl)C(=O)Cl Amb27657532 [1,1,0,0,0,0|2,0,0]=4 3984 B8R0.23 CC(C)C[C@H](Cl)C(=O)O Amb22388637 [1,1,0,0,0,0|1,0,0]=3 3985 B8R0.23 CC(C)C[C@H](F)C(=O)O Amb10841083 [1,1,0,0,0,0|1,0,0]=3 3986 B8R0.23 CC(C)C[C@H](N)B(O)O Amb24578467 [1,1,0,0,0,0|1,0,1]=4 3987 B8R0.23 CC(C)C[C@H](N)C(=O)O Amb3499446 [1,1,0,0,0,0|0,0,0]=2 3988 B8R0.23 CC(C)C[C@H](N)C(=O)S Amb27810129 [1,1,0,0,0,0|0,1,0]=3 3989 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb10670112 [1,1,0,0,0,0|1,0,0]=3 3990 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb8515324 [1,1,0,0,0,0|1,0,0]=3 3991 B8R0.23 CC(C)C[C@H](N)C(N)=S Amb28285298 [1,1,0,0,0,0|1,1,0]=4 3992 B8R0.23 CC(C)C[C@H](O)C(=O)O Amb16232074 [1,1,0,0,0,0|1,0,0]=3 3993 B8R0.23 CC(C)NC(C)C(=O)O Amb10199874 [1,1,0,0,0,0|2,0,0]=4 3994 B8R0.23 CC(C)NC(C)C(=O)O Amb1110769 [1,1,0,0,0,0|2,0,0]=4 3995 B8R0.23 CC(C)N[C@H](C)C(=O)O Amb26409390 [1,1,0,0,0,0|2,0,0]=4 3996 B8R0.23 CC(C)OC(C)C(=O)O Amb10607866 [1,1,0,0,0,0|2,0,0]=4 3997 B8R0.23 CC(C)OC(F)C(=O)O Amb28045324 [1,1,0,0,0,0|2,0,0]=4 3998 B8R0.23 CC(C)SC(C)C(=O)O Amb6263656 [1,1,0,0,0,0|2,0,0]=4 3999 B8R0.23 CC(C)S[C@H](C)C(=O)O Amb27771567 [1,1,0,0,0,0|2,0,0]=4 4000 B8R0.23 CC(CC(F)F)C(=O)O Amb22896466 [1,1,0,0,0,0|2,0,0]=4 4001 B8R0.23 CC(CN(C)C)C(=O)O Amb8428203 [1,1,0,0,0,0|2,0,0]=4 4002 B8R0.23 CC(CN(C)C)C(=O)O Amb9173365 [1,1,0,0,0,0|2,0,0]=4 4003 B8R0.23 CC(CN(C)N)C(=O)O Amb28145156 [1,1,0,0,0,0|2,0,0]=4 4004 B8R0.23 CC(CS(C)=O)C(=O)O Amb18974546 [1,1,0,0,0,0|1,0,1]=4 4005 B8R0.23 CC(Cl)CC(N)C(=O)O Amb28325413 [1,1,0,0,0,0|0,0,0]=2 4006 B8R0.23 CC(N)CC(N)C(=O)O Amb28144636 [1,1,0,0,0,0|0,0,0]=2 4007 B8R0.23 CC(N)CC(O)C(=O)O Amb27975686 [1,1,0,0,0,0|1,0,0]=3 4008 B8R0.23 CC(O)CC(=O)C(=O)O Amb25789747 [1,1,0,0,0,0|1,0,1]=4 4009 B8R0.23 CC(O)CC(N)C(=O)O Amb18642918 [1,1,0,0,0,0|0,0,0]=2 4010 B8R0.23 CC(O)CC(N)C(N)=O Amb33065888 [1,1,0,0,0,0|1,0,0]=3 4011 B8R0.23 CC(O)C[C@@H](N)C(=O)O Amb26985188 [1,1,0,0,0,0|0,0,0]=2 4012 B8R0.23 CC(O)C[C@H](N)C(=O)O Amb27185464 [1,1,0,0,0,0|0,0,0]=2 4013 B8R0.23 CN(C)CC(N)C(=O)O Amb23558085 [1,1,0,0,0,0|1,0,0]=3 4014 B8R0.23 CN(C)CC(N)C(=O)O Amb32644516 [1,1,0,0,0,0|1,0,0]=3 4015 B8R0.23 CN(C)CC(N)C(=O)O Amb33756799 [1,1,0,0,0,0|1,0,0]=3 4016 B8R0.23 CN(C)CC(N)C(N)=O Amb18984335 [1,1,0,0,0,0|2,0,0]=4 4017 B8R0.23 CN(C)CC(O)C(=O)O Amb27856754 [1,1,0,0,0,0|2,0,0]=4 4018 B8R0.23 CN(C)C[C@@H](N)C(=O)O Amb19889770 [1,1,0,0,0,0|1,0,0]=3 4019 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb24078627 [1,1,0,0,0,0|1,0,0]=3 4020 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb8515079 [1,1,0,0,0,0|1,0,0]=3 4021 B8R0.23 CN(C)C[C@H](O)C(=O)O Amb24372674 [1,1,0,0,0,0|2,0,0]=4 4022 B8R0.23 CS(=N)C[C@H](N)C(=O)O Amb27838573 [1,1,0,0,0,0|0,0,1]=3 4023 B8R0.23 CS(=O)CC(N)C(=O)O Amb18125279 [1,1,0,0,0,0|0,0,1]=3 4024 B8R0.23 CS(=O)CC(N)C(N)=O Amb27608115 [1,1,0,0,0,0|1,0,1]=4 4025 B8R0.23 CS(=O)C[C@@H](N)C(=O)O Amb22745418 [1,1,0,0,0,0|0,0,1]=3 4026 B8R0.23 CS(=O)C[C@H](N)C(=O)O Amb16232229 [1,1,0,0,0,0|0,0,1]=3 4027 B8R0.23 C[C@@H](CC(F)F)C(=O)O Amb33749533 [1,1,0,0,0,0|2,0,0]=4 4028 B8R0.23 C[C@@H](Cl)C[C@H](N)C(=O)O Amb27863035 [1,1,0,0,0,0|0,0,0]=2 4029 B8R0.23 C[C@@H](O)C[C@@H](N)C(=O)O Amb27254158 [1,1,0,0,0,0|0,0,0]=2 4030 B8R0.23 C[C@H](CC(F)F)C(=O)O Amb33727762 [1,1,0,0,0,0|2,0,0]=4 4031 B8R0.23 C[C@H](N)C[C@@H](O)C(=O)O Amb27231129 [1,1,0,0,0,0|1,0,0]=3 4032 B8R0.23 C[C@H](N)C[C@H](N)C(=O)O Amb27815088 [1,1,0,0,0,0|0,0,0]=2 4033 B8R0.23 C[C@H](N)C[C@H](O)C(=O)O Amb27180466 [1,1,0,0,0,0|1,0,0]=3 4034 B8R0.23 C[S@@](=O)C[C@H](N)C(=O)O Amb35789128 [1,1,0,0,0,0|0,0,1]=3 4035 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb33756818 [1,1,0,0,0,0|0,0,1]=3 4036 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb35788678 [1,1,0,0,0,0|0,0,1]=3 4037 B8R0.23 NC(=O)C(N)CC(F)F Amb27409676 [1,1,0,0,0,0|2,0,0]=4 4038 B8R0.23 NC(=O)CC(N)C(=O)O Amb2725509 [1,1,0,0,0,0|0,1,1]=4 4039 B8R0.23 NC(=O)CC(N)C(=O)O Amb3940878 [1,1,0,0,0,0|0,1,1]=4 4040 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb10071271 [1,1,0,0,0,0|0,1,1]=4 4041 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb17749060 [1,1,0,0,0,0|0,1,1]=4 4042 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb3940760 [1,1,0,0,0,0|0,1,1]=4 4043 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb8513755 [1,1,0,0,0,0|0,1,1]=4 4044 B8R0.23 NC(=O)[C@H](N)CC(F)F Amb27163215 [1,1,0,0,0,0|2,0,0]=4 4045 B8R0.23 NC(=S)C[C@H](N)C(=O)O Amb28410343 [1,1,0,0,0,0|0,0,2]=4 4046 B8R0.23 NC(CB(O)O)C(=O)O Amb28285179 [1,1,0,0,0,0|1,1,0]=4 4047 B8R0.23 NC(CB(O)O)C(=O)O Amb33803309 [1,1,0,0,0,0|1,1,0]=4 4048 B8R0.23 NC(CC(=O)O)C(=O)O Amb9702780 [1,1,0,0,0,0|0,1,1]=4 4049 B8R0.23 NC(CC(Cl)Cl)C(=O)O Amb27791749 [1,1,0,0,0,0|1,0,0]=3 4050 B8R0.23 NC(CC(F)F)C(=O)O Amb13952714 [1,1,0,0,0,0|1,0,0]=3 4051 B8R0.23 NC(CC(F)F)C(=O)O Amb33546007 [1,1,0,0,0,0|1,0,0]=3 4052 B8R0.23 NC(CS(=O)O)C(=O)O Amb541272 [1,1,0,0,0,0|1,0,1]=4 4053 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb34163080 [1,1,0,0,0,0|0,1,1]=4 4054 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb3940320 [1,1,0,0,0,0|0,1,1]=4 4055 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb20240565 [1,1,0,0,0,0|0,1,1]=4 4056 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb22748769 [1,1,0,0,0,0|0,1,1]=4 4057 B8R0.23 N[C@@H](CC(F)F)C(=O)O Amb26944439 [1,1,0,0,0,0|1,0,0]=3 4058 B8R0.23 N[C@@H](CC(F)F)C(=O)O Amb33482837 [1,1,0,0,0,0|1,0,0]=3 4059 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb6600148 [1,1,0,0,0,0|1,0,1]=4 4060 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb9809803 [1,1,0,0,0,0|1,0,1]=4 4061 B8R0.23 N[C@@H](C[SH](=O)=O)C(=O)O Amb27858626 [1,1,0,0,0,0|1,0,1]=4 4062 B8R0.23 N[C@H](CC(=O)O)C(=O)O Amb6599992 [1,1,0,0,0,0|0,1,1]=4 4063 B8R0.23 N[C@H](CC(F)F)C(=O)O Amb25117310 [1,1,0,0,0,0|1,0,0]=3 4064 B8R0.23 N[C@H](CC(F)F)C(=O)O Amb33743521 [1,1,0,0,0,0|1,0,0]=3 4065 B8R0.23 O=C(O)C(O)CC(F)F Amb25274709 [1,1,0,0,0,0|2,0,0]=4 4066 B8R0.23 O=C(O)C(O)CC(O)O Amb28397948 [1,1,0,0,0,0|1,1,0]=4 4067 B8R0.23 O=C(O)[C@H](Cl)CC(Cl)Cl Amb27831354 [1,1,0,0,0,0|2,0,0]=4 4068 B10R0.6 CC#CCCC(O)CC(=O)O Amb27990189 [0,1,0,0,0,1|2,0,0]=4 4069 B10R0.6 CCCCCC(C)CC(=O)O Amb19375410 [0,1,0,0,0,1|2,0,0]=4 4070 B10R0.6 CCCCCC(N)CC(=O)O Amb21857987 [0,1,0,0,0,1|1,0,0]=3 4071 B10R0.6 CCCCCC(N)CC(=O)O Amb31307614 [0,1,0,0,0,1|1,0,0]=3 4072 B10R0.6 CCCCCC(N)CC(N)=O Amb33255748 [0,1,0,0,0,1|2,0,0]=4 4073 B10R0.6 CCCCCC(O)CC(=O)O Amb18797787 [0,1,0,0,0,1|2,0,0]=4 4074 B10R0.6 CCCCC[C@@H](O)CC(=O)O Amb31308365 [0,1,0,0,0,1|2,0,0]=4 4075 B10R0.6 CCCCC[C@H](O)CC(=O)O Amb33872470 [0,1,0,0,0,1|2,0,0]=4 4076 B10R0.6 CCCSCC(N)CC(=O)O Amb32687888 [0,1,0,0,0,1|1,0,0]=3 4077 B10R0.6 CCC\C=C\C(N)CC(=O)O Amb33429157 [0,1,0,0,0,1|1,0,1]=4 4078 B10R0.6 CCSCCC(N)CC(=O)O Amb33254745 [0,1,0,0,0,1|0,0,0]=2 4079 B10R0.6 CCSCCC(N)CC(N)=O Amb33308127 [0,1,0,0,0,1|1,0,0]=3 4080 B10R0.6 CSCCCC(N)CC(=O)O Amb33308380 [0,1,0,0,0,1|0,0,0]=2 4081 B10R0.6 CSCCCC(N)CC(N)=O Amb32787351 [0,1,0,0,0,1|1,0,0]=3 4082 B10R0.6 NCCCC[C@@H](N)CC(=O)O Amb22746256 [0,1,0,0,0,1|1,0,0]=3 4083 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb16184018 [0,1,0,0,0,1|1,0,0]=3 4084 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb22369388 [0,1,0,0,0,1|1,0,0]=3 4085 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb33929234 [0,1,0,0,0,1|1,0,0]=3 4086 B10R0.6 NCCCC[C@H](N)CC(N)=O Amb32650909 [0,1,0,0,0,1|2,0,0]=4 4087 B10R0.18 C#CC(=O)NC(C)CCSC Amb27271824 [0,1,0,0,0,1|2,0,0]=4 4088 B10R0.18 CCCCC(N)CC(=O)OC Amb33254235 [0,1,0,0,0,1|1,0,0]=3 4089 B10R0.18 CCCCC(O)CC(=O)OC Amb33171767 [0,1,0,0,0,1|2,0,0]=4 4090 B10R0.18 CCCC[C@@H](N)CC(=O)OC Amb33804734 [0,1,0,0,0,1|1,0,0]=3 4091 B10R0.18 CCCC[C@@H](O)CC(=O)OC Amb31308361 [0,1,0,0,0,1|2,0,0]=4 4092 B10R0.18 CCCC[C@H](N)CC(=O)OC Amb33803082 [0,1,0,0,0,1|1,0,0]=3 4093 B10R0.18 CCCC[C@H](O)CC(=O)OC Amb33449561 [0,1,0,0,0,1|2,0,0]=4 4094 B10R0.18 CNC(=O)NC(C)CCSC Amb28387540 [0,1,0,0,0,1|2,0,0]=4 4095 B10R0.18 COC(=O)CC(=O)CCSC Amb32954555 [0,1,0,0,0,1|1,0,1]=4 4096 B10R0.18 COC(=O)CC(N)CCSC Amb33254438 [0,1,0,0,0,1|0,0,0]=2 4097 B10R0.18 COC(=O)CC(O)CCSC Amb33448861 [0,1,0,0,0,1|1,0,0]=3 4098 B10R0.18 COC(=O)C[C@@H](N)CCSC Amb33803194 [0,1,0,0,0,1|0,0,0]=2 4099 B10R0.18 COC(=O)C[C@@H](O)CCSC Amb33198532 [0,1,0,0,0,1|1,0,0]=3 4100 B10R0.18 COC(=O)C[C@H](O)CCSC Amb33198531 [0,1,0,0,0,1|1,0,0]=3 4101 B10R0.18 COCCC(O)CC(=O)OC Amb33474750 [0,1,0,0,0,1|1,1,0]=4 4102 B10R0.18 COCC[C@@H](O)CC(=O)OC Amb33224045 [0,1,0,0,0,1|1,1,0]=4 4103 B10R0.18 COCC[C@H](O)CC(=O)OC Amb33377479 [0,1,0,0,0,1|1,1,0]=4 4104 B10R0.18 CSCCC(C)NC(=O)NN Amb27986356 [0,1,0,0,0,1|2,0,0]=4 4105 B10R0.32 CCCC(C)C(C)CC(=O)O Amb33473817 [0,1,0,0,0,1|2,0,0]=4 4106 B10R0.32 CCCC(C)C(N)CC(=O)O Amb2423447 [0,1,0,0,0,1|1,0,0]=3 4107 B10R0.32 CCCC(C)C(N)CC(N)=O Amb33253971 [0,1,0,0,0,1|2,0,0]=4 4108 B10R0.32 CCCC(C)C(O)CC(=O)O Amb18797789 [0,1,0,0,0,1|2,0,0]=4 4109 B10R0.32 CCCC(C)[C@@H](O)CC(=O)O Amb33319032 [0,1,0,0,0,1|2,0,0]=4 4110 B10R0.32 CCCC(C)[C@H](O)CC(=O)O Amb33318872 [0,1,0,0,0,1|2,0,0]=4 4111 B10R0.32 CCOC(C)C(N)CC(=O)O Amb33425727 [0,1,0,0,0,1|2,0,0]=4 4112 B10R0.32 COCC(C)C(N)CC(=O)O Amb33255879 [0,1,0,0,0,1|0,1,0]=3 4113 B10R0.32 COCC(C)C(N)CC(N)=O Amb33308179 [0,1,0,0,0,1|1,1,0]=4 4114 B10R0.32 COCC(C)[C@@H](N)CC(=O)O Amb33254476 [0,1,0,0,0,1|0,1,0]=3 4115 B10R0.32 COCC(C)[C@@H](N)CC(N)=O Amb33308198 [0,1,0,0,0,1|1,1,0]=4 4116 B10R0.32 COCC(C)[C@H](N)CC(=O)O Amb33255361 [0,1,0,0,0,1|0,1,0]=3 4117 B10R0.32 COCC(C)[C@H](N)CC(N)=O Amb33255734 [0,1,0,0,0,1|1,1,0]=4 4118 B10R0.32 CSCC(C)C(N)C=C(C)C Amb27818566 [0,1,0,0,0,1|2,0,0]=4 4119 B10R0.44 CCC(C)CC(N)CC(N)=O Amb33255690 [0,1,0,0,0,1|2,0,0]=4 4120 B10R0.44 CCC(C)CC(O)CC(=O)O Amb33036189 [0,1,0,0,0,1|2,0,0]=4 4121 B10R0.44 CCC(N)CC(C)CC(=O)O Amb32669801 [0,1,0,0,0,1|2,0,0]=4 4122 B10R0.44 COC(=O)C[C@@H](N)CC(=O)O Amb33621255 [0,1,0,0,0,1|0,1,1]=4 4123 B10R0.44 COC(=O)C[C@@H](N)CC(=O)O Amb33747103 [0,1,0,0,0,1|0,1,1]=4 4124 B10R0.81 CCCCC(N)C(C)C(=O)O Amb33036302 [0,1,0,0,0,1|1,0,0]=3 4125 B10R0.81 CCCCC(N)C(O)C(=O)O Amb28652900 [0,1,0,0,0,1|1,0,0]=3 4126 B10R0.81 CCCCC(O)C(C)C(=O)O Amb18182520 [0,1,0,0,0,1|2,0,0]=4 4127 B10R0.81 CCCCC(O)C(N)C(=O)O Amb33358191 [0,1,0,0,0,1|2,0,0]=4 4128 B10R0.81 COCCC(C)C(N)C(=O)O Amb33066103 [0,1,0,0,0,1|1,1,0]=4 4129 B10R0.81 COCCC(C)[C@@H](N)C(=O)O Amb33309204 [0,1,0,0,0,1|1,1,0]=4 4130 B10R0.81 COCCC(C)[C@H](N)C(=O)O Amb33308617 [0,1,0,0,0,1|1,1,0]=4 4131 B10R0.81 COCCC(O)C(N)C(=O)O Amb33377811 [0,1,0,0,0,1|1,1,0]=4 4132 B10R0.81 CSCCC(O)C(N)C(=O)O Amb33358674 [0,1,0,0,0,1|1,0,0]=3 4133 B10R0.87 CCCCC(CC)CC(=O)O Amb18797358 [0,1,0,0,0,1|2,0,0]=4 4134 B10R0.87 CCCCC(CN)CC(=O)O Amb33171809 [0,1,0,0,0,1|1,0,0]=3 4135 B10R0.87 CCSCC(CN)CC(=O)O Amb33224190 [0,1,0,0,0,1|2,0,0]=4 4136 B10R0.87 COCCC(CN)CC(=O)O Amb33377833 [0,1,0,0,0,1|0,1,0]=3 4137 B10R0.87 CSCCC(CN)CC(=O)O Amb33199122 [0,1,0,0,0,1|0,0,0]=2 4138 B10R0.96 CC(=O)CCC(C)CC(=O)O Amb32668383 [0,1,0,0,0,1|2,0,0]=4 4139 B10R0.96 CC(C)CCC(C)CC(=O)O Amb6749235 [0,1,0,0,0,1|2,0,0]=4 4140 B10R0.96 CC(C)CCC(N)CC(=O)O Amb18830323 [0,1,0,0,0,1|1,0,0]=3 4141 B10R0.96 CC(C)CCC(N)CC(N)=O Amb33253974 [0,1,0,0,0,1|2,0,0]=4 4142 B10R0.96 CC(C)OCC(N)CC(=O)O Amb33447444 [0,1,0,0,0,1|2,0,0]=4 4143 B10R0.96 CC(CCN(C)C)CC(=O)O Amb33473550 [0,1,0,0,0,1|2,0,0]=4 4144 B10R0.96 CN(C)CCC(N)CC(=O)O Amb33273734 [0,1,0,0,0,1|1,0,0]=3 4145 B10R0.96 CN(C)CCC(O)CC(=O)O Amb33272268 [0,1,0,0,0,1|2,0,0]=4 4146 B10R0.96 CN(C)CC[C@@H](O)CC(=O)O Amb33272267 [0,1,0,0,0,1|2,0,0]=4 4147 B10R0.96 CN(C)CC[C@H](O)CC(=O)O Amb33272266 [0,1,0,0,0,1|2,0,0]=4 4148 B10R0.96 NC(=O)CC[C@@H](N)CC(=O)O Amb22746285 [0,1,0,0,0,1|2,0,0]=4 4149 B10R0.96 NC(=O)CC[C@H](N)CC(=O)O Amb22348459 [0,1,0,0,0,1|2,0,0]=4 4150 B10R0.96 NC(CCC(=O)O)CC(=O)O Amb8631356 [0,1,0,0,0,1|2,0,0]=4 4151 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O Amb16232070 [0,1,0,0,0,1|2,0,0]=4 4152 B10R0.96 N[C@H](CCC(=O)O)CC(=O)O Amb22750585 [0,1,0,0,0,1|2,0,0]=4 4153 B10R0.122 CCCCC(C)(N)CC(=O)O Amb33254302 [0,1,0,0,0,1|1,0,0]=3 4154 B10R0.122 CCCCC(C)(N)CC(N)=O Amb33255922 [0,1,0,0,0,1|2,0,0]=4 4155 B10R0.122 CCCCC(C)(O)CC(=O)O Amb33036225 [0,1,0,0,0,1|2,0,0]=4 4156 B10R0.122 CCOCC(C)(N)CC(=O)O Amb33254607 [0,1,0,0,0,1|2,0,0]=4 4157 B10R0.122 CCSCC(C)(N)CC(=O)O Amb33254871 [0,1,0,0,0,1|2,0,0]=4 4158 B10R0.122 COCCC(C)(C)CC(=O)O Amb32990133 [0,1,0,0,0,1|1,1,0]=4 4159 B10R0.122 COCCC(C)(N)CC(=O)O Amb33254523 [0,1,0,0,0,1|0,1,0]=3 4160 B10R0.122 COCCC(C)(N)CC(N)=O Amb32787600 [0,1,0,0,0,1|1,1,0]=4 4161 B10R0.122 CSCCC(C)(C)CC(=O)O Amb32954253 [0,1,0,0,0,1|1,0,0]=3 4162 B10R0.5 CCCCCC(N)P(=O)(O)O Amb8516013 [0,2,0,0,0,0|2,0,0]=4 4163 B10R0.52 CCC(C)CC(N)S(=O)(=O)O Amb27989982 [0,2,0,0,0,0|2,0,0]=4 4164 B10R0.13 CC(=O)CC(C)C(C)C(=O)O Amb18126130 [0,2,0,0,0,0|2,0,0]=4 4165 B10R0.13 CC(=O)OC(C)C(N)C(=O)O Amb25385009 [0,2,0,0,0,0|2,0,0]=4 4166 B10R0.13 CC(=O)O[C@@H](C)[C@@H](N)C(=O)O Amb22747815 [0,2,0,0,0,0|2,0,0]=4 4167 B10R0.13 CC(=O)O[C@H](C)[C@H](N)C(=O)O Amb27272567 [0,2,0,0,0,0|2,0,0]=4 4168 B10R0.13 CC(C)CC(C)C(C)C(=O)O Amb26998835 [0,2,0,0,0,0|2,0,0]=4 4169 B10R0.13 CC(C)CC(C)C(N)C(=O)O Amb25384855 [0,2,0,0,0,0|1,0,0]=3 4170 B10R0.13 CC(C)CC(C)C(N)C(=O)O Amb33329315 [0,2,0,0,0,0|1,0,0]=3 4171 B10R0.13 CC(C)CC(C)C(N)C(N)=O Amb24750735 [0,2,0,0,0,0|2,0,0]=4 4172 B10R0.13 CC(C)CC(C)C(O)C(=O)O Amb27492041 [0,2,0,0,0,0|2,0,0]=4 4173 B10R0.13 CC(C)CC(C)[C@@H](C)C(=O)O Amb33727253 [0,2,0,0,0,0|2,0,0]=4 4174 B10R0.13 CC(C)CC(C)[C@@H](N)C(=O)O Amb27671005 [0,2,0,0,0,0|1,0,0]=3 4175 B10R0.13 CC(C)CC(C)[C@H](C)C(=O)O Amb33744624 [0,2,0,0,0,0|2,0,0]=4 4176 B10R0.13 CC(C)CC(C)[C@H](N)C(=O)O Amb27671004 [0,2,0,0,0,0|1,0,0]=3 4177 B10R0.13 CC(C)CC(N)C(C)C(=O)O Amb26082832 [0,2,0,0,0,0|2,0,0]=4 4178 B10R0.13 CC(C)CC(N)C(F)C(=O)O Amb26083817 [0,2,0,0,0,0|2,0,0]=4 4179 B10R0.13 CC(C)CC(O)C(C)C(=O)O Amb18310730 [0,2,0,0,0,0|2,0,0]=4 4180 B10R0.13 CC(C)CC(O)C(F)C(=O)O Amb33036201 [0,2,0,0,0,0|2,0,0]=4 4181 B10R0.13 CC(C)CC(O)C(N)C(=O)O Amb26992515 [0,2,0,0,0,0|1,0,0]=3 4182 B10R0.13 CC(C)CC(O)C(O)C(=O)O Amb27990260 [0,2,0,0,0,0|2,0,0]=4 4183 B10R0.13 CC(C)C[C@@H](N)[C@H](O)C(=O)O Amb27269202 [0,2,0,0,0,0|2,0,0]=4 4184 B10R0.13 CC(C)C[C@@H](O)[C@@H](N)C(=O)O Amb27990182 [0,2,0,0,0,0|1,0,0]=3 4185 B10R0.13 CC(C)C[C@@H](O)[C@H](N)C(=O)O Amb27990181 [0,2,0,0,0,0|1,0,0]=3 4186 B10R0.13 CC(C)C[C@H](N)C(O)C(=O)O Amb27269200 [0,2,0,0,0,0|2,0,0]=4 4187 B10R0.13 CC(C)C[C@H](N)[C@H](O)C(=O)O Amb27001572 [0,2,0,0,0,0|2,0,0]=4 4188 B10R0.13 CC(C)C[C@H](O)[C@H](N)C(=O)O Amb27271131 [0,2,0,0,0,0|1,0,0]=3 4189 B10R0.13 CC(CC(=O)O)C(N)C(=O)O Amb23440872 [0,2,0,0,0,0|2,0,0]=4 4190 B10R0.13 CC(CC(=O)O)[C@H](N)C(=O)O Amb26990553 [0,2,0,0,0,0|2,0,0]=4 4191 B10R0.13 CC(CC(N)=O)C(N)C(=O)O Amb27989323 [0,2,0,0,0,0|2,0,0]=4 4192 B10R0.13 CC(CN(C)C)C(N)C(=O)O Amb33066048 [0,2,0,0,0,0|1,0,0]=3 4193 B10R0.13 CC(CN(C)C)C(N)C(N)=O Amb33069962 [0,2,0,0,0,0|2,0,0]=4 4194 B10R0.13 CC(CN(C)C)[C@@H](N)C(=O)O Amb33036586 [0,2,0,0,0,0|1,0,0]=3 4195 B10R0.13 CC(CN(C)C)[C@H](N)C(=O)O Amb33066275 [0,2,0,0,0,0|1,0,0]=3 4196 B10R0.13 C[C@@H](CC(=O)O)[C@@H](N)C(=O)O Amb19133152 [0,2,0,0,0,0|2,0,0]=4 4197 B10R0.13 C[C@@H](CC(=O)O)[C@H](N)C(=O)O Amb28388115 [0,2,0,0,0,0|2,0,0]=4 4198 B10R0.13 C[C@H](CC(=O)O)[C@@H](N)C(=O)O Amb28388114 [0,2,0,0,0,0|2,0,0]=4 4199 B10R0.13 NC(=O)C[C@@H](O)[C@@H](N)C(=O)O Amb27990186 [0,2,0,0,0,0|2,0,0]=4 4200 B10R0.13 NC(C(=O)O)C(O)CC(=O)O Amb25383245 [0,2,0,0,0,0|2,0,0]=4 4201 B10R0.13 NC(CC(=O)O)[C@H](N)C(=O)O Amb24764806 [0,2,0,0,0,0|2,0,0]=4 4202 B10R0.13 N[C@@H](C(=O)O)[C@@H](O)CC(=O)O Amb27990015 [0,2,0,0,0,0|2,0,0]=4 4203 B10R0.13 N[C@H](C(=O)O)C(F)CC(=O)O Amb26083316 [0,2,0,0,0,0|2,0,0]=4 4204 B10R0.25 CCC(CC#N)C(N)C(=O)O Amb33065493 [0,2,0,0,0,0|2,0,0]=4 4205 B10R0.25 CCC(CC#N)[C@@H](N)C(=O)O Amb32788605 [0,2,0,0,0,0|2,0,0]=4 4206 B10R0.25 CCC(CC#N)[C@H](N)C(=O)O Amb32937027 [0,2,0,0,0,0|2,0,0]=4 4207 B10R0.25 CCCC(CC)C(C)C(=O)O Amb33731304 [0,2,0,0,0,0|2,0,0]=4 4208 B10R0.25 CCCC(CC)[C@@H](C)C(=O)O Amb33743248 [0,2,0,0,0,0|2,0,0]=4 4209 B10R0.25 CCCC(CC)[C@H](C)C(=O)O Amb33744636 [0,2,0,0,0,0|2,0,0]=4 4210 B10R0.25 CCCC(CN)C(O)C(=O)O Amb32693187 [0,2,0,0,0,0|2,0,0]=4 4211 B10R0.35 C=CCC(C)C(N)C(=O)OC Amb33065697 [0,2,0,0,0,0|1,0,1]=4 4212 B10R0.35 CCCC(C)C(N)C(=O)OC Amb18787864 [0,2,0,0,0,0|1,0,0]=3 4213 B10R0.35 CCCC(C)C(N)C(=O)OC Amb32664970 [0,2,0,0,0,0|1,0,0]=3 4214 B10R0.35 CCCC(C)C(O)C(=O)OC Amb18800352 [0,2,0,0,0,0|2,0,0]=4 4215 B10R0.35 CCCC(N)C(C)C(=O)OC Amb33036375 [0,2,0,0,0,0|2,0,0]=4 4216 B10R0.35 CCCC(O)C(C)C(=O)OC Amb18182518 [0,2,0,0,0,0|2,0,0]=4 4217 B10R0.35 CCOC(C)C(N)C(=O)OC Amb33308906 [0,2,0,0,0,0|2,0,0]=4 4218 B10R0.35 CNC(=O)[C@@H](N)[C@@H](C)COC Amb27673424 [0,2,0,0,0,0|1,1,0]=4 4219 B10R0.35 CNC(=O)[C@@H](N)[C@H](C)COC Amb27673422 [0,2,0,0,0,0|1,1,0]=4 4220 B10R0.35 COC(=O)C(N)C(C)CC#N Amb33034710 [0,2,0,0,0,0|2,0,0]=4 4221 B10R0.35 COCC(C)C(N)C(=O)OC Amb33066322 [0,2,0,0,0,0|0,1,0]=3 4222 B10R0.36 CCCC(C)C(C)(C)C(=O)O Amb26084153 [0,2,0,0,0,0|2,0,0]=4 4223 B10R0.36 CCCC(C)C(F)(F)C(=O)O Amb27001229 [0,2,0,0,0,0|2,0,0]=4 4224 B10R0.36 CCCC(F)C(F)(F)C(=O)O Amb32946944 [0,2,0,0,0,0|2,0,0]=4 4225 B10R0.36 CCCC(N)C(C)(C)C(=O)O Amb26651463 [0,2,0,0,0,0|2,0,0]=4 4226 B10R0.36 CCCC(O)C(C)(C)C(=O)O Amb18310742 [0,2,0,0,0,0|2,0,0]=4 4227 B10R0.36 CCCC(O)C(F)(F)C(=O)O Amb18182664 [0,2,0,0,0,0|2,0,0]=4 4228 B10R0.36 COCC(C)C(C)(C)C(=O)O Amb27670924 [0,2,0,0,0,0|1,1,0]=4 4229 B10R0.36 COCC(N)C(C)(C)C(=O)O Amb26651459 [0,2,0,0,0,0|1,1,0]=4 4230 B10R0.36 COCC(O)C(C)(C)C(=O)O Amb33036275 [0,2,0,0,0,0|1,1,0]=4 4231 B10R0.56 CC(C(O)CO)C(N)C(=O)O Amb25385170 [0,2,0,0,0,0|2,0,0]=4 4232 B10R0.56 CCC(=O)[C@@H](C)[C@H](N)C(=O)O Amb27990250 [0,2,0,0,0,0|1,0,1]=4 4233 B10R0.56 CCC(=O)[C@H](C)[C@H](N)C(=O)O Amb27990251 [0,2,0,0,0,0|1,0,1]=4 4234 B10R0.56 CCC(C)C(C)C(N)C(=O)O Amb26999260 [0,2,0,0,0,0|1,0,0]=3 4235 B10R0.56 CCC(C)C(C)C(N)C(N)=O Amb26999259 [0,2,0,0,0,0|2,0,0]=4 4236 B10R0.56 CCC(C)C(C)C(O)C(=O)O Amb27492042 [0,2,0,0,0,0|2,0,0]=4 4237 B10R0.56 CCC(C)C(C)[C@@H](N)C(=O)O Amb27000221 [0,2,0,0,0,0|1,0,0]=3 4238 B10R0.56 CCC(C)C(C)[C@H](N)C(=O)O Amb27000219 [0,2,0,0,0,0|1,0,0]=3 4239 B10R0.56 CCC(C)C(N)C(C)C(=O)O Amb33036330 [0,2,0,0,0,0|2,0,0]=4 4240 B10R0.56 CCC(C)C(O)C(C)C(=O)O Amb18182521 [0,2,0,0,0,0|2,0,0]=4 4241 B10R0.56 CCC(C)C(O)C(N)C(=O)O Amb26992516 [0,2,0,0,0,0|1,0,0]=3 4242 B10R0.56 CC[C@@H](O)[C@@H](C)[C@H](N)C(=O)O Amb27990252 [0,2,0,0,0,0|1,0,0]=3 4243 B10R0.56 CC[C@@H](O)[C@H](C)[C@H](N)C(=O)O Amb27990254 [0,2,0,0,0,0|1,0,0]=3 4244 B10R0.56 CC[C@H](C)[C@@H](O)[C@@H](C)C(=O)O Amb27990010 [0,2,0,0,0,0|2,0,0]=4 4245 B10R0.56 CC[C@H](O)[C@@H](C)[C@H](N)C(=O)O Amb27990253 [0,2,0,0,0,0|1,0,0]=3 4246 B10R0.56 CC[C@H](O)[C@H](C)[C@H](N)C(=O)O Amb27990255 [0,2,0,0,0,0|1,0,0]=3 4247 B10R0.56 CNC(C)C(C)C(C)C(=O)O Amb27671603 [0,2,0,0,0,0|2,0,0]=4 4248 B10R0.56 COC(=O)C(F)C(N)C(=O)O Amb27671674 [0,2,0,0,0,0|0,1,1]=4 4249 B10R0.56 COC(=O)C(F)[C@H](N)C(=O)O Amb26083722 [0,2,0,0,0,0|0,1,1]=4 4250 B10R0.56 COC(=O)C(O)C(N)C(=O)O Amb18645752 [0,2,0,0,0,0|0,1,1]=4 4251 B10R0.56 COC(=O)[C@@H](O)[C@H](N)C(=O)O Amb27271132 [0,2,0,0,0,0|0,1,1]=4 4252 B10R0.56 COC(C)C(N)C(C)C(=O)O Amb33036377 [0,2,0,0,0,0|1,1,0]=4 4253 B10R0.56 COC(C)C(O)C(C)C(=O)O Amb25385684 [0,2,0,0,0,0|1,1,0]=4 4254 B10R0.56 NC(C(=O)O)C(O)C(O)CBr Amb28080388 [0,2,0,0,0,0|2,0,0]=4 4255 B10R0.101 CCCC(C)C(C#N)C(=O)O Amb27670726 [0,2,0,0,0,0|1,0,1]=4 4256 B10R0.101 CCCC(C)C(CC)C(=O)O Amb33079161 [0,2,0,0,0,0|2,0,0]=4 4257 B10R0.101 CCCC(C)C(CN)C(=O)O Amb31295625 [0,2,0,0,0,0|1,0,0]=3 4258 B10R0.101 CCOC(C)C(CN)C(=O)O Amb33425723 [0,2,0,0,0,0|2,0,0]=4 4259 B10R0.104 C=CCC(F)(F)C(N)C(=O)O Amb22547195 [0,2,0,0,0,0|1,0,1]=4 4260 B10R0.104 CC(C)(CCF)C(N)C(=O)O Amb33196448 [0,2,0,0,0,0|2,0,0]=4 4261 B10R0.104 CCCC(C)(C)C(N)C(=O)O Amb26659761 [0,2,0,0,0,0|1,0,0]=3 4262 B10R0.104 CCCC(C)(C)C(O)C(=O)O Amb25385207 [0,2,0,0,0,0|2,0,0]=4 4263 B10R0.104 CCCC(C)(N)C(C)C(=O)O Amb33036373 [0,2,0,0,0,0|2,0,0]=4 4264 B10R0.104 CCCC(C)(O)C(C)C(=O)O Amb19022360 [0,2,0,0,0,0|2,0,0]=4 4265 B10R0.104 CCCC(C)(S)C(N)C(=O)O Amb27671669 [0,2,0,0,0,0|1,0,0]=3 4266 B10R0.104 COCC(C)(C)C(C)C(=O)O Amb33727405 [0,2,0,0,0,0|1,1,0]=4 4267 B10R0.104 COCC(C)(C)C(N)C(=O)O Amb26084120 [0,2,0,0,0,0|0,1,0]=3 4268 B10R0.104 COCC(C)(C)C(N)C(=O)O Amb32652492 [0,2,0,0,0,0|0,1,0]=3 4269 B10R0.104 COCC(C)(C)C(O)C(=O)O Amb25384891 [0,2,0,0,0,0|1,1,0]=4 4270 B10R0.104 COCC(C)(C)[C@@H](C)C(=O)O Amb33729111 [0,2,0,0,0,0|1,1,0]=4 4271 B10R0.104 COCC(C)(C)[C@H](C)C(=O)O Amb33728821 [0,2,0,0,0,0|1,1,0]=4 4272 B10R0.104 COCC(C)(N)C(C)C(=O)O Amb33036290 [0,2,0,0,0,0|1,1,0]=4 4273 B10R0.104 COCC(C)(O)C(C)C(=O)O Amb18312257 [0,2,0,0,0,0|1,1,0]=4 4274 B10R0.104 CSCC(C)(C)C(N)C(=O)O Amb33272049 [0,2,0,0,0,0|0,0,0]=2 4275 B10R0.104 CSCC(C)(C)C(O)C(=O)O Amb33272045 [0,2,0,0,0,0|1,0,0]=3 4276 B10R0.104 CSCC(C)(N)C(C)C(=O)O Amb33036286 [0,2,0,0,0,0|1,0,0]=3 4277 B10R0.104 CSCC(C)(N)C(F)C(=O)O Amb33036379 [0,2,0,0,0,0|1,0,0]=3 4278 B10R0.104 CSCC(C)(O)C(C)C(=O)O Amb33036103 [0,2,0,0,0,0|1,0,0]=3 4279 B10R0.104 CSCC(C)(O)C(F)C(=O)O Amb33036242 [0,2,0,0,0,0|1,0,0]=3 4280 B10R0.43 CC(=O)CCC(C)(C)C(=O)O Amb18645019 [0,2,0,0,0,0|2,0,0]=4 4281 B10R0.43 CC(=O)CCC(C)(N)C(N)=O Amb27989320 [0,2,0,0,0,0|2,0,0]=4 4282 B10R0.43 CC(C)=CCC(C)(N)C(=O)O Amb27176549 [0,2,0,0,0,0|1,0,1]=4 4283 B10R0.43 CC(C)CCC(C)(C)C(=O)O Amb18182372 [0,2,0,0,0,0|2,0,0]=4 4284 B10R0.43 CC(C)CCC(C)(N)C(=O)O Amb4134835 [0,2,0,0,0,0|1,0,0]=3 4285 B10R0.43 CC(C)CCC(C)(N)C(=O)O Amb7969761 [0,2,0,0,0,0|1,0,0]=3 4286 B10R0.43 CC(C)CCC(C)(O)C(=O)O Amb19011235 [0,2,0,0,0,0|2,0,0]=4 4287 B10R0.43 CC(C)CCC(F)(F)C(=O)O Amb25383699 [0,2,0,0,0,0|2,0,0]=4 4288 B10R0.43 CC(C)SCC(C)(N)C(=O)O Amb18178454 [0,2,0,0,0,0|2,0,0]=4 4289 B10R0.43 CC(N)(CCC(=O)O)C(=O)O Amb22801426 [0,2,0,0,0,0|2,0,0]=4 4290 B10R0.43 CC(N)(CCC(=O)O)C(=O)O Amb3940869 [0,2,0,0,0,0|2,0,0]=4 4291 B10R0.43 CC(O)CCC(C)(C)C(=O)O Amb28387125 [0,2,0,0,0,0|2,0,0]=4 4292 B10R0.43 CN(C)CCC(C)(C)C(=O)O Amb27492607 [0,2,0,0,0,0|2,0,0]=4 4293 B10R0.43 CN(C)CCC(C)(N)C(=O)O Amb18800387 [0,2,0,0,0,0|1,0,0]=3 4294 B10R0.43 CN(C)CCC(C)(N)C(N)=O Amb18800165 [0,2,0,0,0,0|2,0,0]=4 4295 B10R0.43 CN(C)CCC(C)(O)C(=O)O Amb27990261 [0,2,0,0,0,0|2,0,0]=4 4296 B10R0.43 CN(C)CCC(F)(F)C(=O)O Amb33408174 [0,2,0,0,0,0|2,0,0]=4 4297 B10R0.43 CN(O)CCC(C)(C)C(=O)O Amb28079719 [0,2,0,0,0,0|2,0,0]=4 4298 B10R0.43 C[C@@](N)(CCC(=O)O)C(=O)O Amb8629033 [0,2,0,0,0,0|2,0,0]=4 4299 B10R0.43 C[C@](N)(CCC(=O)O)C(=O)O Amb8629032 [0,2,0,0,0,0|2,0,0]=4 4300 B10R0.43 NC(=O)CCC(N)(F)C(=O)O Amb10839407 [0,2,0,0,0,0|2,0,0]=4 4301 B10R0.43 NC(N)(CCC(=O)O)C(=O)O Amb26076861 [0,2,0,0,0,0|2,0,0]=4 4302 B10R0.57 C=C(C)CCC(N)C(=O)OC Amb33309178 [0,2,0,0,0,0|1,0,0]=3 4303 B10R0.57 COC(=O)C(N)CC=C(C)C Amb26077073 [0,2,0,0,0,0|1,0,1]=4 4304 B10R0.57 COC(=O)C(N)CCC(C)=O Amb32645698 [0,2,0,0,0,0|1,0,0]=3 4305 B10R0.57 COC(=O)C(N)CCC(C)C Amb32645736 [0,2,0,0,0,0|1,0,0]=3 4306 B10R0.57 COC(=O)C(N)CCC(C)C Amb33339193 [0,2,0,0,0,0|1,0,0]=3 4307 B10R0.57 COC(=O)C(N)CCC(C)O Amb33065655 [0,2,0,0,0,0|1,0,0]=3 4308 B10R0.57 COC(=O)C(N)CCC(N)=O Amb32752608 [0,2,0,0,0,0|2,0,0]=4 4309 B10R0.57 COC(=O)C(N)CCN(C)C Amb18787991 [0,2,0,0,0,0|1,0,0]=3 4310 B10R0.57 COC(=O)C(N)CCS(C)=O Amb18648234 [0,2,0,0,0,0|0,0,1]=3 4311 B10R0.57 COC(=O)C(N)COC(C)=O Amb33803614 [0,2,0,0,0,0|2,0,0]=4 4312 B10R0.57 COC(=O)C(N)COC(C)C Amb18788055 [0,2,0,0,0,0|2,0,0]=4 4313 B10R0.57 COC(=O)C(O)CCC(C)C Amb33450138 [0,2,0,0,0,0|2,0,0]=4 4314 B10R0.57 COC(=O)C(O)CCN(C)C Amb33271942 [0,2,0,0,0,0|2,0,0]=4 4315 B10R0.57 COC(=O)[C@@H](N)CCC(=O)O Amb8390399 [0,2,0,0,0,0|2,0,0]=4 4316 B10R0.57 COC(=O)[C@@H](N)CCC(N)=O Amb8629195 [0,2,0,0,0,0|2,0,0]=4 4317 B10R0.57 COC(=O)[C@@H](N)CCS(C)=O Amb33802381 [0,2,0,0,0,0|0,0,1]=3 4318 B10R0.57 COC(=O)[C@@H](N)CNC(C)=O Amb27990246 [0,2,0,0,0,0|2,0,0]=4 4319 B10R0.57 COC(=O)[C@H](N)CCC(=O)O Amb33801734 [0,2,0,0,0,0|2,0,0]=4 4320 B10R0.57 COC(=O)[C@H](N)CCC(=O)O Amb33866552 [0,2,0,0,0,0|2,0,0]=4 4321 B10R0.57 COC(=O)[C@H](N)CCC(=O)[O-] Amb34915024 [0,2,0,0,0,0|2,0,0]=4 4322 B10R0.57 COC(=O)[C@H](N)CCC(C)C Amb31295689 [0,2,0,0,0,0|1,0,0]=3 4323 B10R0.57 COC(=O)[C@H](N)CCC(N)=O Amb8629196 [0,2,0,0,0,0|2,0,0]=4 4324 B10R0.57 NC(CCC(=O)O)C(=O)NO Amb27987067 [0,2,0,0,0,0|2,0,0]=4 4325 B10R0.82 C#CC(C)NCC(N)C(=O)O Amb27988083 [0,2,0,0,0,0|1,0,1]=4 4326 B10R0.82 C#CC(N)CCC(N)C(=O)O Amb24762938 [0,2,0,0,0,0|1,0,1]=4 4327 B10R0.82 CC(C#N)CCC(C)C(=O)O Amb27990264 [0,2,0,0,0,0|2,0,0]=4 4328 B10R0.82 CCC(C)CCC(C)C(=O)O Amb22641847 [0,2,0,0,0,0|2,0,0]=4 4329 B10R0.82 CCC(C)OCC(N)C(=O)O Amb18177727 [0,2,0,0,0,0|1,0,0]=3 4330 B10R0.82 CCC(C)OCC(N)C(N)=O Amb18177699 [0,2,0,0,0,0|2,0,0]=4 4331 B10R0.82 CCC(C)OC[C@@H](N)C(=O)O Amb32789388 [0,2,0,0,0,0|1,0,0]=3 4332 B10R0.82 CCC(C)OC[C@H](N)C(=O)O Amb33036875 [0,2,0,0,0,0|1,0,0]=3 4333 B10R0.82 CCN(C)CC[C@@H](N)C(=O)O Amb32698166 [0,2,0,0,0,0|1,0,0]=3 4334 B10R0.82 CNC(=O)CCC(N)C(=O)O Amb18645293 [0,2,0,0,0,0|1,0,0]=3 4335 B10R0.82 CNC(=O)SC[C@H](N)C(=O)O Amb17617278 [0,2,0,0,0,0|1,0,1]=4 4336 B10R0.82 COC(=O)CCC(Br)C(=O)O Amb18134592 [0,2,0,0,0,0|1,1,0]=4 4337 B10R0.82 COC(=O)CCC(Cl)C(=O)O Amb32941125 [0,2,0,0,0,0|1,1,0]=4 4338 B10R0.82 COC(=O)CCC(N)C(=O)O Amb9825413 [0,2,0,0,0,0|0,1,0]=3 4339 B10R0.82 COC(=O)CCC(N)C(N)=O Amb31291204 [0,2,0,0,0,0|1,1,0]=4 4340 B10R0.82 COC(=O)CCC(O)C(=O)O Amb32941120 [0,2,0,0,0,0|1,1,0]=4 4341 B10R0.82 COC(=O)CC[C@@H](N)C(=O)O Amb16183875 [0,2,0,0,0,0|0,1,0]=3 4342 B10R0.82 COC(=O)CC[C@@H](N)C(=O)O Amb22746068 [0,2,0,0,0,0|0,1,0]=3 4343 B10R0.82 COC(=O)CC[C@H](N)C(=O)O Amb2720571 [0,2,0,0,0,0|0,1,0]=3 4344 B10R0.82 COC(=O)CC[C@H](N)C(=O)[O-] Amb34916015 [0,2,0,0,0,0|0,1,1]=4 4345 B10R0.82 COC(=O)CC[C@H](N)C(N)=O Amb22432474 [0,2,0,0,0,0|1,1,0]=4 4346 B10R0.82 COC(=O)CC[C@H](N)C(N)=O Amb34916457 [0,2,0,0,0,0|1,1,0]=4 4347 B10R0.82 CSC(C)CNC(=O)C(=O)O Amb28387383 [0,2,0,0,0,0|1,0,1]=4 4348 B10R0.82 NC(CCC(=O)NO)C(=O)O Amb22350145 [0,2,0,0,0,0|2,0,0]=4 4349 B10R0.82 NC(CC[PH](=O)CO)C(=O)[O-] Amb22167951 [0,2,0,0,0,0|1,0,1]=4 4350 B10R0.82 NC(CF)CCC(N)C(=O)O Amb31030977 [0,2,0,0,0,0|1,0,0]=3 4351 B10R0.82 NC(CF)CCC(N)C(=O)O Amb33204489 [0,2,0,0,0,0|1,0,0]=3 4352 B10R0.82 NC(CNC(=O)CCl)C(=O)O Amb27990068 [0,2,0,0,0,0|2,0,0]=4 4353 B10R0.82 NCC(F)CCC(N)C(=O)O Amb10839781 [0,2,0,0,0,0|1,0,0]=3 4354 B10R0.82 NCC(O)CCC(N)C(=O)O Amb2720125 [0,2,0,0,0,0|1,0,0]=3 4355 B10R0.82 NCC(O)CCC(N)C(=O)O Amb9809250 [0,2,0,0,0,0|1,0,0]=3 4356 B10R0.82 NCC(O)CC[C@H](N)C(=O)O Amb34175411 [0,2,0,0,0,0|1,0,0]=3 4357 B10R0.82 NC[C@@H](O)CC[C@H](N)C(=O)O Amb24117040 [0,2,0,0,0,0|1,0,0]=3 4358 B10R0.82 NC[C@H](O)CC[C@@H](N)C(=O)O Amb33802991 [0,2,0,0,0,0|1,0,0]=3 4359 B10R0.82 NC[C@H](O)CC[C@@H](N)C(=O)O Amb33804786 [0,2,0,0,0,0|1,0,0]=3 4360 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O Amb22747912 [0,2,0,0,0,0|1,0,0]=3 4361 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O Amb24121192 [0,2,0,0,0,0|1,0,0]=3 4362 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O Amb35788437 [0,2,0,0,0,0|1,0,0]=3 4363 B10R0.82 NNC(=O)CCC(N)C(=O)O Amb6366546 [0,2,0,0,0,0|2,0,0]=4 4364 B10R0.82 NNC(=O)CC[C@H](N)C(=O)O Amb25379957 [0,2,0,0,0,0|2,0,0]=4 4365 B10R0.82 N[C@@H](CCC(=O)NO)C(=O)O Amb27269199 [0,2,0,0,0,0|2,0,0]=4 4366 B10R0.82 N[C@@H](C\C=C(/Cl)CO)C(=O)O Amb27988484 [0,2,0,0,0,0|1,0,1]=4 4367 B10R0.84 CC(C)OCC(CN)C(=O)O Amb33274848 [0,2,0,0,0,0|2,0,0]=4 4368 B10R0.84 CCC(CCN(C)C)C(=O)O Amb33273732 [0,2,0,0,0,0|2,0,0]=4 4369 B10R0.84 CN(C)CCC(CN)C(=O)O Amb33272650 [0,2,0,0,0,0|1,0,0]=3 4370 B10R0.84 CN[C@@H](CCC(=O)O)C(=O)O Amb13884885 [0,2,0,0,0,0|2,0,0]=4 4371 B10R0.84 CN[C@@H](CCC(=O)O)C(=O)O Amb24117978 [0,2,0,0,0,0|2,0,0]=4 4372 B10R0.84 COC(CCC(C)C)C(=O)O Amb33359779 [0,2,0,0,0,0|2,0,0]=4 4373 B10R0.92 CC(=O)C(N)CCS(C)(=O)=O Amb5716772 [0,2,0,0,0,0|1,0,1]=4 4374 B10R0.92 CC(C)(C)CCC(N)C(=O)O Amb18307415 [0,2,0,0,0,0|1,0,0]=3 4375 B10R0.92 CC(C)(C)CCC(N)C(=O)O Amb32882445 [0,2,0,0,0,0|1,0,0]=3 4376 B10R0.92 CC(C)(C)CCC(N)C(N)=O Amb27986986 [0,2,0,0,0,0|2,0,0]=4 4377 B10R0.92 CC(C)(C)CCC(N)C(N)=O Amb33528956 [0,2,0,0,0,0|2,0,0]=4 4378 B10R0.92 CC(C)(C)CCC(O)C(=O)O Amb27271609 [0,2,0,0,0,0|2,0,0]=4 4379 B10R0.92 CC(C)(C)CC[C@@H](N)C(=O)O Amb25383852 [0,2,0,0,0,0|1,0,0]=3 4380 B10R0.92 CC(C)(C)CC[C@H](N)C(=O)O Amb28386947 [0,2,0,0,0,0|1,0,0]=3 4381 B10R0.92 CC(C)(C)OCC(N)C(=O)O Amb9790049 [0,2,0,0,0,0|2,0,0]=4 4382 B10R0.92 CC(C)(C)OC[C@@H](N)C(=O)O Amb8390419 [0,2,0,0,0,0|2,0,0]=4 4383 B10R0.92 CC(C)(C)OC[C@H](N)C(=O)O Amb10844851 [0,2,0,0,0,0|2,0,0]=4 4384 B10R0.92 CC(C)(C)SCC(N)C(=O)O Amb18790874 [0,2,0,0,0,0|2,0,0]=4 4385 B10R0.92 CC(C)(C)SC[C@@H](N)C(=O)O Amb22745248 [0,2,0,0,0,0|2,0,0]=4 4386 B10R0.92 CC(C)(C)SC[C@@H](N)C(=O)O Amb8389453 [0,2,0,0,0,0|2,0,0]=4 4387 B10R0.92 CC(C)(C)SC[C@H](N)C(=O)O Amb2721173 [0,2,0,0,0,0|2,0,0]=4 4388 B10R0.92 CC(C)(C)SC[C@H](N)C(=O)O Amb8629100 [0,2,0,0,0,0|2,0,0]=4 4389 B10R0.92 CC(C)(N)CCC(F)C(=O)O Amb27671747 [0,2,0,0,0,0|2,0,0]=4 4390 B10R0.92 CC(C)(O)CCC(N)C(=O)O Amb26659578 [0,2,0,0,0,0|1,0,0]=3 4391 B10R0.92 CC(C)(O)CCC(N)C(N)=O Amb33036734 [0,2,0,0,0,0|2,0,0]=4 4392 B10R0.92 CC(C)(O)CC[C@@H](N)C(=O)O Amb33036146 [0,2,0,0,0,0|1,0,0]=3 4393 B10R0.92 CC(C)(O)CC[C@H](N)C(=O)O Amb26659762 [0,2,0,0,0,0|1,0,0]=3 4394 B10R0.92 CC(CCC(C)(C)C)C(=O)O Amb18307461 [0,2,0,0,0,0|2,0,0]=4 4395 B10R0.92 CC(CCC(C)(C)F)C(=O)O Amb33271583 [0,2,0,0,0,0|2,0,0]=4 4396 B10R0.92 CC(CCC(C)(C)N)C(=O)O Amb27671746 [0,2,0,0,0,0|2,0,0]=4 4397 B10R0.92 CC(CCC(C)(C)O)C(=O)O Amb27986533 [0,2,0,0,0,0|2,0,0]=4 4398 B10R0.92 CC(CCC(C)(F)F)C(=O)O Amb33437006 [0,2,0,0,0,0|2,0,0]=4 4399 B10R0.92 CC(CCS(C)(=O)=O)C(=O)O Amb18305099 [0,2,0,0,0,0|1,0,1]=4 4400 B10R0.92 CC(F)(F)CCC(N)C(=O)O Amb27990024 [0,2,0,0,0,0|1,0,0]=3 4401 B10R0.92 CC(F)(F)CC[C@@H](N)C(=O)O Amb25383712 [0,2,0,0,0,0|1,0,0]=3 4402 B10R0.92 CP(=O)(O)CCC(N)C(=O)O Amb4424634 [0,2,0,0,0,0|1,0,0]=3 4403 B10R0.92 CP(=O)(O)CCC(O)C(=O)O Amb27000184 [0,2,0,0,0,0|2,0,0]=4 4404 B10R0.92 CP(=O)(O)CC[C@H](N)C(=O)O Amb27001058 [0,2,0,0,0,0|1,0,0]=3 4405 B10R0.92 CP(=O)(O)CC[C@H](N)C(N)=O Amb27671698 [0,2,0,0,0,0|2,0,0]=4 4406 B10R0.92 CP(C)(=O)CC[C@H](N)C(=O)O Amb27671929 [0,2,0,0,0,0|1,0,0]=3 4407 B10R0.92 CP(C)(=S)SCC(N)C(=O)O Amb27671765 [0,2,0,0,0,0|2,0,0]=4 4408 B10R0.92 CS(=N)(=O)CCC(N)C(=O)O Amb2747058 [0,2,0,0,0,0|0,0,1]=3 4409 B10R0.92 CS(=N)(=O)CC[C@H](N)C(=O)O Amb8514715 [0,2,0,0,0,0|0,0,1]=3 4410 B10R0.92 CS(=O)(=O)CCC(N)C(=O)O Amb1905637 [0,2,0,0,0,0|0,0,1]=3 4411 B10R0.92 CS(=O)(=O)CCC(N)C(N)=O Amb6261914 [0,2,0,0,0,0|1,0,1]=4 4412 B10R0.92 CS(=O)(=O)CCC(N)C(N)=O Amb9178007 [0,2,0,0,0,0|1,0,1]=4 4413 B10R0.92 CS(=O)(=O)CCC(O)C(=O)O Amb18129022 [0,2,0,0,0,0|1,0,1]=4 4414 B10R0.92 CS(=O)(=O)CC[C@@H](N)C(=O)O Amb22745329 [0,2,0,0,0,0|0,0,1]=3 4415 B10R0.92 CS(=O)(=O)CC[C@H](N)C(=O)O Amb9809971 [0,2,0,0,0,0|0,0,1]=3 4416 B10R0.92 CS(C)(Cl)CCC(N)C(=O)O Amb25384324 [0,2,0,0,0,0|0,0,1]=3 4417 B10R0.92 C[C@@H](CCC(C)(C)C)C(=O)O Amb33744627 [0,2,0,0,0,0|2,0,0]=4 4418 B10R0.92 C[C@H](CCC(C)(C)C)C(=O)O Amb33749381 [0,2,0,0,0,0|2,0,0]=4 4419 B10R0.92 C[S@@](=N)(=O)CC[C@H](N)C(=O)O Amb17616898 [0,2,0,0,0,0|0,0,1]=3 4420 B10R0.92 C[S@](=N)(=O)CC[C@H](N)C(=O)O Amb17616899 [0,2,0,0,0,0|0,0,1]=3 4421 B10R0.92 C[SH](=N)(O)CCC(N)C(=O)O Amb27673254 [0,2,0,0,0,0|0,0,1]=3 4422 B10R0.92 NC(CCC(F)(F)Cl)C(=O)O Amb33308947 [0,2,0,0,0,0|2,0,0]=4 4423 B10R0.92 NC(CCC(F)(F)F)C(=O)O Amb2732192 [0,2,0,0,0,0|2,0,0]=4 4424 B10R0.92 NC(CCC(F)(F)F)C(=O)O Amb28652882 [0,2,0,0,0,0|2,0,0]=4 4425 B10R0.92 NC(CCP(=O)(O)O)C(=O)O Amb542828 [0,2,0,0,0,0|2,0,0]=4 4426 B10R0.92 NC(CCS(=O)(=O)Cl)C(=O)O Amb28079864 [0,2,0,0,0,0|1,0,1]=4 4427 B10R0.92 NC(CCS(=O)(=O)O)C(=O)O Amb3940449 [0,2,0,0,0,0|1,0,1]=4 4428 B10R0.92 NC(CCS(=O)(=O)S)C(=O)O Amb27990225 [0,2,0,0,0,0|1,0,1]=4 4429 B10R0.92 NC(CCS(N)(=O)=O)C(=O)O Amb27271128 [0,2,0,0,0,0|1,0,1]=4 4430 B10R0.92 N[C@@H](CCC(F)(F)Cl)C(=O)O Amb33036981 [0,2,0,0,0,0|2,0,0]=4 4431 B10R0.92 N[C@@H](CCC(F)(F)F)C(=O)O Amb19889289 [0,2,0,0,0,0|2,0,0]=4 4432 B10R0.92 N[C@@H](CCC(F)(F)F)C(=O)O Amb33331073 [0,2,0,0,0,0|2,0,0]=4 4433 B10R0.92 N[C@@H](CCP(=O)(O)O)C(=O)O Amb30666599 [0,2,0,0,0,0|2,0,0]=4 4434 B10R0.92 N[C@@H](CCP(=O)(O)O)C(=O)O Amb544255 [0,2,0,0,0,0|2,0,0]=4 4435 B10R0.92 N[C@@H](CCP(O)(O)=S)C(=O)O Amb19929411 [0,2,0,0,0,0|2,0,0]=4 4436 B10R0.92 N[C@H](CCC(F)(F)Cl)C(=O)O Amb33065677 [0,2,0,0,0,0|2,0,0]=4 4437 B10R0.92 N[C@H](CCC(F)(F)F)C(=O)O Amb19889288 [0,2,0,0,0,0|2,0,0]=4 4438 B10R0.92 N[C@H](CCP(=O)(O)O)C(=O)O Amb2719726 [0,2,0,0,0,0|2,0,0]=4 4439 B10R0.92 N[C@H](CCS(=O)(=O)O)C(=O)O Amb27672864 [0,2,0,0,0,0|1,0,1]=4 4440 B10R0.93 CC(=O)C(C)CC(C)C(=O)O Amb4014440 [0,2,0,0,0,0|2,0,0]=4 4441 B10R0.93 CC(=O)[C@@H](C)C[C@H](C)C(=O)O Amb27989934 [0,2,0,0,0,0|2,0,0]=4 4442 B10R0.93 CC(C)C(=O)CC(N)C(=O)O Amb25385142 [0,2,0,0,0,0|1,0,1]=4 4443 B10R0.93 CC(C)C(=O)C[C@@H](N)C(=O)O Amb28386948 [0,2,0,0,0,0|1,0,1]=4 4444 B10R0.93 CC(C)C(=O)C[C@H](N)C(=O)O Amb25385141 [0,2,0,0,0,0|1,0,1]=4 4445 B10R0.93 CC(C)C(C)CC(F)C(=O)O Amb28387341 [0,2,0,0,0,0|2,0,0]=4 4446 B10R0.93 CC(C)C(C)CC(N)C(=O)O Amb28387309 [0,2,0,0,0,0|1,0,0]=3 4447 B10R0.93 CC(C)C(C)CC(O)C(=O)O Amb25385155 [0,2,0,0,0,0|2,0,0]=4 4448 B10R0.93 CC(C)C(C)CC(S)C(=O)O Amb28387314 [0,2,0,0,0,0|2,0,0]=4 4449 B10R0.93 CC(C)C(C)C[C@@H](N)C(=O)O Amb28387332 [0,2,0,0,0,0|1,0,0]=3 4450 B10R0.93 CC(C)C(C)C[C@H](N)C(=O)O Amb28387331 [0,2,0,0,0,0|1,0,0]=3 4451 B10R0.93 CC(C)C(O)CC(N)C(=O)O Amb26081646 [0,2,0,0,0,0|1,0,0]=3 4452 B10R0.93 CC(C)C(O)CC(N)C(N)=O Amb32865932 [0,2,0,0,0,0|2,0,0]=4 4453 B10R0.93 CC(C)C(O)C[C@@H](N)C(=O)O Amb33065734 [0,2,0,0,0,0|1,0,0]=3 4454 B10R0.93 CC(C)C(O)C[C@H](N)C(=O)O Amb33066238 [0,2,0,0,0,0|1,0,0]=3 4455 B10R0.93 CC(C)[C@@H](C)C[C@H](N)C(=O)O Amb25384069 [0,2,0,0,0,0|1,0,0]=3 4456 B10R0.93 CC(C)[C@@H](F)C[C@@H](N)C(=O)O Amb26660930 [0,2,0,0,0,0|1,0,0]=3 4457 B10R0.93 CC(CC(C)C(C)C)C(=O)O Amb28387340 [0,2,0,0,0,0|2,0,0]=4 4458 B10R0.93 CC(CC(F)C(C)C)C(=O)O Amb27989461 [0,2,0,0,0,0|2,0,0]=4 4459 B10R0.93 CC(CC(N)C(=O)O)C(=O)O Amb23440871 [0,2,0,0,0,0|2,0,0]=4 4460 B10R0.93 CC(CC(N)C(N)=O)N(C)C Amb27989321 [0,2,0,0,0,0|2,0,0]=4 4461 B10R0.93 CC(CC(O)C(C)C)C(=O)O Amb18182511 [0,2,0,0,0,0|2,0,0]=4 4462 B10R0.93 CC(C[C@@H](N)C(=O)O)C(=O)O Amb26999819 [0,2,0,0,0,0|2,0,0]=4 4463 B10R0.93 CC(C[C@H](N)C(=O)O)C(=O)O Amb27000115 [0,2,0,0,0,0|2,0,0]=4 4464 B10R0.93 CC(C[C@H](N)C(=O)O)C(O)O Amb25384090 [0,2,0,0,0,0|2,0,0]=4 4465 B10R0.93 C[C@@H](C[C@@H](N)C(=O)O)C(=O)O Amb19133151 [0,2,0,0,0,0|2,0,0]=4 4466 B10R0.93 C[C@@H](C[C@H](N)C(=O)O)C(N)=O Amb27990165 [0,2,0,0,0,0|2,0,0]=4 4467 B10R0.93 C[C@H](C[C@H](N)C(=O)O)C(=O)O Amb10807462 [0,2,0,0,0,0|2,0,0]=4 4468 B10R0.93 NC(=O)C(F)CC(N)C(=O)O Amb25386442 [0,2,0,0,0,0|2,0,0]=4 4469 B10R0.93 NC(=O)C(F)C[C@H](N)C(=O)O Amb25383170 [0,2,0,0,0,0|2,0,0]=4 4470 B10R0.93 NC(=O)C(O)C[C@H](N)C(=O)O Amb27990187 [0,2,0,0,0,0|2,0,0]=4 4471 B10R0.93 NC(=O)[C@@H](F)C[C@@H](N)C(=O)O Amb10839752 [0,2,0,0,0,0|2,0,0]=4 4472 B10R0.93 NC(=O)[C@@H](F)C[C@H](N)C(=O)O Amb10839753 [0,2,0,0,0,0|2,0,0]=4 4473 B10R0.93 NC(=O)[C@H](F)C[C@@H](N)C(=O)O Amb25384972 [0,2,0,0,0,0|2,0,0]=4 4474 B10R0.93 NC(=O)[C@H](F)C[C@H](N)C(=O)O Amb26083606 [0,2,0,0,0,0|2,0,0]=4 4475 B10R0.93 NC(=O)[C@H](F)C[C@H](N)C(=O)O Amb33804028 [0,2,0,0,0,0|2,0,0]=4 4476 B10R0.93 NC(CC(F)C(=O)O)C(=O)O Amb2688100 [0,2,0,0,0,0|2,0,0]=4 4477 B10R0.93 NC(CC(N)C(=O)O)C(=O)O Amb24117887 [0,2,0,0,0,0|2,0,0]=4 4478 B10R0.93 NC(CC(N)C(=O)O)C(=O)O Amb3994432 [0,2,0,0,0,0|2,0,0]=4 4479 B10R0.93 N[C@@H](CC(F)C(=O)O)C(=O)O Amb22800491 [0,2,0,0,0,0|2,0,0]=4 4480 B10R0.93 N[C@@H](CC(O)C(=O)O)C(=O)O Amb27492043 [0,2,0,0,0,0|2,0,0]=4 4481 B10R0.93 N[C@@H](C[C@@H](F)C(=O)O)C(=O)O Amb24055860 [0,2,0,0,0,0|2,0,0]=4 4482 B10R0.93 N[C@@H](C[C@@H](N)C(=O)O)C(=O)O Amb22746048 [0,2,0,0,0,0|2,0,0]=4 4483 B10R0.93 N[C@@H](C[C@@H](O)C(=O)O)C(=O)O Amb6600059 [0,2,0,0,0,0|2,0,0]=4 4484 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O Amb22388564 [0,2,0,0,0,0|2,0,0]=4 4485 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O Amb22745417 [0,2,0,0,0,0|2,0,0]=4 4486 B10R0.93 N[C@@H](C[C@H](O)C(=O)O)C(=O)O Amb22800665 [0,2,0,0,0,0|2,0,0]=4 4487 B10R0.93 N[C@@H](C[C@H](O)C(=O)O)C(=O)O Amb24117514 [0,2,0,0,0,0|2,0,0]=4 4488 B10R0.93 N[C@H](C[C@@H](F)C(=O)O)C(=O)O Amb26083605 [0,2,0,0,0,0|2,0,0]=4 4489 B10R0.93 N[C@H](C[C@@H](N)C(=O)O)C(=O)O Amb22388558 [0,2,0,0,0,0|2,0,0]=4 4490 B10R0.93 N[C@H](C[C@H](F)C(=O)O)C(=O)O Amb10839750 [0,2,0,0,0,0|2,0,0]=4 4491 B10R0.19 C#CCCC(N)C(=O)OCC Amb32796091 [0,2,0,0,0,0|1,0,1]=4 4492 B10R0.19 C=CCCC(N)C(=O)OCC Amb32662922 [0,2,0,0,0,0|1,0,1]=4 4493 B10R0.19 CC#CCC(N)C(=O)OCC Amb26077075 [0,2,0,0,0,0|1,0,1]=4 4494 B10R0.19 CCCCC(Br)C(=O)OCC Amb3939967 [0,2,0,0,0,0|2,0,0]=4 4495 B10R0.19 CCCCC(N)C(=O)NC#N Amb27271669 [0,2,0,0,0,0|2,0,0]=4 4496 B10R0.19 CCCCC(N)C(=O)NCC Amb18179826 [0,2,0,0,0,0|2,0,0]=4 4497 B10R0.19 CCCCC(N)C(=O)OCC Amb2786375 [0,2,0,0,0,0|1,0,0]=3 4498 B10R0.19 CCCCN(N)C(=O)COC Amb33191469 [0,2,0,0,0,0|2,0,0]=4 4499 B10R0.19 CCCC[C@@H](N)C(=O)OCC Amb33804647 [0,2,0,0,0,0|1,0,0]=3 4500 B10R0.19 CCCC[C@H](N)C(=O)NC#N Amb27988592 [0,2,0,0,0,0|2,0,0]=4 4501 B10R0.19 CCCC[C@H](N)C(=O)OCC Amb33803846 [0,2,0,0,0,0|1,0,0]=3 4502 B10R0.19 CCNC(=O)C(N)CCSC Amb23555057 [0,2,0,0,0,0|1,0,0]=3 4503 B10R0.19 CCOC(=O)C(N)CCC#N Amb18125982 [0,2,0,0,0,0|2,0,0]=4 4504 B10R0.19 CCOC(=O)C(N)CCC#N Amb35748093 [0,2,0,0,0,0|2,0,0]=4 4505 B10R0.19 CCOC(=O)C(N)CCCF Amb33036729 [0,2,0,0,0,0|2,0,0]=4 4506 B10R0.19 CCOC(=O)C(N)CCCO Amb33309108 [0,2,0,0,0,0|2,0,0]=4 4507 B10R0.19 CCOC(=O)C(N)CCOC Amb18183465 [0,2,0,0,0,0|0,1,0]=3 4508 B10R0.19 CCOC(=O)C(N)CCOC Amb31188257 [0,2,0,0,0,0|0,1,0]=3 4509 B10R0.19 CCOC(=O)C(N)CCSC Amb17758560 [0,2,0,0,0,0|0,0,0]=2 4510 B10R0.19 CCOC(=O)C(N)CCSC Amb2719833 [0,2,0,0,0,0|0,0,0]=2 4511 B10R0.19 CCOC(=O)C(O)CCSC Amb33529798 [0,2,0,0,0,0|1,0,0]=3 4512 B10R0.19 CCOC(=O)[C@@H](N)CCCN Amb16234080 [0,2,0,0,0,0|2,0,0]=4 4513 B10R0.19 CCOC(=O)[C@@H](N)CCCN Amb22745899 [0,2,0,0,0,0|2,0,0]=4 4514 B10R0.19 CCOC(=O)[C@@H](N)CCON Amb31295636 [0,2,0,0,0,0|1,1,0]=4 4515 B10R0.19 CCOC(=O)[C@@H](N)CCSC Amb2720481 [0,2,0,0,0,0|0,0,0]=2 4516 B10R0.19 CCOC(=O)[C@@H](N)CCSC Amb2725102 [0,2,0,0,0,0|0,0,0]=2 4517 B10R0.19 CCOC(=O)[C@H](N)CCSC Amb16183948 [0,2,0,0,0,0|0,0,0]=2 4518 B10R0.19 CCOC(=O)[C@H](N)CCSC Amb8628591 [0,2,0,0,0,0|0,0,0]=2 4519 B10R0.19 CCOCC(N)C(=O)OCC Amb33527129 [0,2,0,0,0,0|2,0,0]=4 4520 B10R0.19 CCOCC(N)C(=O)OCC Amb6740294 [0,2,0,0,0,0|2,0,0]=4 4521 B10R0.19 CSCC[C@H](N)C(=O)NC#N Amb27271670 [0,2,0,0,0,0|1,0,0]=3 4522 B10R0.19 C\C=C\CC(N)C(=O)OCC Amb24117498 [0,2,0,0,0,0|1,0,1]=4 4523 B10R0.19 C\C=C\CC(N)C(=O)OCC Amb33164102 [0,2,0,0,0,0|1,0,1]=4 4524 B10R0.46 C#CC(=O)C(N)CC(C)CC Amb27671956 [0,2,0,0,0,0|2,0,0]=4 4525 B10R0.46 C=C(CC)CC(N)C(=O)OC Amb33037025 [0,2,0,0,0,0|1,0,1]=4 4526 B10R0.46 CCC(=O)CC(N)C(=O)OC Amb32789392 [0,2,0,0,0,0|1,0,1]=4 4527 B10R0.46 CCC(C)CC(N)C(=O)NC Amb28080635 [0,2,0,0,0,0|2,0,0]=4 4528 B10R0.46 CCC(C)CC(N)C(=O)NN Amb28080636 [0,2,0,0,0,0|2,0,0]=4 4529 B10R0.46 CCC(C)CC(N)C(=O)NO Amb28080637 [0,2,0,0,0,0|1,0,0]=3 4530 B10R0.46 CCC(C)CC(N)C(=O)OC Amb18645214 [0,2,0,0,0,0|1,0,0]=3 4531 B10R0.46 CCC(C)CC(O)C(=O)OC Amb33171873 [0,2,0,0,0,0|2,0,0]=4 4532 B10R0.46 CCC(O)CC(N)C(=O)OC Amb33308655 [0,2,0,0,0,0|1,0,0]=3 4533 B10R0.46 CNC(=O)CC(N)C(=O)OC Amb27671628 [0,2,0,0,0,0|1,0,1]=4 4534 B10R0.46 COC(=O)C(N)CC(C)C#N Amb32788595 [0,2,0,0,0,0|2,0,0]=4 4535 B10R0.46 COC(=O)C(N)CC(C)CO Amb33308527 [0,2,0,0,0,0|2,0,0]=4 4536 B10R0.46 COC(=O)C(N)CC(C)OC Amb32937042 [0,2,0,0,0,0|0,1,0]=3 4537 B10R0.46 COC(=O)C(N)CC(O)CF Amb33308978 [0,2,0,0,0,0|2,0,0]=4 4538 B10R0.46 COC(=O)C(N)CC(O)CO Amb33066084 [0,2,0,0,0,0|2,0,0]=4 4539 B10R0.46 COC(=O)CC(N)C(=O)OC Amb18126274 [0,2,0,0,0,0|0,1,1]=4 4540 B10R0.46 COC(=O)CC(N)C(=O)OC Amb6366547 [0,2,0,0,0,0|0,1,1]=4 4541 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC Amb16183880 [0,2,0,0,0,0|0,1,1]=4 4542 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC Amb19372612 [0,2,0,0,0,0|0,1,1]=4 4543 B10R0.46 COC(=O)C[C@H](N)C(=O)OC Amb6211510 [0,2,0,0,0,0|0,1,1]=4 4544 B10R0.83 C#CCCCC(N)C(=O)OC Amb33065464 [0,2,0,0,0,0|1,0,1]=4 4545 B10R0.83 C=CCCCC(N)C(=O)OC Amb32684483 [0,2,0,0,0,0|1,0,1]=4 4546 B10R0.83 C=CCOCC(N)C(=O)OC Amb33378986 [0,2,0,0,0,0|1,0,1]=4 4547 B10R0.83 C=CCOCC(N)C(=O)OC Amb33379009 [0,2,0,0,0,0|1,0,1]=4 4548 B10R0.83 C=CCSCC(N)C(=O)OC Amb33338835 [0,2,0,0,0,0|1,0,1]=4 4549 B10R0.83 CC#CCCC(N)C(=O)OC Amb27988390 [0,2,0,0,0,0|1,0,0]=3 4550 B10R0.83 CC=C=CCC(N)C(=O)OC Amb24764814 [0,2,0,0,0,0|1,0,1]=4 4551 B10R0.83 CCCCCC(N)C(=O)OC Amb18792090 [0,2,0,0,0,0|1,0,0]=3 4552 B10R0.83 CCCCCC(N)C(=O)OC Amb33552080 [0,2,0,0,0,0|1,0,0]=3 4553 B10R0.83 CCCCCC(O)C(=O)OC Amb18183408 [0,2,0,0,0,0|2,0,0]=4 4554 B10R0.83 CCCOCC(N)C(=O)OC Amb18788065 [0,2,0,0,0,0|1,0,0]=3 4555 B10R0.83 CCC\C=C\C(N)C(=O)OC Amb32954819 [0,2,0,0,0,0|1,0,1]=4 4556 B10R0.83 CCNCCC(N)C(=O)OC Amb32993441 [0,2,0,0,0,0|1,0,0]=3 4557 B10R0.83 CCOCCC(N)C(=O)OC Amb18788075 [0,2,0,0,0,0|0,1,0]=3 4558 B10R0.83 CCSCCC(N)C(=O)OC Amb18790887 [0,2,0,0,0,0|0,0,0]=2 4559 B10R0.83 CCSCCC(O)C(=O)OC Amb33359216 [0,2,0,0,0,0|1,0,0]=3 4560 B10R0.83 CNC(=O)C(N)CCCCN Amb23443536 [0,2,0,0,0,0|2,0,0]=4 4561 B10R0.83 COC(=O)C(N)CCCC#N Amb31295592 [0,2,0,0,0,0|1,0,1]=4 4562 B10R0.83 COC(=O)C(N)CCCCF Amb33308782 [0,2,0,0,0,0|1,0,0]=3 4563 B10R0.83 COC(=O)C(N)CCCCN Amb782588 [0,2,0,0,0,0|1,0,0]=3 4564 B10R0.83 COC(=O)C(N)CCCCO Amb32789408 [0,2,0,0,0,0|1,0,0]=3 4565 B10R0.83 COC(=O)C(N)CCCCO Amb33625200 [0,2,0,0,0,0|1,0,0]=3 4566 B10R0.83 COC(=O)C(N)CCCSC Amb33065999 [0,2,0,0,0,0|0,0,0]=2 4567 B10R0.83 COC(=O)C(O)CCCSC Amb33358801 [0,2,0,0,0,0|1,0,0]=3 4568 B10R0.83 COC(=O)C([NH3+])CCCC[NH3+] Amb4259242 [0,2,0,0,0,0|1,0,1]=4 4569 B10R0.83 COC(=O)[C@@H](N)CCCCN Amb19930733 [0,2,0,0,0,0|1,0,0]=3 4570 B10R0.83 COC(=O)[C@H](N)CCCCN Amb33757553 [0,2,0,0,0,0|1,0,0]=3 4571 B10R0.83 COCCCC(N)C(=O)OC Amb32712059 [0,2,0,0,0,0|0,1,0]=3 4572 B10R0.83 COCCCC(N)C(=O)OC Amb33470192 [0,2,0,0,0,0|0,1,0]=3 4573 B10R0.83 COCCCC(O)C(=O)OC Amb33171907 [0,2,0,0,0,0|1,1,0]=4 4574 B10R0.85 CCCCC(CC)C(=O)NO Amb7764759 [0,2,0,0,0,0|2,0,0]=4 4575 B10R0.85 CCCCC(CC)C(=O)O[Na] Amb22411561 [0,2,0,0,0,0|2,0,0]=4 4576 B10R0.85 CCCCC(CN)C(=O)OC Amb33428108 [0,2,0,0,0,0|1,0,0]=3 4577 B10R0.85 CCCCC(CO)C(=O)OC Amb33036185 [0,2,0,0,0,0|2,0,0]=4 4578 B10R0.85 CCCCC(NC)C(=O)OC Amb18787860 [0,2,0,0,0,0|1,0,0]=3 4579 B10R0.85 CCOCC(NC)C(=O)OC Amb18788062 [0,2,0,0,0,0|2,0,0]=4 4580 B10R0.85 CCSCC(CN)C(=O)OC Amb33323720 [0,2,0,0,0,0|2,0,0]=4 4581 B10R0.85 COC(=O)C(CN)CCSC Amb33198268 [0,2,0,0,0,0|0,0,0]=2 4582 B10R0.85 COCCC(CN)C(=O)OC Amb33377473 [0,2,0,0,0,0|0,1,0]=3 4583 B10R0.124 CCCCC(F)(F)C(=O)OC Amb20621595 [0,2,0,0,0,0|2,0,0]=4 4584 B10R0.124 COC(=O)C(C)(N)CCC#N Amb18125981 [0,2,0,0,0,0|2,0,0]=4 4585 B10R0.124 COCCC(C)(N)C(=O)OC Amb18183461 [0,2,0,0,0,0|0,1,0]=3 4586 B10R0.124 CSCCC(C)(C)\C(N)=N\O Amb27987059 [0,2,0,0,0,0|2,0,0]=4 4587 B10R0.17 CCCCC(C(=O)O)C(=O)O Amb2759447 [0,2,0,0,0,0|2,0,0]=4 4588 B10R0.17 CCCCC(C(=O)O)C(C)C Amb18179821 [0,2,0,0,0,0|2,0,0]=4 4589 B10R0.17 CCCCC(C(=O)O)N(C)C Amb18787861 [0,2,0,0,0,0|1,0,0]=3 4590 B10R0.17 CCCCC(C(N)=O)C(N)=O Amb341379 [0,2,0,0,0,0|2,0,0]=4 4591 B10R0.17 CCCCC(C(N)=O)N(C)C Amb24116643 [0,2,0,0,0,0|2,0,0]=4 4592 B10R0.17 CCCC[C@H](C(=O)O)N(C)C Amb32660269 [0,2,0,0,0,0|1,0,0]=3 4593 B10R0.17 COCCC(C(=O)O)C(C)C Amb18179972 [0,2,0,0,0,0|1,1,0]=4 4594 B10R0.17 CSCCC(C(=O)O)C(C)C Amb33429469 [0,2,0,0,0,0|1,0,0]=3 4595 B10R0.17 CSCC\C(C(=O)O)=C(/N)O Amb27818530 [0,2,0,0,0,0|0,0,1]=3 4596 B10R0.53 CCC(C)CC(OC)C(=O)O Amb33227722 [0,2,0,0,0,0|2,0,0]=4 4597 B10R0.53 CCC(C)CC(ON)C(=O)O Amb32660232 [0,2,0,0,0,0|1,0,0]=3 4598 B10R0.86 CC#CCCC(C#N)C(=O)O Amb35741478 [0,2,0,0,0,0|1,0,1]=4 4599 B10R0.86 CC#CCNC(CN)C(=O)O Amb28387395 [0,2,0,0,0,0|1,0,1]=4 4600 B10R0.86 CCC(OCCNC)C(=O)O Amb18630743 [0,2,0,0,0,0|2,0,0]=4 4601 B10R0.86 CCCCCC(CC)C(=O)O Amb18791930 [0,2,0,0,0,0|2,0,0]=4 4602 B10R0.86 CCCCCC(OC)C(=O)O Amb32953478 [0,2,0,0,0,0|2,0,0]=4 4603 B10R0.86 CCCCSC(CC)C(=O)O Amb9675509 [0,2,0,0,0,0|2,0,0]=4 4604 B10R0.86 CCC\C=C\C(CN)C(=O)O Amb33224469 [0,2,0,0,0,0|1,0,1]=4 4605 B10R0.86 CCSCCC(OC)C(=O)O Amb33172115 [0,2,0,0,0,0|1,0,0]=3 4606 B10R0.86 CN[C@@H](CCCCN)C(=O)O Amb33876452 [0,2,0,0,0,0|1,0,0]=3 4607 B10R0.86 COC(CCCSC)C(=O)O Amb33359228 [0,2,0,0,0,0|1,0,0]=3 4608 B10R0.86 COCCCC(OC)C(=O)O Amb33377469 [0,2,0,0,0,0|1,1,0]=4 4609 B10R0.88 C#CCCC(NC=O)C(=O)O Amb26077063 [0,2,0,0,0,0|1,0,1]=4 4610 B10R0.88 C=CCCC(NC=O)C(=O)O Amb33065581 [0,2,0,0,0,0|1,0,1]=4 4611 B10R0.88 CC#CCC(NC=O)C(=O)O Amb26628786 [0,2,0,0,0,0|1,0,1]=4 4612 B10R0.88 CCCCC(N=C=S)C(=O)O Amb33471522 [0,2,0,0,0,0|1,0,1]=4 4613 B10R0.88 CCCCC(NC=O)C(=O)O Amb18179873 [0,2,0,0,0,0|1,0,0]=3 4614 B10R0.88 CCCCC(OCC)C(=O)O Amb33624644 [0,2,0,0,0,0|2,0,0]=4 4615 B10R0.88 CCCC[C@@H](N=C=O)C(=O)O Amb33471346 [0,2,0,0,0,0|1,0,1]=4 4616 B10R0.88 CCCC[C@@H](N=C=S)C(=O)O Amb33471576 [0,2,0,0,0,0|1,0,1]=4 4617 B10R0.88 CCCC[C@@H](NCC)C(=O)O Amb33347490 [0,2,0,0,0,0|1,0,0]=3 4618 B10R0.88 CCCC[C@H](N=C=O)C(=O)O Amb33471343 [0,2,0,0,0,0|1,0,1]=4 4619 B10R0.88 CCCC[C@H](N=C=S)C(=O)O Amb33471572 [0,2,0,0,0,0|1,0,1]=4 4620 B10R0.88 CCCC[C@H](NC=O)C(=O)O Amb33774736 [0,2,0,0,0,0|1,0,0]=3 4621 B10R0.88 CCN[C@@H](COCC)C(=O)O Amb33347504 [0,2,0,0,0,0|2,0,0]=4 4622 B10R0.88 CCN[C@H](CCSC)C(=O)O Amb33347486 [0,2,0,0,0,0|0,0,0]=2 4623 B10R0.88 CCOCC(NC=O)C(=O)O Amb33309089 [0,2,0,0,0,0|2,0,0]=4 4624 B10R0.88 COCCC(N=C=O)C(=O)O Amb33471358 [0,2,0,0,0,0|0,1,1]=4 4625 B10R0.88 COCCC(N=C=S)C(=O)O Amb33471588 [0,2,0,0,0,0|0,1,1]=4 4626 B10R0.88 COCCC(NC=O)C(=O)O Amb18183451 [0,2,0,0,0,0|0,1,0]=3 4627 B10R0.88 CSCCC(N=C=O)C(=O)O Amb33471293 [0,2,0,0,0,0|0,0,1]=3 4628 B10R0.88 CSCCC(N=C=S)C(=O)O Amb33194605 [0,2,0,0,0,0|0,0,1]=3 4629 B10R0.88 CSCC[C@@H](N=[N+]=[N-])C(=O)O Amb32620204 [0,2,0,0,0,0|0,0,1]=3 4630 B10R0.88 CSCC[C@@H](NC=O)C(=O)O Amb18180656 [0,2,0,0,0,0|0,0,0]=2 4631 B10R0.88 CSCC[C@H](N=C=O)C(=O)O Amb33471339 [0,2,0,0,0,0|0,0,1]=3 4632 B10R0.88 CSCC[C@H](N=C=S)C(=O)O Amb33471567 [0,2,0,0,0,0|0,0,1]=3 4633 B10R0.88 CSCC[C@H](N=[N+]=[N-])C(=O)O Amb32620233 [0,2,0,0,0,0|0,0,1]=3 4634 B10R0.88 CSCC[C@H](NC=O)C(=O)O Amb16232222 [0,2,0,0,0,0|0,0,0]=2 4635 B10R0.88 C\C=C\CC(NC=O)C(=O)O Amb33036726 [0,2,0,0,0,0|1,0,1]=4 4636 B10R0.88 N#CCCC(NC=O)C(=O)O Amb25386038 [0,2,0,0,0,0|2,0,0]=4 4637 B10R0.88 O=CNC(CCCF)C(=O)O Amb33127554 [0,2,0,0,0,0|2,0,0]=4 4638 B10R0.88 O=CNC(CCCO)C(=O)O Amb33037084 [0,2,0,0,0,0|2,0,0]=4 4639 B10R0.133 C#C[C@](N)(CCCN)C(=O)O Amb27271139 [0,2,0,0,0,0|2,0,0]=4 4640 B10R0.133 C=CC(C)(CCOC)C(=O)O Amb33102644 [0,2,0,0,0,0|1,1,0]=4 4641 B10R0.133 CCC(N)(CCCF)C(=O)O Amb32670158 [0,2,0,0,0,0|2,0,0]=4 4642 B10R0.133 CSCCC(C)(C#N)C(C)=O Amb27271795 [0,2,0,0,0,0|1,0,1]=4 4643 B10R0.133 NC(CO)(CCCF)C(=O)O Amb32670160 [0,2,0,0,0,0|2,0,0]=4 4644 B10R0.26 C#CCN(C)CC(N)C(=O)O Amb27986636 [0,2,0,0,0,0|1,0,1]=4 4645 B10R0.26 C=CCS(=O)C[C@@H](N)C(=O)O Amb16193379 [0,2,0,0,0,0|1,0,1]=4 4646 B10R0.26 C=CCS(=O)C[C@H](N)C(=O)O Amb10843492 [0,2,0,0,0,0|1,0,1]=4 4647 B10R0.26 CCCC(=O)CC(N)C(=O)O Amb33065496 [0,2,0,0,0,0|1,0,0]=3 4648 B10R0.26 CCCC(=O)CC(N)C(N)=O Amb33036932 [0,2,0,0,0,0|2,0,0]=4 4649 B10R0.26 CCCC(=O)C[C@@H](N)C(=O)O Amb33036798 [0,2,0,0,0,0|1,0,0]=3 4650 B10R0.26 CCCC(=O)C[C@H](N)C(=O)O Amb33065790 [0,2,0,0,0,0|1,0,0]=3 4651 B10R0.26 CCCC(C)CC(C)C(=O)O Amb18799967 [0,2,0,0,0,0|2,0,0]=4 4652 B10R0.26 CCCC(C)CC(N)C(=O)O Amb18183357 [0,2,0,0,0,0|1,0,0]=3 4653 B10R0.26 CCCC(C)CC(N)C(N)=O Amb33308991 [0,2,0,0,0,0|2,0,0]=4 4654 B10R0.26 CCCC(C)CC(O)C(=O)O Amb33353286 [0,2,0,0,0,0|2,0,0]=4 4655 B10R0.26 CCCC(C)C[C@@H](N)C(=O)O Amb33065585 [0,2,0,0,0,0|1,0,0]=3 4656 B10R0.26 CCCC(C)C[C@H](N)C(=O)O Amb33127579 [0,2,0,0,0,0|1,0,0]=3 4657 B10R0.26 CCCS(=O)C[C@@H](N)C(=O)O Amb22904243 [0,2,0,0,0,0|1,0,0]=3 4658 B10R0.26 CCNC(=O)CC(N)C(=O)O Amb27990016 [0,2,0,0,0,0|1,0,1]=4 4659 B10R0.26 CCOC(=O)CC(N)C(=O)O Amb4017449 [0,2,0,0,0,0|0,1,1]=4 4660 B10R0.26 CCOC(=O)CC(N)C(=O)O Amb4019239 [0,2,0,0,0,0|0,1,1]=4 4661 B10R0.26 CCOC(C)CC(C)C(=O)O Amb33474365 [0,2,0,0,0,0|1,1,0]=4 4662 B10R0.26 CCOC(C)CC(N)C(=O)O Amb33425733 [0,2,0,0,0,0|0,1,0]=3 4663 B10R0.26 CCOC(C)CC(O)C(=O)O Amb33079786 [0,2,0,0,0,0|1,1,0]=4 4664 B10R0.26 COCC(=O)CC(N)C(=O)O Amb32789418 [0,2,0,0,0,0|0,1,0]=3 4665 B10R0.26 COCC(=O)CC(N)C(N)=O Amb33065478 [0,2,0,0,0,0|1,1,0]=4 4666 B10R0.26 COCC(=O)C[C@@H](N)C(=O)O Amb33308520 [0,2,0,0,0,0|0,1,0]=3 4667 B10R0.26 COCC(=O)C[C@H](N)C(=O)O Amb33036839 [0,2,0,0,0,0|0,1,0]=3 4668 B10R0.26 COCC(C)CC(O)C(=O)O Amb33353382 [0,2,0,0,0,0|1,1,0]=4 4669 B10R0.26 COCC(O)CC(N)C(=O)O Amb33065944 [0,2,0,0,0,0|0,1,0]=3 4670 B10R0.26 COCC(O)CC(N)C(N)=O Amb33309017 [0,2,0,0,0,0|1,1,0]=4 4671 B10R0.26 COCC(O)C[C@@H](N)C(=O)O Amb33036693 [0,2,0,0,0,0|0,1,0]=3 4672 B10R0.26 COCC(O)C[C@H](N)C(=O)O Amb33037070 [0,2,0,0,0,0|0,1,0]=3 4673 B10R0.26 CSCC(=O)NC(C)C(=O)O Amb6743913 [0,2,0,0,0,0|1,0,1]=4 4674 B10R0.26 C\C(=C/CO)C[C@H](N)C(=O)O Amb27990183 [0,2,0,0,0,0|1,0,1]=4 4675 B10R0.26 C\C=C/[C@H](C)C[C@H](C)C(=O)O Amb27269205 [0,2,0,0,0,0|2,0,0]=4 4676 B10R0.26 C\C=C\S(=O)C[C@H](N)C(=O)O Amb27269201 [0,2,0,0,0,0|1,0,1]=4 4677 B10R0.26 N#CCS(=O)CC(N)C(=O)O Amb26081512 [0,2,0,0,0,0|2,0,0]=4 4678 B10R0.26 N#CCS(=O)C[C@H](N)C(=O)O Amb26998029 [0,2,0,0,0,0|2,0,0]=4 4679 B10R0.26 NCCC(Cl)CC(N)C(=O)O Amb29838276 [0,2,0,0,0,0|1,0,0]=3 4680 B10R0.26 NCCC(O)CC(N)C(=O)O Amb31031050 [0,2,0,0,0,0|1,0,0]=3 4681 B10R0.47 CC(N)(CC(N)CO)C(=O)O Amb27673261 [0,2,0,0,0,0|2,0,0]=4 4682 B10R0.47 CCC(C)CC(C)(C)C(=O)O Amb18182374 [0,2,0,0,0,0|2,0,0]=4 4683 B10R0.47 CCC(C)CC(C)(O)C(=O)O Amb33318471 [0,2,0,0,0,0|2,0,0]=4 4684 B10R0.47 CCC(C)CC(F)(F)C(=O)O Amb32811228 [0,2,0,0,0,0|2,0,0]=4 4685 B10R0.47 CCC(O)CC(C)(C)C(=O)O Amb27670925 [0,2,0,0,0,0|2,0,0]=4 4686 B10R0.47 CCN(C)CC(C)(N)C(=O)O Amb18183424 [0,2,0,0,0,0|2,0,0]=4 4687 B10R0.67 CC(C)(C#N)CC(N)C(=O)O Amb33308635 [0,2,0,0,0,0|2,0,0]=4 4688 B10R0.67 CC(C)(C#N)C[C@@H](N)C(=O)O Amb33065962 [0,2,0,0,0,0|2,0,0]=4 4689 B10R0.67 CC(C)(C#N)C[C@H](N)C(=O)O Amb33065461 [0,2,0,0,0,0|2,0,0]=4 4690 B10R0.67 CC(C)(CO)CC(N)C(=O)O Amb26082923 [0,2,0,0,0,0|2,0,0]=4 4691 B10R0.67 CC(C)(CO)C[C@@H](N)C(=O)O Amb33065558 [0,2,0,0,0,0|2,0,0]=4 4692 B10R0.67 CC(C)(CO)C[C@H](N)C(=O)O Amb25385185 [0,2,0,0,0,0|2,0,0]=4 4693 B10R0.67 CCC(C)(C)CC(C)C(=O)O Amb26999768 [0,2,0,0,0,0|2,0,0]=4 4694 B10R0.67 CCC(C)(C)CC(N)C(=O)O Amb27671645 [0,2,0,0,0,0|1,0,0]=3 4695 B10R0.67 CCC(C)(C)CC(N)C(N)=O Amb33065837 [0,2,0,0,0,0|2,0,0]=4 4696 B10R0.67 CCC(C)(C)CC(O)C(=O)O Amb33267014 [0,2,0,0,0,0|2,0,0]=4 4697 B10R0.67 CCC(C)(C)C[C@@H](N)C(=O)O Amb31295646 [0,2,0,0,0,0|1,0,0]=3 4698 B10R0.67 CCC(C)(C)C[C@H](N)C(=O)O Amb26660839 [0,2,0,0,0,0|1,0,0]=3 4699 B10R0.67 CCC(C)(O)CC(N)C(=O)O Amb33036874 [0,2,0,0,0,0|1,0,0]=3 4700 B10R0.67 CCC(C)(O)CC(N)C(N)=O Amb33309100 [0,2,0,0,0,0|2,0,0]=4 4701 B10R0.67 CCC(C)(O)C[C@@H](N)C(=O)O Amb33036712 [0,2,0,0,0,0|1,0,0]=3 4702 B10R0.67 CCC(C)(O)C[C@H](N)C(=O)O Amb33036564 [0,2,0,0,0,0|1,0,0]=3 4703 B10R0.67 CCC(F)(F)CC(N)C(=O)O Amb33309080 [0,2,0,0,0,0|1,0,0]=3 4704 B10R0.67 CCC(F)(F)CC(N)C(N)=O Amb33309052 [0,2,0,0,0,0|2,0,0]=4 4705 B10R0.67 CCC(F)(F)C[C@@H](N)C(=O)O Amb33308969 [0,2,0,0,0,0|1,0,0]=3 4706 B10R0.67 CCC(F)(F)C[C@H](N)C(=O)O Amb33036710 [0,2,0,0,0,0|1,0,0]=3 4707 B10R0.67 COC(C)(C)CC(C)C(=O)O Amb18305510 [0,2,0,0,0,0|1,1,0]=4 4708 B10R0.67 COC(C)(C)CC(F)C(=O)O Amb27674274 [0,2,0,0,0,0|1,1,0]=4 4709 B10R0.67 COC(C)(C)CC(N)C(=O)O Amb26997349 [0,2,0,0,0,0|0,1,0]=3 4710 B10R0.67 COC(C)(C)CC(N)C(N)=O Amb26997350 [0,2,0,0,0,0|1,1,0]=4 4711 B10R0.67 COC(C)(C)CC(O)C(=O)O Amb26997370 [0,2,0,0,0,0|1,1,0]=4 4712 B10R0.67 COC(C)(C)C[C@@H](N)C(=O)O Amb24764653 [0,2,0,0,0,0|0,1,0]=3 4713 B10R0.67 COC(C)(C)C[C@H](N)C(=O)O Amb24764652 [0,2,0,0,0,0|0,1,0]=3 4714 B10R0.67 CSC(C)(C)CC(N)C(=O)O Amb27674340 [0,2,0,0,0,0|0,0,0]=2 4715 B10R0.67 NCC(F)(F)C[C@@H](N)C(=O)O Amb25383715 [0,2,0,0,0,0|2,0,0]=4 4716 B10R0.72 CCC(CC(C)C(=O)O)OC Amb33321256 [0,2,0,0,0,0|1,1,0]=4 4717 B10R0.72 CCC(CC(N)C(=O)O)OC Amb33066094 [0,2,0,0,0,0|0,1,0]=3 4718 B10R0.72 CCC(CC(N)C(N)=O)OC Amb33127527 [0,2,0,0,0,0|1,1,0]=4 4719 B10R0.72 CCC(CC(O)C(=O)O)OC Amb33353281 [0,2,0,0,0,0|1,1,0]=4 4720 B10R0.72 CCC(CC)CC(C)C(=O)O Amb32413010 [0,2,0,0,0,0|2,0,0]=4 4721 B10R0.72 CCC(CC)CC(N)C(=O)O Amb18797540 [0,2,0,0,0,0|1,0,0]=3 4722 B10R0.72 CCC(CC)CC(N)C(N)=O Amb33065565 [0,2,0,0,0,0|2,0,0]=4 4723 B10R0.72 CCC(CC)CC(O)C(=O)O Amb33353320 [0,2,0,0,0,0|2,0,0]=4 4724 B10R0.72 CCC(CC)C[C@@H](N)C(=O)O Amb18182442 [0,2,0,0,0,0|1,0,0]=3 4725 B10R0.72 CCC(CC)C[C@@H](N)C(=O)O Amb30884428 [0,2,0,0,0,0|1,0,0]=3 4726 B10R0.72 CCC(CC)C[C@H](N)C(=O)O Amb33037013 [0,2,0,0,0,0|1,0,0]=3 4727 B10R0.72 CCC(C[C@@H](N)C(=O)O)OC Amb33036804 [0,2,0,0,0,0|0,1,0]=3 4728 B10R0.72 CCC(C[C@H](N)C(=O)O)OC Amb33065449 [0,2,0,0,0,0|0,1,0]=3 4729 B10R0.72 CCN(CC)CC(N)C(=O)O Amb18800375 [0,2,0,0,0,0|2,0,0]=4 4730 B10R0.72 CCN(CC)C[C@@H](N)C(=O)O Amb24078634 [0,2,0,0,0,0|2,0,0]=4 4731 B10R0.72 COC(CC(N)C(=O)O)OC Amb33225610 [0,2,0,0,0,0|0,1,0]=3 4732 B10R0.72 COC(CC(O)C(=O)O)OC Amb33342032 [0,2,0,0,0,0|1,1,0]=4 4733 B10R0.72 N#CC(C#N)C[C@H](N)C(=O)O Amb26880263 [0,2,0,0,0,0|2,0,0]=4 4734 B10R0.42 CC(N)(C\C=C\CN)C(=O)O Amb27673467 [0,2,0,0,0,0|1,0,1]=4 4735 B10R0.42 CCCCCC(C)(C)C(=O)O Amb33531410 [0,2,0,0,0,0|2,0,0]=4 4736 B10R0.42 CCCCCC(C)(O)C(=O)O Amb33359515 [0,2,0,0,0,0|2,0,0]=4 4737 B10R0.42 CCCCSC(C)(C)C(=O)O Amb17501482 [0,2,0,0,0,0|2,0,0]=4 4738 B10R0.42 CCCNCC(F)(F)C(=O)O Amb33170575 [0,2,0,0,0,0|2,0,0]=4 4739 B10R0.42 CCCOCC(F)(F)C(=O)O Amb33171243 [0,2,0,0,0,0|2,0,0]=4 4740 B10R0.42 CCCSCC(F)(F)C(=O)O Amb33171140 [0,2,0,0,0,0|2,0,0]=4 4741 B10R0.42 CCSCCC(C)(C)C(=O)O Amb33429927 [0,2,0,0,0,0|1,0,0]=3 4742 B10R0.42 CCSCCC(C)(O)C(=O)O Amb33323707 [0,2,0,0,0,0|1,0,0]=3 4743 B10R0.42 CNCCOC(C)(C)C(=O)O Amb18111854 [0,2,0,0,0,0|2,0,0]=4 4744 B10R0.42 COCCCC(C)(C)C(=O)O Amb18797801 [0,2,0,0,0,0|1,1,0]=4 4745 B10R0.42 COCCCC(C)(O)C(=O)O Amb33378802 [0,2,0,0,0,0|1,1,0]=4 4746 B10R0.42 COCCNC(C)(C)C(=O)O Amb17400084 [0,2,0,0,0,0|1,1,0]=4 4747 B10R0.42 COCCNC(C)(C)C(=O)O Amb32941889 [0,2,0,0,0,0|1,1,0]=4 4748 B10R0.42 COCOCC(C)(C)C(=O)O Amb32413741 [0,2,0,0,0,0|1,1,0]=4 4749 B10R0.42 CSCCCC(C)(C)C(=O)O Amb33172307 [0,2,0,0,0,0|1,0,0]=3 4750 B10R0.42 CSCCCC(C)(O)C(=O)O Amb33197644 [0,2,0,0,0,0|1,0,0]=3 4751 B10R0.42 O=C(O)C(O)(O)CCCCO Amb24113204 [0,2,0,0,0,0|2,0,0]=4 4752 B10R0.75 C=CCCCCC(N)C(=O)O Amb34184143 [0,2,0,0,0,0|1,0,0]=3 4753 B10R0.75 C=CCCCC[C@@H](N)C(=O)O Amb22747247 [0,2,0,0,0,0|1,0,0]=3 4754 B10R0.75 C=CCCCC[C@H](N)C(=O)O Amb22270014 [0,2,0,0,0,0|1,0,0]=3 4755 B10R0.75 C=CCOCCC(N)C(=O)O Amb33065557 [0,2,0,0,0,0|0,1,0]=3 4756 B10R0.75 C=CCOCCC(N)C(N)=O Amb32788581 [0,2,0,0,0,0|1,1,0]=4 4757 B10R0.75 C=CCOCC[C@@H](N)C(=O)O Amb33065682 [0,2,0,0,0,0|0,1,0]=3 4758 B10R0.75 C=CCOCC[C@H](N)C(=O)O Amb33065627 [0,2,0,0,0,0|0,1,0]=3 4759 B10R0.75 C=CCSCCC(N)C(=O)O Amb18180511 [0,2,0,0,0,0|0,0,0]=2 4760 B10R0.75 C=CCSCCC(N)C(=O)O Amb32663205 [0,2,0,0,0,0|0,0,0]=2 4761 B10R0.75 C=CCSCC[C@H](N)C(=O)O Amb32663418 [0,2,0,0,0,0|0,0,0]=2 4762 B10R0.75 C=CCSCC[C@H](N)C(=O)O Amb32663419 [0,2,0,0,0,0|0,0,0]=2 4763 B10R0.75 C=CCSSC[C@H](N)C(=O)O Amb33330242 [0,2,0,0,0,0|1,0,0]=3 4764 B10R0.75 C=C\C=C\CCC(N)C(=O)O Amb33308773 [0,2,0,0,0,0|1,0,1]=4 4765 B10R0.75 C=C\C=C\CC[C@@H](N)C(=O)O Amb33309012 [0,2,0,0,0,0|1,0,1]=4 4766 B10R0.75 C=C\C=C\CC[C@H](N)C(=O)O Amb33066030 [0,2,0,0,0,0|1,0,1]=4 4767 B10R0.75 CC#CCCCC(N)C(=O)O Amb27673466 [0,2,0,0,0,0|1,0,0]=3 4768 B10R0.75 CC#CCCOC(C)C(=O)O Amb27986310 [0,2,0,0,0,0|2,0,0]=4 4769 B10R0.75 CC#CCCO[C@@H](C)C(=O)O Amb27986322 [0,2,0,0,0,0|2,0,0]=4 4770 B10R0.75 CC#CCCO[C@H](C)C(=O)O Amb27986321 [0,2,0,0,0,0|2,0,0]=4 4771 B10R0.75 CC#CCCSC(C)C(=O)O Amb27988375 [0,2,0,0,0,0|2,0,0]=4 4772 B10R0.75 CC#CCNCC(C)C(=O)O Amb27988170 [0,2,0,0,0,0|2,0,0]=4 4773 B10R0.75 CC#CCNCC(N)C(=O)O Amb27988454 [0,2,0,0,0,0|1,0,0]=3 4774 B10R0.75 CC#CCNCC(O)C(=O)O Amb27270942 [0,2,0,0,0,0|2,0,0]=4 4775 B10R0.75 CC#CCSCC(C)C(=O)O Amb28386864 [0,2,0,0,0,0|2,0,0]=4 4776 B10R0.75 CC#CCSCC(N)C(=O)O Amb18183766 [0,2,0,0,0,0|1,0,0]=3 4777 B10R0.75 CC#CCSC[C@H](N)C(=O)O Amb27670833 [0,2,0,0,0,0|1,0,0]=3 4778 B10R0.75 CC(SCCCCN)C(=O)O Amb17500920 [0,2,0,0,0,0|2,0,0]=4 4779 B10R0.75 CCCCCCC(C)C(=O)O Amb10843971 [0,2,0,0,0,0|2,0,0]=4 4780 B10R0.75 CCCCCCC(F)C(=O)O Amb32663880 [0,2,0,0,0,0|2,0,0]=4 4781 B10R0.75 CCCCCCC(N)C(=O)O Amb2613445 [0,2,0,0,0,0|1,0,0]=3 4782 B10R0.75 CCCCCCC(N)C(N)=O Amb18791950 [0,2,0,0,0,0|2,0,0]=4 4783 B10R0.75 CCCCCC[C@@H](N)C(=O)O Amb16183913 [0,2,0,0,0,0|1,0,0]=3 4784 B10R0.75 CCCCCC[C@H](N)C(=O)O Amb16183914 [0,2,0,0,0,0|1,0,0]=3 4785 B10R0.75 CCCOCCC(N)C(=O)O Amb18177730 [0,2,0,0,0,0|0,1,0]=3 4786 B10R0.75 CCCOCCC(N)C(N)=O Amb18787994 [0,2,0,0,0,0|1,1,0]=4 4787 B10R0.75 CCCOCC[C@@H](N)C(=O)O Amb33036139 [0,2,0,0,0,0|0,1,0]=3 4788 B10R0.75 CCCOCC[C@H](N)C(=O)O Amb33065384 [0,2,0,0,0,0|0,1,0]=3 4789 B10R0.75 CCC\C=C\CC(C)C(=O)O Amb33171981 [0,2,0,0,0,0|2,0,0]=4 4790 B10R0.75 CCC\C=C\CC(N)C(=O)O Amb33327187 [0,2,0,0,0,0|1,0,0]=3 4791 B10R0.75 CCOCCCC(N)C(=O)O Amb33036943 [0,2,0,0,0,0|0,1,0]=3 4792 B10R0.75 CCOCCCC(N)C(N)=O Amb33308891 [0,2,0,0,0,0|1,1,0]=4 4793 B10R0.75 CCOCCC[C@@H](N)C(=O)O Amb33065544 [0,2,0,0,0,0|0,1,0]=3 4794 B10R0.75 CCOCCC[C@H](N)C(=O)O Amb33065515 [0,2,0,0,0,0|0,1,0]=3 4795 B10R0.75 CCOCCOC(C)C(=O)O Amb6262432 [0,2,0,0,0,0|1,1,0]=4 4796 B10R0.75 CCSCCCC(C)C(=O)O Amb33449009 [0,2,0,0,0,0|1,0,0]=3 4797 B10R0.75 CCSCCCC(N)C(=O)O Amb32865930 [0,2,0,0,0,0|0,0,0]=2 4798 B10R0.75 CCSCCCC(N)C(N)=O Amb33065711 [0,2,0,0,0,0|1,0,0]=3 4799 B10R0.75 CCSCCC[C@@H](N)C(=O)O Amb33066174 [0,2,0,0,0,0|0,0,0]=2 4800 B10R0.75 CCSCCC[C@H](N)C(=O)O Amb32937037 [0,2,0,0,0,0|0,0,0]=2 4801 B10R0.75 CC\C=C\CCC(C)C(=O)O Amb33267859 [0,2,0,0,0,0|2,0,0]=4 4802 B10R0.75 CNCCCC[C@H](N)C(=O)O Amb33786042 [0,2,0,0,0,0|1,0,0]=3 4803 B10R0.75 COCC#CCC(N)C(=O)O Amb33065829 [0,2,0,0,0,0|0,1,0]=3 4804 B10R0.75 COCC#CCC(N)C(N)=O Amb33308679 [0,2,0,0,0,0|1,1,0]=4 4805 B10R0.75 COCC#CC[C@@H](N)C(=O)O Amb33308826 [0,2,0,0,0,0|0,1,0]=3 4806 B10R0.75 COCC#CC[C@H](N)C(=O)O Amb33066259 [0,2,0,0,0,0|0,1,0]=3 4807 B10R0.75 COCCCCC(C)C(=O)O Amb32953450 [0,2,0,0,0,0|1,1,0]=4 4808 B10R0.75 COCCCCC(N)C(=O)O Amb33066324 [0,2,0,0,0,0|0,1,0]=3 4809 B10R0.75 COCCCCC(N)C(N)=O Amb33065768 [0,2,0,0,0,0|1,1,0]=4 4810 B10R0.75 COCCCC[C@@H](N)C(=O)O Amb33308996 [0,2,0,0,0,0|0,1,0]=3 4811 B10R0.75 COCCCC[C@H](N)C(=O)O Amb33036987 [0,2,0,0,0,0|0,1,0]=3 4812 B10R0.75 COCCOCC(N)C(=O)O Amb18177789 [0,2,0,0,0,0|0,1,0]=3 4813 B10R0.75 COCCOCC(N)C(N)=O Amb18788117 [0,2,0,0,0,0|1,1,0]=4 4814 B10R0.75 COCCOC[C@@H](N)C(=O)O Amb33308732 [0,2,0,0,0,0|0,1,0]=3 4815 B10R0.75 COCCOC[C@H](N)C(=O)O Amb32668352 [0,2,0,0,0,0|0,1,0]=3 4816 B10R0.75 COCCSCC(N)C(=O)O Amb6258105 [0,2,0,0,0,0|0,1,0]=3 4817 B10R0.75 CSCCCCC(C)C(=O)O Amb32953968 [0,2,0,0,0,0|1,0,0]=3 4818 B10R0.75 N#CCCCCC(N)C(=O)O Amb33042685 [0,2,0,0,0,0|1,0,0]=3 4819 B10R0.75 N#CCCCCC(N)C(N)=O Amb32789441 [0,2,0,0,0,0|2,0,0]=4 4820 B10R0.75 N#CCCCC[C@@H](N)C(=O)O Amb33308868 [0,2,0,0,0,0|1,0,0]=3 4821 B10R0.75 N#CCCCC[C@H](N)C(=O)O Amb32788598 [0,2,0,0,0,0|1,0,0]=3 4822 B10R0.75 N#[N+][N-]CCC[C@H](N)C(=O)O Amb33826504 [0,2,0,0,0,0|2,0,0]=4 4823 B10R0.75 NC(=O)C(N)CCCCCF Amb32789422 [0,2,0,0,0,0|2,0,0]=4 4824 B10R0.75 NC(=O)C(N)CCCCCO Amb33036732 [0,2,0,0,0,0|2,0,0]=4 4825 B10R0.75 NC(=O)C(N)CCOCCO Amb33308715 [0,2,0,0,0,0|1,1,0]=4 4826 B10R0.75 NC(CCC#CCCl)C(=O)O Amb28280148 [0,2,0,0,0,0|1,0,0]=3 4827 B10R0.75 NC(CCCCCF)C(=O)O Amb33036467 [0,2,0,0,0,0|1,0,0]=3 4828 B10R0.75 NC(CCCCCO)C(=O)O Amb33037096 [0,2,0,0,0,0|1,0,0]=3 4829 B10R0.75 NC(CCOCCO)C(=O)O Amb33065845 [0,2,0,0,0,0|0,1,0]=3 4830 B10R0.75 NC(CSCCCO)C(=O)O Amb8390352 [0,2,0,0,0,0|1,0,0]=3 4831 B10R0.75 NCCCSCC(N)C(=O)O Amb28652964 [0,2,0,0,0,0|1,0,0]=3 4832 B10R0.75 NCCCSCC(N)C(=O)O Amb32652572 [0,2,0,0,0,0|1,0,0]=3 4833 B10R0.75 NCCOCCC(N)C(=O)O Amb24081026 [0,2,0,0,0,0|0,1,0]=3 4834 B10R0.75 NCCOCCC(N)C(=O)O Amb32652927 [0,2,0,0,0,0|0,1,0]=3 4835 B10R0.75 NCCSCCC(N)C(=O)O Amb32652508 [0,2,0,0,0,0|0,0,0]=2 4836 B10R0.75 NCCSCCC(N)C(=O)O Amb32652509 [0,2,0,0,0,0|0,0,0]=2 4837 B10R0.75 N[C@@H](CCCCCF)C(=O)O Amb33065721 [0,2,0,0,0,0|1,0,0]=3 4838 B10R0.75 N[C@@H](CCCCCO)C(=O)O Amb33308918 [0,2,0,0,0,0|1,0,0]=3 4839 B10R0.75 N[C@@H](CCOCCO)C(=O)O Amb32864914 [0,2,0,0,0,0|0,1,0]=3 4840 B10R0.75 N[C@@H](CSCCCO)C(=O)O Amb8390824 [0,2,0,0,0,0|1,0,0]=3 4841 B10R0.75 N[C@H](CCCCCF)C(=O)O Amb33036618 [0,2,0,0,0,0|1,0,0]=3 4842 B10R0.75 N[C@H](CCCCCO)C(=O)O Amb33065614 [0,2,0,0,0,0|1,0,0]=3 4843 B10R0.75 N[C@H](CCOCCO)C(=O)O Amb33036125 [0,2,0,0,0,0|0,1,0]=3 4844 B10R0.98 CC(=O)CCCC(N)C(=O)O Amb33036722 [0,2,0,0,0,0|1,0,0]=3 4845 B10R0.98 CC(=O)CCCC(N)C(N)=O Amb33308963 [0,2,0,0,0,0|2,0,0]=4 4846 B10R0.98 CC(=O)CCC[C@@H](N)C(=O)O Amb32937025 [0,2,0,0,0,0|1,0,0]=3 4847 B10R0.98 CC(=O)CCC[C@H](N)C(=O)O Amb32865922 [0,2,0,0,0,0|1,0,0]=3 4848 B10R0.98 CC(=O)CCNC(C)C(=O)O Amb32675829 [0,2,0,0,0,0|2,0,0]=4 4849 B10R0.98 CC(=O)NCCC(C)C(=O)O Amb27270987 [0,2,0,0,0,0|2,0,0]=4 4850 B10R0.98 CC(=O)NCC[C@H](N)C(=O)O Amb26659493 [0,2,0,0,0,0|1,0,0]=3 4851 B10R0.98 CC(=O)NCC[C@H](O)C(=O)O Amb27670710 [0,2,0,0,0,0|2,0,0]=4 4852 B10R0.98 CC(C)=CCCC(N)C(=O)O Amb27001257 [0,2,0,0,0,0|1,0,0]=3 4853 B10R0.98 CC(C)=CCCC(N)C(N)=O Amb33065941 [0,2,0,0,0,0|2,0,0]=4 4854 B10R0.98 CC(C)=CCC[C@@H](N)C(=O)O Amb33065465 [0,2,0,0,0,0|1,0,0]=3 4855 B10R0.98 CC(C)=CCC[C@H](N)C(=O)O Amb25383796 [0,2,0,0,0,0|1,0,0]=3 4856 B10R0.98 CC(C)=CSCC(N)C(=O)O Amb25386034 [0,2,0,0,0,0|1,0,1]=4 4857 B10R0.98 CC(C)CCCC(C)C(=O)O Amb33358621 [0,2,0,0,0,0|2,0,0]=4 4858 B10R0.98 CC(C)CCCC(N)C(=O)O Amb30584746 [0,2,0,0,0,0|1,0,0]=3 4859 B10R0.98 CC(C)CCCC(N)C(=O)O Amb32679429 [0,2,0,0,0,0|1,0,0]=3 4860 B10R0.98 CC(C)CCCC(N)C(N)=O Amb32796888 [0,2,0,0,0,0|2,0,0]=4 4861 B10R0.98 CC(C)CCC[C@@H](C)C(=O)O Amb33727257 [0,2,0,0,0,0|2,0,0]=4 4862 B10R0.98 CC(C)CCC[C@@H](N)C(=O)O Amb22745714 [0,2,0,0,0,0|1,0,0]=3 4863 B10R0.98 CC(C)CCC[C@H](C)C(=O)O Amb33744631 [0,2,0,0,0,0|2,0,0]=4 4864 B10R0.98 CC(C)CCC[C@H](N)C(=O)O Amb34161240 [0,2,0,0,0,0|1,0,0]=3 4865 B10R0.98 CC(C)CCNC(C)C(=O)O Amb10609116 [0,2,0,0,0,0|2,0,0]=4 4866 B10R0.98 CC(C)CCNC(C)C(=O)O Amb1109923 [0,2,0,0,0,0|2,0,0]=4 4867 B10R0.98 CC(C)CCOC(C)C(=O)O Amb9728095 [0,2,0,0,0,0|2,0,0]=4 4868 B10R0.98 CC(C)CCSC(C)C(=O)O Amb6265720 [0,2,0,0,0,0|2,0,0]=4 4869 B10R0.98 CC(C)COCC(N)C(=O)O Amb18788052 [0,2,0,0,0,0|1,0,0]=3 4870 B10R0.98 CC(C)COCC(N)C(N)=O Amb18787974 [0,2,0,0,0,0|2,0,0]=4 4871 B10R0.98 CC(C)COC[C@@H](N)C(=O)O Amb33065410 [0,2,0,0,0,0|1,0,0]=3 4872 B10R0.98 CC(C)COC[C@H](N)C(=O)O Amb32668496 [0,2,0,0,0,0|1,0,0]=3 4873 B10R0.98 CC(C)OCCC(C)C(=O)O Amb18792223 [0,2,0,0,0,0|1,1,0]=4 4874 B10R0.98 CC(C)OCCC(N)C(=O)O Amb18180011 [0,2,0,0,0,0|0,1,0]=3 4875 B10R0.98 CC(C)OCCC(N)C(N)=O Amb18787993 [0,2,0,0,0,0|1,1,0]=4 4876 B10R0.98 CC(C)OCCC(O)C(=O)O Amb33274843 [0,2,0,0,0,0|1,1,0]=4 4877 B10R0.98 CC(C)OCC[C@@H](N)C(=O)O Amb31295667 [0,2,0,0,0,0|0,1,0]=3 4878 B10R0.98 CC(C)OCC[C@H](N)C(=O)O Amb33036708 [0,2,0,0,0,0|0,1,0]=3 4879 B10R0.98 CC(C)SCCC(N)C(=O)O Amb18180682 [0,2,0,0,0,0|0,0,0]=2 4880 B10R0.98 CC(C)SCCC(N)C(N)=O Amb18178327 [0,2,0,0,0,0|1,0,0]=3 4881 B10R0.98 CC(C)SCC[C@@H](N)C(=O)O Amb33069965 [0,2,0,0,0,0|0,0,0]=2 4882 B10R0.98 CC(C)SCC[C@H](N)C(=O)O Amb33065836 [0,2,0,0,0,0|0,0,0]=2 4883 B10R0.98 CC(CCCN(C)C)C(=O)O Amb33359292 [0,2,0,0,0,0|2,0,0]=4 4884 B10R0.98 CC(N)CCCC(C)C(=O)O Amb19337779 [0,2,0,0,0,0|2,0,0]=4 4885 B10R0.98 CC(N)CCCC(C)C(=O)O Amb22059651 [0,2,0,0,0,0|2,0,0]=4 4886 B10R0.98 CC(O)CCCC(N)C(=O)O Amb32941153 [0,2,0,0,0,0|1,0,0]=3 4887 B10R0.98 CC(O)CCCC(N)C(N)=O Amb33308669 [0,2,0,0,0,0|2,0,0]=4 4888 B10R0.98 CC(O)CCC[C@@H](N)C(=O)O Amb33066250 [0,2,0,0,0,0|1,0,0]=3 4889 B10R0.98 CC(O)CCC[C@H](N)C(=O)O Amb33127508 [0,2,0,0,0,0|1,0,0]=3 4890 B10R0.98 CC(OCCN(C)C)C(=O)O Amb33620705 [0,2,0,0,0,0|2,0,0]=4 4891 B10R0.98 CN(C)CCCC(N)C(=O)O Amb18199837 [0,2,0,0,0,0|1,0,0]=3 4892 B10R0.98 CN(C)CCCC(N)C(N)=O Amb33065486 [0,2,0,0,0,0|2,0,0]=4 4893 B10R0.98 CN(C)CCCC(O)C(=O)O Amb33272932 [0,2,0,0,0,0|2,0,0]=4 4894 B10R0.98 CN(C)CCC[C@@H](N)C(=O)O Amb31295703 [0,2,0,0,0,0|1,0,0]=3 4895 B10R0.98 CN(C)CCC[C@H](N)C(=O)O Amb33036715 [0,2,0,0,0,0|1,0,0]=3 4896 B10R0.98 C[C@@H](OCCN(C)C)C(=O)O Amb33803134 [0,2,0,0,0,0|2,0,0]=4 4897 B10R0.98 C[C@@H](OCCN(C)C)C(=O)O Amb33803286 [0,2,0,0,0,0|2,0,0]=4 4898 B10R0.98 N=C(N)NCC[C@@H](N)C(=O)O Amb27266501 [0,2,0,0,0,0|1,0,1]=4 4899 B10R0.98 N=C(N)NCC[C@H](N)C(=O)O Amb20240584 [0,2,0,0,0,0|1,0,1]=4 4900 B10R0.98 NC(=O)C(N)CCCC(F)F Amb33065708 [0,2,0,0,0,0|2,0,0]=4 4901 B10R0.98 NC(CCCC(=O)O)C(=O)O Amb22740152 [0,2,0,0,0,0|1,0,1]=4 4902 B10R0.98 NC(CCCC(=O)O)C(=O)O Amb6334822 [0,2,0,0,0,0|1,0,1]=4 4903 B10R0.98 NC(CCCC(F)F)C(=O)O Amb32788578 [0,2,0,0,0,0|1,0,0]=3 4904 B10R0.98 NC(CSCC(=O)O)C(=O)O Amb6740297 [0,2,0,0,0,0|2,0,0]=4 4905 B10R0.98 NC(N)=NCCC(N)C(=O)O Amb22492813 [0,2,0,0,0,0|1,0,1]=4 4906 B10R0.98 NC(N)=NCC[C@H](N)C(=O)O Amb33842525 [0,2,0,0,0,0|1,0,1]=4 4907 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O Amb6600090 [0,2,0,0,0,0|1,0,1]=4 4908 B10R0.98 N[C@@H](CCCC(F)F)C(=O)O Amb33066046 [0,2,0,0,0,0|1,0,0]=3 4909 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O Amb16232500 [0,2,0,0,0,0|2,0,0]=4 4910 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O Amb6336477 [0,2,0,0,0,0|2,0,0]=4 4911 B10R0.98 N[C@H](CCCC(=O)O)C(=O)O Amb8629031 [0,2,0,0,0,0|1,0,1]=4 4912 B10R0.98 N[C@H](CCCC(F)F)C(=O)O Amb33309003 [0,2,0,0,0,0|1,0,0]=3 4913 B8R1.1 C=C[C@@H]1CC[C@H](C)N1 Amb27788856 [1,0,0,1,0,0|2,0,0]=4 4914 B8R1.1 CC1CCC(C=O)C1 Amb33549452 [1,0,0,1,0,0|2,0,0]=4 4915 B8R1.1 CC1CCC(CO)N1 Amb26316183 [1,0,0,1,0,0|1,0,1]=4 4916 B8R1.1 CC1CCC(CO)N1 Amb32666058 [1,0,0,1,0,0|1,0,1]=4 4917 B8R1.1 CCC1CC(N)CO1 Amb29866234 [1,0,0,1,0,0|1,0,1]=4 4918 B8R1.1 CN1CCC(C=O)C1 Amb18833062 [1,0,0,1,0,0|2,0,0]=4 4919 B8R1.1 CSC1CCC(N)C1 Amb19337233 [1,0,0,1,0,0|1,0,1]=4 4920 B8R1.1 C[C@@H]1CC[C@H](CO)N1 Amb24679369 [1,0,0,1,0,0|1,0,1]=4 4921 B8R1.1 C[C@@H]1CC[C@H](CO)N1 Amb30594251 [1,0,0,1,0,0|1,0,1]=4 4922 B8R1.1 C[C@H]1CC[C@@H](CO)N1 Amb22886262 [1,0,0,1,0,0|1,0,1]=4 4923 B8R1.1 O=CC1CCC(=O)N1 Amb24113125 [1,0,0,1,0,0|2,0,0]=4 4924 B8R1.1 O=C[C@@H]1CCC(=O)N1 Amb27390986 [1,0,0,1,0,0|2,0,0]=4 4925 B8R1.2 C=CC1CCCCN1 Amb33551305 [1,0,0,1,0,0|2,0,0]=4 4926 B8R1.2 C=CC1CCCCN1 Amb6740273 [1,0,0,1,0,0|2,0,0]=4 4927 B8R1.2 O=CC1CCCCC1 Amb3939850 [1,0,0,1,0,0|2,0,0]=4 4928 B8R1.2 O=CC1CCCCN1 Amb20242687 [1,0,0,1,0,0|1,0,0]=3 4929 B8R1.2 O=CC1CCCCN1 Amb8384317 [1,0,0,1,0,0|1,0,0]=3 4930 B8R1.2 O=CC1CCCCO1 Amb8009759 [1,0,0,1,0,0|2,0,0]=4 4931 B8R1.2 O=CC1CCCCS1 Amb18642816 [1,0,0,1,0,0|2,0,0]=4 4932 B8R1.2 O=CC1CCNCC1 Amb16232416 [1,0,0,1,0,0|2,0,0]=4 4933 B8R1.2 O=CC1CCNCC1 Amb8630349 [1,0,0,1,0,0|2,0,0]=4 4934 B8R1.2 O=CC1CCOCC1 Amb2683355 [1,0,0,1,0,0|1,1,0]=4 4935 B8R1.2 O=CC1CCSCC1 Amb2683357 [1,0,0,1,0,0|1,0,0]=3 4936 B8R1.2 O=CC1COCCN1 Amb18833023 [1,0,0,1,0,0|2,0,0]=4 4937 B8R1.2 O=CN1CCSCC1 Amb28254656 [1,0,0,1,0,0|2,0,0]=4 4938 B8R1.2 O=C[C@@H]1CCCCN1 Amb27468660 [1,0,0,1,0,0|1,0,0]=3 4939 B8R1.2 O=C[C@H]1CCCCN1 Amb27203300 [1,0,0,1,0,0|1,0,0]=3 4940 B8R1.2 OCC1CCCCN1 Amb6768986 [1,0,0,1,0,0|1,0,1]=4 4941 B8R1.2 OCC1CCCCN1 Amb9703110 [1,0,0,1,0,0|1,0,1]=4 4942 B8R1.2 OCC1CCSCC1 Amb7990078 [1,0,0,1,0,0|1,0,1]=4 4943 B8R1.2 OCC1CCSCN1 Amb27216503 [1,0,0,1,0,0|0,0,1]=3 4944 B8R1.2 OC[C@@H]1CCCCN1 Amb13886314 [1,0,0,1,0,0|1,0,1]=4 4945 B8R1.2 OC[C@H]1CCCCN1 Amb13886286 [1,0,0,1,0,0|1,0,1]=4 4946 B8R1.3 CC1CCC(N)CO1 Amb35709402 [1,0,0,1,0,0|1,0,1]=4 4947 B8R1.5 C=C1CCCC[C@@H]1N Amb27252272 [1,0,0,1,0,0|2,0,0]=4 4948 B8R1.5 CC1CCCCC1=O Amb6608749 [1,0,0,1,0,0|2,0,0]=4 4949 B8R1.5 CC1CCNCC1=O Amb28990014 [1,0,0,1,0,0|2,0,0]=4 4950 B8R1.5 CC1CCNCC1=O Amb8388554 [1,0,0,1,0,0|2,0,0]=4 4951 B8R1.5 CC1CCOCC1=O Amb25718285 [1,0,0,1,0,0|1,1,0]=4 4952 B8R1.5 CC1CSCCC1N Amb18202892 [1,0,0,1,0,0|1,0,1]=4 4953 B8R1.5 NC1CCCCC1=O Amb17939051 [1,0,0,1,0,0|1,0,0]=3 4954 B8R1.5 NC1CCCCC1=O Amb22001819 [1,0,0,1,0,0|1,0,0]=3 4955 B8R1.5 NC1CCCCC1O Amb22228578 [1,0,0,1,0,0|1,0,1]=4 4956 B8R1.5 NC1CCCCC1O Amb31302362 [1,0,0,1,0,0|1,0,1]=4 4957 B8R1.5 NC1CCCCC1O Amb3428551 [1,0,0,1,0,0|1,0,1]=4 4958 B8R1.5 NC1CCCNC1=O Amb1088746 [1,0,0,1,0,0|2,0,0]=4 4959 B8R1.5 NC1CCCNC1=O Amb8428208 [1,0,0,1,0,0|2,0,0]=4 4960 B8R1.5 NC1CCNCC1O Amb22388661 [1,0,0,1,0,0|1,0,1]=4 4961 B8R1.5 NC1CCOCC1O Amb18198453 [1,0,0,1,0,0|0,1,1]=4 4962 B8R1.5 NC1CCOCC1O Amb28934888 [1,0,0,1,0,0|0,1,1]=4 4963 B8R1.5 NC1CCONC1=O Amb22295935 [1,0,0,1,0,0|1,1,0]=4 4964 B8R1.5 NC1CNCCC1=O Amb27635311 [1,0,0,1,0,0|2,0,0]=4 4965 B8R1.5 NC1COCCC1=O Amb18833021 [1,0,0,1,0,0|2,0,0]=4 4966 B8R1.5 NC1COCCC1=O Amb32670691 [1,0,0,1,0,0|2,0,0]=4 4967 B8R1.5 NC1CSCCC1=O Amb4296938 [1,0,0,1,0,0|2,0,0]=4 4968 B8R1.5 NN1CCCCC1=O Amb13952152 [1,0,0,1,0,0|2,0,0]=4 4969 B8R1.5 NN1CCCCC1=O Amb22275946 [1,0,0,1,0,0|2,0,0]=4 4970 B8R1.5 NN1CCOCC1=O Amb27238452 [1,0,0,1,0,0|1,1,0]=4 4971 B8R1.5 N[C@@H]1CCCC[C@@H]1O Amb1993806 [1,0,0,1,0,0|1,0,1]=4 4972 B8R1.5 N[C@@H]1CCCC[C@@H]1O Amb1993917 [1,0,0,1,0,0|1,0,1]=4 4973 B8R1.5 N[C@@H]1CCCC[C@H]1O Amb1993805 [1,0,0,1,0,0|1,0,1]=4 4974 B8R1.5 N[C@@H]1CCCC[C@H]1O Amb1993916 [1,0,0,1,0,0|1,0,1]=4 4975 B8R1.5 N[C@@H]1CCCNC1=O Amb19943908 [1,0,0,1,0,0|2,0,0]=4 4976 B8R1.5 N[C@@H]1CCCNC1=O Amb22388613 [1,0,0,1,0,0|2,0,0]=4 4977 B8R1.5 N[C@@H]1CCNC[C@H]1O Amb27421907 [1,0,0,1,0,0|1,0,1]=4 4978 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb22406155 [1,0,0,1,0,0|0,1,1]=4 4979 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb23385312 [1,0,0,1,0,0|0,1,1]=4 4980 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb22406158 [1,0,0,1,0,0|0,1,1]=4 4981 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb23385253 [1,0,0,1,0,0|0,1,1]=4 4982 B8R1.5 N[C@@H]1CCSC[C@@H]1O Amb27207385 [1,0,0,1,0,0|0,0,1]=3 4983 B8R1.5 N[C@@H]1CCSC[C@H]1O Amb27456499 [1,0,0,1,0,0|0,0,1]=3 4984 B8R1.5 N[C@H]1CCCC[C@@H]1O Amb19515805 [1,0,0,1,0,0|1,0,1]=4 4985 B8R1.5 N[C@H]1CCCC[C@@H]1O Amb2612694 [1,0,0,1,0,0|1,0,1]=4 4986 B8R1.5 N[C@H]1CCCC[C@H]1O Amb19516016 [1,0,0,1,0,0|1,0,1]=4 4987 B8R1.5 N[C@H]1CCCC[C@H]1O Amb20622436 [1,0,0,1,0,0|1,0,1]=4 4988 B8R1.5 N[C@H]1CCCNC1=O Amb10603272 [1,0,0,1,0,0|2,0,0]=4 4989 B8R1.5 N[C@H]1CCCNC1=O Amb8631316 [1,0,0,1,0,0|2,0,0]=4 4990 B8R1.5 N[C@H]1CCNC[C@@H]1O Amb28052491 [1,0,0,1,0,0|1,0,1]=4 4991 B8R1.5 N[C@H]1CCNC[C@H]1O Amb27815748 [1,0,0,1,0,0|1,0,1]=4 4992 B8R1.5 N[C@H]1CCOC[C@@H]1O Amb25970035 [1,0,0,1,0,0|0,1,1]=4 4993 B8R1.5 N[C@H]1CCOC[C@@H]1O Amb33725444 [1,0,0,1,0,0|0,1,1]=4 4994 B8R1.5 N[C@H]1CCOC[C@H]1O Amb26407654 [1,0,0,1,0,0|0,1,1]=4 4995 B8R1.5 N[C@H]1CCOC[C@H]1O Amb33801116 [1,0,0,1,0,0|0,1,1]=4 4996 B8R1.5 N[C@H]1CCSC[C@@H]1O Amb28052492 [1,0,0,1,0,0|0,0,1]=3 4997 B8R1.5 O=C1CCCCC1Br Amb8394127 [1,0,0,1,0,0|2,0,0]=4 4998 B8R1.5 O=C1CCCCC1Cl Amb1154371 [1,0,0,1,0,0|2,0,0]=4 4999 B8R1.5 O=C1CCCCC1F Amb10605769 [1,0,0,1,0,0|2,0,0]=4 5000 B8R1.5 O=C1CCCCC1I Amb28239314 [1,0,0,1,0,0|2,0,0]=4 5001 B8R1.5 O=C1CCCCC1O Amb8390042 [1,0,0,1,0,0|2,0,0]=4 5002 B8R1.5 O=C1CCCCC1S Amb25839265 [1,0,0,1,0,0|2,0,0]=4 5003 B8R1.5 O=C1CCCC[C@@H]1F Amb24379012 [1,0,0,1,0,0|2,0,0]=4 5004 B8R1.5 O=C1CCCC[C@@H]1O Amb28316212 [1,0,0,1,0,0|2,0,0]=4 5005 B8R1.5 O=C1CCCC[C@H]1Cl Amb28119800 [1,0,0,1,0,0|2,0,0]=4 5006 B8R1.5 O=C1COCCC1Br Amb24416092 [1,0,0,1,0,0|1,1,0]=4 5007 B8R1.5 O=C1COCCC1F Amb28048950 [1,0,0,1,0,0|1,1,0]=4 5008 B8R1.5 O=C1COCC[C@H]1F Amb27207103 [1,0,0,1,0,0|1,1,0]=4 5009 B8R1.5 OC1CCSCC1O Amb27211025 [1,0,0,1,0,0|1,0,1]=4 5010 B8R1.10 CSCCC1CCN1 Amb33198741 [1,0,0,1,0,0|1,0,1]=4 5011 B8R1.17 CCC[C@@H]1C[C@@H]1C=O Amb27841173 [1,0,0,1,0,0|2,0,0]=4 5012 B8R1.17 CCC[C@@H]1O[C@@H]1C=O Amb28142382 [1,0,0,1,0,0|2,0,0]=4 5013 B8R1.22 NC1C=CCCCC1 Amb24377373 [1,0,0,1,0,0|2,0,0]=4 5014 B8R1.22 NC1CCCSCC1 Amb18199477 [1,0,0,1,0,0|1,0,1]=4 5015 B8R1.22 NC1CCCSCC1 Amb33328660 [1,0,0,1,0,0|1,0,1]=4 5016 B8R1.38 C#CC(N)C1CSC1 Amb35697078 [1,0,0,1,0,0|1,0,1]=4 5017 B8R1.38 C=CC(N)C1CSC1 Amb35697080 [1,0,0,1,0,0|1,0,0]=3 5018 B8R1.38 C=CC(O)C1CSC1 Amb35711349 [1,0,0,1,0,0|2,0,0]=4 5019 B8R1.38 C=C[C@@H](N)C1CCC1 Amb27810796 [1,0,0,1,0,0|2,0,0]=4 5020 B8R1.38 C=C[C@H](N)C1CCC1 Amb27817658 [1,0,0,1,0,0|2,0,0]=4 5021 B8R1.38 CC(C=O)C1CCC1 Amb25918317 [1,0,0,1,0,0|2,0,0]=4 5022 B8R1.38 CC(CO)C1CSC1 Amb27215580 [1,0,0,1,0,0|1,0,1]=4 5023 B8R1.38 CCC(N)C1CSC1 Amb25938941 [1,0,0,1,0,0|1,0,1]=4 5024 B8R1.38 CC[C@@H](N)C1CSC1 Amb35717409 [1,0,0,1,0,0|1,0,1]=4 5025 B8R1.38 CC[C@H](N)C1CSC1 Amb35717410 [1,0,0,1,0,0|1,0,1]=4 5026 B8R1.38 NC(CO)C1CCC1 Amb24077492 [1,0,0,1,0,0|1,0,1]=4 5027 B8R1.38 NC(CO)C1CCC1 Amb33544272 [1,0,0,1,0,0|1,0,1]=4 5028 B8R1.38 N[C@@H](CO)C1CCC1 Amb24077485 [1,0,0,1,0,0|1,0,1]=4 5029 B8R1.38 N[C@@H](CO)C1CCC1 Amb27780087 [1,0,0,1,0,0|1,0,1]=4 5030 B8R1.38 N[C@H](CO)C1CCC1 Amb24077520 [1,0,0,1,0,0|1,0,1]=4 5031 B8R1.38 N[C@H](CO)C1CCC1 Amb26018518 [1,0,0,1,0,0|1,0,1]=4 5032 B8R1.38 N\C(=N/O)C1CSC1 Amb26890692 [1,0,0,1,0,0|1,0,1]=4 5033 B8R1.38 O=CC(F)C1CCC1 Amb22011677 [1,0,0,1,0,0|2,0,0]=4 5034 B8R1.40 CC(C=O)CC1CC1 Amb25100922 [1,0,0,1,0,0|2,0,0]=4 5035 B8R1.40 NC(CO)CC1CC1 Amb18203350 [1,0,0,1,0,0|1,0,1]=4 5036 B8R1.40 NC(CO)CC1CC1 Amb33544543 [1,0,0,1,0,0|1,0,1]=4 5037 B8R1.40 N[C@@H](CO)CC1CC1 Amb28457801 [1,0,0,1,0,0|1,0,1]=4 5038 B8R1.40 N[C@@H](CO)CC1CC1 Amb34154929 [1,0,0,1,0,0|1,0,1]=4 5039 B8R1.40 N[C@H](CO)CC1CC1 Amb26843116 [1,0,0,1,0,0|1,0,1]=4 5040 B8R1.40 N[C@H](CO)CC1CC1 Amb34160420 [1,0,0,1,0,0|1,0,1]=4 5041 B8R1.40 O=CC(O)CC1CC1 Amb27490937 [1,0,0,1,0,0|2,0,0]=4 5042 B8R1.41 CSCCC1(C)CO1 Amb33198274 [1,0,0,1,0,0|1,0,1]=4 5043 B8R1.41 CSCCC1(N)CC1 Amb26891078 [1,0,0,1,0,0|1,0,1]=4 5044 B8R1.46 CCN1CC(N)C1=O Amb28120795 [1,0,0,1,0,0|2,0,0]=4 5045 B8R1.46 CON1CC(N)C1=O Amb35713160 [1,0,0,1,0,0|1,1,0]=4 5046 B8R1.47 COC1CC(C=O)C1 Amb26439325 [1,0,0,1,0,0|1,1,0]=4 5047 B8R1.50 CC1CCC(C)C1=O Amb27198252 [1,0,0,1,0,0|2,0,0]=4 5048 B8R1.50 CC1CCC(F)C1=O Amb32656355 [1,0,0,1,0,0|2,0,0]=4 5049 B8R1.50 CC1CCC(N)C1O Amb27595668 [1,0,0,1,0,0|1,0,1]=4 5050 B8R1.50 CC1CCN(C)C1=O Amb10068267 [1,0,0,1,0,0|2,0,0]=4 5051 B8R1.50 CN1CCC(Br)C1=O Amb19514590 [1,0,0,1,0,0|2,0,0]=4 5052 B8R1.50 CN1CCC(Cl)C1=O Amb26433662 [1,0,0,1,0,0|2,0,0]=4 5053 B8R1.50 CN1CCC(N)C1=O Amb22491599 [1,0,0,1,0,0|1,0,0]=3 5054 B8R1.50 CN1CCC(N)C1=O Amb33538759 [1,0,0,1,0,0|1,0,0]=3 5055 B8R1.50 CN1CCC(O)C1=O Amb20622738 [1,0,0,1,0,0|2,0,0]=4 5056 B8R1.50 CN1CCN(N)C1=O Amb24643625 [1,0,0,1,0,0|2,0,0]=4 5057 B8R1.50 CN1CC[C@@H](N)C1=O Amb25303747 [1,0,0,1,0,0|1,0,0]=3 5058 B8R1.50 CN1CC[C@H](N)C1=O Amb25889201 [1,0,0,1,0,0|1,0,0]=3 5059 B8R1.50 CN1OCC(N)C1=O Amb25867269 [1,0,0,1,0,0|2,0,0]=4 5060 B8R1.50 C[C@H]1CC[C@H](C)C1=O Amb27434148 [1,0,0,1,0,0|2,0,0]=4 5061 B8R1.50 NC1CCN(O)C1=O Amb8631273 [1,0,0,1,0,0|2,0,0]=4 5062 B8R1.50 N[C@@H]1CCN(O)C1=O Amb22362895 [1,0,0,1,0,0|2,0,0]=4 5063 B8R1.50 N[C@H]1CCN(O)C1=O Amb25345964 [1,0,0,1,0,0|2,0,0]=4 5064 B8R1.52 C=CC1(N)CCCC1 Amb28430427 [1,0,0,1,0,0|2,0,0]=4 5065 B8R1.52 C=CC1(N)CCCC1 Amb31188132 [1,0,0,1,0,0|2,0,0]=4 5066 B8R1.52 C=CC1(O)CCSC1 Amb28062723 [1,0,0,1,0,0|2,0,0]=4 5067 B8R1.52 CC1(C=O)CCCC1 Amb18641706 [1,0,0,1,0,0|2,0,0]=4 5068 B8R1.52 CC1(C=O)CCOC1 Amb18641777 [1,0,0,1,0,0|1,1,0]=4 5069 B8R1.52 N#CC1(N)CCSC1 Amb9704515 [1,0,0,1,0,0|1,0,1]=4 5070 B8R1.52 NC1(CO)CCCC1 Amb2236186 [1,0,0,1,0,0|1,0,1]=4 5071 B8R1.52 NC1(CO)CCCC1 Amb2695458 [1,0,0,1,0,0|1,0,1]=4 5072 B8R1.52 NC1(CO)CCNC1 Amb23515101 [1,0,0,1,0,0|1,0,1]=4 5073 B8R1.52 NC1(CO)CCNC1 Amb33624213 [1,0,0,1,0,0|1,0,1]=4 5074 B8R1.52 NC1(CO)CCOC1 Amb23440194 [1,0,0,1,0,0|0,1,1]=4 5075 B8R1.52 NC1(CO)CCSC1 Amb18944443 [1,0,0,1,0,0|0,0,1]=3 5076 B8R1.52 O=CC1(Br)CCCC1 Amb25758600 [1,0,0,1,0,0|2,0,0]=4 5077 B8R1.52 O=CC1(Cl)CCCC1 Amb35788343 [1,0,0,1,0,0|2,0,0]=4 5078 B8R1.52 O=CC1(F)CCCC1 Amb27948601 [1,0,0,1,0,0|2,0,0]=4 5079 B8R1.52 O=CC1(O)CCCC1 Amb18124253 [1,0,0,1,0,0|2,0,0]=4 5080 B8R1.52 OCC1(F)CCSC1 Amb27782192 [1,0,0,1,0,0|1,0,1]=4 5081 B8R1.52 OCC1(O)CCSC1 Amb24116839 [1,0,0,1,0,0|1,0,1]=4 5082 B8R1.83 C=CC(N)C1CC1C Amb27494331 [1,0,0,1,0,0|2,0,0]=4 5083 B8R1.83 CC(C=O)C1CC1C Amb33144234 [1,0,0,1,0,0|2,0,0]=4 5084 B8R1.83 CC1CC1C(N)CO Amb33359775 [1,0,0,1,0,0|1,0,1]=4 5085 B8R1.83 CC1CC1[C@@H](N)CO Amb33144259 [1,0,0,1,0,0|1,0,1]=4 5086 B8R1.83 CC1CC1[C@H](N)CO Amb33144260 [1,0,0,1,0,0|1,0,1]=4 5087 B8R1.4 CC1=CC(=O)CCC1 Amb17776565 [1,0,0,1,0,0|2,0,0]=4 5088 B8R1.4 CC1=CCCC(=O)O1 Amb21520320 [1,0,0,1,0,0|1,0,1]=4 5089 B8R1.4 CC1=NC(=O)CCC1 Amb28239945 [1,0,0,1,0,0|2,0,0]=4 5090 B8R1.4 CC1CCCC(=O)C1 Amb1151295 [1,0,0,1,0,0|2,0,0]=4 5091 B8R1.4 CC1CCCC(=O)N1 Amb22372271 [1,0,0,1,0,0|2,0,0]=4 5092 B8R1.4 CC1CCCC(=O)O1 Amb19405726 [1,0,0,1,0,0|1,0,0]=3 5093 B8R1.4 CC1CCOC(=O)O1 Amb33714707 [1,0,0,1,0,0|2,0,0]=4 5094 B8R1.4 CN1CCCC(=O)C1 Amb10602467 [1,0,0,1,0,0|2,0,0]=4 5095 B8R1.4 CN1CCCC(=O)C1 Amb22304741 [1,0,0,1,0,0|2,0,0]=4 5096 B8R1.4 CN1CCCC(=O)C1 Amb31204623 [1,0,0,1,0,0|2,0,0]=4 5097 B8R1.4 C[C@@H]1CCCC(=O)C1 Amb21618704 [1,0,0,1,0,0|2,0,0]=4 5098 B8R1.4 C[C@@H]1CCCC(=O)N1 Amb25772093 [1,0,0,1,0,0|2,0,0]=4 5099 B8R1.4 C[C@@H]1CCCC(=O)O1 Amb4166295 [1,0,0,1,0,0|1,0,0]=3 5100 B8R1.4 C[C@H]1CCCC(=O)C1 Amb22799724 [1,0,0,1,0,0|2,0,0]=4 5101 B8R1.4 C[C@H]1CCCC(=O)O1 Amb26865751 [1,0,0,1,0,0|1,0,0]=3 5102 B8R1.4 O=C1CCCC(=O)O1 Amb6608952 [1,0,0,1,0,0|2,0,0]=4 5103 B8R1.6 CCCC1CC(=O)C1 Amb27398824 [1,0,0,1,0,0|2,0,0]=4 5104 B8R1.6 CCCC1CC(=O)N1 Amb26494598 [1,0,0,1,0,0|2,0,0]=4 5105 B8R1.6 CCC[C@H]1CC(=O)N1 Amb27184591 [1,0,0,1,0,0|2,0,0]=4 5106 B8R1.6 COCC1CC(=O)C1 Amb25771052 [1,0,0,1,0,0|1,1,0]=4 5107 B8R1.7 CC(=O)C1CCCC1 Amb2612425 [1,0,0,1,0,0|2,0,0]=4 5108 B8R1.7 CC(=O)C1CCNC1 Amb18833067 [1,0,0,1,0,0|2,0,0]=4 5109 B8R1.7 CC(=O)C1CCNC1 Amb22899078 [1,0,0,1,0,0|2,0,0]=4 5110 B8R1.7 CC(=O)C1CCOC1 Amb18833038 [1,0,0,1,0,0|1,1,0]=4 5111 B8R1.7 CC(=O)C1CCSC1 Amb27412975 [1,0,0,1,0,0|1,0,0]=3 5112 B8R1.7 CC(=O)[C@@H]1CCNC1 Amb30039124 [1,0,0,1,0,0|2,0,0]=4 5113 B8R1.7 CC(=O)[C@H]1CCNC1 Amb33132071 [1,0,0,1,0,0|2,0,0]=4 5114 B8R1.7 C[C@@H](O)C1CCSC1 Amb33141336 [1,0,0,1,0,0|1,0,1]=4 5115 B8R1.7 C[C@H](O)C1CCSC1 Amb33141325 [1,0,0,1,0,0|1,0,1]=4 5116 B8R1.7 N=C(N)C1CCSC1 Amb29849405 [1,0,0,1,0,0|2,0,0]=4 5117 B8R1.7 NC(=O)C1CCCC1 Amb8858372 [1,0,0,1,0,0|2,0,0]=4 5118 B8R1.7 NC(=O)C1CCNC1 Amb19373271 [1,0,0,1,0,0|2,0,0]=4 5119 B8R1.7 NC(=O)C1CCNC1 Amb9728548 [1,0,0,1,0,0|2,0,0]=4 5120 B8R1.7 NC(=O)C1CCOC1 Amb9677690 [1,0,0,1,0,0|1,1,0]=4 5121 B8R1.7 NC(=O)C1CSCN1 Amb2967256 [1,0,0,1,0,0|2,0,0]=4 5122 B8R1.7 NC(=O)[C@@H]1CCNC1 Amb20671394 [1,0,0,1,0,0|2,0,0]=4 5123 B8R1.7 NC(=O)[C@@H]1CCNC1 Amb22405894 [1,0,0,1,0,0|2,0,0]=4 5124 B8R1.7 NC(=O)[C@@H]1CCOC1 Amb27413583 [1,0,0,1,0,0|1,1,0]=4 5125 B8R1.7 NC(=O)[C@H]1CCNC1 Amb20671395 [1,0,0,1,0,0|2,0,0]=4 5126 B8R1.7 NC(=O)[C@H]1CCNC1 Amb22405893 [1,0,0,1,0,0|2,0,0]=4 5127 B8R1.7 NC(=O)[C@H]1CCOC1 Amb33228699 [1,0,0,1,0,0|1,1,0]=4 5128 B8R1.7 NC(=S)C1CCSC1 Amb30011189 [1,0,0,1,0,0|1,1,0]=4 5129 B8R1.7 O=C(Br)C1CCCC1 Amb27793826 [1,0,0,1,0,0|2,0,0]=4 5130 B8R1.7 O=C(Cl)C1CCCC1 Amb3939172 [1,0,0,1,0,0|2,0,0]=4 5131 B8R1.7 O=C(Cl)C1CCNC1 Amb28316213 [1,0,0,1,0,0|2,0,0]=4 5132 B8R1.7 O=C(Cl)C1CCOC1 Amb9677595 [1,0,0,1,0,0|1,1,0]=4 5133 B8R1.7 O=C(Cl)C1CCSC1 Amb27778382 [1,0,0,1,0,0|1,0,0]=3 5134 B8R1.7 O=C(Cl)C1CSCN1 Amb17142875 [1,0,0,1,0,0|2,0,0]=4 5135 B8R1.7 O=C(O)C1=CCSC1 Amb18642797 [1,0,0,1,0,0|0,0,2]=4 5136 B8R1.7 O=C(O)C1C=CCC1 Amb18641680 [1,0,0,1,0,0|1,0,1]=4 5137 B8R1.7 O=C(O)C1CC=CC1 Amb2694750 [1,0,0,1,0,0|1,0,1]=4 5138 B8R1.7 O=C(O)C1CCC=N1 Amb27849168 [1,0,0,1,0,0|2,0,0]=4 5139 B8R1.7 O=C(O)C1CCCC1 Amb3939849 [1,0,0,1,0,0|1,0,0]=3 5140 B8R1.7 O=C(O)C1CCCN1 Amb1157517 [1,0,0,1,0,0|2,0,0]=4 5141 B8R1.7 O=C(O)C1CCCN1 Amb22040086 [1,0,0,1,0,0|2,0,0]=4 5142 B8R1.7 O=C(O)C1CCCO1 Amb9702828 [1,0,0,1,0,0|2,0,0]=4 5143 B8R1.7 O=C(O)C1CCCS1 Amb18124363 [1,0,0,1,0,0|2,0,0]=4 5144 B8R1.7 O=C(O)C1CCNC1 Amb16230724 [1,0,0,1,0,0|1,0,0]=3 5145 B8R1.7 O=C(O)C1CCNC1 Amb16233446 [1,0,0,1,0,0|1,0,0]=3 5146 B8R1.7 O=C(O)C1CCNC1 Amb2694866 [1,0,0,1,0,0|1,0,0]=3 5147 B8R1.7 O=C(O)C1CCNO1 Amb28205451 [1,0,0,1,0,0|2,0,0]=4 5148 B8R1.7 O=C(O)C1CCNO1 Amb33329025 [1,0,0,1,0,0|2,0,0]=4 5149 B8R1.7 O=C(O)C1CCOC1 Amb33542759 [1,0,0,1,0,0|0,1,0]=3 5150 B8R1.7 O=C(O)C1CCSC1 Amb18124360 [1,0,0,1,0,0|0,0,0]=2 5151 B8R1.7 O=C(O)C1CCSS1 Amb8388097 [1,0,0,1,0,0|1,0,0]=3 5152 B8R1.7 O=C(O)C1CNCN1 Amb27597638 [1,0,0,1,0,0|2,0,0]=4 5153 B8R1.7 O=C(O)C1COCN1 Amb2694915 [1,0,0,1,0,0|1,1,0]=4 5154 B8R1.7 O=C(O)C1COCN1 Amb2696354 [1,0,0,1,0,0|1,1,0]=4 5155 B8R1.7 O=C(O)C1COCO1 Amb27810510 [1,0,0,1,0,0|1,1,0]=4 5156 B8R1.7 O=C(O)C1CSCN1 Amb532947 [1,0,0,1,0,0|1,0,0]=3 5157 B8R1.7 O=C(O)C1CSSC1 Amb17593735 [1,0,0,1,0,0|1,0,0]=3 5158 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb3940757 [1,0,0,1,0,0|2,0,0]=4 5159 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb6754105 [1,0,0,1,0,0|2,0,0]=4 5160 B8R1.7 O=C(O)[C@@H]1CCCO1 Amb3940908 [1,0,0,1,0,0|2,0,0]=4 5161 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb6893875 [1,0,0,1,0,0|1,0,0]=3 5162 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb8630322 [1,0,0,1,0,0|1,0,0]=3 5163 B8R1.7 O=C(O)[C@@H]1CCOC1 Amb10603235 [1,0,0,1,0,0|0,1,0]=3 5164 B8R1.7 O=C(O)[C@@H]1CCON1 Amb26919409 [1,0,0,1,0,0|1,1,0]=4 5165 B8R1.7 O=C(O)[C@@H]1COCN1 Amb19515958 [1,0,0,1,0,0|1,1,0]=4 5166 B8R1.7 O=C(O)[C@@H]1CSC=N1 Amb35648199 [1,0,0,1,0,0|1,0,1]=4 5167 B8R1.7 O=C(O)[C@@H]1CSCN1 Amb3940400 [1,0,0,1,0,0|1,0,0]=3 5168 B8R1.7 O=C(O)[C@H]1C=CCC1 Amb27872028 [1,0,0,1,0,0|1,0,1]=4 5169 B8R1.7 O=C(O)[C@H]1CCC=N1 Amb28128325 [1,0,0,1,0,0|2,0,0]=4 5170 B8R1.7 O=C(O)[C@H]1CCCN1 Amb2720569 [1,0,0,1,0,0|2,0,0]=4 5171 B8R1.7 O=C(O)[C@H]1CCCO1 Amb3941554 [1,0,0,1,0,0|2,0,0]=4 5172 B8R1.7 O=C(O)[C@H]1CCNC1 Amb2700058 [1,0,0,1,0,0|1,0,0]=3 5173 B8R1.7 O=C(O)[C@H]1CCNC1 Amb6893874 [1,0,0,1,0,0|1,0,0]=3 5174 B8R1.7 O=C(O)[C@H]1CCOC1 Amb22226787 [1,0,0,1,0,0|0,1,0]=3 5175 B8R1.7 O=C(O)[C@H]1CCSC1 Amb28241390 [1,0,0,1,0,0|0,0,0]=2 5176 B8R1.7 O=C(O)[C@H]1CNCS1 Amb27414077 [1,0,0,1,0,0|2,0,0]=4 5177 B8R1.7 O=C(O)[C@H]1CSC=N1 Amb35641724 [1,0,0,1,0,0|1,0,1]=4 5178 B8R1.7 O=C(O)[C@H]1CSCN1 Amb544887 [1,0,0,1,0,0|1,0,0]=3 5179 B8R1.7 O=[N+]([O-])C1CCSC1 Amb33299031 [1,0,0,1,0,0|1,0,1]=4 5180 B8R1.20 C=C1CC1CC(=O)O Amb25870954 [1,0,0,1,0,0|1,0,1]=4 5181 B8R1.20 CC(=O)CC1CC1C Amb26916692 [1,0,0,1,0,0|2,0,0]=4 5182 B8R1.20 CC(=O)C[C@H]1C[C@H]1C Amb28121459 [1,0,0,1,0,0|2,0,0]=4 5183 B8R1.20 CC1CC1CC(=O)O Amb25316515 [1,0,0,1,0,0|1,0,0]=3 5184 B8R1.20 C[C@@H]1C[C@H]1CC(=O)O Amb28058267 [1,0,0,1,0,0|1,0,0]=3 5185 B8R1.20 NC1CC1CC(=O)O Amb27201670 [1,0,0,1,0,0|2,0,0]=4 5186 B8R1.20 N[C@@H]1C[C@H]1CC(=O)O Amb27252154 [1,0,0,1,0,0|2,0,0]=4 5187 B8R1.20 O=C(O)CC1CC1O Amb27981662 [1,0,0,1,0,0|2,0,0]=4 5188 B8R1.31 C=C1CCC1C(=O)O Amb28281144 [1,0,0,1,0,0|1,0,1]=4 5189 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C Amb26866992 [1,0,0,1,0,0|2,0,0]=4 5190 B8R1.31 CC(=O)[C@H]1CC[C@H]1C Amb26361346 [1,0,0,1,0,0|2,0,0]=4 5191 B8R1.31 CC1CCC1C(=O)O Amb21857447 [1,0,0,1,0,0|1,0,0]=3 5192 B8R1.31 CC1NCC1C(=O)O Amb26984410 [1,0,0,1,0,0|2,0,0]=4 5193 B8R1.31 CN1CCC1C(=O)O Amb22011586 [1,0,0,1,0,0|1,0,0]=3 5194 B8R1.31 CN1CC[C@@H]1C(=O)O Amb24183372 [1,0,0,1,0,0|1,0,0]=3 5195 B8R1.31 CN1CC[C@H]1C(=O)O Amb24699921 [1,0,0,1,0,0|1,0,0]=3 5196 B8R1.31 C[C@@H]1CC[C@@H]1C(=O)O Amb28203929 [1,0,0,1,0,0|1,0,0]=3 5197 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb24597629 [1,0,0,1,0,0|2,0,0]=4 5198 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb33620541 [1,0,0,1,0,0|2,0,0]=4 5199 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O Amb34913092 [1,0,0,1,0,0|2,0,0]=4 5200 B8R1.31 C[C@H]1CC[C@H]1C(N)=O Amb27237000 [1,0,0,1,0,0|2,0,0]=4 5201 B8R1.31 NC1CCC1C(=O)O Amb26979562 [1,0,0,1,0,0|2,0,0]=4 5202 B8R1.31 NN1CC[C@H]1C(=O)O Amb27261518 [1,0,0,1,0,0|2,0,0]=4 5203 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24117048 [1,0,0,1,0,0|2,0,0]=4 5204 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24183584 [1,0,0,1,0,0|2,0,0]=4 5205 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb25976891 [1,0,0,1,0,0|2,0,0]=4 5206 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb31291972 [1,0,0,1,0,0|2,0,0]=4 5207 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb27187220 [1,0,0,1,0,0|2,0,0]=4 5208 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb33805288 [1,0,0,1,0,0|2,0,0]=4 5209 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb25911896 [1,0,0,1,0,0|2,0,0]=4 5210 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb33801366 [1,0,0,1,0,0|2,0,0]=4 5211 B8R1.31 O=C(O)C1CCC1Cl Amb27490061 [1,0,0,1,0,0|2,0,0]=4 5212 B8R1.31 O=C(O)C1CCC1F Amb27835547 [1,0,0,1,0,0|2,0,0]=4 5213 B8R1.31 O=C(O)C1CCC1O Amb24481384 [1,0,0,1,0,0|2,0,0]=4 5214 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O Amb27619188 [1,0,0,1,0,0|2,0,0]=4 5215 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O Amb34913090 [1,0,0,1,0,0|2,0,0]=4 5216 B8R1.34 CC(=O)CC1CCC1 Amb20668826 [1,0,0,1,0,0|2,0,0]=4 5217 B8R1.34 CC(=O)CC1CNC1 Amb26366652 [1,0,0,1,0,0|2,0,0]=4 5218 B8R1.34 CC(=O)CC1COC1 Amb22728373 [1,0,0,1,0,0|1,1,0]=4 5219 B8R1.34 NC(=O)CC1CNC1 Amb25890059 [1,0,0,1,0,0|2,0,0]=4 5220 B8R1.34 NC(=O)CC1CNC1 Amb28819957 [1,0,0,1,0,0|2,0,0]=4 5221 B8R1.34 NC(=O)OC1CSC1 Amb22364584 [1,0,0,1,0,0|2,0,0]=4 5222 B8R1.34 O=C(Cl)CC1CCC1 Amb22491179 [1,0,0,1,0,0|2,0,0]=4 5223 B8R1.34 O=C(O)C=C1CSC1 Amb24379733 [1,0,0,1,0,0|0,0,2]=4 5224 B8R1.34 O=C(O)CC1CCC1 Amb2696078 [1,0,0,1,0,0|1,0,0]=3 5225 B8R1.34 O=C(O)CC1CCN1 Amb25068427 [1,0,0,1,0,0|2,0,0]=4 5226 B8R1.34 O=C(O)CC1CCO1 Amb28136625 [1,0,0,1,0,0|2,0,0]=4 5227 B8R1.34 O=C(O)CC1CNC1 Amb21856240 [1,0,0,1,0,0|1,0,0]=3 5228 B8R1.34 O=C(O)CC1CNC1 Amb22057370 [1,0,0,1,0,0|1,0,0]=3 5229 B8R1.34 O=C(O)CC1CNC1 Amb22739043 [1,0,0,1,0,0|1,0,0]=3 5230 B8R1.34 O=C(O)CC1COC1 Amb18199145 [1,0,0,1,0,0|0,1,0]=3 5231 B8R1.34 O=C(O)CC1CSC1 Amb26049907 [1,0,0,1,0,0|0,0,0]=2 5232 B8R1.34 O=C(O)CN1CCC1 Amb28934892 [1,0,0,1,0,0|2,0,0]=4 5233 B8R1.34 O=C(O)C[C@@H]1CCO1 Amb33715997 [1,0,0,1,0,0|2,0,0]=4 5234 B8R1.34 O=C(O)C[C@H]1CCO1 Amb26570015 [1,0,0,1,0,0|2,0,0]=4 5235 B8R1.34 O=C([O-])CC1COC1 Amb32664987 [1,0,0,1,0,0|0,1,1]=4 5236 B8R1.34 O=S(O)CC1CCC1 Amb27426399 [1,0,0,1,0,0|2,0,0]=4 5237 B8R1.34 O=[N+]([O-])CC1CSC1 Amb27836157 [1,0,0,1,0,0|1,0,1]=4 5238 B8R1.35 CC(=O)CCC1CC1 Amb25305448 [1,0,0,1,0,0|2,0,0]=4 5239 B8R1.35 CC(=O)CCC1CO1 Amb28388031 [1,0,0,1,0,0|1,1,0]=4 5240 B8R1.35 NC(=O)CCC1CC1 Amb28066625 [1,0,0,1,0,0|2,0,0]=4 5241 B8R1.35 NC(=O)CCC1CO1 Amb28252693 [1,0,0,1,0,0|1,1,0]=4 5242 B8R1.35 O=C(Cl)CCC1CC1 Amb25337452 [1,0,0,1,0,0|2,0,0]=4 5243 B8R1.35 O=C(O)CCC1=CC1 Amb28364765 [1,0,0,1,0,0|1,0,1]=4 5244 B8R1.35 O=C(O)CCC1CC1 Amb2686667 [1,0,0,1,0,0|1,0,0]=3 5245 B8R1.35 O=C(O)CCC1CO1 Amb27667995 [1,0,0,1,0,0|0,1,0]=3 5246 B8R1.35 O=C(O)CNC1CC1 Amb7766401 [1,0,0,1,0,0|2,0,0]=4 5247 B8R1.35 O=C(O)CNC1CC1 Amb9677481 [1,0,0,1,0,0|2,0,0]=4 5248 B8R1.35 O=C(O)COC1CC1 Amb27214838 [1,0,0,1,0,0|2,0,0]=4 5249 B8R1.35 O=C(O)CSC1CC1 Amb6760620 [1,0,0,1,0,0|2,0,0]=4 5250 B8R1.36 CSCCCC1CO1 Amb24687956 [1,0,0,1,0,0|1,0,1]=4 5251 B8R1.43 C#CC1CC1C(=O)O Amb27398329 [1,0,0,1,0,0|1,0,1]=4 5252 B8R1.43 C#C[C@H]1C[C@@H]1C(=O)O Amb24076488 [1,0,0,1,0,0|1,0,1]=4 5253 B8R1.43 C#C[C@H]1C[C@H]1C(=O)O Amb28073511 [1,0,0,1,0,0|1,0,1]=4 5254 B8R1.43 C=C[C@@H]1C[C@H]1C(=O)O Amb28347448 [1,0,0,1,0,0|1,0,1]=4 5255 B8R1.43 CCC1CC1C(=O)Cl Amb27778180 [1,0,0,1,0,0|2,0,0]=4 5256 B8R1.43 CCC1CC1C(=O)O Amb18961272 [1,0,0,1,0,0|1,0,0]=3 5257 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O Amb24112910 [1,0,0,1,0,0|1,0,0]=3 5258 B8R1.43 CC[C@@H]1O[C@@H]1C(=O)O Amb27855470 [1,0,0,1,0,0|2,0,0]=4 5259 B8R1.43 CC[C@H]1C[C@H]1C(=O)O Amb33098417 [1,0,0,1,0,0|1,0,0]=3 5260 B8R1.43 CC[C@H]1O[C@@H]1C(=O)O Amb27811556 [1,0,0,1,0,0|2,0,0]=4 5261 B8R1.43 CC[C@H]1O[C@H]1C(=O)O Amb27222314 [1,0,0,1,0,0|2,0,0]=4 5262 B8R1.43 COC1CC1C(=O)Cl Amb35717346 [1,0,0,1,0,0|1,1,0]=4 5263 B8R1.43 COC1CC1C(N)=O Amb35671242 [1,0,0,1,0,0|1,1,0]=4 5264 B8R1.43 CO[C@@H]1C[C@H]1C(=O)O Amb24514838 [1,0,0,1,0,0|0,1,0]=3 5265 B8R1.43 CO[C@@H]1C[C@H]1C(C)=O Amb27407296 [1,0,0,1,0,0|1,1,0]=4 5266 B8R1.43 N#CC1CC1C(=O)O Amb24183452 [1,0,0,1,0,0|2,0,0]=4 5267 B8R1.43 N#C[C@@H]1C[C@@H]1C(=O)O Amb24183522 [1,0,0,1,0,0|2,0,0]=4 5268 B8R1.43 N#C[C@@H]1C[C@H]1C(=O)O Amb24183456 [1,0,0,1,0,0|2,0,0]=4 5269 B8R1.43 N#C[C@H]1C[C@@H]1C(=O)O Amb33805321 [1,0,0,1,0,0|2,0,0]=4 5270 B8R1.43 N#C[C@H]1C[C@H]1C(=O)O Amb25168974 [1,0,0,1,0,0|2,0,0]=4 5271 B8R1.43 NCC1CC1C(=O)O Amb2694938 [1,0,0,1,0,0|2,0,0]=4 5272 B8R1.43 NC[C@@H]1C[C@@H]1C(=O)O Amb24680970 [1,0,0,1,0,0|2,0,0]=4 5273 B8R1.43 NC[C@@H]1C[C@@H]1C(=O)O Amb32992808 [1,0,0,1,0,0|2,0,0]=4 5274 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O Amb27205078 [1,0,0,1,0,0|2,0,0]=4 5275 B8R1.43 NC[C@H]1C[C@@H]1C(=O)O Amb27252099 [1,0,0,1,0,0|2,0,0]=4 5276 B8R1.43 NC[C@H]1C[C@H]1C(=O)O Amb28069146 [1,0,0,1,0,0|2,0,0]=4 5277 B8R1.43 NNC1CC1C(=O)O Amb10576221 [1,0,0,1,0,0|2,0,0]=4 5278 B8R1.43 O=C(O)C1CC1CBr Amb27407770 [1,0,0,1,0,0|2,0,0]=4 5279 B8R1.43 O=C(O)C1CC1CCl Amb26895220 [1,0,0,1,0,0|2,0,0]=4 5280 B8R1.43 O=C(O)C1CC1CO Amb25173469 [1,0,0,1,0,0|2,0,0]=4 5281 B8R1.43 O=C(O)[C@@H]1C[C@@H]1CO Amb28198703 [1,0,0,1,0,0|2,0,0]=4 5282 B8R1.43 O=C(O)[C@@H]1C[C@H]1CBr Amb26552185 [1,0,0,1,0,0|2,0,0]=4 5283 B8R1.43 O=C(O)[C@@H]1C[C@H]1CF Amb33098414 [1,0,0,1,0,0|2,0,0]=4 5284 B8R1.43 O=C(O)[C@@H]1C[C@H]1CO Amb25231147 [1,0,0,1,0,0|2,0,0]=4 5285 B8R1.43 O=C(O)[C@H]1C[C@H]1CO Amb26916980 [1,0,0,1,0,0|2,0,0]=4 5286 B8R1.43 O=C[C@H]1C[C@H]1C(=O)O Amb25911990 [1,0,0,1,0,0|2,0,0]=4 5287 B8R1.72 CC1(O)CCCSC1 Amb29857705 [1,0,0,1,0,0|1,0,1]=4 5288 B8R1.18 C=C1CC(C)OC1=O Amb8389608 [1,0,0,1,0,0|1,0,1]=4 5289 B8R1.18 CC1CC(=O)C(C)C1 Amb26510571 [1,0,0,1,0,0|2,0,0]=4 5290 B8R1.18 CC1CC(Br)C(=O)O1 Amb6608903 [1,0,0,1,0,0|1,0,0]=3 5291 B8R1.18 CC1CC(C)C(=O)N1 Amb24698782 [1,0,0,1,0,0|2,0,0]=4 5292 B8R1.18 CC1CC(C)C(=O)O1 Amb4017434 [1,0,0,1,0,0|1,0,0]=3 5293 B8R1.18 CC1CC(N)C(=O)O1 Amb32653104 [1,0,0,1,0,0|0,0,0]=2 5294 B8R1.18 CC1CC(N)C(=O)O1 Amb448594 [1,0,0,1,0,0|0,0,0]=2 5295 B8R1.18 CC1CC(N)C(C)O1 Amb24619349 [1,0,0,1,0,0|1,0,1]=4 5296 B8R1.18 CC1CC(N)C(C)O1 Amb30585143 [1,0,0,1,0,0|1,0,1]=4 5297 B8R1.18 CC1CC(O)C(=O)N1 Amb27784846 [1,0,0,1,0,0|2,0,0]=4 5298 B8R1.18 CC1CC(O)C(=O)O1 Amb27451083 [1,0,0,1,0,0|1,0,0]=3 5299 B8R1.18 CC1C[C@@H](C)CC1=O Amb27424916 [1,0,0,1,0,0|2,0,0]=4 5300 B8R1.18 CC1C[C@H](N)C(=O)O1 Amb27844768 [1,0,0,1,0,0|0,0,0]=2 5301 B8R1.18 CN1CC(N)C(=O)N1 Amb25872890 [1,0,0,1,0,0|2,0,0]=4 5302 B8R1.18 C[C@@H]1C[C@@H](Cl)C(=O)O1 Amb25288126 [1,0,0,1,0,0|1,0,0]=3 5303 B8R1.18 C[C@H]1CC(=O)[C@H](C)C1 Amb28429622 [1,0,0,1,0,0|2,0,0]=4 5304 B8R1.18 C[C@H]1C[C@@H](C)C(=O)O1 Amb28060142 [1,0,0,1,0,0|1,0,0]=3 5305 B8R1.18 C[C@H]1C[C@@H](C)NC1=O Amb27619178 [1,0,0,1,0,0|2,0,0]=4 5306 B8R1.18 C[C@H]1C[C@H](O)C(=O)O1 Amb27852763 [1,0,0,1,0,0|1,0,0]=3 5307 B8R1.18 NC1CC(=O)OC1=O Amb27216215 [1,0,0,1,0,0|0,1,1]=4 5308 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb25992097 [1,0,0,1,0,0|0,1,1]=4 5309 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb8631355 [1,0,0,1,0,0|0,1,1]=4 5310 B8R1.18 N[C@H]1CC(=O)OC1=O Amb24745675 [1,0,0,1,0,0|0,1,1]=4 5311 B8R1.18 O=C1OC(O)CC1O Amb27761542 [1,0,0,1,0,0|1,1,0]=4 5312 B8R1.23 CC(=O)C1CC(C)C1 Amb23590280 [1,0,0,1,0,0|2,0,0]=4 5313 B8R1.23 CC(=O)[C@H]1C[C@@H](C)C1 Amb28253646 [1,0,0,1,0,0|2,0,0]=4 5314 B8R1.23 CC1CC(C(=O)O)C1 Amb19515989 [1,0,0,1,0,0|1,0,0]=3 5315 B8R1.23 CC1CC(C(=O)O)N1 Amb27816510 [1,0,0,1,0,0|0,0,0]=2 5316 B8R1.23 CC1CC(C(=O)O)N1 Amb33482923 [1,0,0,1,0,0|0,0,0]=2 5317 B8R1.23 CC1CC(C(N)=O)C1 Amb27954948 [1,0,0,1,0,0|2,0,0]=4 5318 B8R1.23 CN1CC(C(=O)O)C1 Amb19958116 [1,0,0,1,0,0|2,0,0]=4 5319 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483898 [1,0,0,1,0,0|0,0,0]=2 5320 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483920 [1,0,0,1,0,0|0,0,0]=2 5321 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483819 [1,0,0,1,0,0|0,0,0]=2 5322 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483820 [1,0,0,1,0,0|0,0,0]=2 5323 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 Amb22746374 [1,0,0,1,0,0|1,0,0]=3 5324 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 Amb22746375 [1,0,0,1,0,0|1,0,0]=3 5325 B8R1.23 NC1CC(C(=O)O)C1 Amb10610660 [1,0,0,1,0,0|2,0,0]=4 5326 B8R1.23 NC1CC(C(=O)O)C1 Amb33533143 [1,0,0,1,0,0|2,0,0]=4 5327 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb10604131 [1,0,0,1,0,0|2,0,0]=4 5328 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb6893769 [1,0,0,1,0,0|2,0,0]=4 5329 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb19514893 [1,0,0,1,0,0|2,0,0]=4 5330 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb33524058 [1,0,0,1,0,0|2,0,0]=4 5331 B8R1.23 O=C(O)C1CC(Br)C1 Amb25889305 [1,0,0,1,0,0|2,0,0]=4 5332 B8R1.23 O=C(O)C1CC(Cl)C1 Amb16233600 [1,0,0,1,0,0|2,0,0]=4 5333 B8R1.23 O=C(O)C1CC(F)C1 Amb20621267 [1,0,0,1,0,0|2,0,0]=4 5334 B8R1.23 O=C(O)C1CC(O)C1 Amb8011535 [1,0,0,1,0,0|1,1,0]=4 5335 B8R1.23 O=C(O)[C@H]1C[C@@H](Br)C1 Amb35751665 [1,0,0,1,0,0|2,0,0]=4 5336 B8R1.23 O=C(O)[C@H]1C[C@@H](Cl)C1 Amb28119343 [1,0,0,1,0,0|2,0,0]=4 5337 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 Amb27974528 [1,0,0,1,0,0|2,0,0]=4 5338 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 Amb19516179 [1,0,0,1,0,0|1,1,0]=4 5339 B8R1.23 O=C(O)[C@H]1C[C@H](Br)C1 Amb24339433 [1,0,0,1,0,0|2,0,0]=4 5340 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 Amb25883786 [1,0,0,1,0,0|2,0,0]=4 5341 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 Amb27883529 [1,0,0,1,0,0|2,0,0]=4 5342 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 Amb19516178 [1,0,0,1,0,0|1,1,0]=4 5343 B8R1.23 O=C1CC(C(=O)O)N1 Amb16232079 [1,0,0,1,0,0|0,1,1]=4 5344 B8R1.23 O=C1C[C@@H](C(=O)O)N1 Amb22367070 [1,0,0,1,0,0|0,1,1]=4 5345 B8R1.23 O=C1C[C@H](C(=O)O)N1 Amb26975061 [1,0,0,1,0,0|0,1,1]=4 5346 B8R1.30 C=C1CC1(N)C(=O)O Amb22274582 [1,0,0,1,0,0|0,0,2]=4 5347 B8R1.30 CC(=O)[C@@]1(C)C[C@H]1C Amb28131473 [1,0,0,1,0,0|2,0,0]=4 5348 B8R1.30 CC(=O)[C@]1(C)C[C@H]1C Amb28054445 [1,0,0,1,0,0|2,0,0]=4 5349 B8R1.30 CC1(C(=O)O)CC1Br Amb25889224 [1,0,0,1,0,0|2,0,0]=4 5350 B8R1.30 CC1(C(=O)O)CC1Cl Amb28325885 [1,0,0,1,0,0|2,0,0]=4 5351 B8R1.30 CC1(C(=O)O)CC1F Amb24445672 [1,0,0,1,0,0|2,0,0]=4 5352 B8R1.30 CC1CC1(C)C(=O)O Amb28456906 [1,0,0,1,0,0|1,0,0]=3 5353 B8R1.30 CC1CC1(F)C(=O)O Amb32679974 [1,0,0,1,0,0|1,0,0]=3 5354 B8R1.30 CC1CC1(N)C(=O)O Amb26066646 [1,0,0,1,0,0|0,0,0]=2 5355 B8R1.30 CC1CC1(N)C(N)=O Amb28434643 [1,0,0,1,0,0|1,0,0]=3 5356 B8R1.30 C[C@@H]1C[C@@]1(C)C(=O)O Amb24680945 [1,0,0,1,0,0|1,0,0]=3 5357 B8R1.30 C[C@@H]1C[C@@]1(N)C(N)=O Amb27969162 [1,0,0,1,0,0|1,0,0]=3 5358 B8R1.30 C[C@@H]1C[C@@]1(O)C(=O)O Amb28133921 [1,0,0,1,0,0|1,0,0]=3 5359 B8R1.30 C[C@@H]1O[C@]1(C)C(=O)O Amb28057500 [1,0,0,1,0,0|2,0,0]=4 5360 B8R1.30 C[C@@]1(C(=O)O)C[C@@H]1Cl Amb28134278 [1,0,0,1,0,0|2,0,0]=4 5361 B8R1.30 C[C@@]1(C(=O)O)C[C@@H]1F Amb24053139 [1,0,0,1,0,0|2,0,0]=4 5362 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1Br Amb27222642 [1,0,0,1,0,0|2,0,0]=4 5363 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1Cl Amb28196682 [1,0,0,1,0,0|2,0,0]=4 5364 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1F Amb26656665 [1,0,0,1,0,0|2,0,0]=4 5365 B8R1.30 C[C@H]1C[C@@]1(C)C(=O)O Amb27789627 [1,0,0,1,0,0|1,0,0]=3 5366 B8R1.30 C[C@H]1C[C@@]1(Cl)C(=O)O Amb28286348 [1,0,0,1,0,0|1,0,0]=3 5367 B8R1.30 C[C@H]1C[C@]1(N)C(=O)O Amb27873946 [1,0,0,1,0,0|0,0,0]=2 5368 B8R1.30 C[C@H]1C[C@]1(N)C(N)=O Amb27419998 [1,0,0,1,0,0|1,0,0]=3 5369 B8R1.30 C[C@H]1C[C@]1(O)C(=O)O Amb27881113 [1,0,0,1,0,0|1,0,0]=3 5370 B8R1.30 C[C@]1(C(=O)O)C[C@@H]1F Amb26987734 [1,0,0,1,0,0|2,0,0]=4 5371 B8R1.30 C[C@]1(C(=O)O)C[C@H]1F Amb26870422 [1,0,0,1,0,0|2,0,0]=4 5372 B8R1.30 NC1(C(=O)O)CC1Br Amb27430541 [1,0,0,1,0,0|1,0,0]=3 5373 B8R1.30 NC1(C(=O)O)CC1Cl Amb27596928 [1,0,0,1,0,0|1,0,0]=3 5374 B8R1.30 N[C@@]1(C(=O)O)C[C@@H]1Br Amb28411230 [1,0,0,1,0,0|1,0,0]=3 5375 B8R1.30 N[C@@]1(C(=O)O)C[C@@H]1Cl Amb25245700 [1,0,0,1,0,0|1,0,0]=3 5376 B8R1.30 N[C@@]1(C(=O)O)C[C@H]1Cl Amb28436769 [1,0,0,1,0,0|1,0,0]=3 5377 B8R1.30 N[C@]1(C(=O)O)C[C@@H]1Cl Amb26587370 [1,0,0,1,0,0|1,0,0]=3 5378 B8R1.30 N[C@]1(C(=O)O)C[C@H]1Cl Amb22748908 [1,0,0,1,0,0|1,0,0]=3 5379 B8R1.54 C=C(C(=O)O)C1CC1 Amb24481397 [1,0,0,1,0,0|1,0,1]=4 5380 B8R1.54 C=C(C)C(N)C1CC1 Amb27234544 [1,0,0,1,0,0|2,0,0]=4 5381 B8R1.54 CC(=O)C(C)C1CC1 Amb25798488 [1,0,0,1,0,0|2,0,0]=4 5382 B8R1.54 CC(=O)C(N)C1CC1 Amb27668423 [1,0,0,1,0,0|1,0,0]=3 5383 B8R1.54 CC(=O)N(N)C1CC1 Amb33191631 [1,0,0,1,0,0|2,0,0]=4 5384 B8R1.54 CC(C(=O)O)C1CC1 Amb33537630 [1,0,0,1,0,0|1,0,0]=3 5385 B8R1.54 C[C@@H](C(=O)O)C1CC1 Amb33732043 [1,0,0,1,0,0|1,0,0]=3 5386 B8R1.54 C[C@@H](O)[C@@H](N)C1CC1 Amb28132696 [1,0,0,1,0,0|1,0,1]=4 5387 B8R1.54 C[C@H](C(=O)O)C1CC1 Amb33744363 [1,0,0,1,0,0|1,0,0]=3 5388 B8R1.54 C[C@H](O)[C@@H](N)C1CC1 Amb28429788 [1,0,0,1,0,0|1,0,1]=4 5389 B8R1.54 N=C(N)C(N)C1CC1 Amb28142515 [1,0,0,1,0,0|2,0,0]=4 5390 B8R1.54 NC(=O)C(Cl)C1CC1 Amb26875098 [1,0,0,1,0,0|2,0,0]=4 5391 B8R1.54 NC(=O)C(N)C1CC1 Amb18282442 [1,0,0,1,0,0|1,0,0]=3 5392 B8R1.54 NC(=O)C(N)C1CC1 Amb28991331 [1,0,0,1,0,0|1,0,0]=3 5393 B8R1.54 NC(=O)C(O)C1CC1 Amb20630809 [1,0,0,1,0,0|2,0,0]=4 5394 B8R1.54 NC(=O)[C@H](N)C1CC1 Amb27436476 [1,0,0,1,0,0|1,0,0]=3 5395 B8R1.54 NC(=S)C(N)C1CC1 Amb27858041 [1,0,0,1,0,0|1,1,0]=4 5396 B8R1.54 NC(C(=O)O)C1CC1 Amb19515010 [1,0,0,1,0,0|0,0,0]=2 5397 B8R1.54 NC(C(=O)O)C1CC1 Amb2696737 [1,0,0,1,0,0|0,0,0]=2 5398 B8R1.54 N[C@@H](C(=O)O)C1CC1 Amb2699141 [1,0,0,1,0,0|0,0,0]=2 5399 B8R1.54 N[C@H](C(=O)O)C1CC1 Amb19929447 [1,0,0,1,0,0|0,0,0]=2 5400 B8R1.54 N[C@H](C(=O)O)C1CC1 Amb2694840 [1,0,0,1,0,0|0,0,0]=2 5401 B8R1.54 O=C(O)C(=O)C1CC1 Amb16233327 [1,0,0,1,0,0|1,0,1]=4 5402 B8R1.54 O=C(O)C(F)C1CC1 Amb25936979 [1,0,0,1,0,0|1,0,0]=3 5403 B8R1.54 O=C(O)C(O)C1CC1 Amb18282441 [1,0,0,1,0,0|1,0,0]=3 5404 B8R1.78 C=C(C)C1(N)CCC1 Amb33199176 [1,0,0,1,0,0|2,0,0]=4 5405 B8R1.78 CC(=O)C1(C)CCC1 Amb27249451 [1,0,0,1,0,0|2,0,0]=4 5406 B8R1.78 CC(=O)C1(N)CCC1 Amb26578364 [1,0,0,1,0,0|1,0,0]=3 5407 B8R1.78 CC(=O)C1(O)CCC1 Amb33328556 [1,0,0,1,0,0|2,0,0]=4 5408 B8R1.78 CC(O)C1(N)CCC1 Amb29874794 [1,0,0,1,0,0|1,0,1]=4 5409 B8R1.78 CC1(C(=O)Cl)CCC1 Amb24533834 [1,0,0,1,0,0|2,0,0]=4 5410 B8R1.78 CC1(C(=O)O)CCC1 Amb33544631 [1,0,0,1,0,0|1,0,0]=3 5411 B8R1.78 CC1(C(=O)O)CCN1 Amb24483061 [1,0,0,1,0,0|2,0,0]=4 5412 B8R1.78 CC1(C(=O)O)CCN1 Amb33483840 [1,0,0,1,0,0|2,0,0]=4 5413 B8R1.78 CC1(C(=O)O)CCN1 Amb34138205 [1,0,0,1,0,0|2,0,0]=4 5414 B8R1.78 CC1(C(=O)O)CCO1 Amb22001906 [1,0,0,1,0,0|1,1,0]=4 5415 B8R1.78 CC1(C(=O)O)CNC1 Amb24077476 [1,0,0,1,0,0|2,0,0]=4 5416 B8R1.78 CC1(C(=O)O)CNC1 Amb24561978 [1,0,0,1,0,0|2,0,0]=4 5417 B8R1.78 CC1(C(=O)O)COC1 Amb33543882 [1,0,0,1,0,0|1,1,0]=4 5418 B8R1.78 CC1(C(=O)O)CSC1 Amb21960451 [1,0,0,1,0,0|1,0,0]=3 5419 B8R1.78 CC1(C(N)=O)CCC1 Amb28396894 [1,0,0,1,0,0|2,0,0]=4 5420 B8R1.78 NC(=O)C1(Br)CCC1 Amb24481413 [1,0,0,1,0,0|2,0,0]=4 5421 B8R1.78 NC(=O)C1(N)CCC1 Amb18523727 [1,0,0,1,0,0|1,0,0]=3 5422 B8R1.78 NC(=O)C1(N)CCC1 Amb33550276 [1,0,0,1,0,0|1,0,0]=3 5423 B8R1.78 NC(=O)C1(N)CNC1 Amb26851458 [1,0,0,1,0,0|2,0,0]=4 5424 B8R1.78 NC(=O)C1(N)CNC1 Amb33482864 [1,0,0,1,0,0|2,0,0]=4 5425 B8R1.78 NC(=O)C1(N)COC1 Amb24483241 [1,0,0,1,0,0|1,1,0]=4 5426 B8R1.78 NC(=O)C1(N)COC1 Amb32679270 [1,0,0,1,0,0|1,1,0]=4 5427 B8R1.78 NC(=O)C1(O)CCC1 Amb24122570 [1,0,0,1,0,0|2,0,0]=4 5428 B8R1.78 NC1(C(=O)Cl)CCC1 Amb32409362 [1,0,0,1,0,0|1,0,0]=3 5429 B8R1.78 NC1(C(=O)F)CCC1 Amb34148081 [1,0,0,1,0,0|1,0,0]=3 5430 B8R1.78 NC1(C(=O)O)CCC1 Amb2694933 [1,0,0,1,0,0|0,0,0]=2 5431 B8R1.78 NC1(C(=O)O)CCC1 Amb8630070 [1,0,0,1,0,0|0,0,0]=2 5432 B8R1.78 NC1(C(=O)O)CNC1 Amb19895006 [1,0,0,1,0,0|1,0,0]=3 5433 B8R1.78 NC1(C(=O)O)CNC1 Amb21960937 [1,0,0,1,0,0|1,0,0]=3 5434 B8R1.78 NC1(C(=O)O)COC1 Amb18199133 [1,0,0,1,0,0|0,1,0]=3 5435 B8R1.78 NC1(C(=O)O)COC1 Amb33109883 [1,0,0,1,0,0|0,1,0]=3 5436 B8R1.78 NC1(C(=O)O)CSC1 Amb21927718 [1,0,0,1,0,0|0,0,0]=2 5437 B8R1.78 O=C(Cl)C1(Br)CCC1 Amb26358748 [1,0,0,1,0,0|2,0,0]=4 5438 B8R1.78 O=C(Cl)C1(Cl)CCC1 Amb33127943 [1,0,0,1,0,0|2,0,0]=4 5439 B8R1.78 O=C(O)C1(Br)CCC1 Amb495556 [1,0,0,1,0,0|1,0,0]=3 5440 B8R1.78 O=C(O)C1(Cl)CCC1 Amb24422884 [1,0,0,1,0,0|1,0,0]=3 5441 B8R1.78 O=C(O)C1(F)CCC1 Amb22886536 [1,0,0,1,0,0|1,0,0]=3 5442 B8R1.78 O=C(O)C1(F)CNC1 Amb23440120 [1,0,0,1,0,0|2,0,0]=4 5443 B8R1.78 O=C(O)C1(O)CCC1 Amb495557 [1,0,0,1,0,0|1,0,0]=3 5444 B8R1.78 O=C(O)C1(O)CNC1 Amb24122891 [1,0,0,1,0,0|2,0,0]=4 5445 B8R1.78 O=C(O)C1(O)CNC1 Amb28934838 [1,0,0,1,0,0|2,0,0]=4 5446 B8R1.78 O=C(O)C1(O)COC1 Amb25714262 [1,0,0,1,0,0|1,1,0]=4 5447 B8R1.78 O=C(O)C1(S)CCC1 Amb34159631 [1,0,0,1,0,0|1,0,0]=3 5448 B10R1.16 CCCCC1CC(=O)NN1 Amb29859945 [0,0,0,1,0,1|2,0,0]=4 5449 B10R1.16 CCCCC1COC(=O)N1 Amb24482077 [0,0,0,1,0,1|2,0,0]=4 5450 B10R1.16 CCCC[C@@H]1COC(=O)N1 Amb22225366 [0,0,0,1,0,1|2,0,0]=4 5451 B10R1.16 COCCC1COC(=O)N1 Amb33377307 [0,0,0,1,0,1|1,1,0]=4 5452 B10R1.16 CSCCC1=NOC(=O)N1 Amb35611225 [0,0,0,1,0,1|0,0,2]=4 5453 B10R1.16 CSCCC1CC(=O)CO1 Amb35693010 [0,0,0,1,0,1|2,0,0]=4 5454 B10R1.16 CSCCC1CC(=O)NN1 Amb29860506 [0,0,0,1,0,1|1,0,0]=3 5455 B10R1.16 CSCCC1CNC(=O)C1 Amb27626421 [0,0,0,1,0,1|2,0,0]=4 5456 B10R1.16 CSCCC1CNC(=O)O1 Amb33203358 [0,0,0,1,0,1|2,0,0]=4 5457 B10R1.16 CSCCC1COC(=O)N1 Amb26545150 [0,0,0,1,0,1|1,0,0]=3 5458 B10R1.16 CSCCC1COC(N)=N1 Amb27494391 [0,0,0,1,0,1|2,0,0]=4 5459 B10R1.18 CC(=O)CC1CCCCN1 Amb10607341 [0,0,0,1,0,1|2,0,0]=4 5460 B10R1.18 CC(=O)C[C@H]1CCCCN1 Amb27807842 [0,0,0,1,0,1|2,0,0]=4 5461 B10R1.18 CC(=O)OC1CCSCC1 Amb28050264 [0,0,0,1,0,1|2,0,0]=4 5462 B10R1.18 NC(=O)CC1CCCCN1 Amb1076649 [0,0,0,1,0,1|2,0,0]=4 5463 B10R1.18 NC(=O)CC1CCCCN1 Amb22283730 [0,0,0,1,0,1|2,0,0]=4 5464 B10R1.18 NC(=O)CC1CCSCC1 Amb27830749 [0,0,0,1,0,1|2,0,0]=4 5465 B10R1.18 O=C(Cl)NC1CCSCC1 Amb35625875 [0,0,0,1,0,1|2,0,0]=4 5466 B10R1.18 O=C(O)C=C1CCSCC1 Amb26480822 [0,0,0,1,0,1|1,0,1]=4 5467 B10R1.18 O=C(O)CC1CCCCC1 Amb3939015 [0,0,0,1,0,1|2,0,0]=4 5468 B10R1.18 O=C(O)CC1CCCCN1 Amb10576328 [0,0,0,1,0,1|1,0,0]=3 5469 B10R1.18 O=C(O)CC1CCCCN1 Amb1083025 [0,0,0,1,0,1|1,0,0]=3 5470 B10R1.18 O=C(O)CC1CCCCN1 Amb22587703 [0,0,0,1,0,1|1,0,0]=3 5471 B10R1.18 O=C(O)CC1CCCCO1 Amb1091980 [0,0,0,1,0,1|2,0,0]=4 5472 B10R1.18 O=C(O)CC1CCNCC1 Amb2683992 [0,0,0,1,0,1|2,0,0]=4 5473 B10R1.18 O=C(O)CC1CCNCC1 Amb33544417 [0,0,0,1,0,1|2,0,0]=4 5474 B10R1.18 O=C(O)CC1CCOCC1 Amb2684134 [0,0,0,1,0,1|1,1,0]=4 5475 B10R1.18 O=C(O)CC1CCSCC1 Amb18283322 [0,0,0,1,0,1|1,0,0]=3 5476 B10R1.18 O=C(O)CC1CNCCN1 Amb8630816 [0,0,0,1,0,1|2,0,0]=4 5477 B10R1.18 O=C(O)CC1COCCN1 Amb21964558 [0,0,0,1,0,1|2,0,0]=4 5478 B10R1.18 O=C(O)CC1COCCN1 Amb2699908 [0,0,0,1,0,1|2,0,0]=4 5479 B10R1.18 O=C(O)CC1CSCCN1 Amb18199026 [0,0,0,1,0,1|2,0,0]=4 5480 B10R1.18 O=C(O)CC1NCCCS1 Amb18645532 [0,0,0,1,0,1|2,0,0]=4 5481 B10R1.18 O=C(O)CN1CCSCC1 Amb10072976 [0,0,0,1,0,1|2,0,0]=4 5482 B10R1.18 O=C(O)CN1CCSCC1 Amb6307186 [0,0,0,1,0,1|2,0,0]=4 5483 B10R1.18 O=C(O)C[C@@H]1CCCCN1 Amb13885774 [0,0,0,1,0,1|1,0,0]=3 5484 B10R1.18 O=C(O)C[C@@H]1CCCCN1 Amb33296463 [0,0,0,1,0,1|1,0,0]=3 5485 B10R1.18 O=C(O)C[C@@H]1COCCN1 Amb34913922 [0,0,0,1,0,1|2,0,0]=4 5486 B10R1.18 O=C(O)C[C@H]1CCCCN1 Amb13885779 [0,0,0,1,0,1|1,0,0]=3 5487 B10R1.18 O=C(O)C[C@H]1CCCCN1 Amb33456128 [0,0,0,1,0,1|1,0,0]=3 5488 B10R1.18 O=C(O)C[C@H]1COCCN1 Amb25992590 [0,0,0,1,0,1|2,0,0]=4 5489 B10R1.18 O=C(O)C[C@H]1COCCN1 Amb34913503 [0,0,0,1,0,1|2,0,0]=4 5490 B10R1.18 O=C(O)C[S+]1CCSCC1 Amb27176492 [0,0,0,1,0,1|2,0,0]=4 5491 B10R1.18 O=C(O)NC1CCCCC1 Amb22039352 [0,0,0,1,0,1|2,0,0]=4 5492 B10R1.54 CC1CCC(CC(=O)O)C1 Amb18643912 [0,0,0,1,0,1|2,0,0]=4 5493 B10R1.54 CC1CCC(CC(=O)O)N1 Amb8387923 [0,0,0,1,0,1|1,0,0]=3 5494 B10R1.54 CC1CCC(CC(=O)O)O1 Amb24715878 [0,0,0,1,0,1|2,0,0]=4 5495 B10R1.54 CC1NC(CC(=O)O)CS1 Amb32990251 [0,0,0,1,0,1|2,0,0]=4 5496 B10R1.54 CN1CCC(CC(=O)O)C1 Amb33550954 [0,0,0,1,0,1|2,0,0]=4 5497 B10R1.54 CN1CCC(CC(=O)O)C1 Amb8009899 [0,0,0,1,0,1|2,0,0]=4 5498 B10R1.54 C[C@@H]1CCC(CC(=O)O)C1 Amb27436927 [0,0,0,1,0,1|2,0,0]=4 5499 B10R1.54 C[C@@H]1CCC(CC(=O)O)O1 Amb33423873 [0,0,0,1,0,1|2,0,0]=4 5500 B10R1.54 C[C@@H]1CC[C@H](CC(=O)O)O1 Amb27969185 [0,0,0,1,0,1|2,0,0]=4 5501 B10R1.54 O=C(O)CC1CCC(=O)N1 Amb2372619 [0,0,0,1,0,1|2,0,0]=4 5502 B10R1.54 O=C(O)C[C@@H]1CCC(=O)N1 Amb22587587 [0,0,0,1,0,1|2,0,0]=4 5503 B10R1.54 O=C(O)C[C@H]1CCC(=O)N1 Amb22587585 [0,0,0,1,0,1|2,0,0]=4 5504 B10R1.61 CC(=O)C1CCCCC1N Amb18124599 [0,0,0,1,0,1|2,0,0]=4 5505 B10R1.61 CC(=O)C1CCCCC1N Amb33447090 [0,0,0,1,0,1|2,0,0]=4 5506 B10R1.61 CC(=O)[C@@H]1CCCC[C@@H]1N Amb33307705 [0,0,0,1,0,1|2,0,0]=4 5507 B10R1.61 CC(=O)[C@H]1CSCC[C@H]1O Amb27230577 [0,0,0,1,0,1|2,0,0]=4 5508 B10R1.61 CC1CCCCC1C(=O)O Amb1923858 [0,0,0,1,0,1|2,0,0]=4 5509 B10R1.61 CC1CCNCC1C(=O)O Amb18124644 [0,0,0,1,0,1|2,0,0]=4 5510 B10R1.61 CC1CCNCC1C(=O)O Amb33330563 [0,0,0,1,0,1|2,0,0]=4 5511 B10R1.61 CN1CCSCC1C(=O)O Amb27816216 [0,0,0,1,0,1|2,0,0]=4 5512 B10R1.61 C[C@@H]1CCCC[C@H]1C(=O)O Amb10843965 [0,0,0,1,0,1|2,0,0]=4 5513 B10R1.61 C[C@@H]1CCNC[C@@H]1C(=O)O Amb25911818 [0,0,0,1,0,1|2,0,0]=4 5514 B10R1.61 C[C@@H]1CCNC[C@@H]1C(=O)O Amb32967641 [0,0,0,1,0,1|2,0,0]=4 5515 B10R1.61 NC(=O)C1CCCCC1N Amb1125131 [0,0,0,1,0,1|2,0,0]=4 5516 B10R1.61 NC(=O)C1CCCCC1N Amb20623397 [0,0,0,1,0,1|2,0,0]=4 5517 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N Amb8515028 [0,0,0,1,0,1|2,0,0]=4 5518 B10R1.61 NC(=O)[C@@H]1CCCC[C@H]1N Amb1994026 [0,0,0,1,0,1|2,0,0]=4 5519 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N Amb10608207 [0,0,0,1,0,1|2,0,0]=4 5520 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N Amb22757841 [0,0,0,1,0,1|2,0,0]=4 5521 B10R1.61 NC1C=CSCC1C(=O)O Amb24480458 [0,0,0,1,0,1|0,0,2]=4 5522 B10R1.61 NC1CC=CCC1C(=O)O Amb18563429 [0,0,0,1,0,1|1,0,1]=4 5523 B10R1.61 NC1CCCCC1C(=O)O Amb20626164 [0,0,0,1,0,1|1,0,0]=3 5524 B10R1.61 NC1CCCCC1C(=O)O Amb2694788 [0,0,0,1,0,1|1,0,0]=3 5525 B10R1.61 NC1CCCNC1C(=O)O Amb35750913 [0,0,0,1,0,1|2,0,0]=4 5526 B10R1.61 NC1CCCNC1C(=O)O Amb35751901 [0,0,0,1,0,1|2,0,0]=4 5527 B10R1.61 NC1CCCOC1C(=O)O Amb18202149 [0,0,0,1,0,1|2,0,0]=4 5528 B10R1.61 NC1CCNCC1C(=O)O Amb13886611 [0,0,0,1,0,1|1,0,0]=3 5529 B10R1.61 NC1CCOCC1C(=O)O Amb18202373 [0,0,0,1,0,1|0,1,0]=3 5530 B10R1.61 NC1CNCCC1C(=O)O Amb27790638 [0,0,0,1,0,1|2,0,0]=4 5531 B10R1.61 N[C@@H]1C=CSC[C@@H]1C(=O)O Amb24635580 [0,0,0,1,0,1|0,0,2]=4 5532 B10R1.61 N[C@@H]1C=CSC[C@H]1C(=O)O Amb27831011 [0,0,0,1,0,1|0,0,2]=4 5533 B10R1.61 N[C@@H]1CC=CC[C@@H]1C(=O)O Amb22800975 [0,0,0,1,0,1|1,0,1]=4 5534 B10R1.61 N[C@@H]1CC=CC[C@@H]1C(=O)O Amb9854886 [0,0,0,1,0,1|1,0,1]=4 5535 B10R1.61 N[C@@H]1CC=CC[C@H]1C(=O)O Amb1993723 [0,0,0,1,0,1|1,0,1]=4 5536 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O Amb19148605 [0,0,0,1,0,1|1,0,0]=3 5537 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O Amb22224856 [0,0,0,1,0,1|1,0,0]=3 5538 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O Amb1993721 [0,0,0,1,0,1|1,0,0]=3 5539 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O Amb1993765 [0,0,0,1,0,1|1,0,0]=3 5540 B10R1.61 N[C@@H]1COCC[C@@H]1C(=O)O Amb23399726 [0,0,0,1,0,1|2,0,0]=4 5541 B10R1.61 N[C@@H]1COCC[C@@H]1C(=O)O Amb33484156 [0,0,0,1,0,1|2,0,0]=4 5542 B10R1.61 N[C@H]1CC=CC[C@@H]1C(=O)O Amb26896028 [0,0,0,1,0,1|1,0,1]=4 5543 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O Amb1993722 [0,0,0,1,0,1|1,0,1]=4 5544 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O Amb6365687 [0,0,0,1,0,1|1,0,1]=4 5545 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O Amb22224868 [0,0,0,1,0,1|1,0,0]=3 5546 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O Amb1993720 [0,0,0,1,0,1|1,0,0]=3 5547 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O Amb6365686 [0,0,0,1,0,1|1,0,0]=3 5548 B10R1.61 N[C@H]1CNCC[C@H]1C(=O)O Amb28345659 [0,0,0,1,0,1|2,0,0]=4 5549 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O Amb26014626 [0,0,0,1,0,1|2,0,0]=4 5550 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O Amb33482769 [0,0,0,1,0,1|2,0,0]=4 5551 B10R1.61 O=C(O)C1CCCCC1Br Amb27425110 [0,0,0,1,0,1|2,0,0]=4 5552 B10R1.61 O=C(O)C1CCCCC1Cl Amb18126348 [0,0,0,1,0,1|2,0,0]=4 5553 B10R1.61 O=C(O)C1CCCCC1F Amb32667613 [0,0,0,1,0,1|2,0,0]=4 5554 B10R1.61 O=C(O)C1CCCCC1O Amb2694762 [0,0,0,1,0,1|2,0,0]=4 5555 B10R1.61 O=C(O)C1CNCCC1F Amb24331967 [0,0,0,1,0,1|2,0,0]=4 5556 B10R1.61 O=C(O)[C@@H]1CCCC[C@H]1Cl Amb28288041 [0,0,0,1,0,1|2,0,0]=4 5557 B10R1.61 O=C(O)[C@@H]1CCCC[C@H]1O Amb16204296 [0,0,0,1,0,1|2,0,0]=4 5558 B10R1.61 O=C(O)[C@H]1CCCC[C@@H]1Cl Amb27634391 [0,0,0,1,0,1|2,0,0]=4 5559 B10R1.61 O=C(O)[C@H]1CCCC[C@H]1O Amb4022448 [0,0,0,1,0,1|2,0,0]=4 5560 B10R1.61 O=C(O)[C@H]1CNCC[C@@H]1S Amb28199242 [0,0,0,1,0,1|2,0,0]=4 5561 B10R1.61 O=C(O)[C@H]1CNCC[C@H]1S Amb27444152 [0,0,0,1,0,1|2,0,0]=4 5562 B10R1.91 CCCC1C(C)C1C(=O)O Amb28421897 [0,0,0,1,0,1|2,0,0]=4 5563 B10R1.91 CCC[C@@H]1[C@H](C)[C@H]1C(=O)O Amb28067787 [0,0,0,1,0,1|2,0,0]=4 5564 B10R1.110 CC(CC(=O)O)C1CC1C Amb24666851 [0,0,0,1,0,1|2,0,0]=4 5565 B10R1.110 CC1CC1C(N)CC(=O)O Amb33253734 [0,0,0,1,0,1|1,0,0]=3 5566 B10R1.110 CC1CC1C(N)CC(N)=O Amb33254879 [0,0,0,1,0,1|2,0,0]=4 5567 B10R1.110 CC1CC1C(O)CC(=O)O Amb33036107 [0,0,0,1,0,1|2,0,0]=4 5568 B10R1.110 CC1CC1[C@@H](N)CC(=O)O Amb33254242 [0,0,0,1,0,1|1,0,0]=3 5569 B10R1.110 CC1CC1[C@@H](N)CC(N)=O Amb33255336 [0,0,0,1,0,1|2,0,0]=4 5570 B10R1.110 CC1CC1[C@@H](O)CC(=O)O Amb33144258 [0,0,0,1,0,1|2,0,0]=4 5571 B10R1.110 CC1CC1[C@H](N)CC(=O)O Amb33308232 [0,0,0,1,0,1|1,0,0]=3 5572 B10R1.110 CC1CC1[C@H](N)CC(N)=O Amb33254271 [0,0,0,1,0,1|2,0,0]=4 5573 B10R1.110 CC1CC1[C@H](O)CC(=O)O Amb33144257 [0,0,0,1,0,1|2,0,0]=4 5574 B10R1.115 CC1CCC1(N)CC(=O)O Amb25209192 [0,0,0,1,0,1|1,0,0]=3 5575 B10R1.115 CC1CCC1(N)CC(N)=O Amb33255694 [0,0,0,1,0,1|2,0,0]=4 5576 B10R1.130 CCCC1OC(=O)CC1N Amb27454546 [0,0,0,1,0,1|1,0,0]=3 5577 B10R1.130 CCC[C@H]1OC(=O)C[C@@H]1O Amb28455056 [0,0,0,1,0,1|2,0,0]=4 5578 B10R1.130 CCOC1OC(=O)CC1N Amb28342346 [0,0,0,1,0,1|2,0,0]=4 5579 B10R1.144 CCCCC1CC1C(=O)O Amb10608641 [0,0,0,1,0,1|2,0,0]=4 5580 B10R1.144 CCCC[C@@H]1C[C@H]1C(=O)O Amb25960764 [0,0,0,1,0,1|2,0,0]=4 5581 B10R1.144 CCCC[C@@H]1O[C@H]1C(=O)O Amb24585157 [0,0,0,1,0,1|2,0,0]=4 5582 B10R1.144 COCCC1CC1C(=O)O Amb33377829 [0,0,0,1,0,1|1,1,0]=4 5583 B10R1.144 COCC[C@@H]1C[C@H]1C(=O)O Amb33377827 [0,0,0,1,0,1|1,1,0]=4 5584 B10R1.144 CSCCC1CC1C(=O)O Amb33198761 [0,0,0,1,0,1|1,0,0]=3 5585 B10R1.144 CSCC[C@@H]1C[C@H]1C(=O)O Amb33198757 [0,0,0,1,0,1|1,0,0]=3 5586 B10R1.154 CCC1CC1(N)CC(N)=O Amb27225269 [0,0,0,1,0,1|2,0,0]=4 5587 B10R1.154 NC1(CC(=O)O)CC1CO Amb27759300 [0,0,0,1,0,1|2,0,0]=4 5588 B10R1.154 N[C@@]1(CC(=O)O)C[C@H]1CO Amb26554585 [0,0,0,1,0,1|2,0,0]=4 5589 B10R1.154 N[C@]1(CC(=O)O)CC1CO Amb28343286 [0,0,0,1,0,1|2,0,0]=4 5590 B10R1.168 CCC1CC(CC(=O)O)C1 Amb24585666 [0,0,0,1,0,1|2,0,0]=4 5591 B10R1.168 CO[C@H]1C[C@@H](CC(=O)O)C1 Amb35751669 [0,0,0,1,0,1|1,1,0]=4 5592 B10R1.192 CC1CCC(F)C1C(=O)O Amb20623940 [0,0,0,1,0,1|2,0,0]=4 5593 B10R1.192 CC1CCC(N)C1C(=O)O Amb20623939 [0,0,0,1,0,1|1,0,0]=3 5594 B10R1.192 CC1CCC(O)C1C(=O)O Amb20623938 [0,0,0,1,0,1|2,0,0]=4 5595 B10R1.192 CC1CCN(C)[C@@H]1C(=O)O Amb27242607 [0,0,0,1,0,1|2,0,0]=4 5596 B10R1.192 CC1CC[C@H](N)[C@@H]1C(=O)O Amb27880687 [0,0,0,1,0,1|1,0,0]=3 5597 B10R1.192 CN1CCC(N)C1C(=O)O Amb18831502 [0,0,0,1,0,1|1,0,0]=3 5598 B10R1.192 CN1CC[C@@H](O)[C@H]1C(=O)O Amb25324440 [0,0,0,1,0,1|2,0,0]=4 5599 B10R1.192 C[C@@H]1CC[C@@H](N)[C@H]1C(=O)O Amb27777880 [0,0,0,1,0,1|1,0,0]=3 5600 B10R1.192 C[C@@H]1CC[C@H](N)[C@@H]1C(=O)O Amb27423889 [0,0,0,1,0,1|1,0,0]=3 5601 B10R1.192 N[C@H]1CC[C@H](O)[C@@H]1C(=O)O Amb27257928 [0,0,0,1,0,1|2,0,0]=4 5602 B10R1.266 C=C(C)CC(N)C1CSC1 Amb35697093 [0,0,0,1,0,1|2,0,0]=4 5603 B10R1.266 CC(C)=CC(N)C1CSC1 Amb35697091 [0,0,0,1,0,1|2,0,0]=4 5604 B10R1.266 CC(CC(=O)O)C1CCC1 Amb26657160 [0,0,0,1,0,1|2,0,0]=4 5605 B10R1.266 NC(=O)CC(N)C1CCC1 Amb26353093 [0,0,0,1,0,1|2,0,0]=4 5606 B10R1.266 NC(=O)C[C@@H](N)C1CCC1 Amb28454256 [0,0,0,1,0,1|2,0,0]=4 5607 B10R1.266 NC(=O)C[C@H](N)C1CCC1 Amb25688130 [0,0,0,1,0,1|2,0,0]=4 5608 B10R1.266 NC(CC(=O)O)C1CCC1 Amb2683962 [0,0,0,1,0,1|1,0,0]=3 5609 B10R1.266 N[C@@H](CC(=O)O)C1CCC1 Amb24538021 [0,0,0,1,0,1|1,0,0]=3 5610 B10R1.266 N[C@H](CC(=O)O)C1CCC1 Amb25324207 [0,0,0,1,0,1|1,0,0]=3 5611 B10R1.266 O=C(O)CC(O)C1CCC1 Amb33036231 [0,0,0,1,0,1|2,0,0]=4 5612 B10R1.266 O=C(O)C[C@@H](O)C1CCC1 Amb33314120 [0,0,0,1,0,1|2,0,0]=4 5613 B10R1.266 O=C(O)C[C@H](O)C1CCC1 Amb33314121 [0,0,0,1,0,1|2,0,0]=4 5614 B10R1.268 CC(CC(=O)O)CC1CC1 Amb25147806 [0,0,0,1,0,1|2,0,0]=4 5615 B10R1.268 NC(=O)CC(N)CC1CC1 Amb26056276 [0,0,0,1,0,1|2,0,0]=4 5616 B10R1.268 NC(CC(=O)O)CC1CC1 Amb25704189 [0,0,0,1,0,1|1,0,0]=3 5617 B10R1.268 O=C(O)CC(O)CC1CC1 Amb33036272 [0,0,0,1,0,1|2,0,0]=4 5618 B10R1.268 O=C(O)C[C@@H](O)CC1CC1 Amb33361926 [0,0,0,1,0,1|2,0,0]=4 5619 B10R1.268 O=C(O)C[C@H](O)CC1CC1 Amb33361927 [0,0,0,1,0,1|2,0,0]=4 5620 B10R1.370 CC(=O)CC1(N)CCCC1 Amb27788263 [0,0,0,1,0,1|2,0,0]=4 5621 B10R1.370 CC(=O)CC1(O)CCSC1 Amb32943771 [0,0,0,1,0,1|2,0,0]=4 5622 B10R1.370 CC1(CC(=O)O)CCCC1 Amb33544780 [0,0,0,1,0,1|2,0,0]=4 5623 B10R1.370 CC1(CC(=O)O)CCOC1 Amb28193907 [0,0,0,1,0,1|1,1,0]=4 5624 B10R1.370 NC(=O)CC1(N)CCCC1 Amb27488719 [0,0,0,1,0,1|2,0,0]=4 5625 B10R1.370 NC(=O)CC1(N)CCNC1 Amb33254814 [0,0,0,1,0,1|2,0,0]=4 5626 B10R1.370 NC(=O)CC1(N)CCOC1 Amb33254358 [0,0,0,1,0,1|1,1,0]=4 5627 B10R1.370 NC(=O)CC1(N)CCSC1 Amb33254333 [0,0,0,1,0,1|1,0,0]=3 5628 B10R1.370 NC1(CC(=O)O)C=CCC1 Amb33036359 [0,0,0,1,0,1|1,0,1]=4 5629 B10R1.370 NC1(CC(=O)O)CCCC1 Amb22295785 [0,0,0,1,0,1|1,0,0]=3 5630 B10R1.370 NC1(CC(=O)O)CCCC1 Amb22337063 [0,0,0,1,0,1|1,0,0]=3 5631 B10R1.370 NC1(CC(=O)O)CCNC1 Amb26460077 [0,0,0,1,0,1|1,0,0]=3 5632 B10R1.370 NC1(CC(=O)O)CCOC1 Amb22059549 [0,0,0,1,0,1|0,1,0]=3 5633 B10R1.370 NC1(CC(=O)O)CCOC1 Amb32693448 [0,0,0,1,0,1|0,1,0]=3 5634 B10R1.370 NC1(CC(=O)O)CCSC1 Amb23515102 [0,0,0,1,0,1|0,0,0]=2 5635 B10R1.370 NC1(CC(=O)O)CCSC1 Amb28555637 [0,0,0,1,0,1|0,0,0]=2 5636 B10R1.370 O=C(O)CC1(F)CCNC1 Amb28070974 [0,0,0,1,0,1|2,0,0]=4 5637 B10R1.370 O=C(O)CC1(O)CCCC1 Amb18285919 [0,0,0,1,0,1|2,0,0]=4 5638 B10R1.370 O=C(O)CC1(O)CCNC1 Amb25135404 [0,0,0,1,0,1|2,0,0]=4 5639 B10R1.370 O=C(O)CC1(O)CCOC1 Amb32672194 [0,0,0,1,0,1|1,1,0]=4 5640 B10R1.370 O=C(O)CC1(O)CCSC1 Amb18961446 [0,0,0,1,0,1|1,0,0]=3 5641 B10R1.435 CSCCC1(N)CC(O)C1 Amb33203356 [0,0,0,1,0,1|1,0,1]=4 5642 B10R1.28 CP(=O)(O)C1CCCCN1 Amb3714695 [0,1,0,1,0,0|2,0,0]=4 5643 B10R1.28 O=P(O)(O)C1CCCCN1 Amb3775555 [0,1,0,1,0,0|2,0,0]=4 5644 B10R1.28 O=P(O)(O)[C@H]1CCCCN1 Amb27633857 [0,1,0,1,0,0|2,0,0]=4 5645 B10R1.167 CC[C@@H]1C[C@@]1(N)P(=O)(O)O Amb28051789 [0,1,0,1,0,0|2,0,0]=4 5646 B10R1.274 NC(C1CCC1)P(=O)(O)O Amb27441400 [0,1,0,1,0,0|2,0,0]=4 5647 B10R1.304 CC(C)(O)C1(N)CCSC1 Amb33219808 [0,1,0,1,0,0|1,0,1]=4 5648 B10R1.22 C[C@@H]1C[C@@H](O)[C@@H](O)C(=O)O1 Amb27219011 [0,1,0,1,0,0|2,0,0]=4 5649 B10R1.22 C[C@@H]1C[C@@H](O)[C@H](O)C(=O)O1 Amb28321483 [0,1,0,1,0,0|2,0,0]=4 5650 B10R1.23 C=C(C(=O)O)C1CCSC1 Amb33345720 [0,1,0,1,0,0|1,0,1]=4 5651 B10R1.23 C=C(C)C(N)C1CCSC1 Amb28050319 [0,1,0,1,0,0|2,0,0]=4 5652 B10R1.23 CC(=O)C(C)C1CCSC1 Amb35697102 [0,1,0,1,0,0|2,0,0]=4 5653 B10R1.23 CC(C(=O)O)C1CCCC1 Amb33531206 [0,1,0,1,0,0|2,0,0]=4 5654 B10R1.23 CC(C(=O)O)C1CCCN1 Amb18202477 [0,1,0,1,0,0|2,0,0]=4 5655 B10R1.23 CC(C(=O)O)C1CCCO1 Amb27253801 [0,1,0,1,0,0|2,0,0]=4 5656 B10R1.23 CC(C(=O)O)C1CCCS1 Amb27186076 [0,1,0,1,0,0|2,0,0]=4 5657 B10R1.23 CC(C(=O)O)C1CCNC1 Amb18831577 [0,1,0,1,0,0|2,0,0]=4 5658 B10R1.23 CC(C(=O)O)C1CCOC1 Amb18831507 [0,1,0,1,0,0|1,1,0]=4 5659 B10R1.23 CC(C(=O)O)C1CCSC1 Amb27850440 [0,1,0,1,0,0|1,0,0]=3 5660 B10R1.23 CC(C(=O)O)N1CCCC1 Amb9783423 [0,1,0,1,0,0|2,0,0]=4 5661 B10R1.23 C[C@@H](C(=O)O)C1CCCC1 Amb10844017 [0,1,0,1,0,0|2,0,0]=4 5662 B10R1.23 C[C@@H](C(=O)O)C1CCCO1 Amb33726955 [0,1,0,1,0,0|2,0,0]=4 5663 B10R1.23 C[C@@H](C(=O)O)C1CCOC1 Amb33729604 [0,1,0,1,0,0|1,1,0]=4 5664 B10R1.23 C[C@@H](C(=O)O)N1CCCC1 Amb28050114 [0,1,0,1,0,0|2,0,0]=4 5665 B10R1.23 C[C@H](C(=O)O)C1CCCC1 Amb10844018 [0,1,0,1,0,0|2,0,0]=4 5666 B10R1.23 C[C@H](C(=O)O)C1CCCO1 Amb33744367 [0,1,0,1,0,0|2,0,0]=4 5667 B10R1.23 C[C@H](C(=O)O)C1CCOC1 Amb33747705 [0,1,0,1,0,0|1,1,0]=4 5668 B10R1.23 C[C@H](C(=O)O)[C@H]1CCCN1 Amb27630718 [0,1,0,1,0,0|2,0,0]=4 5669 B10R1.23 NC(=O)C(N)C1CCCC1 Amb18958717 [0,1,0,1,0,0|2,0,0]=4 5670 B10R1.23 NC(=O)C(N)C1CCCN1 Amb27959202 [0,1,0,1,0,0|2,0,0]=4 5671 B10R1.23 NC(=O)C(N)C1CCCO1 Amb26620475 [0,1,0,1,0,0|2,0,0]=4 5672 B10R1.23 NC(=O)C(N)C1CCCS1 Amb27959206 [0,1,0,1,0,0|2,0,0]=4 5673 B10R1.23 NC(=O)C(N)C1CCOC1 Amb18950565 [0,1,0,1,0,0|1,1,0]=4 5674 B10R1.23 NC(=O)C(N)C1CCOC1 Amb32708489 [0,1,0,1,0,0|1,1,0]=4 5675 B10R1.23 NC(=O)C(N)C1CCSC1 Amb26340123 [0,1,0,1,0,0|1,0,0]=3 5676 B10R1.23 NC(C(=O)O)C1C=CCO1 Amb27838140 [0,1,0,1,0,0|1,0,1]=4 5677 B10R1.23 NC(C(=O)O)C1CCCC1 Amb19373068 [0,1,0,1,0,0|1,0,0]=3 5678 B10R1.23 NC(C(=O)O)C1CCCC1 Amb9721618 [0,1,0,1,0,0|1,0,0]=3 5679 B10R1.23 NC(C(=O)O)C1CCCO1 Amb18644193 [0,1,0,1,0,0|1,0,0]=3 5680 B10R1.23 NC(C(=O)O)C1CCCS1 Amb26645781 [0,1,0,1,0,0|1,0,0]=3 5681 B10R1.23 NC(C(=O)O)C1CCNC1 Amb2699126 [0,1,0,1,0,0|1,0,0]=3 5682 B10R1.23 NC(C(=O)O)C1CCNC1 Amb33718664 [0,1,0,1,0,0|1,0,0]=3 5683 B10R1.23 NC(C(=O)O)C1CCOC1 Amb9724906 [0,1,0,1,0,0|0,1,0]=3 5684 B10R1.23 NC(C(=O)O)C1CCSC1 Amb25837887 [0,1,0,1,0,0|0,0,0]=2 5685 B10R1.23 N[C@@H](C(=O)O)C1CCCC1 Amb2699119 [0,1,0,1,0,0|1,0,0]=3 5686 B10R1.23 N[C@@H](C(=O)O)C1CCCO1 Amb33066080 [0,1,0,1,0,0|1,0,0]=3 5687 B10R1.23 N[C@@H](C(=O)O)C1CCOC1 Amb24437668 [0,1,0,1,0,0|0,1,0]=3 5688 B10R1.23 N[C@@H](C(=O)O)C1CCSC1 Amb30011061 [0,1,0,1,0,0|0,0,0]=2 5689 B10R1.23 N[C@@H](C(=O)O)[C@@H]1C=CCC1 Amb27975764 [0,1,0,1,0,0|1,0,1]=4 5690 B10R1.23 N[C@@H](C(=O)O)[C@@H]1CCCO1 Amb28366221 [0,1,0,1,0,0|1,0,0]=3 5691 B10R1.23 N[C@H](C(=O)O)C1CCCC1 Amb2699120 [0,1,0,1,0,0|1,0,0]=3 5692 B10R1.23 N[C@H](C(=O)O)C1CCCN1 Amb27823844 [0,1,0,1,0,0|1,0,0]=3 5693 B10R1.23 N[C@H](C(=O)O)C1CCCO1 Amb33309007 [0,1,0,1,0,0|1,0,0]=3 5694 B10R1.23 N[C@H](C(=O)O)C1CCOC1 Amb24353330 [0,1,0,1,0,0|0,1,0]=3 5695 B10R1.23 N[C@H](C(=O)O)C1CCSC1 Amb30013147 [0,1,0,1,0,0|0,0,0]=2 5696 B10R1.23 N[C@H](C(=O)O)C1SCCS1 Amb27753737 [0,1,0,1,0,0|2,0,0]=4 5697 B10R1.23 N[C@H](C(=O)O)[C@@H]1CC=NO1 Amb27222035 [0,1,0,1,0,0|2,0,0]=4 5698 B10R1.23 N[C@H](C(=O)O)[C@@H]1CCCO1 Amb27625760 [0,1,0,1,0,0|1,0,0]=3 5699 B10R1.23 N[C@H](C(=O)O)[C@@H]1CCOC1 Amb24621873 [0,1,0,1,0,0|0,1,0]=3 5700 B10R1.23 N[C@H](C(=O)O)[C@H]1C=CCO1 Amb27473290 [0,1,0,1,0,0|1,0,1]=4 5701 B10R1.23 N[C@H](C(=O)O)[C@H]1CC=NO1 Amb27968338 [0,1,0,1,0,0|2,0,0]=4 5702 B10R1.23 N[C@H](C(=O)O)[C@H]1CCOC1 Amb24621874 [0,1,0,1,0,0|0,1,0]=3 5703 B10R1.23 O=C(O)C(=O)C1CCSC1 Amb33141373 [0,1,0,1,0,0|1,0,1]=4 5704 B10R1.23 O=C(O)C(Br)C1CCCC1 Amb18130988 [0,1,0,1,0,0|2,0,0]=4 5705 B10R1.23 O=C(O)C(F)C1CCCC1 Amb26343220 [0,1,0,1,0,0|2,0,0]=4 5706 B10R1.23 O=C(O)C(F)C1CCOC1 Amb27589906 [0,1,0,1,0,0|1,1,0]=4 5707 B10R1.23 O=C(O)C(F)C1CCSC1 Amb27449563 [0,1,0,1,0,0|1,0,0]=3 5708 B10R1.23 O=C(O)C(O)C1CCCC1 Amb18958313 [0,1,0,1,0,0|2,0,0]=4 5709 B10R1.23 O=C(O)C(O)C1CCCN1 Amb27447229 [0,1,0,1,0,0|2,0,0]=4 5710 B10R1.23 O=C(O)C(O)C1CCCO1 Amb27596051 [0,1,0,1,0,0|2,0,0]=4 5711 B10R1.23 O=C(O)C(O)C1CCCS1 Amb33416223 [0,1,0,1,0,0|2,0,0]=4 5712 B10R1.23 O=C(O)C(O)C1CCNC1 Amb18124721 [0,1,0,1,0,0|2,0,0]=4 5713 B10R1.23 O=C(O)C(O)C1CCSC1 Amb25788192 [0,1,0,1,0,0|1,0,0]=3 5714 B10R1.23 O=C(O)C(O)[C@@H]1CCCN1 Amb27982415 [0,1,0,1,0,0|2,0,0]=4 5715 B10R1.23 O=C(O)C(S)C1CCCC1 Amb28050893 [0,1,0,1,0,0|2,0,0]=4 5716 B10R1.23 O=C(O)[C@H](O)C1CCCC1 Amb27494022 [0,1,0,1,0,0|2,0,0]=4 5717 B10R1.34 CC1C(CBr)OC(=O)C1N Amb28127554 [0,1,0,1,0,0|2,0,0]=4 5718 B10R1.34 CC1C(CO)OC(=O)C1N Amb27838157 [0,1,0,1,0,0|2,0,0]=4 5719 B10R1.34 CCC1OC(=O)C(O)C1C Amb27978237 [0,1,0,1,0,0|2,0,0]=4 5720 B10R1.34 CC[C@@H]1OC(=O)[C@@H](N)[C@@H]1C Amb27235698 [0,1,0,1,0,0|1,0,0]=3 5721 B10R1.34 C[C@@H]1[C@H](N)C(=O)O[C@H]1CO Amb27974858 [0,1,0,1,0,0|2,0,0]=4 5722 B10R1.34 NCC1OC(=O)C(N)C1N Amb27838158 [0,1,0,1,0,0|2,0,0]=4 5723 B10R1.34 N[C@@H]1C(=O)O[C@H](CBr)[C@@H]1O Amb28411165 [0,1,0,1,0,0|2,0,0]=4 5724 B10R1.51 CC1C(CO)C1(N)C(=O)O Amb27159945 [0,1,0,1,0,0|2,0,0]=4 5725 B10R1.51 C[C@@H]1[C@@H](CO)[C@]1(N)C(=O)O Amb27217363 [0,1,0,1,0,0|2,0,0]=4 5726 B10R1.59 CC1=CC(C(=O)O)C(N)C1 Amb27838089 [0,1,0,1,0,0|2,0,0]=4 5727 B10R1.59 CC1=C[C@@H](C(=O)O)[C@@H](N)C1 Amb27629270 [0,1,0,1,0,0|2,0,0]=4 5728 B10R1.59 CC1=C[C@H](C(=O)O)[C@@H](N)C1 Amb27975743 [0,1,0,1,0,0|2,0,0]=4 5729 B10R1.59 CC1CC(=O)NC1C(=O)O Amb25063723 [0,1,0,1,0,0|2,0,0]=4 5730 B10R1.59 CC1CC(C)C(C(=O)O)O1 Amb25943591 [0,1,0,1,0,0|2,0,0]=4 5731 B10R1.59 CC1CC(F)C(C(=O)O)O1 Amb28198814 [0,1,0,1,0,0|2,0,0]=4 5732 B10R1.59 CC1CC(N)C(C(=O)O)C1 Amb28075037 [0,1,0,1,0,0|2,0,0]=4 5733 B10R1.59 CC1CN(C)CC1C(=O)O Amb24478023 [0,1,0,1,0,0|2,0,0]=4 5734 B10R1.59 CC1CN(C)CC1C(=O)O Amb33552546 [0,1,0,1,0,0|2,0,0]=4 5735 B10R1.59 CC1C[C@@H](O)[C@@H](C(=O)O)N1 Amb27818206 [0,1,0,1,0,0|1,0,0]=3 5736 B10R1.59 CC1C[C@H](N)[C@H](C(=O)O)C1 Amb27871980 [0,1,0,1,0,0|2,0,0]=4 5737 B10R1.59 CN1CC(F)C(C(=O)O)C1 Amb27658048 [0,1,0,1,0,0|2,0,0]=4 5738 B10R1.59 C[C@@H]1CC(=O)N[C@@H]1C(=O)O Amb27188183 [0,1,0,1,0,0|2,0,0]=4 5739 B10R1.59 C[C@@H]1CN(C)C[C@H]1C(=O)O Amb24643115 [0,1,0,1,0,0|2,0,0]=4 5740 B10R1.59 C[C@@H]1C[C@@H](F)[C@@H](C(=O)O)O1 Amb28058745 [0,1,0,1,0,0|2,0,0]=4 5741 B10R1.59 C[C@@H]1C[C@@H](O)[C@@H](C(=O)O)N1 Amb25966968 [0,1,0,1,0,0|1,0,0]=3 5742 B10R1.59 C[C@@H]1C[C@@H](O)[C@H](C(=O)O)N1 Amb27204031 [0,1,0,1,0,0|1,0,0]=3 5743 B10R1.59 C[C@@H]1C[C@H](Cl)[C@H](C(=O)O)O1 Amb28457445 [0,1,0,1,0,0|2,0,0]=4 5744 B10R1.59 C[C@@H]1C[C@H](O)[C@@H](C(=O)O)N1 Amb27249841 [0,1,0,1,0,0|1,0,0]=3 5745 B10R1.59 C[C@H]1CC(=O)N[C@@H]1C(=O)O Amb28429784 [0,1,0,1,0,0|2,0,0]=4 5746 B10R1.59 C[C@H]1C[C@@H](O)[C@H](C(=O)O)N1 Amb27420162 [0,1,0,1,0,0|1,0,0]=3 5747 B10R1.59 C[C@H]1C[C@H](O)[C@@H](C(=O)O)N1 Amb26930084 [0,1,0,1,0,0|1,0,0]=3 5748 B10R1.59 O=C1CC(O)C(C(=O)O)N1 Amb27175349 [0,1,0,1,0,0|2,0,0]=4 5749 B10R1.59 O=C1C[C@H](O)[C@@H](C(=O)O)N1 Amb27803055 [0,1,0,1,0,0|2,0,0]=4 5750 B10R1.81 CC(C(=O)O)C1CC(F)C1 Amb33727408 [0,1,0,1,0,0|2,0,0]=4 5751 B10R1.81 CC(C(=O)O)C1CN(C)C1 Amb27205795 [0,1,0,1,0,0|2,0,0]=4 5752 B10R1.81 CC1CC(C(N)C(=O)O)C1 Amb35666631 [0,1,0,1,0,0|1,0,0]=3 5753 B10R1.81 CC1CC(C(O)C(=O)O)C1 Amb28194701 [0,1,0,1,0,0|2,0,0]=4 5754 B10R1.81 CN1CC(C(N)C(N)=O)C1 Amb27796704 [0,1,0,1,0,0|2,0,0]=4 5755 B10R1.81 CN1CC(C(O)C(=O)O)C1 Amb27441324 [0,1,0,1,0,0|2,0,0]=4 5756 B10R1.81 C[C@@H](C(=O)O)C1CC(F)C1 Amb33729206 [0,1,0,1,0,0|2,0,0]=4 5757 B10R1.81 C[C@H](C(=O)O)C1CC(F)C1 Amb33728834 [0,1,0,1,0,0|2,0,0]=4 5758 B10R1.81 NC(C(=O)O)C1CC(F)C1 Amb34162536 [0,1,0,1,0,0|1,0,0]=3 5759 B10R1.94 CCC[C@H]1ONC(=O)[C@H]1N Amb27786867 [0,1,0,1,0,0|1,0,0]=3 5760 B10R1.155 CCC1CC1C(C)C(=O)O Amb28130000 [0,1,0,1,0,0|2,0,0]=4 5761 B10R1.155 CCC1CC1C(N)C(=O)O Amb27639984 [0,1,0,1,0,0|1,0,0]=3 5762 B10R1.155 NC(C(=O)O)C1CC1CO Amb28076860 [0,1,0,1,0,0|1,0,0]=3 5763 B10R1.163 O=C(O)C1NC(CO)C1O Amb28143118 [0,1,0,1,0,0|2,0,0]=4 5764 B10R1.275 CC1CCCNC(=O)C1N Amb32455740 [0,1,0,1,0,0|2,0,0]=4 5765 B10R1.275 CN1CCCCC(N)C1=O Amb22492778 [0,1,0,1,0,0|2,0,0]=4 5766 B10R1.275 CN1CCCCC(N)C1=O Amb32412576 [0,1,0,1,0,0|2,0,0]=4 5767 B10R1.275 CN1CCCC[C@@H](N)C1=O Amb17933194 [0,1,0,1,0,0|2,0,0]=4 5768 B10R1.275 CN1CCCC[C@H](N)C1=O Amb2699112 [0,1,0,1,0,0|2,0,0]=4 5769 B10R1.275 N[C@@H]1C(=O)NCCC[C@H]1O Amb27494056 [0,1,0,1,0,0|2,0,0]=4 5770 B10R1.275 O=C1[C@@H](O)CCCC[C@H]1O Amb27432631 [0,1,0,1,0,0|2,0,0]=4 5771 B10R1.278 CC(C(=O)O)C(C)C1CC1 Amb18202584 [0,1,0,1,0,0|2,0,0]=4 5772 B10R1.278 CC(C(=O)O)C(N)C1CC1 Amb33036351 [0,1,0,1,0,0|2,0,0]=4 5773 B10R1.278 CC(C(=O)O)C(O)C1CC1 Amb18298174 [0,1,0,1,0,0|2,0,0]=4 5774 B10R1.278 CC(C1CC1)C(F)C(=O)O Amb27450821 [0,1,0,1,0,0|2,0,0]=4 5775 B10R1.278 CC(C1CC1)C(N)C(=O)O Amb18202475 [0,1,0,1,0,0|1,0,0]=3 5776 B10R1.278 CC(C1CC1)C(N)C(=O)O Amb28895992 [0,1,0,1,0,0|1,0,0]=3 5777 B10R1.278 CC(C1CC1)[C@@H](C)C(=O)O Amb33729612 [0,1,0,1,0,0|2,0,0]=4 5778 B10R1.278 CC(C1CC1)[C@H](C)C(=O)O Amb33744621 [0,1,0,1,0,0|2,0,0]=4 5779 B10R1.278 C[C@@H](C1CC1)[C@@H](O)C(=O)O Amb27882738 [0,1,0,1,0,0|2,0,0]=4 5780 B10R1.278 NC(C(=O)O)C(O)C1CC1 Amb18202143 [0,1,0,1,0,0|1,0,0]=3 5781 B10R1.278 NC(C1CC1)C(F)C(=O)O Amb33036371 [0,1,0,1,0,0|2,0,0]=4 5782 B10R1.278 N[C@@H](C(=O)O)[C@H](O)C1CC1 Amb27970559 [0,1,0,1,0,0|1,0,0]=3 5783 B10R1.278 O=C(O)C(F)C(O)C1CC1 Amb33136391 [0,1,0,1,0,0|2,0,0]=4 5784 B10R1.291 CC1(C(=O)O)CCCC1N Amb18643994 [0,1,0,1,0,0|2,0,0]=4 5785 B10R1.291 CC1(C(=O)O)CCCC1N Amb32693462 [0,1,0,1,0,0|2,0,0]=4 5786 B10R1.291 CC1(C(=O)O)CCCC1O Amb18644145 [0,1,0,1,0,0|2,0,0]=4 5787 B10R1.291 CC1=CCC[C@]1(C)C(=O)O Amb27493964 [0,1,0,1,0,0|2,0,0]=4 5788 B10R1.291 CC1CCCC1(C)C(=O)O Amb33545081 [0,1,0,1,0,0|2,0,0]=4 5789 B10R1.291 CC1CCCC1(N)C(=O)O Amb2695736 [0,1,0,1,0,0|1,0,0]=3 5790 B10R1.291 CC1CCCC1(N)C(=O)O Amb31156300 [0,1,0,1,0,0|1,0,0]=3 5791 B10R1.291 CC1CCCC1(N)C(N)=O Amb33547798 [0,1,0,1,0,0|2,0,0]=4 5792 B10R1.291 CC1COCC1(N)C(=O)O Amb35646804 [0,1,0,1,0,0|0,1,0]=3 5793 B10R1.291 CC1COCC1(N)C(N)=O Amb35635778 [0,1,0,1,0,0|1,1,0]=4 5794 B10R1.291 CC1COCC1(O)C(=O)O Amb35632025 [0,1,0,1,0,0|1,1,0]=4 5795 B10R1.291 CC1OCCC1(C)C(=O)O Amb26591045 [0,1,0,1,0,0|1,1,0]=4 5796 B10R1.291 CC1OCCC1(F)C(=O)O Amb33078512 [0,1,0,1,0,0|1,1,0]=4 5797 B10R1.291 CC1OCCC1(O)C(=O)O Amb27606899 [0,1,0,1,0,0|1,1,0]=4 5798 B10R1.291 CN1CCC[C@@]1(C)C(=O)O Amb25068442 [0,1,0,1,0,0|2,0,0]=4 5799 B10R1.291 CN1CCC[C@@]1(O)C(=O)O Amb28061304 [0,1,0,1,0,0|2,0,0]=4 5800 B10R1.291 CN1CCC[C@]1(C)C(=O)O Amb26930260 [0,1,0,1,0,0|2,0,0]=4 5801 B10R1.291 C[C@@H]1CCC[C@@]1(N)C(=O)O Amb26580738 [0,1,0,1,0,0|1,0,0]=3 5802 B10R1.291 C[C@@H]1CCC[C@@]1(N)C(N)=O Amb27420226 [0,1,0,1,0,0|2,0,0]=4 5803 B10R1.291 C[C@@H]1CCC[C@]1(N)C(=O)O Amb24562232 [0,1,0,1,0,0|1,0,0]=3 5804 B10R1.291 C[C@@H]1CNC[C@@]1(C)C(=O)O Amb28287365 [0,1,0,1,0,0|2,0,0]=4 5805 B10R1.291 C[C@@H]1CNC[C@@]1(C)C(=O)O Amb31156310 [0,1,0,1,0,0|2,0,0]=4 5806 B10R1.291 C[C@@]1(C(=O)O)CCC[C@@H]1N Amb22504290 [0,1,0,1,0,0|2,0,0]=4 5807 B10R1.291 C[C@H]1CCC[C@@]1(N)C(=O)O Amb27786907 [0,1,0,1,0,0|1,0,0]=3 5808 B10R1.291 C[C@H]1CCC[C@@]1(N)C(N)=O Amb27960295 [0,1,0,1,0,0|2,0,0]=4 5809 B10R1.291 C[C@H]1CCC[C@]1(N)C(N)=O Amb27420225 [0,1,0,1,0,0|2,0,0]=4 5810 B10R1.291 C[C@H]1CSC[C@@]1(N)C(=O)O Amb27202538 [0,1,0,1,0,0|0,0,0]=2 5811 B10R1.291 C[C@]1(C(=O)O)CCC[C@@H]1N Amb24580091 [0,1,0,1,0,0|2,0,0]=4 5812 B10R1.291 C[C@]1(C(=O)O)CCC[C@@H]1O Amb28058141 [0,1,0,1,0,0|2,0,0]=4 5813 B10R1.291 C[C@]1(C(=O)O)CCC[C@H]1N Amb27767841 [0,1,0,1,0,0|2,0,0]=4 5814 B10R1.291 NC1(C(=O)O)CCCC1Cl Amb2695624 [0,1,0,1,0,0|1,0,0]=3 5815 B10R1.291 NC1(C(=O)O)CCCC1F Amb27841625 [0,1,0,1,0,0|1,0,0]=3 5816 B10R1.291 NC1CCCC1(N)C(=O)O Amb27817777 [0,1,0,1,0,0|1,0,0]=3 5817 B10R1.291 O=C(O)C1(O)CCCC1F Amb27461367 [0,1,0,1,0,0|2,0,0]=4 5818 B10R1.291 O=C(O)C1(O)COCC1O Amb28126796 [0,1,0,1,0,0|1,1,0]=4 5819 B10R1.291 O=C(O)[C@@]1(O)CCC[C@H]1F Amb27767897 [0,1,0,1,0,0|2,0,0]=4 5820 B10R1.291 O=C(O)[C@@]1(O)COC[C@H]1O Amb27472429 [0,1,0,1,0,0|1,1,0]=4 5821 B10R1.319 CCCC1CC1(N)C(=O)O Amb24391690 [0,1,0,1,0,0|1,0,0]=3 5822 B10R1.319 CCCC1OC1(C)C(=O)O Amb28325821 [0,1,0,1,0,0|2,0,0]=4 5823 B10R1.319 COC[C@@H]1C[C@@]1(C)C(=O)O Amb33098406 [0,1,0,1,0,0|1,1,0]=4 5824 B10R1.319 COC[C@H]1C[C@@]1(C)C(=O)O Amb33098401 [0,1,0,1,0,0|1,1,0]=4 5825 B10R1.319 CSCC1CC1(N)C(=O)O Amb27838049 [0,1,0,1,0,0|0,0,0]=2 5826 B10R1.319 CSC[C@H]1C[C@@]1(N)C(=O)O Amb28365949 [0,1,0,1,0,0|0,0,0]=2 5827 B10R1.319 CSC[C@H]1C[C@]1(N)C(=O)O Amb27780183 [0,1,0,1,0,0|0,0,0]=2 5828 B10R1.319 NC1(C(=O)O)CC1CCO Amb28290452 [0,1,0,1,0,0|1,0,0]=3 5829 B10R1.393 COCC1(C)CC1C(=O)O Amb18299135 [0,1,0,1,0,0|1,1,0]=4 5830 B10R1.495 CC(C(=O)O)C1(C)COC1 Amb33314598 [0,1,0,1,0,0|1,1,0]=4 5831 B10R1.495 CC(C(=O)O)C1(N)CCC1 Amb33036394 [0,1,0,1,0,0|2,0,0]=4 5832 B10R1.495 CC(C(=O)O)C1(N)COC1 Amb33036419 [0,1,0,1,0,0|1,1,0]=4 5833 B10R1.495 CC(C(=O)O)C1(N)CSC1 Amb33036335 [0,1,0,1,0,0|1,0,0]=3 5834 B10R1.495 CC(C(=O)O)C1(O)CCC1 Amb18961465 [0,1,0,1,0,0|2,0,0]=4 5835 B10R1.495 CC(C(=O)O)C1(O)COC1 Amb33036283 [0,1,0,1,0,0|1,1,0]=4 5836 B10R1.495 CC(C(=O)O)C1(O)CSC1 Amb25228626 [0,1,0,1,0,0|1,0,0]=3 5837 B10R1.495 CC1(C(N)C(=O)O)COC1 Amb24524694 [0,1,0,1,0,0|0,1,0]=3 5838 B10R1.495 CC1(C(O)C(=O)O)COC1 Amb33314498 [0,1,0,1,0,0|1,1,0]=4 5839 B10R1.495 C[C@@H](C(=O)O)C1(C)COC1 Amb33729188 [0,1,0,1,0,0|1,1,0]=4 5840 B10R1.495 C[C@H](C(=O)O)C1(C)COC1 Amb33728386 [0,1,0,1,0,0|1,1,0]=4 5841 B10R1.495 NC(C(=O)O)C1(F)COC1 Amb24735386 [0,1,0,1,0,0|0,1,0]=3 5842 B10R1.495 NC1(C(F)C(=O)O)COC1 Amb33036332 [0,1,0,1,0,0|1,1,0]=4 5843 B10R1.495 NC1(C(F)C(=O)O)CSC1 Amb33036322 [0,1,0,1,0,0|1,0,0]=3 5844 B10R1.495 NC1(C(O)C(=O)O)CCC1 Amb32946657 [0,1,0,1,0,0|2,0,0]=4 5845 B10R1.495 NC1(C(O)C(=O)O)CNC1 Amb32946686 [0,1,0,1,0,0|2,0,0]=4 5846 B10R1.495 NC1(C(O)C(=O)O)COC1 Amb32946667 [0,1,0,1,0,0|1,1,0]=4 5847 B10R1.495 O=C(O)C(F)C1(O)CNC1 Amb35788810 [0,1,0,1,0,0|2,0,0]=4 5848 B10R1.495 O=C(O)C(F)C1(O)CNC1 Amb35788822 [0,1,0,1,0,0|2,0,0]=4 5849 B10R1.495 O=C(O)C(F)C1(O)COC1 Amb33036211 [0,1,0,1,0,0|1,1,0]=4 5850 B10R1.495 O=C(O)C(F)C1(O)CSC1 Amb27196068 [0,1,0,1,0,0|1,0,0]=3 5851 B10R1.495 O=C(O)C(O)C1(O)CCC1 Amb24561983 [0,1,0,1,0,0|2,0,0]=4 5852 B10R1.495 O=C(O)C(O)C1(O)CNC1 Amb32946615 [0,1,0,1,0,0|2,0,0]=4 5853 B10R1.495 O=C(O)C(O)C1(O)COC1 Amb32946625 [0,1,0,1,0,0|1,1,0]=4 5854 B10R1.13 C=C1CCC(C(=O)O)CC1 Amb15695314 [0,1,0,1,0,0|2,0,0]=4 5855 B10R1.13 CC(=O)C1CCC(C)NC1 Amb28067890 [0,1,0,1,0,0|2,0,0]=4 5856 B10R1.13 CC1=CCC(C(=O)O)CC1 Amb18124574 [0,1,0,1,0,0|2,0,0]=4 5857 B10R1.13 CC1=CCC(C(=O)O)CN1 Amb2613014 [0,1,0,1,0,0|1,0,1]=4 5858 B10R1.13 CC1CCC(C(=O)O)CC1 Amb6456606 [0,1,0,1,0,0|2,0,0]=4 5859 B10R1.13 CC1CCC(C(=O)O)CN1 Amb18643999 [0,1,0,1,0,0|1,0,0]=3 5860 B10R1.13 CC1CCC(C(=O)O)CN1 Amb33329255 [0,1,0,1,0,0|1,0,0]=3 5861 B10R1.13 CC1CCC(C(=O)O)CO1 Amb29860383 [0,1,0,1,0,0|2,0,0]=4 5862 B10R1.13 CC1CCC(C(=O)O)NC1 Amb25324436 [0,1,0,1,0,0|1,0,0]=3 5863 B10R1.13 CC1CCC(C(=O)O)NC1 Amb33482831 [0,1,0,1,0,0|1,0,0]=3 5864 B10R1.13 CC1CCC(C(=O)O)OC1 Amb27832232 [0,1,0,1,0,0|2,0,0]=4 5865 B10R1.13 CC1CCC(C(N)=O)CN1 Amb6256393 [0,1,0,1,0,0|2,0,0]=4 5866 B10R1.13 CC1CCC(C(N)=O)NC1 Amb33495759 [0,1,0,1,0,0|2,0,0]=4 5867 B10R1.13 CC1CNC(C(=O)O)CN1 Amb28049378 [0,1,0,1,0,0|2,0,0]=4 5868 B10R1.13 CC1CNC(C(=O)O)CO1 Amb26356239 [0,1,0,1,0,0|2,0,0]=4 5869 B10R1.13 CC1CNC(C(=O)O)CO1 Amb32653486 [0,1,0,1,0,0|2,0,0]=4 5870 B10R1.13 CN1CCC(C(=O)O)CC1 Amb2236137 [0,1,0,1,0,0|2,0,0]=4 5871 B10R1.13 CN1CCC(C(=O)O)CC1 Amb2237314 [0,1,0,1,0,0|2,0,0]=4 5872 B10R1.13 C[C@@H]1CC[C@@H](C(=O)O)CN1 Amb26919968 [0,1,0,1,0,0|1,0,0]=3 5873 B10R1.13 C[C@@H]1CC[C@@H](C(=O)O)NC1 Amb33017682 [0,1,0,1,0,0|1,0,0]=3 5874 B10R1.13 C[C@@H]1CC[C@@H](C(=O)O)NC1 Amb33299403 [0,1,0,1,0,0|1,0,0]=3 5875 B10R1.13 C[C@@H]1CC[C@H](C(=O)O)CN1 Amb24620510 [0,1,0,1,0,0|1,0,0]=3 5876 B10R1.13 C[C@@H]1CC[C@H](C(=O)O)CN1 Amb35788844 [0,1,0,1,0,0|1,0,0]=3 5877 B10R1.13 C[C@@H]1CC[C@H](C(=O)O)NC1 Amb33804580 [0,1,0,1,0,0|1,0,0]=3 5878 B10R1.13 C[C@@H]1CC[C@H](C(N)=O)CN1 Amb33290243 [0,1,0,1,0,0|2,0,0]=4 5879 B10R1.13 C[C@@H]1CC[C@H](C(N)=O)CN1 Amb33483115 [0,1,0,1,0,0|2,0,0]=4 5880 B10R1.13 C[C@@H]1CN[C@@H](C(=O)O)CO1 Amb25949341 [0,1,0,1,0,0|2,0,0]=4 5881 B10R1.13 C[C@@H]1CN[C@@H](C(=O)O)CO1 Amb31156297 [0,1,0,1,0,0|2,0,0]=4 5882 B10R1.13 C[C@@H]1CN[C@H](C(=O)O)CO1 Amb24694579 [0,1,0,1,0,0|2,0,0]=4 5883 B10R1.13 C[C@@H]1CN[C@H](C(=O)O)CO1 Amb32661059 [0,1,0,1,0,0|2,0,0]=4 5884 B10R1.13 C[C@H]1CC[C@@H](C(=O)O)CC1 Amb10843977 [0,1,0,1,0,0|2,0,0]=4 5885 B10R1.13 C[C@H]1CC[C@@H](C(=O)O)CN1 Amb24580654 [0,1,0,1,0,0|1,0,0]=3 5886 B10R1.13 C[C@H]1CC[C@@H](C(=O)O)ON1 Amb27881757 [0,1,0,1,0,0|1,0,0]=3 5887 B10R1.13 C[C@H]1CC[C@@H](C(N)=O)CN1 Amb28429822 [0,1,0,1,0,0|2,0,0]=4 5888 B10R1.13 C[C@H]1CC[C@H](C(=O)O)CC1 Amb3939943 [0,1,0,1,0,0|2,0,0]=4 5889 B10R1.13 C[C@H]1CC[C@H](C(N)=O)CN1 Amb27214664 [0,1,0,1,0,0|2,0,0]=4 5890 B10R1.13 C[C@H]1CN[C@@H](C(=O)O)CO1 Amb28367492 [0,1,0,1,0,0|2,0,0]=4 5891 B10R1.13 C[C@H]1CN[C@H](C(=O)O)CO1 Amb35746793 [0,1,0,1,0,0|2,0,0]=4 5892 B10R1.13 NC1CCC(C(=O)O)CC1 Amb2699182 [0,1,0,1,0,0|2,0,0]=4 5893 B10R1.13 NC1CCC(C(=O)O)CC1 Amb6739811 [0,1,0,1,0,0|2,0,0]=4 5894 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 Amb10070763 [0,1,0,1,0,0|2,0,0]=4 5895 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 Amb33524039 [0,1,0,1,0,0|2,0,0]=4 5896 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 Amb33524062 [0,1,0,1,0,0|2,0,0]=4 5897 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 Amb8631309 [0,1,0,1,0,0|2,0,0]=4 5898 B10R1.13 O=C(O)C1CCC(Br)CC1 Amb27239245 [0,1,0,1,0,0|2,0,0]=4 5899 B10R1.13 O=C(O)C1CCC(Cl)CC1 Amb18126347 [0,1,0,1,0,0|2,0,0]=4 5900 B10R1.13 O=C(O)C1CCC(F)CC1 Amb20670645 [0,1,0,1,0,0|2,0,0]=4 5901 B10R1.13 O=C(O)C1CCC(I)CC1 Amb27443730 [0,1,0,1,0,0|2,0,0]=4 5902 B10R1.13 O=C(O)C1CCC(O)CC1 Amb2720801 [0,1,0,1,0,0|2,0,0]=4 5903 B10R1.13 O=C(O)C1CCC(O)CN1 Amb22034512 [0,1,0,1,0,0|1,0,0]=3 5904 B10R1.13 O=C(O)C1CCC(O)CN1 Amb5719819 [0,1,0,1,0,0|1,0,0]=3 5905 B10R1.13 O=C(O)C1CCC(O)CO1 Amb23596937 [0,1,0,1,0,0|2,0,0]=4 5906 B10R1.13 O=C(O)C1CCC(S)CC1 Amb26844518 [0,1,0,1,0,0|2,0,0]=4 5907 B10R1.13 O=C(O)C1CCN(Cl)CC1 Amb28458328 [0,1,0,1,0,0|2,0,0]=4 5908 B10R1.13 O=C(O)C1CCS(=O)CC1 Amb25295426 [0,1,0,1,0,0|1,0,1]=4 5909 B10R1.13 O=C(O)C1CNC(O)CN1 Amb25332404 [0,1,0,1,0,0|2,0,0]=4 5910 B10R1.13 O=C(O)[C@@H]1CC[C@@H](F)CN1 Amb24763804 [0,1,0,1,0,0|1,0,0]=3 5911 B10R1.13 O=C(O)[C@@H]1CC[C@@H](F)CN1 Amb35752872 [0,1,0,1,0,0|1,0,0]=3 5912 B10R1.13 O=C(O)[C@@H]1CC[C@@H](O)CN1 Amb24120629 [0,1,0,1,0,0|1,0,0]=3 5913 B10R1.13 O=C(O)[C@@H]1CC[C@@H](O)CN1 Amb2697173 [0,1,0,1,0,0|1,0,0]=3 5914 B10R1.13 O=C(O)[C@@H]1CC[C@@H](O)CO1 Amb27758209 [0,1,0,1,0,0|2,0,0]=4 5915 B10R1.13 O=C(O)[C@@H]1CC[C@H](O)CN1 Amb28132662 [0,1,0,1,0,0|1,0,0]=3 5916 B10R1.13 O=C(O)[C@@H]1CC[C@H](O)CN1 Amb33726118 [0,1,0,1,0,0|1,0,0]=3 5917 B10R1.13 O=C(O)[C@H]1CC[C@@H](F)CC1 Amb28042515 [0,1,0,1,0,0|2,0,0]=4 5918 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CC1 Amb22387642 [0,1,0,1,0,0|2,0,0]=4 5919 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CN1 Amb23440007 [0,1,0,1,0,0|1,0,0]=3 5920 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CN1 Amb23440183 [0,1,0,1,0,0|1,0,0]=3 5921 B10R1.13 O=C(O)[C@H]1CC[C@H](F)CC1 Amb27786373 [0,1,0,1,0,0|2,0,0]=4 5922 B10R1.13 O=C(O)[C@H]1CC[C@H](O)CC1 Amb22387641 [0,1,0,1,0,0|2,0,0]=4 5923 B10R1.13 O=C(O)[C@H]1CC[C@H](O)CN1 Amb26401050 [0,1,0,1,0,0|1,0,0]=3 5924 B10R1.13 O=C1CCC(C(=O)O)CC1 Amb5719059 [0,1,0,1,0,0|2,0,0]=4 5925 B10R1.13 O=C1CCC(C(=O)O)CN1 Amb8503400 [0,1,0,1,0,0|2,0,0]=4 5926 B10R1.13 O=C1CCC(C(=O)O)CN1 Amb9721708 [0,1,0,1,0,0|2,0,0]=4 5927 B10R1.13 O=C1CCC(C(=O)O)NC1 Amb21960863 [0,1,0,1,0,0|1,0,0]=3 5928 B10R1.13 O=C1CCC(C(=O)O)NC1 Amb5719827 [0,1,0,1,0,0|1,0,0]=3 5929 B10R1.13 O=C1CCC(C(=O)O)NN1 Amb23441127 [0,1,0,1,0,0|2,0,0]=4 5930 B10R1.13 O=C1CCC(C(=O)O)SC1 Amb23596925 [0,1,0,1,0,0|2,0,0]=4 5931 B10R1.13 O=C1CC[C@@H](C(=O)O)CN1 Amb26878933 [0,1,0,1,0,0|2,0,0]=4 5932 B10R1.13 O=C1CC[C@@H](C(=O)O)NC1 Amb24655763 [0,1,0,1,0,0|1,0,0]=3 5933 B10R1.13 O=C1CC[C@@H](C(=O)O)NC1 Amb31291189 [0,1,0,1,0,0|1,0,0]=3 5934 B10R1.13 O=C1CC[C@H](C(=O)O)CN1 Amb26515676 [0,1,0,1,0,0|2,0,0]=4 5935 B10R1.13 O=C1CC[C@H](C(=O)O)NC1 Amb27648107 [0,1,0,1,0,0|1,0,0]=3 5936 B10R1.13 O=C1CC[C@H](C(=O)O)NC1 Amb31291190 [0,1,0,1,0,0|1,0,0]=3 5937 B10R1.13 O=C1CNC(C(=O)O)CN1 Amb22235954 [0,1,0,1,0,0|2,0,0]=4 5938 B10R1.13 O=C1CNC(C(=O)O)CN1 Amb22641428 [0,1,0,1,0,0|2,0,0]=4 5939 B10R1.13 O=C1CN[C@@H](C(=O)O)CN1 Amb24423079 [0,1,0,1,0,0|2,0,0]=4 5940 B10R1.13 O=C1CN[C@H](C(=O)O)CN1 Amb22756547 [0,1,0,1,0,0|2,0,0]=4 5941 B10R1.58 CC(O)[C@H]1C[C@H](N)C(=O)O1 Amb27782386 [0,1,0,1,0,0|1,0,0]=3 5942 B10R1.58 CC1=NC(C(=O)O)CC1C Amb27397721 [0,1,0,1,0,0|1,0,1]=4 5943 B10R1.58 CC1CC(C(=O)O)CC1C Amb28251040 [0,1,0,1,0,0|2,0,0]=4 5944 B10R1.58 CC1CC(C(=O)O)CN1C Amb18831573 [0,1,0,1,0,0|2,0,0]=4 5945 B10R1.58 CC1CC(C(=O)O)NC1C Amb18831587 [0,1,0,1,0,0|1,0,0]=3 5946 B10R1.58 CC1C[C@H](C(=O)O)CC1O Amb27882643 [0,1,0,1,0,0|2,0,0]=4 5947 B10R1.58 CC1NC(C(=O)O)CC1N Amb27768615 [0,1,0,1,0,0|1,0,0]=3 5948 B10R1.58 CC1NC(C(=O)O)CC1O Amb27876074 [0,1,0,1,0,0|1,0,0]=3 5949 B10R1.58 CC1NC(C(=O)O)C[C@H]1O Amb27167587 [0,1,0,1,0,0|1,0,0]=3 5950 B10R1.58 CC1O[C@@H](C(=O)O)C[C@H]1O Amb27216683 [0,1,0,1,0,0|2,0,0]=4 5951 B10R1.58 CN1NC(C(=O)O)CC1=O Amb27495618 [0,1,0,1,0,0|1,0,1]=4 5952 B10R1.58 C[C@@H](O)[C@H]1C[C@@H](O)C(=O)O1 Amb27427653 [0,1,0,1,0,0|2,0,0]=4 5953 B10R1.58 C[C@@H]1C[C@@H](C(=O)O)N[C@@H]1C Amb27640711 [0,1,0,1,0,0|1,0,0]=3 5954 B10R1.58 C[C@@H]1C[C@@H]([C@@H](C)Br)OC1=O Amb27438583 [0,1,0,1,0,0|2,0,0]=4 5955 B10R1.58 C[C@@H]1C[C@H](C(=O)O)CN1C Amb35788874 [0,1,0,1,0,0|2,0,0]=4 5956 B10R1.58 C[C@@H]1N[C@H](C(=O)O)C[C@H]1F Amb27781898 [0,1,0,1,0,0|1,0,0]=3 5957 B10R1.58 C[C@H](O)[C@H]1C[C@H](O)C(=O)O1 Amb27219090 [0,1,0,1,0,0|2,0,0]=4 5958 B10R1.58 C[C@H]1C[C@@H](C(=O)O)C[C@H]1C Amb27447222 [0,1,0,1,0,0|2,0,0]=4 5959 B10R1.58 C[C@H]1O[C@H](C(=O)O)C[C@@H]1O Amb27194347 [0,1,0,1,0,0|2,0,0]=4 5960 B10R1.58 NC1CC(C(=O)O)OC1=O Amb25147458 [0,1,0,1,0,0|2,0,0]=4 5961 B10R1.58 N[C@H]1C[C@@H](C(=O)O)OC1=O Amb27782562 [0,1,0,1,0,0|2,0,0]=4 5962 B10R1.58 O=C(O)[C@@H]1C[C@@H](F)C(=O)N1 Amb10839466 [0,1,0,1,0,0|2,0,0]=4 5963 B10R1.58 O=C1NC(C(=O)O)CC1F Amb24696741 [0,1,0,1,0,0|2,0,0]=4 5964 B10R1.58 O=C1N[C@@H](C(=O)O)C[C@@H]1F Amb27421959 [0,1,0,1,0,0|2,0,0]=4 5965 B10R1.58 O=C1N[C@H](C(=O)O)CC1F Amb25360897 [0,1,0,1,0,0|2,0,0]=4 5966 B10R1.58 O=C1N[C@H](C(=O)O)CC1O Amb28208546 [0,1,0,1,0,0|2,0,0]=4 5967 B10R1.58 O=C1N[C@H](C(=O)O)C[C@@H]1F Amb10838332 [0,1,0,1,0,0|2,0,0]=4 5968 B10R1.80 CC(C)CC1NC(=O)C1N Amb28146791 [0,1,0,1,0,0|2,0,0]=4 5969 B10R1.80 CC(C)C[C@H]1NC(=O)[C@@H]1N Amb27422028 [0,1,0,1,0,0|2,0,0]=4 5970 B10R1.80 C[C@H](O)C[C@H]1OC(=O)[C@@H]1C Amb27420290 [0,1,0,1,0,0|2,0,0]=4 5971 B10R1.147 CC1(C)CCC(N)C(=O)O1 Amb27789981 [0,1,0,1,0,0|1,0,0]=3 5972 B10R1.147 CC1(C)CC[C@H](N)C(=O)O1 Amb27855723 [0,1,0,1,0,0|1,0,0]=3 5973 B10R1.190 C=C1CC1CC(N)C(=O)O Amb24117524 [0,1,0,1,0,0|1,0,0]=3 5974 B10R1.190 C=C1CC1C[C@@H](N)C(=O)O Amb24640688 [0,1,0,1,0,0|1,0,0]=3 5975 B10R1.190 C=C1C[C@@H]1C[C@H](N)C(=O)O Amb17615983 [0,1,0,1,0,0|1,0,0]=3 5976 B10R1.190 CC(CC1CC1C)C(=O)O Amb33448930 [0,1,0,1,0,0|2,0,0]=4 5977 B10R1.190 CC1CC1CC(N)C(=O)O Amb25147396 [0,1,0,1,0,0|1,0,0]=3 5978 B10R1.190 CC1CC1CC(N)C(N)=O Amb33308625 [0,1,0,1,0,0|2,0,0]=4 5979 B10R1.190 CC1CC1CC(O)C(=O)O Amb33353335 [0,1,0,1,0,0|2,0,0]=4 5980 B10R1.190 CC1CC1C[C@@H](N)C(=O)O Amb33036595 [0,1,0,1,0,0|1,0,0]=3 5981 B10R1.190 CC1CC1C[C@H](N)C(=O)O Amb25305763 [0,1,0,1,0,0|1,0,0]=3 5982 B10R1.190 CC1SC1CC(N)C(=O)O Amb28143562 [0,1,0,1,0,0|0,0,0]=2 5983 B10R1.190 C[C@@H]1O[C@H]1C[C@H](N)C(=O)O Amb27421923 [0,1,0,1,0,0|0,1,0]=3 5984 B10R1.190 C[C@H]1O[C@H]1C[C@H](N)C(=O)O Amb27254136 [0,1,0,1,0,0|0,1,0]=3 5985 B10R1.190 NC(C[C@@H]1C[C@H]1N)C(=O)O Amb27783818 [0,1,0,1,0,0|1,0,0]=3 5986 B10R1.190 N[C@@H](CC1CC1=O)C(=O)O Amb28315789 [0,1,0,1,0,0|1,0,0]=3 5987 B10R1.190 N[C@H](C[C@@H]1C[C@H]1N)C(=O)O Amb27194166 [0,1,0,1,0,0|1,0,0]=3 5988 B10R1.205 CC(CCC1CC1)C(=O)O Amb28042040 [0,1,0,1,0,0|2,0,0]=4 5989 B10R1.205 CC(CNC1CC1)C(=O)O Amb9400282 [0,1,0,1,0,0|2,0,0]=4 5990 B10R1.205 CC(CSC1CC1)C(=O)O Amb27228111 [0,1,0,1,0,0|2,0,0]=4 5991 B10R1.205 CC(OCC1CC1)C(=O)O Amb6680906 [0,1,0,1,0,0|2,0,0]=4 5992 B10R1.205 C[C@@H](CCC1CC1)C(=O)O Amb33744645 [0,1,0,1,0,0|2,0,0]=4 5993 B10R1.205 C[C@H](CCC1CC1)C(=O)O Amb33738116 [0,1,0,1,0,0|2,0,0]=4 5994 B10R1.205 NC(=O)C(N)CCC1CC1 Amb25284806 [0,1,0,1,0,0|2,0,0]=4 5995 B10R1.205 NC(CCC1CC1)C(=O)O Amb18831582 [0,1,0,1,0,0|1,0,0]=3 5996 B10R1.205 NC(CNC1CC1)C(=O)O Amb27668994 [0,1,0,1,0,0|1,0,0]=3 5997 B10R1.205 N[C@@H](CCC1CC1)C(=O)O Amb25236249 [0,1,0,1,0,0|1,0,0]=3 5998 B10R1.205 N[C@H](CCC1CC1)C(=O)O Amb27801629 [0,1,0,1,0,0|1,0,0]=3 5999 B10R1.205 O=C(O)C(O)CCC1CC1 Amb25187335 [0,1,0,1,0,0|2,0,0]=4 6000 B10R1.332 CC1CCC(N)C(=O)NC1 Amb32455739 [0,1,0,1,0,0|2,0,0]=4 6001 B10R1.332 NC1CCC(O)CNC1=O Amb27816247 [0,1,0,1,0,0|2,0,0]=4 6002 B10R1.349 C=C(O)C1CC(C(=O)O)N1 Amb27397366 [0,1,0,1,0,0|1,0,1]=4 6003 B10R1.349 CC(=O)C1CC(C(=O)O)C1 Amb25113879 [0,1,0,1,0,0|2,0,0]=4 6004 B10R1.349 CC(C)C1CC(C(=O)O)C1 Amb33545058 [0,1,0,1,0,0|2,0,0]=4 6005 B10R1.349 CN(C)C1CC(C(=O)O)C1 Amb27841678 [0,1,0,1,0,0|2,0,0]=4 6006 B10R1.349 CN(C)[C@H]1C[C@@H](C(=O)O)C1 Amb25338254 [0,1,0,1,0,0|2,0,0]=4 6007 B10R1.349 CN(C)[C@H]1C[C@H](C(=O)O)C1 Amb28400180 [0,1,0,1,0,0|2,0,0]=4 6008 B10R1.349 CN(C)[C@H]1C[C@H](C(=O)O)C1 Amb33804183 [0,1,0,1,0,0|2,0,0]=4 6009 B10R1.349 NC(=O)C1CC(C(=O)O)N1 Amb27872340 [0,1,0,1,0,0|2,0,0]=4 6010 B10R1.349 NC(=O)[C@@H]1C[C@H](C(=O)O)N1 Amb27186909 [0,1,0,1,0,0|2,0,0]=4 6011 B10R1.349 NC(=O)[C@H]1C[C@@H](C(=O)O)N1 Amb27961402 [0,1,0,1,0,0|2,0,0]=4 6012 B10R1.349 O=C(O)C1CC(C(=O)O)N1 Amb28318335 [0,1,0,1,0,0|2,0,0]=4 6013 B10R1.349 O=C(O)[C@@H]1C[C@@H](C(=O)O)N1 Amb8515688 [0,1,0,1,0,0|2,0,0]=4 6014 B10R1.349 O=C(O)[C@@H]1C[C@H](C(=O)O)N1 Amb8515686 [0,1,0,1,0,0|2,0,0]=4 6015 B10R1.349 O=C(O)[C@H]1C[C@H](C(=O)O)N1 Amb8515687 [0,1,0,1,0,0|2,0,0]=4 6016 B10R1.359 CC1(C)CCC(C(=O)O)C1 Amb33545093 [0,1,0,1,0,0|2,0,0]=4 6017 B10R1.359 CC1(C)CCC(C(=O)O)N1 Amb17593611 [0,1,0,1,0,0|1,0,0]=3 6018 B10R1.359 CC1(C)CCC(C(=O)O)N1 Amb22755806 [0,1,0,1,0,0|1,0,0]=3 6019 B10R1.359 CC1(C)CCC(C(=O)O)O1 Amb23455423 [0,1,0,1,0,0|2,0,0]=4 6020 B10R1.359 CC1(C)NC(C(=O)O)CS1 Amb1155998 [0,1,0,1,0,0|2,0,0]=4 6021 B10R1.359 CC1(C)NC(C(=O)O)CS1 Amb9749517 [0,1,0,1,0,0|2,0,0]=4 6022 B10R1.359 CC1(C)N[C@H](C(=O)O)CO1 Amb27483148 [0,1,0,1,0,0|2,0,0]=4 6023 B10R1.359 CC1(C)N[C@H](C(=O)O)CS1 Amb2719501 [0,1,0,1,0,0|2,0,0]=4 6024 B10R1.359 CC1(C)N[C@H](C(=O)O)CS1 Amb29838195 [0,1,0,1,0,0|2,0,0]=4 6025 B10R1.359 CP1(=O)CCC(C(=O)O)N1 Amb28436164 [0,1,0,1,0,0|1,0,0]=3 6026 B10R1.359 C[Si]1(C)CCC(C(=O)O)C1 Amb29837961 [0,1,0,1,0,0|2,0,0]=4 6027 B10R1.359 O=C(O)C1CCS(=O)(=O)N1 Amb19888363 [0,1,0,1,0,0|1,0,1]=4 6028 B10R1.359 O=C(O)[C@@H]1CCS(=O)(=O)N1 Amb27272810 [0,1,0,1,0,0|1,0,1]=4 6029 B10R1.359 O=C(O)[C@H]1CCS(=O)(=O)N1 Amb27600587 [0,1,0,1,0,0|1,0,1]=4 6030 B10R1.360 CC(C)C1CC1(F)C(=O)O Amb24356680 [0,1,0,1,0,0|2,0,0]=4 6031 B10R1.360 CC(C)C1CC1(N)C(=O)O Amb24477051 [0,1,0,1,0,0|1,0,0]=3 6032 B10R1.360 CC(C)[C@@H]1C[C@@]1(N)C(=O)O Amb23452874 [0,1,0,1,0,0|1,0,0]=3 6033 B10R1.360 CC(C)[C@@H]1C[C@]1(N)C(=O)O Amb23452873 [0,1,0,1,0,0|1,0,0]=3 6034 B10R1.360 CC(C)[C@H]1C[C@@]1(F)C(=O)O Amb28195278 [0,1,0,1,0,0|2,0,0]=4 6035 B10R1.360 CC(C)[C@H]1C[C@@]1(N)C(=O)O Amb26968202 [0,1,0,1,0,0|1,0,0]=3 6036 B10R1.360 CC(C)[C@H]1C[C@]1(N)C(=O)O Amb27961206 [0,1,0,1,0,0|1,0,0]=3 6037 B10R1.360 NC1(C(=O)O)CC1C(=O)O Amb25124900 [0,1,0,1,0,0|2,0,0]=4 6038 B10R1.360 N[C@@]1(C(=O)O)C[C@H]1C(=O)O Amb24515142 [0,1,0,1,0,0|2,0,0]=4 6039 B10R1.360 N[C@]1(C(=O)O)C[C@H]1C(=O)O Amb23452828 [0,1,0,1,0,0|2,0,0]=4 6040 B10R1.365 CC1(C)CCC1(C)C(=O)O Amb27831961 [0,1,0,1,0,0|2,0,0]=4 6041 B10R1.368 CC(C)CC1CC1C(=O)O Amb18297987 [0,1,0,1,0,0|2,0,0]=4 6042 B10R1.368 CC(C)CC1OC1C(=O)O Amb28397897 [0,1,0,1,0,0|2,0,0]=4 6043 B10R1.368 CC(C)C[C@@H]1C[C@H]1C(=O)O Amb28325147 [0,1,0,1,0,0|2,0,0]=4 6044 B10R1.470 C=C1CCC(C)(C(=O)O)C1 Amb25789474 [0,1,0,1,0,0|2,0,0]=4 6045 B10R1.470 C=C1CCC(O)(C(=O)O)C1 Amb27620508 [0,1,0,1,0,0|2,0,0]=4 6046 B10R1.470 CC1(C(=O)O)CCC(=O)C1 Amb23454199 [0,1,0,1,0,0|2,0,0]=4 6047 B10R1.470 CC1(C(=O)O)CCC(=O)N1 Amb33545084 [0,1,0,1,0,0|2,0,0]=4 6048 B10R1.470 CC1(C(=O)O)CCC(F)C1 Amb28193818 [0,1,0,1,0,0|2,0,0]=4 6049 B10R1.470 CC1(C(=O)O)CCC(N)C1 Amb23454122 [0,1,0,1,0,0|2,0,0]=4 6050 B10R1.470 CC1(C(=O)O)CCC(N)C1 Amb30666627 [0,1,0,1,0,0|2,0,0]=4 6051 B10R1.470 CC1(C(=O)O)CCC(O)C1 Amb23454235 [0,1,0,1,0,0|2,0,0]=4 6052 B10R1.470 CC1=CCC(C)(C(=O)O)N1 Amb17593567 [0,1,0,1,0,0|1,0,1]=4 6053 B10R1.470 CC1CC(C)(C(=O)O)CO1 Amb32654901 [0,1,0,1,0,0|1,1,0]=4 6054 B10R1.470 CC1CC(N)(C(=O)O)CO1 Amb30010992 [0,1,0,1,0,0|0,1,0]=3 6055 B10R1.470 CC1CC(N)(C(N)=O)CO1 Amb30010757 [0,1,0,1,0,0|1,1,0]=4 6056 B10R1.470 CC1CC(N)(C(N)=O)CS1 Amb27796730 [0,1,0,1,0,0|1,0,0]=3 6057 B10R1.470 CC1CC(O)(C(=O)O)CN1 Amb26426348 [0,1,0,1,0,0|2,0,0]=4 6058 B10R1.470 CC1CC(O)(C(=O)O)CO1 Amb29850198 [0,1,0,1,0,0|1,1,0]=4 6059 B10R1.470 CC1CC(O)(C(=O)O)CS1 Amb27390741 [0,1,0,1,0,0|1,0,0]=3 6060 B10R1.470 CC1CCC(C)(C(=O)O)C1 Amb33545098 [0,1,0,1,0,0|2,0,0]=4 6061 B10R1.470 CC1CCC(N)(C(=O)O)C1 Amb2695735 [0,1,0,1,0,0|1,0,0]=3 6062 B10R1.470 CC1CCC(N)(C(=O)O)C1 Amb31188353 [0,1,0,1,0,0|1,0,0]=3 6063 B10R1.470 CC1CCC(O)(C(=O)O)C1 Amb8836763 [0,1,0,1,0,0|2,0,0]=4 6064 B10R1.470 CN1CCC(C)(C(=O)O)C1 Amb7088950 [0,1,0,1,0,0|2,0,0]=4 6065 B10R1.470 C[C@@H]1CC[C@@](N)(C(=O)O)C1 Amb24373352 [0,1,0,1,0,0|1,0,0]=3 6066 B10R1.470 C[C@@]1(C(=O)O)CCC(=O)N1 Amb28126701 [0,1,0,1,0,0|2,0,0]=4 6067 B10R1.470 C[C@H]1CC[C@@](N)(C(=O)O)C1 Amb27622425 [0,1,0,1,0,0|1,0,0]=3 6068 B10R1.470 C[C@H]1C[C@](N)(C(=O)O)CS1 Amb27439498 [0,1,0,1,0,0|0,0,0]=2 6069 B10R1.470 NC(=O)C1(N)CCC(O)C1 Amb30013934 [0,1,0,1,0,0|2,0,0]=4 6070 B10R1.470 NC1(C(=O)O)CCC(O)C1 Amb26331332 [0,1,0,1,0,0|1,0,0]=3 6071 B10R1.470 NC1(C(=O)O)CCC(O)C1 Amb33456869 [0,1,0,1,0,0|1,0,0]=3 6072 B10R1.470 NC1(C(=O)O)CCS(=O)C1 Amb26884927 [0,1,0,1,0,0|0,0,1]=3 6073 B10R1.470 NC1CCC(F)(C(=O)O)C1 Amb24352012 [0,1,0,1,0,0|2,0,0]=4 6074 B10R1.470 NC1CCC(F)(C(=O)O)C1 Amb32952913 [0,1,0,1,0,0|2,0,0]=4 6075 B10R1.470 N[C@@]1(C(=O)O)CC[C@@H](O)C1 Amb10066916 [0,1,0,1,0,0|1,0,0]=3 6076 B10R1.470 N[C@H]1CC[C@@](O)(C(=O)O)C1 Amb27796254 [0,1,0,1,0,0|2,0,0]=4 6077 B10R1.470 N[C@]1(C(=O)O)CC[C@H](O)C1 Amb35745821 [0,1,0,1,0,0|1,0,0]=3 6078 B10R1.494 CC(C(=O)O)C1CC1(C)C Amb26569562 [0,1,0,1,0,0|2,0,0]=4 6079 B10R1.494 C[C@@H](C(=O)O)C1CC1(C)C Amb33728208 [0,1,0,1,0,0|2,0,0]=4 6080 B10R1.494 C[C@H](C(=O)O)C1CC1(C)C Amb33749541 [0,1,0,1,0,0|2,0,0]=4 6081 B10R1.7 NC1CCCCCCC1=O Amb28050100 [0,1,0,1,0,0|2,0,0]=4 6082 B10R1.7 NC1CCCCCNC1=O Amb26056483 [0,1,0,1,0,0|2,0,0]=4 6083 B10R1.7 N[C@@H]1CCCCCNC1=O Amb27210584 [0,1,0,1,0,0|2,0,0]=4 6084 B10R1.14 CC1CCC(C(=O)NO)O1 Amb28289930 [0,1,0,1,0,0|2,0,0]=4 6085 B10R1.14 COC(=O)C1C=C(C)CC1 Amb24527976 [0,1,0,1,0,0|2,0,0]=4 6086 B10R1.14 COC(=O)C1CCC(=O)N1 Amb2698115 [0,1,0,1,0,0|2,0,0]=4 6087 B10R1.14 COC(=O)C1CCC(=S)N1 Amb26593867 [0,1,0,1,0,0|2,0,0]=4 6088 B10R1.14 COC(=O)C1CCC(C)=N1 Amb28143507 [0,1,0,1,0,0|1,0,1]=4 6089 B10R1.14 COC(=O)C1CCC(C)C1 Amb27831203 [0,1,0,1,0,0|2,0,0]=4 6090 B10R1.14 COC(=O)C1CCC(C)O1 Amb17939078 [0,1,0,1,0,0|2,0,0]=4 6091 B10R1.14 COC(=O)C1CCC(O)N1 Amb27838033 [0,1,0,1,0,0|2,0,0]=4 6092 B10R1.14 COC(=O)C1CCN(C)C1 Amb9901745 [0,1,0,1,0,0|2,0,0]=4 6093 B10R1.14 COC(=O)C1CSC(C)N1 Amb24598201 [0,1,0,1,0,0|2,0,0]=4 6094 B10R1.14 COC(=O)C1NC(C)CS1 Amb28290260 [0,1,0,1,0,0|2,0,0]=4 6095 B10R1.14 COC(=O)[C@@H]1CCC(=O)N1 Amb2695231 [0,1,0,1,0,0|2,0,0]=4 6096 B10R1.14 COC(=O)[C@@H]1CCC(=S)N1 Amb24066743 [0,1,0,1,0,0|2,0,0]=4 6097 B10R1.14 COC(=O)[C@@H]1CCC(C)N1 Amb25843220 [0,1,0,1,0,0|1,0,0]=3 6098 B10R1.14 COC(=O)[C@@H]1CCC(O)N1 Amb27252881 [0,1,0,1,0,0|2,0,0]=4 6099 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C)C1 Amb25868500 [0,1,0,1,0,0|2,0,0]=4 6100 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C)N1 Amb25919536 [0,1,0,1,0,0|1,0,0]=3 6101 B10R1.14 COC(=O)[C@@H]1CC[C@H](C)C1 Amb24578320 [0,1,0,1,0,0|2,0,0]=4 6102 B10R1.14 COC(=O)[C@@H]1CC[C@H](C)N1 Amb26966282 [0,1,0,1,0,0|1,0,0]=3 6103 B10R1.14 COC(=O)[C@@H]1CC[C@H](O)N1 Amb27814660 [0,1,0,1,0,0|2,0,0]=4 6104 B10R1.14 COC(=O)[C@@H]1CSC(C)N1 Amb24428971 [0,1,0,1,0,0|2,0,0]=4 6105 B10R1.14 COC(=O)[C@H]1CCC(=O)N1 Amb8628992 [0,1,0,1,0,0|2,0,0]=4 6106 B10R1.14 COC(=O)[C@H]1CCC(C)=N1 Amb27251391 [0,1,0,1,0,0|1,0,1]=4 6107 B10R1.14 COC(=O)[C@H]1CC[C@@H](C)C1 Amb26602282 [0,1,0,1,0,0|2,0,0]=4 6108 B10R1.14 COC(=O)[C@H]1CC[C@@H](C)N1 Amb26655238 [0,1,0,1,0,0|1,0,0]=3 6109 B10R1.14 COC(=O)[C@H]1CC[C@@H](C)O1 Amb24630211 [0,1,0,1,0,0|2,0,0]=4 6110 B10R1.14 COC(=O)[C@H]1CS[C@@H](C)N1 Amb28051866 [0,1,0,1,0,0|2,0,0]=4 6111 B10R1.14 O=C1CCC(C(=O)NO)N1 Amb24377086 [0,1,0,1,0,0|2,0,0]=4 6112 B10R1.14 O=C1CC[C@@H](C(=O)NO)N1 Amb27434478 [0,1,0,1,0,0|2,0,0]=4 6113 B10R1.14 O=C1CC[C@H](C(=O)NO)N1 Amb28137782 [0,1,0,1,0,0|2,0,0]=4 6114 B10R1.15 C#CC(=O)C1CCCCN1 Amb26505485 [0,1,0,1,0,0|2,0,0]=4 6115 B10R1.15 C#CC(=O)C1CCSCC1 Amb35694895 [0,1,0,1,0,0|2,0,0]=4 6116 B10R1.15 C#CC(=O)[C@@H]1CCCCN1 Amb33131917 [0,1,0,1,0,0|2,0,0]=4 6117 B10R1.15 C#CC(=O)[C@H]1CCCCN1 Amb33132019 [0,1,0,1,0,0|2,0,0]=4 6118 B10R1.15 C=CC(=O)C1CCCCN1 Amb27770503 [0,1,0,1,0,0|2,0,0]=4 6119 B10R1.15 C=CC(=O)C1CCSCC1 Amb35694897 [0,1,0,1,0,0|2,0,0]=4 6120 B10R1.15 C=CC(=O)[C@@H]1CCCCN1 Amb33131918 [0,1,0,1,0,0|2,0,0]=4 6121 B10R1.15 C=CC(=O)[C@H]1CCCCN1 Amb33132020 [0,1,0,1,0,0|2,0,0]=4 6122 B10R1.15 CCC(=O)C1CCCCN1 Amb19373844 [0,1,0,1,0,0|2,0,0]=4 6123 B10R1.15 CCC(=O)C1CCCCN1 Amb23536940 [0,1,0,1,0,0|2,0,0]=4 6124 B10R1.15 CCC(=O)[C@@H]1CCCCN1 Amb26360719 [0,1,0,1,0,0|2,0,0]=4 6125 B10R1.15 CCC(=O)[C@H]1CCCCN1 Amb30026044 [0,1,0,1,0,0|2,0,0]=4 6126 B10R1.15 CNC(=O)C1CCCCN1 Amb15740884 [0,1,0,1,0,0|2,0,0]=4 6127 B10R1.15 CNC(=O)C1CCCCN1 Amb9717177 [0,1,0,1,0,0|2,0,0]=4 6128 B10R1.15 CNC(=O)C1CCSCC1 Amb27802257 [0,1,0,1,0,0|2,0,0]=4 6129 B10R1.15 CNC(=O)[C@@H]1CCCCN1 Amb27877932 [0,1,0,1,0,0|2,0,0]=4 6130 B10R1.15 CNC(=O)[C@@H]1CCCCN1 Amb34913744 [0,1,0,1,0,0|2,0,0]=4 6131 B10R1.15 CNC(=O)[C@H]1CCCCN1 Amb33801473 [0,1,0,1,0,0|2,0,0]=4 6132 B10R1.15 COC(=N)C1CCSCC1 Amb35702023 [0,1,0,1,0,0|2,0,0]=4 6133 B10R1.15 COC(=O)C1CC=CCN1 Amb25147577 [0,1,0,1,0,0|1,0,1]=4 6134 B10R1.15 COC(=O)C1CCCCC1 Amb2691983 [0,1,0,1,0,0|2,0,0]=4 6135 B10R1.15 COC(=O)C1CCCCN1 Amb1156676 [0,1,0,1,0,0|1,0,0]=3 6136 B10R1.15 COC(=O)C1CCCCN1 Amb2371538 [0,1,0,1,0,0|1,0,0]=3 6137 B10R1.15 COC(=O)C1CCCCO1 Amb17935766 [0,1,0,1,0,0|2,0,0]=4 6138 B10R1.15 COC(=O)C1CCCCS1 Amb23568621 [0,1,0,1,0,0|2,0,0]=4 6139 B10R1.15 COC(=O)C1CCNCC1 Amb2695657 [0,1,0,1,0,0|2,0,0]=4 6140 B10R1.15 COC(=O)C1CCNCC1 Amb4009936 [0,1,0,1,0,0|2,0,0]=4 6141 B10R1.15 COC(=O)C1CCOCC1 Amb9245211 [0,1,0,1,0,0|1,1,0]=4 6142 B10R1.15 COC(=O)C1CCSCC1 Amb6572255 [0,1,0,1,0,0|1,0,0]=3 6143 B10R1.15 COC(=O)C1CCSCN1 Amb28368896 [0,1,0,1,0,0|0,0,0]=2 6144 B10R1.15 COC(=O)C1CNCCN1 Amb2690350 [0,1,0,1,0,0|2,0,0]=4 6145 B10R1.15 COC(=O)C1CNCCN1 Amb8391081 [0,1,0,1,0,0|2,0,0]=4 6146 B10R1.15 COC(=O)C1CNCCN1 Amb8630814 [0,1,0,1,0,0|2,0,0]=4 6147 B10R1.15 COC(=O)C1COCCN1 Amb2695519 [0,1,0,1,0,0|2,0,0]=4 6148 B10R1.15 COC(=O)C1COCCN1 Amb8630123 [0,1,0,1,0,0|2,0,0]=4 6149 B10R1.15 COC(=O)C1CSCCN1 Amb32682328 [0,1,0,1,0,0|2,0,0]=4 6150 B10R1.15 COC(=O)C1CSCCN1 Amb8381902 [0,1,0,1,0,0|2,0,0]=4 6151 B10R1.15 COC(=O)C1NCCCS1 Amb27837914 [0,1,0,1,0,0|2,0,0]=4 6152 B10R1.15 COC(=O)[C@@H]1CC=CCN1 Amb27167577 [0,1,0,1,0,0|1,0,1]=4 6153 B10R1.15 COC(=O)[C@@H]1CCCCN1 Amb2700061 [0,1,0,1,0,0|1,0,0]=3 6154 B10R1.15 COC(=O)[C@@H]1CCCCN1 Amb2700077 [0,1,0,1,0,0|1,0,0]=3 6155 B10R1.15 COC(=O)[C@@H]1CCCNN1 Amb26551193 [0,1,0,1,0,0|2,0,0]=4 6156 B10R1.15 COC(=O)[C@@H]1CNCCN1 Amb15690749 [0,1,0,1,0,0|2,0,0]=4 6157 B10R1.15 COC(=O)[C@@H]1CNCCN1 Amb22737176 [0,1,0,1,0,0|2,0,0]=4 6158 B10R1.15 COC(=O)[C@@H]1COCCN1 Amb10066914 [0,1,0,1,0,0|2,0,0]=4 6159 B10R1.15 COC(=O)[C@@H]1COCCN1 Amb2695527 [0,1,0,1,0,0|2,0,0]=4 6160 B10R1.15 COC(=O)[C@@H]1COCCN1 Amb32414653 [0,1,0,1,0,0|2,0,0]=4 6161 B10R1.15 COC(=O)[C@@H]1CSCCN1 Amb24182066 [0,1,0,1,0,0|2,0,0]=4 6162 B10R1.15 COC(=O)[C@H]1CCCCN1 Amb10604194 [0,1,0,1,0,0|1,0,0]=3 6163 B10R1.15 COC(=O)[C@H]1CCCCN1 Amb2700076 [0,1,0,1,0,0|1,0,0]=3 6164 B10R1.15 COC(=O)[C@H]1CCCCO1 Amb25113469 [0,1,0,1,0,0|2,0,0]=4 6165 B10R1.15 COC(=O)[C@H]1CCSCN1 Amb27463833 [0,1,0,1,0,0|0,0,0]=2 6166 B10R1.15 COC(=O)[C@H]1CNCCN1 Amb15690748 [0,1,0,1,0,0|2,0,0]=4 6167 B10R1.15 COC(=O)[C@H]1CNCCN1 Amb22284323 [0,1,0,1,0,0|2,0,0]=4 6168 B10R1.15 COC(=O)[C@H]1COCCN1 Amb2695526 [0,1,0,1,0,0|2,0,0]=4 6169 B10R1.15 COC(=O)[C@H]1COCCN1 Amb8630124 [0,1,0,1,0,0|2,0,0]=4 6170 B10R1.15 NNC(=O)C1CCCCN1 Amb25082270 [0,1,0,1,0,0|2,0,0]=4 6171 B10R1.15 NNC(=O)C1CCSCC1 Amb27839378 [0,1,0,1,0,0|2,0,0]=4 6172 B10R1.15 NOC(=O)C1CCNCC1 Amb27461392 [0,1,0,1,0,0|2,0,0]=4 6173 B10R1.15 NOC(=O)C1CCOCC1 Amb16233776 [0,1,0,1,0,0|1,1,0]=4 6174 B10R1.15 N\C(=N/O)C1CCCCN1 Amb27637417 [0,1,0,1,0,0|2,0,0]=4 6175 B10R1.15 N\C(=N/O)C1CCSCC1 Amb32675577 [0,1,0,1,0,0|2,0,0]=4 6176 B10R1.15 O=C(CO)C1CCCCC1 Amb18063314 [0,1,0,1,0,0|2,0,0]=4 6177 B10R1.15 O=C(CO)C1CCOCC1 Amb27953688 [0,1,0,1,0,0|1,1,0]=4 6178 B10R1.15 O=C(CO)C1CSCCN1 Amb28368785 [0,1,0,1,0,0|2,0,0]=4 6179 B10R1.15 O=C(CO)N1CCSCC1 Amb27399488 [0,1,0,1,0,0|2,0,0]=4 6180 B10R1.15 O=C(NO)C1CCCCC1 Amb6264217 [0,1,0,1,0,0|2,0,0]=4 6181 B10R1.15 O=C(NO)C1CCOCC1 Amb27776190 [0,1,0,1,0,0|1,1,0]=4 6182 B10R1.15 O=C(NO)N1CCSCC1 Amb27781117 [0,1,0,1,0,0|2,0,0]=4 6183 B10R1.15 O=C(NO)[C@H]1CCCCN1 Amb27641113 [0,1,0,1,0,0|1,0,0]=3 6184 B10R1.19 CNC1CCCCNC1=O Amb9721933 [0,1,0,1,0,0|2,0,0]=4 6185 B10R1.19 NCC1CCCCCC1=O Amb27965542 [0,1,0,1,0,0|2,0,0]=4 6186 B10R1.19 NCC1CCCCNC1=O Amb33097714 [0,1,0,1,0,0|2,0,0]=4 6187 B10R1.19 NCC1CCCCNC1=O Amb6667851 [0,1,0,1,0,0|2,0,0]=4 6188 B10R1.19 NOC1CCCCNC1=O Amb27410321 [0,1,0,1,0,0|2,0,0]=4 6189 B10R1.29 CCCCC1COCC1=O Amb29885828 [0,1,0,1,0,0|2,0,0]=4 6190 B10R1.29 CSCCC1CCCC1=O Amb27794162 [0,1,0,1,0,0|2,0,0]=4 6191 B10R1.29 CSCCC1CCOC1=O Amb27467850 [0,1,0,1,0,0|1,0,0]=3 6192 B10R1.29 CSCCC1CSCC1=O Amb27166207 [0,1,0,1,0,0|1,1,0]=4 6193 B10R1.29 CSCCC1NCCC1=O Amb27192382 [0,1,0,1,0,0|1,0,0]=3 6194 B10R1.29 CSCC[C@@H]1NCCC1=O Amb18830317 [0,1,0,1,0,0|1,0,0]=3 6195 B10R1.29 CSCC[C@@H]1NCCC1O Amb18198742 [0,1,0,1,0,0|1,0,1]=4 6196 B10R1.35 CCC1CC(C=O)C(=O)O1 Amb27863811 [0,1,0,1,0,0|2,0,0]=4 6197 B10R1.35 CC[C@@H]1C[C@@H](C=O)C(=O)O1 Amb28140673 [0,1,0,1,0,0|2,0,0]=4 6198 B10R1.99 CCCC1CC1C(=O)OC Amb26043595 [0,1,0,1,0,0|2,0,0]=4 6199 B10R1.99 CCCC1OC1C(=O)OC Amb25275181 [0,1,0,1,0,0|2,0,0]=4 6200 B10R1.99 CCC[C@@H]1O[C@H]1C(=O)OC Amb25974941 [0,1,0,1,0,0|2,0,0]=4 6201 B10R1.99 CCC[C@H]1O[C@@H]1C(=O)OC Amb26559452 [0,1,0,1,0,0|2,0,0]=4 6202 B10R1.99 CCC[C@H]1O[C@H]1C(=O)OC Amb26444626 [0,1,0,1,0,0|2,0,0]=4 6203 B10R1.119 CC1CCC(N)C(=O)C1N Amb28056125 [0,1,0,1,0,0|2,0,0]=4 6204 B10R1.119 CC1CCC(N)C(=O)N1C Amb27208299 [0,1,0,1,0,0|2,0,0]=4 6205 B10R1.159 C=CC1CC1(N)C(=O)OC Amb10601397 [0,1,0,1,0,0|1,0,1]=4 6206 B10R1.159 C=CC1CC1(N)C(=O)OC Amb25314372 [0,1,0,1,0,0|1,0,1]=4 6207 B10R1.159 C=CC1C[C@]1(N)C(=O)OC Amb27162445 [0,1,0,1,0,0|1,0,1]=4 6208 B10R1.159 C=C[C@@H]1C[C@@]1(N)C(=O)OC Amb28250373 [0,1,0,1,0,0|1,0,1]=4 6209 B10R1.159 C=C[C@@H]1C[C@]1(N)C(=O)OC Amb24641397 [0,1,0,1,0,0|1,0,1]=4 6210 B10R1.159 C=C[C@H]1C[C@@]1(N)C(=O)OC Amb27467370 [0,1,0,1,0,0|1,0,1]=4 6211 B10R1.159 CCC1CC1(N)C(=O)OC Amb28143919 [0,1,0,1,0,0|1,0,0]=3 6212 B10R1.159 CC[C@@H]1C[C@@]1(N)C(=O)OC Amb23452881 [0,1,0,1,0,0|1,0,0]=3 6213 B10R1.159 CC[C@@H]1C[C@]1(N)C(=O)OC Amb23452885 [0,1,0,1,0,0|1,0,0]=3 6214 B10R1.159 COC(=O)C1(N)CC1CO Amb24419636 [0,1,0,1,0,0|2,0,0]=4 6215 B10R1.159 COC(=O)[C@]1(N)C[C@H]1CO Amb24514805 [0,1,0,1,0,0|2,0,0]=4 6216 B10R1.169 CCC1CC(C(=O)OC)C1 Amb23537800 [0,1,0,1,0,0|2,0,0]=4 6217 B10R1.169 CNC1CC(C(=O)NO)C1 Amb35637704 [0,1,0,1,0,0|2,0,0]=4 6218 B10R1.169 CNC1CC(C(=O)OC)C1 Amb32752638 [0,1,0,1,0,0|2,0,0]=4 6219 B10R1.169 CNC1CC(C(=O)OC)C1 Amb32752639 [0,1,0,1,0,0|2,0,0]=4 6220 B10R1.169 CN[C@H]1C[C@@H](C(=O)NO)C1 Amb35609409 [0,1,0,1,0,0|2,0,0]=4 6221 B10R1.169 CN[C@H]1C[C@@H](C(=O)OC)C1 Amb29849907 [0,1,0,1,0,0|2,0,0]=4 6222 B10R1.169 CN[C@H]1C[C@@H](C(=O)OC)C1 Amb32667481 [0,1,0,1,0,0|2,0,0]=4 6223 B10R1.169 CN[C@H]1C[C@H](C(=O)OC)C1 Amb34142301 [0,1,0,1,0,0|2,0,0]=4 6224 B10R1.169 COC(=O)C1CC(CO)N1 Amb27634309 [0,1,0,1,0,0|2,0,0]=4 6225 B10R1.169 COC(=O)C1CC(OC)C1 Amb24643668 [0,1,0,1,0,0|1,1,0]=4 6226 B10R1.169 COC(=O)C1CC(SC)C1 Amb24403832 [0,1,0,1,0,0|1,0,0]=3 6227 B10R1.176 CC1CCC(CO)OC1=O Amb27772597 [0,1,0,1,0,0|2,0,0]=4 6228 B10R1.176 CCC1CCC(=O)C(N)C1 Amb18279405 [0,1,0,1,0,0|2,0,0]=4 6229 B10R1.176 N[C@H]1CC[C@@H](CF)NC1=O Amb25989934 [0,1,0,1,0,0|2,0,0]=4 6230 B10R1.182 C#CC(=O)C(N)C1CCC1 Amb26579047 [0,1,0,1,0,0|2,0,0]=4 6231 B10R1.182 C=CC(=O)C(N)C1CCC1 Amb27435800 [0,1,0,1,0,0|2,0,0]=4 6232 B10R1.182 CC(C(=O)NO)C1CCC1 Amb29870790 [0,1,0,1,0,0|2,0,0]=4 6233 B10R1.182 CCC(=O)C(N)C1CCC1 Amb27867692 [0,1,0,1,0,0|2,0,0]=4 6234 B10R1.182 CNC(=O)C(N)C1COC1 Amb27872228 [0,1,0,1,0,0|1,1,0]=4 6235 B10R1.182 CNC(=O)[C@H](N)C1COC1 Amb28363881 [0,1,0,1,0,0|1,1,0]=4 6236 B10R1.182 COC(=O)C(C)C1CCC1 Amb35735884 [0,1,0,1,0,0|2,0,0]=4 6237 B10R1.182 COC(=O)C(C)C1CNC1 Amb25888289 [0,1,0,1,0,0|2,0,0]=4 6238 B10R1.182 COC(=O)C(C)C1CNC1 Amb34153525 [0,1,0,1,0,0|2,0,0]=4 6239 B10R1.182 COC(=O)C(F)C1CNC1 Amb33726819 [0,1,0,1,0,0|2,0,0]=4 6240 B10R1.182 COC(=O)C(N)C1CCC1 Amb26512281 [0,1,0,1,0,0|1,0,0]=3 6241 B10R1.182 COC(=O)C(N)C1CCC1 Amb33456941 [0,1,0,1,0,0|1,0,0]=3 6242 B10R1.182 COC(=O)C(N)C1CCO1 Amb28368829 [0,1,0,1,0,0|2,0,0]=4 6243 B10R1.182 COC(=O)C(N)C1CNC1 Amb29890520 [0,1,0,1,0,0|1,0,0]=3 6244 B10R1.182 COC(=O)C(N)C1COC1 Amb17933898 [0,1,0,1,0,0|0,1,0]=3 6245 B10R1.182 COC(=O)C(N)C1COC1 Amb23440113 [0,1,0,1,0,0|0,1,0]=3 6246 B10R1.182 COC(=O)C(N)C1COC1 Amb33716006 [0,1,0,1,0,0|0,1,0]=3 6247 B10R1.182 COC(=O)C(N)C1CSC1 Amb27638758 [0,1,0,1,0,0|0,0,0]=2 6248 B10R1.182 COC(=O)C(O)C1CCC1 Amb26643641 [0,1,0,1,0,0|2,0,0]=4 6249 B10R1.182 COC(=O)C(O)C1CNC1 Amb27826594 [0,1,0,1,0,0|2,0,0]=4 6250 B10R1.182 COC(=O)C(O)C1COC1 Amb35585384 [0,1,0,1,0,0|1,1,0]=4 6251 B10R1.182 COC(=O)[C@@H](N)C1CCC1 Amb2699133 [0,1,0,1,0,0|1,0,0]=3 6252 B10R1.182 COC(=O)[C@@H](N)C1CCC1 Amb33718666 [0,1,0,1,0,0|1,0,0]=3 6253 B10R1.182 COC(=O)[C@H](N)C1CCC1 Amb2699132 [0,1,0,1,0,0|1,0,0]=3 6254 B10R1.182 COC(=O)[C@H](N)C1CCC1 Amb33871581 [0,1,0,1,0,0|1,0,0]=3 6255 B10R1.182 COC(=O)[C@H](N)C1COC1 Amb24697637 [0,1,0,1,0,0|0,1,0]=3 6256 B10R1.182 NC(C(=O)NO)C1CCC1 Amb28134776 [0,1,0,1,0,0|1,0,0]=3 6257 B10R1.182 NNC(=O)C(N)C1CCC1 Amb27969349 [0,1,0,1,0,0|2,0,0]=4 6258 B10R1.182 O=C(NO)C(F)C1CNC1 Amb27766507 [0,1,0,1,0,0|2,0,0]=4 6259 B10R1.184 C#CC(=O)C(N)CC1CC1 Amb33132584 [0,1,0,1,0,0|2,0,0]=4 6260 B10R1.184 C=CC(=O)C(N)CC1CC1 Amb33132585 [0,1,0,1,0,0|2,0,0]=4 6261 B10R1.184 CCC(=O)C(N)CC1CC1 Amb18831689 [0,1,0,1,0,0|2,0,0]=4 6262 B10R1.184 CNC(=O)C(N)CC1CC1 Amb34199450 [0,1,0,1,0,0|2,0,0]=4 6263 B10R1.184 COC(=O)C(N)CC1CC1 Amb26578827 [0,1,0,1,0,0|1,0,0]=3 6264 B10R1.184 COC(=O)C(N)CC1CC1 Amb32663486 [0,1,0,1,0,0|1,0,0]=3 6265 B10R1.184 COC(=O)C(O)CC1CC1 Amb25074187 [0,1,0,1,0,0|2,0,0]=4 6266 B10R1.184 COC(=O)[C@@H](N)CC1CC1 Amb26885525 [0,1,0,1,0,0|1,0,0]=3 6267 B10R1.184 COC(=O)[C@@H](N)CC1CC1 Amb33801513 [0,1,0,1,0,0|1,0,0]=3 6268 B10R1.184 COC(=O)[C@@H](N)C[C@H]1CO1 Amb27469365 [0,1,0,1,0,0|0,1,0]=3 6269 B10R1.184 COC(=O)[C@H](N)CC1CC1 Amb26967519 [0,1,0,1,0,0|1,0,0]=3 6270 B10R1.184 COC(=O)[C@H](O)CC1CC1 Amb24479465 [0,1,0,1,0,0|2,0,0]=4 6271 B10R1.184 NC(CC1CC1)C(=O)NO Amb26516945 [0,1,0,1,0,0|1,0,0]=3 6272 B10R1.184 N[C@@H](CC1CC1)C(=O)NO Amb27617224 [0,1,0,1,0,0|1,0,0]=3 6273 B10R1.217 CCCCC1NC(=O)C1O Amb27837929 [0,1,0,1,0,0|1,0,1]=4 6274 B10R1.411 C#CC(=O)C1(N)CCCC1 Amb25340164 [0,1,0,1,0,0|2,0,0]=4 6275 B10R1.411 C#CC(=O)C1(N)CCOC1 Amb25844994 [0,1,0,1,0,0|1,1,0]=4 6276 B10R1.411 C=CC(=O)C1(N)CCCC1 Amb26589621 [0,1,0,1,0,0|2,0,0]=4 6277 B10R1.411 C=CC(=O)C1(N)CCOC1 Amb27656034 [0,1,0,1,0,0|1,1,0]=4 6278 B10R1.411 CC1(C(=O)NO)CCNC1 Amb27190739 [0,1,0,1,0,0|2,0,0]=4 6279 B10R1.411 CC1(C(=O)NO)CCOC1 Amb27765460 [0,1,0,1,0,0|1,1,0]=4 6280 B10R1.411 CCC(=O)C1(N)CCCC1 Amb18831688 [0,1,0,1,0,0|2,0,0]=4 6281 B10R1.411 CCC(=O)C1(N)CCCC1 Amb35752559 [0,1,0,1,0,0|2,0,0]=4 6282 B10R1.411 CCC(=O)C1(N)CCOC1 Amb24453594 [0,1,0,1,0,0|1,1,0]=4 6283 B10R1.411 CNC(=O)C1(N)CCCC1 Amb13952411 [0,1,0,1,0,0|2,0,0]=4 6284 B10R1.411 CNC(=O)C1(N)CCCC1 Amb25773545 [0,1,0,1,0,0|2,0,0]=4 6285 B10R1.411 COC(=O)C1(Br)CCCC1 Amb27259423 [0,1,0,1,0,0|2,0,0]=4 6286 B10R1.411 COC(=O)C1(C)CCCC1 Amb19737282 [0,1,0,1,0,0|2,0,0]=4 6287 B10R1.411 COC(=O)C1(C)CCNC1 Amb20634440 [0,1,0,1,0,0|2,0,0]=4 6288 B10R1.411 COC(=O)C1(C)CCNC1 Amb30594185 [0,1,0,1,0,0|2,0,0]=4 6289 B10R1.411 COC(=O)C1(C)CCOC1 Amb25905113 [0,1,0,1,0,0|1,1,0]=4 6290 B10R1.411 COC(=O)C1(F)CCCC1 Amb24387644 [0,1,0,1,0,0|2,0,0]=4 6291 B10R1.411 COC(=O)C1(F)CCNC1 Amb20623411 [0,1,0,1,0,0|2,0,0]=4 6292 B10R1.411 COC(=O)C1(F)CCNC1 Amb22504333 [0,1,0,1,0,0|2,0,0]=4 6293 B10R1.411 COC(=O)C1(N)C=CCC1 Amb27776870 [0,1,0,1,0,0|1,0,1]=4 6294 B10R1.411 COC(=O)C1(N)CC=CC1 Amb24618429 [0,1,0,1,0,0|1,0,1]=4 6295 B10R1.411 COC(=O)C1(N)CCCC1 Amb2695249 [0,1,0,1,0,0|1,0,0]=3 6296 B10R1.411 COC(=O)C1(N)CCCC1 Amb6892252 [0,1,0,1,0,0|1,0,0]=3 6297 B10R1.411 COC(=O)C1(N)CCOC1 Amb20667782 [0,1,0,1,0,0|0,1,0]=3 6298 B10R1.411 COC(=O)C1(N)CCOC1 Amb24550968 [0,1,0,1,0,0|0,1,0]=3 6299 B10R1.411 COC(=O)C1(N)CCSC1 Amb18281131 [0,1,0,1,0,0|0,0,0]=2 6300 B10R1.411 COC(=O)C1(N)CCSC1 Amb35752553 [0,1,0,1,0,0|0,0,0]=2 6301 B10R1.411 COC(=O)C1(O)CCCC1 Amb24116814 [0,1,0,1,0,0|2,0,0]=4 6302 B10R1.411 COC(=O)C1(O)CCNC1 Amb23515114 [0,1,0,1,0,0|2,0,0]=4 6303 B10R1.411 COC(=O)C1(O)CCNC1 Amb32679436 [0,1,0,1,0,0|2,0,0]=4 6304 B10R1.411 COC(=O)C1(O)CCOC1 Amb20668950 [0,1,0,1,0,0|1,1,0]=4 6305 B10R1.411 COC(=O)C1(O)CCSC1 Amb18183491 [0,1,0,1,0,0|1,0,0]=3 6306 B10R1.411 COC(=O)C1(S)CCCC1 Amb27614947 [0,1,0,1,0,0|2,0,0]=4 6307 B10R1.411 COC(=O)[C@]1(N)CCNC1 Amb27445124 [0,1,0,1,0,0|1,0,0]=3 6308 B10R1.411 NC1(C(=O)NO)CCCC1 Amb26069257 [0,1,0,1,0,0|1,0,0]=3 6309 B10R1.411 NC1(C(=O)NO)CCOC1 Amb27408315 [0,1,0,1,0,0|0,1,0]=3 6310 B10R1.411 NNC(=O)C1(N)CCOC1 Amb27985705 [0,1,0,1,0,0|1,1,0]=4 6311 B10R1.411 N\C(=N/O)C1(N)CCCC1 Amb25760385 [0,1,0,1,0,0|2,0,0]=4 6312 B10R1.411 O=C(NO)C1(F)CCCC1 Amb27406700 [0,1,0,1,0,0|2,0,0]=4 6313 B10R1.411 O=C(NO)C1(O)CCCC1 Amb28316053 [0,1,0,1,0,0|2,0,0]=4 6314 B10R1.461 COC(=O)C(N)C1CC1C Amb33358871 [0,1,0,1,0,0|1,0,0]=3 6315 B10R1.461 COC(=O)C(O)C1CC1C Amb33171913 [0,1,0,1,0,0|2,0,0]=4 6316 B10R1.25 CC1CCC(CN)C(=O)N1 Amb23590134 [0,1,0,1,0,0|2,0,0]=4 6317 B10R1.31 C#C[C@@H]1CC[C@@H](C(=O)O)N1 Amb25930020 [0,1,0,1,0,0|1,0,1]=4 6318 B10R1.31 C#C[C@@H]1CC[C@H](C(=O)O)N1 Amb27964144 [0,1,0,1,0,0|1,0,1]=4 6319 B10R1.31 C#C[C@H]1CC[C@@H](C(=O)O)N1 Amb28141834 [0,1,0,1,0,0|1,0,1]=4 6320 B10R1.31 C#C[C@H]1CC[C@H](C(=O)O)N1 Amb27789120 [0,1,0,1,0,0|1,0,1]=4 6321 B10R1.31 C=C[C@@H]1CC[C@H](C(=O)O)N1 Amb27196476 [0,1,0,1,0,0|1,0,1]=4 6322 B10R1.31 C=C[C@H]1CC[C@@H](C(=O)O)N1 Amb27195910 [0,1,0,1,0,0|1,0,1]=4 6323 B10R1.31 CCC1=NC(C(=O)O)CC1 Amb23560251 [0,1,0,1,0,0|1,0,1]=4 6324 B10R1.31 CCC1CCC(C(=O)O)N1 Amb24694112 [0,1,0,1,0,0|1,0,0]=3 6325 B10R1.31 CCC1CCC(C(=O)O)N1 Amb28555622 [0,1,0,1,0,0|1,0,0]=3 6326 B10R1.31 CCC1CCC(C(=O)O)O1 Amb20668759 [0,1,0,1,0,0|2,0,0]=4 6327 B10R1.31 CCC1CNC(C(=O)O)C1 Amb22496300 [0,1,0,1,0,0|1,0,0]=3 6328 B10R1.31 CCC1CNC(C(N)=O)C1 Amb27852411 [0,1,0,1,0,0|2,0,0]=4 6329 B10R1.31 CCC1CN[C@H](C(=O)O)C1 Amb27168235 [0,1,0,1,0,0|1,0,0]=3 6330 B10R1.31 CCC1NC(C(=O)O)CS1 Amb32409625 [0,1,0,1,0,0|1,0,0]=3 6331 B10R1.31 CCC1NC(C(=O)O)CS1 Amb9723340 [0,1,0,1,0,0|1,0,0]=3 6332 B10R1.31 CCC1N[C@@H](C(=O)O)CS1 Amb8515134 [0,1,0,1,0,0|1,0,0]=3 6333 B10R1.31 CCC1N[C@H](C(=O)O)CS1 Amb18792350 [0,1,0,1,0,0|1,0,0]=3 6334 B10R1.31 CCN1CCC(C(=O)O)C1 Amb10607746 [0,1,0,1,0,0|2,0,0]=4 6335 B10R1.31 CCN1CC[C@H](C(=O)O)C1 Amb27406792 [0,1,0,1,0,0|2,0,0]=4 6336 B10R1.31 CC[C@@H]1CC[C@@H](C(=O)O)O1 Amb35750180 [0,1,0,1,0,0|2,0,0]=4 6337 B10R1.31 CC[C@@H]1CC[C@@H](C(N)=O)N1 Amb27782933 [0,1,0,1,0,0|2,0,0]=4 6338 B10R1.31 CC[C@@H]1CN[C@H](C(=O)O)C1 Amb35747486 [0,1,0,1,0,0|1,0,0]=3 6339 B10R1.31 CC[C@@H]1CN[C@H](C(=O)O)C1 Amb35747917 [0,1,0,1,0,0|1,0,0]=3 6340 B10R1.31 CC[C@H]1CC[C@@H](C(=O)O)N1 Amb28053433 [0,1,0,1,0,0|1,0,0]=3 6341 B10R1.31 CNC1CCC(C(=O)O)C1 Amb23454119 [0,1,0,1,0,0|2,0,0]=4 6342 B10R1.31 CN[C@H]1CN[C@H](C(=O)O)C1 Amb27781818 [0,1,0,1,0,0|1,0,0]=3 6343 B10R1.31 COC1=NC(C(=O)O)CC1 Amb27246925 [0,1,0,1,0,0|0,1,1]=4 6344 B10R1.31 COC1CCC(C(=O)O)C1 Amb24399167 [0,1,0,1,0,0|1,1,0]=4 6345 B10R1.31 COC1CNC(C(=O)O)C1 Amb33530569 [0,1,0,1,0,0|0,1,0]=3 6346 B10R1.31 COC1CNC(C(C)=O)C1 Amb27390642 [0,1,0,1,0,0|1,1,0]=4 6347 B10R1.31 COC1CNC(C(N)=O)C1 Amb18951799 [0,1,0,1,0,0|1,1,0]=4 6348 B10R1.31 COC1CNC(C(N)=O)C1 Amb32666414 [0,1,0,1,0,0|1,1,0]=4 6349 B10R1.31 COC1CN[C@H](C(=O)O)C1 Amb26037119 [0,1,0,1,0,0|0,1,0]=3 6350 B10R1.31 CO[C@@H]1CN[C@@H](C(=O)O)C1 Amb24112984 [0,1,0,1,0,0|0,1,0]=3 6351 B10R1.31 CO[C@@H]1CN[C@H](C(=O)O)C1 Amb24514992 [0,1,0,1,0,0|0,1,0]=3 6352 B10R1.31 CO[C@@H]1CN[C@H](C(N)=O)C1 Amb27860461 [0,1,0,1,0,0|1,1,0]=4 6353 B10R1.31 CO[C@@H]1CN[C@H](C(N)=O)C1 Amb28697022 [0,1,0,1,0,0|1,1,0]=4 6354 B10R1.31 CO[C@H]1CC[C@@H](C(=O)O)C1 Amb26657399 [0,1,0,1,0,0|1,1,0]=4 6355 B10R1.31 CO[C@H]1CN[C@@H](C(=O)O)C1 Amb25231723 [0,1,0,1,0,0|0,1,0]=3 6356 B10R1.31 CO[C@H]1CN[C@@H](C(N)=O)C1 Amb27882640 [0,1,0,1,0,0|1,1,0]=4 6357 B10R1.31 CO[C@H]1CN[C@H](C(=O)O)C1 Amb25959597 [0,1,0,1,0,0|0,1,0]=3 6358 B10R1.31 CSC1=NC(C(=O)O)CC1 Amb28146794 [0,1,0,1,0,0|0,0,1]=3 6359 B10R1.31 CSC1CNC(C(=O)O)C1 Amb27838029 [0,1,0,1,0,0|0,0,0]=2 6360 B10R1.31 CSC1CN[C@H](C(=O)O)C1 Amb27620352 [0,1,0,1,0,0|0,0,0]=2 6361 B10R1.31 CS[C@@H]1CN[C@H](C(=O)O)C1 Amb27637696 [0,1,0,1,0,0|0,0,0]=2 6362 B10R1.31 N#C[C@@H]1CN[C@H](C(=O)O)C1 Amb10603138 [0,1,0,1,0,0|2,0,0]=4 6363 B10R1.31 N#C[C@H]1CN[C@H](C(=O)O)C1 Amb10603133 [0,1,0,1,0,0|2,0,0]=4 6364 B10R1.31 NCC1CCC(C(=O)O)C1 Amb28202595 [0,1,0,1,0,0|2,0,0]=4 6365 B10R1.31 NCC1CCC(C(=O)O)O1 Amb27451875 [0,1,0,1,0,0|2,0,0]=4 6366 B10R1.31 NC[C@@H]1CC[C@@H](C(=O)O)C1 Amb10066932 [0,1,0,1,0,0|2,0,0]=4 6367 B10R1.31 NC[C@@H]1CC[C@@H](C(=O)O)O1 Amb27420232 [0,1,0,1,0,0|2,0,0]=4 6368 B10R1.31 NC[C@@H]1CC[C@H](C(=O)O)O1 Amb32645997 [0,1,0,1,0,0|2,0,0]=4 6369 B10R1.31 NC[C@@H]1CC[C@H](C(=O)O)O1 Amb33098523 [0,1,0,1,0,0|2,0,0]=4 6370 B10R1.31 NC[C@@H]1CN[C@H](C(=O)O)C1 Amb24117206 [0,1,0,1,0,0|2,0,0]=4 6371 B10R1.31 NC[C@@H]1CN[C@H](C(=O)O)C1 Amb26415233 [0,1,0,1,0,0|2,0,0]=4 6372 B10R1.31 NC[C@H]1CC[C@@H](C(=O)O)O1 Amb27959990 [0,1,0,1,0,0|2,0,0]=4 6373 B10R1.31 NC[C@H]1CN[C@H](C(=O)O)C1 Amb24117205 [0,1,0,1,0,0|2,0,0]=4 6374 B10R1.31 NC[C@H]1CN[C@H](C(=O)O)C1 Amb25912130 [0,1,0,1,0,0|2,0,0]=4 6375 B10R1.31 NO[C@@H]1CN[C@H](C(=O)O)C1 Amb25188204 [0,1,0,1,0,0|1,1,0]=4 6376 B10R1.31 O=C(O)C1CC(OS)CN1 Amb27446350 [0,1,0,1,0,0|1,1,0]=4 6377 B10R1.31 O=C(O)C1CCC(CF)N1 Amb27233067 [0,1,0,1,0,0|1,0,0]=3 6378 B10R1.31 O=C(O)C1CCC(CO)N1 Amb24502434 [0,1,0,1,0,0|1,0,0]=3 6379 B10R1.31 O=C(O)C1CSC(CO)N1 Amb27837995 [0,1,0,1,0,0|2,0,0]=4 6380 B10R1.31 O=C(O)[C@@H]1CC(CO)CN1 Amb25917979 [0,1,0,1,0,0|2,0,0]=4 6381 B10R1.31 O=C(O)[C@@H]1CC(OS)CN1 Amb27983817 [0,1,0,1,0,0|1,1,0]=4 6382 B10R1.31 O=C(O)[C@@H]1CS[C@H](CO)N1 Amb26530942 [0,1,0,1,0,0|2,0,0]=4 6383 B10R1.31 O=C(O)[C@@H]1C[C@@H](CO)CN1 Amb24514873 [0,1,0,1,0,0|2,0,0]=4 6384 B10R1.31 O=C(O)[C@H]1CC[C@@H](CO)O1 Amb25968230 [0,1,0,1,0,0|2,0,0]=4 6385 B10R1.160 CCC1CC1(C#N)C(=O)O Amb27400849 [0,1,0,1,0,0|1,0,1]=4 6386 B10R1.160 CCC1CC1(CN)C(=O)O Amb25888057 [0,1,0,1,0,0|1,0,0]=3 6387 B10R1.160 CCC1CC1(SC)C(=O)O Amb25276918 [0,1,0,1,0,0|2,0,0]=4 6388 B10R1.160 NCC1(C(=O)O)CC1CO Amb25228881 [0,1,0,1,0,0|2,0,0]=4 6389 B10R1.194 C=C1CCC(C(=O)O)C1N Amb25690409 [0,1,0,1,0,0|1,0,1]=4 6390 B10R1.194 C=C1CC[C@@H](C(=O)O)[C@H]1N Amb26884928 [0,1,0,1,0,0|1,0,1]=4 6391 B10R1.194 C=C1CC[C@H](C(=O)O)[C@@H]1N Amb28345701 [0,1,0,1,0,0|1,0,1]=4 6392 B10R1.194 CC1C(C(=O)O)CCN1C Amb28050081 [0,1,0,1,0,0|2,0,0]=4 6393 B10R1.194 CC1C(C(=O)O)CCN1C Amb28555552 [0,1,0,1,0,0|2,0,0]=4 6394 B10R1.194 CC1CCC(C(=O)O)C1N Amb20623936 [0,1,0,1,0,0|1,0,0]=3 6395 B10R1.194 CC1CC[C@@H](C(=O)O)N1C Amb27242545 [0,1,0,1,0,0|1,0,0]=3 6396 B10R1.194 CC1CC[C@@H](C(=O)O)[C@H]1N Amb27789618 [0,1,0,1,0,0|1,0,0]=3 6397 B10R1.194 CC1CC[C@H](C(=O)O)C1C Amb28347215 [0,1,0,1,0,0|2,0,0]=4 6398 B10R1.194 CN1C(=O)CCC1C(=O)O Amb18279438 [0,1,0,1,0,0|2,0,0]=4 6399 B10R1.194 CN1C(=O)CC[C@@H]1C(=O)O Amb24480932 [0,1,0,1,0,0|2,0,0]=4 6400 B10R1.194 CN1C(=O)CC[C@H]1C(=O)O Amb22756511 [0,1,0,1,0,0|2,0,0]=4 6401 B10R1.194 CN1CCC(C(=O)O)C1=O Amb22001693 [0,1,0,1,0,0|2,0,0]=4 6402 B10R1.194 C[C@@H]1CC[C@@H](C(=O)O)N1C Amb24715908 [0,1,0,1,0,0|1,0,0]=3 6403 B10R1.194 C[C@@H]1CC[C@@H](C(=O)O)[C@H]1N Amb27874070 [0,1,0,1,0,0|1,0,0]=3 6404 B10R1.194 C[C@@H]1CC[C@H](C(=O)O)N1C Amb33714494 [0,1,0,1,0,0|1,0,0]=3 6405 B10R1.194 C[C@@H]1CC[C@H](C(=O)O)[C@@H]1C Amb27217301 [0,1,0,1,0,0|2,0,0]=4 6406 B10R1.194 C[C@@H]1CC[C@H](C(=O)O)[C@H]1N Amb24618144 [0,1,0,1,0,0|1,0,0]=3 6407 B10R1.194 C[C@@H]1[C@@H](C(=O)O)CCN1C Amb18202481 [0,1,0,1,0,0|2,0,0]=4 6408 B10R1.194 C[C@@H]1[C@H](C(=O)O)CCN1C Amb28721110 [0,1,0,1,0,0|2,0,0]=4 6409 B10R1.194 C[C@H]1CC[C@@H](C(=O)O)N1C Amb32643970 [0,1,0,1,0,0|1,0,0]=3 6410 B10R1.194 C[C@H]1CC[C@H](C(=O)O)[C@@H]1C Amb28067785 [0,1,0,1,0,0|2,0,0]=4 6411 B10R1.194 NC1C(O)CCC1C(=O)O Amb28077395 [0,1,0,1,0,0|2,0,0]=4 6412 B10R1.194 NN1C(=O)CCC1C(=O)O Amb27839055 [0,1,0,1,0,0|2,0,0]=4 6413 B10R1.194 N[C@H]1[C@@H](O)CC[C@@H]1C(=O)O Amb27473358 [0,1,0,1,0,0|2,0,0]=4 6414 B10R1.194 O=C(O)C1CCC(=O)N1O Amb27807058 [0,1,0,1,0,0|2,0,0]=4 6415 B10R1.194 O=C(O)[C@@H]1CCC(=O)N1O Amb26357551 [0,1,0,1,0,0|2,0,0]=4 6416 B10R1.214 CC1CC1C(CN)C(=O)O Amb33145043 [0,1,0,1,0,0|1,0,0]=3 6417 B10R1.214 CCC(C(=O)O)C1CC1C Amb26951804 [0,1,0,1,0,0|2,0,0]=4 6418 B10R1.219 C=C(C)C(NC)C1CSC1 Amb29867582 [0,1,0,1,0,0|2,0,0]=4 6419 B10R1.219 C=C(C)C(NN)C1CSC1 Amb30018303 [0,1,0,1,0,0|2,0,0]=4 6420 B10R1.219 CC(=O)C(CN)C1CCC1 Amb33132192 [0,1,0,1,0,0|2,0,0]=4 6421 B10R1.219 CCC(C(=O)O)C1CCC1 Amb23590271 [0,1,0,1,0,0|2,0,0]=4 6422 B10R1.219 CCC(C(=O)O)C1COC1 Amb33165629 [0,1,0,1,0,0|1,1,0]=4 6423 B10R1.219 CCC(C(=O)O)C1CSC1 Amb32685726 [0,1,0,1,0,0|1,0,0]=3 6424 B10R1.219 CNC(C(=O)O)C1CCC1 Amb28049636 [0,1,0,1,0,0|1,0,0]=3 6425 B10R1.219 CNC(C(N)=O)C1COC1 Amb27843744 [0,1,0,1,0,0|1,1,0]=4 6426 B10R1.219 CNC(C(N)=O)C1CSC1 Amb27849482 [0,1,0,1,0,0|1,0,0]=3 6427 B10R1.219 COC(C(=O)O)C1CCC1 Amb25027993 [0,1,0,1,0,0|2,0,0]=4 6428 B10R1.219 NCC(C(=O)O)C1CCC1 Amb25977788 [0,1,0,1,0,0|1,0,0]=3 6429 B10R1.219 NCC(C(=O)O)C1CCC1 Amb30868145 [0,1,0,1,0,0|1,0,0]=3 6430 B10R1.219 NCC(C(=O)O)N1CCC1 Amb27648289 [0,1,0,1,0,0|2,0,0]=4 6431 B10R1.219 NCC(C(N)=O)C1CCC1 Amb27636639 [0,1,0,1,0,0|2,0,0]=4 6432 B10R1.219 O=C(O)C(CF)C1CCC1 Amb27624605 [0,1,0,1,0,0|2,0,0]=4 6433 B10R1.219 O=C(O)C(CO)C1CNC1 Amb27964722 [0,1,0,1,0,0|2,0,0]=4 6434 B10R1.229 CC1CCC1(C#N)C(=O)O Amb27185761 [0,1,0,1,0,0|1,0,1]=4 6435 B10R1.229 CC1CCC1(CN)C(=O)O Amb26976234 [0,1,0,1,0,0|1,0,0]=3 6436 B10R1.229 CC1CCC1(CN)C(=O)O Amb32789664 [0,1,0,1,0,0|1,0,0]=3 6437 B10R1.229 CNC1(C(=O)O)CCC1C Amb27632510 [0,1,0,1,0,0|1,0,0]=3 6438 B10R1.229 CSC1(C(=O)O)CCC1C Amb27812983 [0,1,0,1,0,0|2,0,0]=4 6439 B10R1.348 CC(=O)C1CCCCCN1 Amb25169359 [0,1,0,1,0,0|2,0,0]=4 6440 B10R1.348 CC(=O)C1CCCSCC1 Amb30031083 [0,1,0,1,0,0|2,0,0]=4 6441 B10R1.348 NC(=O)C1CCCCCN1 Amb23596651 [0,1,0,1,0,0|2,0,0]=4 6442 B10R1.348 NC(=O)C1CCCCNC1 Amb27483476 [0,1,0,1,0,0|2,0,0]=4 6443 B10R1.348 NC(=O)C1CCCSCC1 Amb30030983 [0,1,0,1,0,0|2,0,0]=4 6444 B10R1.348 O=C(Cl)C1CCCSCC1 Amb35649671 [0,1,0,1,0,0|2,0,0]=4 6445 B10R1.348 O=C(O)C1=NCCCCN1 Amb27975697 [0,1,0,1,0,0|1,0,1]=4 6446 B10R1.348 O=C(O)C1CCC=CCC1 Amb22364688 [0,1,0,1,0,0|2,0,0]=4 6447 B10R1.348 O=C(O)C1CCCCCC1 Amb2721236 [0,1,0,1,0,0|2,0,0]=4 6448 B10R1.348 O=C(O)C1CCCCCN1 Amb542684 [0,1,0,1,0,0|1,0,0]=3 6449 B10R1.348 O=C(O)C1CCCCCN1 Amb8504180 [0,1,0,1,0,0|1,0,0]=3 6450 B10R1.348 O=C(O)C1CCCCCO1 Amb28294213 [0,1,0,1,0,0|2,0,0]=4 6451 B10R1.348 O=C(O)C1CCCCNC1 Amb30586509 [0,1,0,1,0,0|1,0,0]=3 6452 B10R1.348 O=C(O)C1CCCCNC1 Amb8630383 [0,1,0,1,0,0|1,0,0]=3 6453 B10R1.348 O=C(O)C1CCCCNN1 Amb28287718 [0,1,0,1,0,0|1,0,0]=3 6454 B10R1.348 O=C(O)C1CCCNCC1 Amb18831588 [0,1,0,1,0,0|2,0,0]=4 6455 B10R1.348 O=C(O)C1CCCNCC1 Amb33189342 [0,1,0,1,0,0|2,0,0]=4 6456 B10R1.348 O=C(O)C1CCCOCC1 Amb18831505 [0,1,0,1,0,0|1,1,0]=4 6457 B10R1.348 O=C(O)C1CCCSCC1 Amb18199262 [0,1,0,1,0,0|1,0,0]=3 6458 B10R1.348 O=C(O)C1CCNCCO1 Amb27632727 [0,1,0,1,0,0|2,0,0]=4 6459 B10R1.348 O=C(O)C1CNCCCN1 Amb25890339 [0,1,0,1,0,0|1,0,0]=3 6460 B10R1.348 O=C(O)C1CNCCCN1 Amb28896027 [0,1,0,1,0,0|1,0,0]=3 6461 B10R1.348 O=C(O)C1CNCCCO1 Amb17739810 [0,1,0,1,0,0|2,0,0]=4 6462 B10R1.348 O=C(O)C1CNCCOC1 Amb27600407 [0,1,0,1,0,0|2,0,0]=4 6463 B10R1.348 O=C(O)C1CNCCOC1 Amb32664315 [0,1,0,1,0,0|2,0,0]=4 6464 B10R1.348 O=C(O)C1CNCCSC1 Amb27813931 [0,1,0,1,0,0|2,0,0]=4 6465 B10R1.348 O=C(O)[C@@H]1CC=CCCN1 Amb27440042 [0,1,0,1,0,0|1,0,1]=4 6466 B10R1.348 O=C(O)[C@@H]1CCCCCN1 Amb2699229 [0,1,0,1,0,0|1,0,0]=3 6467 B10R1.348 O=C(O)[C@@H]1CCCCCN1 Amb8630384 [0,1,0,1,0,0|1,0,0]=3 6468 B10R1.348 O=C(O)[C@@H]1CCCNCC1 Amb27411309 [0,1,0,1,0,0|2,0,0]=4 6469 B10R1.348 O=C(O)[C@@H]1CCCOCC1 Amb27839414 [0,1,0,1,0,0|1,1,0]=4 6470 B10R1.348 O=C(O)[C@@H]1CSCCCN1 Amb28121128 [0,1,0,1,0,0|1,0,0]=3 6471 B10R1.348 O=C(O)[C@H]1CCCCCN1 Amb27770395 [0,1,0,1,0,0|1,0,0]=3 6472 B10R1.348 O=C(O)[C@H]1CCCCCN1 Amb33299452 [0,1,0,1,0,0|1,0,0]=3 6473 B10R1.348 O=C(O)[C@H]1CCCNCC1 Amb24479341 [0,1,0,1,0,0|2,0,0]=4 6474 B10R1.348 O=C(O)[C@H]1CCCOCC1 Amb27604305 [0,1,0,1,0,0|1,1,0]=4 6475 B10R1.437 CCCCC1(C(=O)O)CC1 Amb18062336 [0,1,0,1,0,0|2,0,0]=4 6476 B10R1.437 COCCC1(C(=O)O)CC1 Amb20622891 [0,1,0,1,0,0|1,1,0]=4 6477 B10R1.437 CSCCC1(C(=O)O)CC1 Amb24732629 [0,1,0,1,0,0|1,0,0]=3 6478 B10R1.437 CSCCC1(C(C)=O)CC1 Amb25990330 [0,1,0,1,0,0|2,0,0]=4 6479 B10R1.469 CC(=O)C(CN)CC1CC1 Amb33308002 [0,1,0,1,0,0|2,0,0]=4 6480 B10R1.469 CCC(CC1CC1)C(=O)O Amb18831634 [0,1,0,1,0,0|2,0,0]=4 6481 B10R1.469 CN[C@H](CC1CC1)C(=O)O Amb33347474 [0,1,0,1,0,0|1,0,0]=3 6482 B10R1.469 COC(CC1CC1)C(=O)O Amb25243296 [0,1,0,1,0,0|2,0,0]=4 6483 B10R1.469 N#CC(CC1CC1)C(=O)O Amb25216051 [0,1,0,1,0,0|1,0,1]=4 6484 B10R1.469 NCC(CC1CC1)C(=O)O Amb19021768 [0,1,0,1,0,0|1,0,0]=3 6485 B10R1.469 NCC(CC1CC1)C(=O)O Amb28555450 [0,1,0,1,0,0|1,0,0]=3 6486 B10R1.469 NCC(CC1CC1)C(N)=O Amb27424967 [0,1,0,1,0,0|2,0,0]=4 6487 B10R1.469 NOC(CC1CC1)C(=O)O Amb32660233 [0,1,0,1,0,0|1,0,0]=3 6488 B10R1.477 C#CC1(C(=O)O)CCCC1 Amb26515640 [0,1,0,1,0,0|2,0,0]=4 6489 B10R1.477 C=CC1(C(=O)O)CCCC1 Amb27955011 [0,1,0,1,0,0|2,0,0]=4 6490 B10R1.477 CC(=O)C1(CN)CCCC1 Amb33447092 [0,1,0,1,0,0|2,0,0]=4 6491 B10R1.477 CCC1(C(=O)O)CCCC1 Amb33531419 [0,1,0,1,0,0|2,0,0]=4 6492 B10R1.477 CCC1(C(=O)O)CCNC1 Amb22059208 [0,1,0,1,0,0|2,0,0]=4 6493 B10R1.477 CCC1(C(=O)O)CCNC1 Amb32658029 [0,1,0,1,0,0|2,0,0]=4 6494 B10R1.477 CCC1(C(=O)O)CCOC1 Amb18964298 [0,1,0,1,0,0|1,1,0]=4 6495 B10R1.477 CC[C@@]1(C(=O)O)CCNC1 Amb27633957 [0,1,0,1,0,0|2,0,0]=4 6496 B10R1.477 CNC1(C(=O)O)CC=CC1 Amb27658870 [0,1,0,1,0,0|1,0,1]=4 6497 B10R1.477 CNC1(C(=O)O)CCCC1 Amb22587341 [0,1,0,1,0,0|1,0,0]=3 6498 B10R1.477 CNC1(C(=O)O)CCCC1 Amb9619694 [0,1,0,1,0,0|1,0,0]=3 6499 B10R1.477 CNC1(C(=O)O)CCOC1 Amb24476836 [0,1,0,1,0,0|0,1,0]=3 6500 B10R1.477 CNC1(C(=O)O)CCSC1 Amb9619643 [0,1,0,1,0,0|0,0,0]=2 6501 B10R1.477 CNC1(C(C)=O)CCCC1 Amb25782620 [0,1,0,1,0,0|2,0,0]=4 6502 B10R1.477 CNC1(C(N)=O)CCCC1 Amb18950554 [0,1,0,1,0,0|2,0,0]=4 6503 B10R1.477 CNC1(C(N)=O)CCNC1 Amb27815203 [0,1,0,1,0,0|2,0,0]=4 6504 B10R1.477 CNC1(C(N)=O)CCSC1 Amb18281480 [0,1,0,1,0,0|1,0,0]=3 6505 B10R1.477 COC1(C(=O)O)CCCC1 Amb33538130 [0,1,0,1,0,0|2,0,0]=4 6506 B10R1.477 COC1(C(=O)O)CCNC1 Amb27795219 [0,1,0,1,0,0|2,0,0]=4 6507 B10R1.477 COC1(C(=O)O)CCNC1 Amb32684699 [0,1,0,1,0,0|2,0,0]=4 6508 B10R1.477 COC1(C(=O)O)CCOC1 Amb25132849 [0,1,0,1,0,0|1,1,0]=4 6509 B10R1.477 COC1(C(=O)O)CCSC1 Amb18953814 [0,1,0,1,0,0|1,0,0]=3 6510 B10R1.477 COC1(C(C)=O)CCSC1 Amb27206875 [0,1,0,1,0,0|2,0,0]=4 6511 B10R1.477 CSC1(C(=O)O)CCCC1 Amb18953834 [0,1,0,1,0,0|2,0,0]=4 6512 B10R1.477 CSC1(C(=O)O)CCOC1 Amb32863048 [0,1,0,1,0,0|1,1,0]=4 6513 B10R1.477 N#CC1(C(=O)O)CCCC1 Amb445430 [0,1,0,1,0,0|1,0,1]=4 6514 B10R1.477 N#CC1(C(=O)O)CCOC1 Amb26630608 [0,1,0,1,0,0|0,1,1]=4 6515 B10R1.477 N#CC1(C(=O)O)CCSC1 Amb32695422 [0,1,0,1,0,0|0,0,1]=3 6516 B10R1.477 NCC1(C(=O)O)CC=CC1 Amb26996046 [0,1,0,1,0,0|1,0,1]=4 6517 B10R1.477 NCC1(C(=O)O)CCCC1 Amb21955748 [0,1,0,1,0,0|1,0,0]=3 6518 B10R1.477 NCC1(C(=O)O)CCCC1 Amb9902139 [0,1,0,1,0,0|1,0,0]=3 6519 B10R1.477 NCC1(C(=O)O)CCOC1 Amb25839450 [0,1,0,1,0,0|0,1,0]=3 6520 B10R1.477 NCC1(C(N)=O)CCCC1 Amb18957372 [0,1,0,1,0,0|2,0,0]=4 6521 B10R1.477 NCC1(C(N)=O)CCOC1 Amb27238499 [0,1,0,1,0,0|1,1,0]=4 6522 B10R1.477 NCC1(C(N)=O)CCSC1 Amb27612995 [0,1,0,1,0,0|1,0,0]=3 6523 B10R1.477 NOC1(C(=O)O)CCCC1 Amb32660231 [0,1,0,1,0,0|1,0,0]=3 6524 B10R1.477 O=C(O)C1(CBr)CCCC1 Amb27857310 [0,1,0,1,0,0|2,0,0]=4 6525 B10R1.477 O=C(O)C1(CF)CCCC1 Amb27623733 [0,1,0,1,0,0|2,0,0]=4 6526 B10R1.477 O=C(O)C1(CO)CCCC1 Amb17399884 [0,1,0,1,0,0|2,0,0]=4 6527 B10R1.477 O=C(O)C1(CO)CCNC1 Amb26328041 [0,1,0,1,0,0|2,0,0]=4 6528 B10R1.477 O=C(O)C1(CO)CCNC1 Amb33743454 [0,1,0,1,0,0|2,0,0]=4 6529 B10R1.477 O=C(O)C1(CO)CCOC1 Amb26961454 [0,1,0,1,0,0|1,1,0]=4 6530 B10R1.477 O=C(O)C1(CO)CCSC1 Amb32946220 [0,1,0,1,0,0|1,0,0]=3 6531 B10R1.477 O=C(O)C1(CS)CCCC1 Amb28042748 [0,1,0,1,0,0|2,0,0]=4 6532 B10R1.113 CC1=CC(C(=O)O)CCC1 Amb27252115 [0,1,0,1,0,0|2,0,0]=4 6533 B10R1.113 CC1=NC(C(=O)O)CCN1 Amb16193456 [0,1,0,1,0,0|1,0,1]=4 6534 B10R1.113 CC1=N[C@H](C(=O)O)CCN1 Amb22348409 [0,1,0,1,0,0|1,0,1]=4 6535 B10R1.113 CC1CC(C(=O)O)CCN1 Amb18831574 [0,1,0,1,0,0|2,0,0]=4 6536 B10R1.113 CC1CC(C(=O)O)CCN1 Amb28555517 [0,1,0,1,0,0|2,0,0]=4 6537 B10R1.113 CC1CC(C(=O)O)CCO1 Amb33545304 [0,1,0,1,0,0|1,1,0]=4 6538 B10R1.113 CC1CC(C(=O)O)CCS1 Amb26442619 [0,1,0,1,0,0|1,0,0]=3 6539 B10R1.113 CC1CCCC(C(=O)O)C1 Amb3939935 [0,1,0,1,0,0|2,0,0]=4 6540 B10R1.113 CC1CCCC(C(=O)O)N1 Amb19959953 [0,1,0,1,0,0|1,0,0]=3 6541 B10R1.113 CC1CCCC(C(=O)O)N1 Amb4314386 [0,1,0,1,0,0|1,0,0]=3 6542 B10R1.113 CC1CCCC(C(=O)O)O1 Amb24529278 [0,1,0,1,0,0|2,0,0]=4 6543 B10R1.113 CC1CCC[C@H](C(=O)O)N1 Amb540211 [0,1,0,1,0,0|1,0,0]=3 6544 B10R1.113 CC1CCNC(C(=O)O)C1 Amb13886199 [0,1,0,1,0,0|1,0,0]=3 6545 B10R1.113 CC1CCNC(C(=O)O)C1 Amb19375550 [0,1,0,1,0,0|1,0,0]=3 6546 B10R1.113 CC1CCNC(C(=O)O)O1 Amb25702339 [0,1,0,1,0,0|2,0,0]=4 6547 B10R1.113 CC1CCNC(C(N)=O)C1 Amb27590357 [0,1,0,1,0,0|2,0,0]=4 6548 B10R1.113 CC1CCOC(C(=O)O)C1 Amb25266110 [0,1,0,1,0,0|2,0,0]=4 6549 B10R1.113 CC1CCOC(C(=O)O)N1 Amb33194311 [0,1,0,1,0,0|1,0,0]=3 6550 B10R1.113 CC1CNCC(C(=O)O)C1 Amb18643998 [0,1,0,1,0,0|2,0,0]=4 6551 B10R1.113 CC1CNCC(C(=O)O)N1 Amb32716215 [0,1,0,1,0,0|1,0,0]=3 6552 B10R1.113 CC1CNCC(C(=O)O)O1 Amb26021863 [0,1,0,1,0,0|2,0,0]=4 6553 B10R1.113 CC1CNCC(C(=O)O)O1 Amb32752555 [0,1,0,1,0,0|2,0,0]=4 6554 B10R1.113 CC1COCC(C(=O)O)N1 Amb23585511 [0,1,0,1,0,0|1,0,0]=3 6555 B10R1.113 CC1COCC(C(=O)O)N1 Amb28555605 [0,1,0,1,0,0|1,0,0]=3 6556 B10R1.113 CC1CSCC(C(=O)O)N1 Amb18645533 [0,1,0,1,0,0|1,0,0]=3 6557 B10R1.113 CC1CSCC(C(=O)O)N1 Amb33456372 [0,1,0,1,0,0|1,0,0]=3 6558 B10R1.113 CC1CSC[C@@H](C(=O)O)N1 Amb27223064 [0,1,0,1,0,0|1,0,0]=3 6559 B10R1.113 CC1NC(C(=O)O)CCS1 Amb18278331 [0,1,0,1,0,0|0,0,0]=2 6560 B10R1.113 CN1CCCC(C(=O)O)C1 Amb2689660 [0,1,0,1,0,0|2,0,0]=4 6561 B10R1.113 CN1CCCC(C(=O)O)C1 Amb9238836 [0,1,0,1,0,0|2,0,0]=4 6562 B10R1.113 CN1CCC[C@@H](C(=O)O)C1 Amb22751960 [0,1,0,1,0,0|2,0,0]=4 6563 B10R1.113 CN1CCC[C@H](C(=O)O)C1 Amb28428437 [0,1,0,1,0,0|2,0,0]=4 6564 B10R1.113 CN1CCNC(C(=O)O)C1 Amb10602764 [0,1,0,1,0,0|2,0,0]=4 6565 B10R1.113 CN1CCNC(C(=O)O)C1 Amb22587697 [0,1,0,1,0,0|2,0,0]=4 6566 B10R1.113 CN1CCNC(C(=O)O)C1 Amb22754371 [0,1,0,1,0,0|2,0,0]=4 6567 B10R1.113 CN1CCOC(C(=O)O)C1 Amb18946166 [0,1,0,1,0,0|2,0,0]=4 6568 B10R1.113 CN1CCOC(C(=O)O)C1 Amb19514725 [0,1,0,1,0,0|2,0,0]=4 6569 B10R1.113 CN1CCSC(C(=O)O)C1 Amb35603313 [0,1,0,1,0,0|2,0,0]=4 6570 B10R1.113 C[C@@H]1CCC[C@H](C(=O)O)N1 Amb25168905 [0,1,0,1,0,0|1,0,0]=3 6571 B10R1.113 C[C@@H]1CCC[C@H](C(=O)O)N1 Amb32666562 [0,1,0,1,0,0|1,0,0]=3 6572 B10R1.113 C[C@@H]1CCN[C@@H](C(=O)O)C1 Amb8393477 [0,1,0,1,0,0|1,0,0]=3 6573 B10R1.113 C[C@@H]1CNC[C@@H](C(=O)O)C1 Amb28198256 [0,1,0,1,0,0|2,0,0]=4 6574 B10R1.113 C[C@@H]1CNC[C@@H](C(=O)O)O1 Amb33804088 [0,1,0,1,0,0|2,0,0]=4 6575 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)C1 Amb28186632 [0,1,0,1,0,0|2,0,0]=4 6576 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)C1 Amb35746974 [0,1,0,1,0,0|2,0,0]=4 6577 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)O1 Amb25378882 [0,1,0,1,0,0|2,0,0]=4 6578 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)O1 Amb32664812 [0,1,0,1,0,0|2,0,0]=4 6579 B10R1.113 C[C@@H]1COC[C@H](C(=O)O)N1 Amb25102766 [0,1,0,1,0,0|1,0,0]=3 6580 B10R1.113 C[C@@H]1COC[C@H](C(=O)O)N1 Amb32796271 [0,1,0,1,0,0|1,0,0]=3 6581 B10R1.113 C[C@@H]1C[C@H](C(=O)O)CCN1 Amb31147397 [0,1,0,1,0,0|2,0,0]=4 6582 B10R1.113 C[C@@H]1C[C@H](C(=O)O)CCN1 Amb32670817 [0,1,0,1,0,0|2,0,0]=4 6583 B10R1.113 C[C@@H]1C[C@H](C(=O)O)NCO1 Amb27618567 [0,1,0,1,0,0|0,1,0]=3 6584 B10R1.113 C[C@@H]1C[C@H](C(=O)O)OCO1 Amb28428440 [0,1,0,1,0,0|1,1,0]=4 6585 B10R1.113 C[C@H]1CCC[C@@H](C(=O)O)C1 Amb25919595 [0,1,0,1,0,0|2,0,0]=4 6586 B10R1.113 C[C@H]1CCC[C@@H](C(=O)O)N1 Amb28145011 [0,1,0,1,0,0|1,0,0]=3 6587 B10R1.113 C[C@H]1CCC[C@@H](C(=O)O)N1 Amb35746778 [0,1,0,1,0,0|1,0,0]=3 6588 B10R1.113 C[C@H]1CCN[C@H](C(=O)O)C1 Amb22744764 [0,1,0,1,0,0|1,0,0]=3 6589 B10R1.113 C[C@H]1CCN[C@H](C(=O)O)C1 Amb33330844 [0,1,0,1,0,0|1,0,0]=3 6590 B10R1.113 C[C@H]1CCOC(C(=O)O)C1 Amb26057818 [0,1,0,1,0,0|2,0,0]=4 6591 B10R1.113 C[C@H]1CCO[C@@H](C(=O)O)O1 Amb27815067 [0,1,0,1,0,0|2,0,0]=4 6592 B10R1.113 C[C@H]1CCO[C@H](C(=O)O)C1 Amb26565299 [0,1,0,1,0,0|2,0,0]=4 6593 B10R1.113 C[C@H]1CNC[C@@H](C(=O)O)C1 Amb26968513 [0,1,0,1,0,0|2,0,0]=4 6594 B10R1.113 C[C@H]1COC[C@@H](C(=O)O)N1 Amb26528283 [0,1,0,1,0,0|1,0,0]=3 6595 B10R1.113 C[C@H]1COC[C@@H](C(=O)O)N1 Amb35746779 [0,1,0,1,0,0|1,0,0]=3 6596 B10R1.113 C[C@H]1COC[C@@H](C(N)=O)N1 Amb27867896 [0,1,0,1,0,0|2,0,0]=4 6597 B10R1.113 C[C@H]1C[C@@H](C(=O)O)CCN1 Amb26405288 [0,1,0,1,0,0|2,0,0]=4 6598 B10R1.113 C[C@H]1C[C@@H](C(=O)O)CCN1 Amb33362296 [0,1,0,1,0,0|2,0,0]=4 6599 B10R1.113 C[C@H]1OCC[C@@H](C(=O)O)O1 Amb26918498 [0,1,0,1,0,0|1,1,0]=4 6600 B10R1.113 N=C1NCC[C@H](C(=O)O)N1 Amb27203442 [0,1,0,1,0,0|1,0,1]=4 6601 B10R1.113 NC1=NC(C(=O)O)CCS1 Amb25756997 [0,1,0,1,0,0|0,0,2]=4 6602 B10R1.113 NC1=NCCC(C(=O)O)N1 Amb27202937 [0,1,0,1,0,0|1,0,1]=4 6603 B10R1.113 NC1CCCC(C(=O)O)C1 Amb32664151 [0,1,0,1,0,0|2,0,0]=4 6604 B10R1.113 NC1CCCC(C(=O)O)C1 Amb33545486 [0,1,0,1,0,0|2,0,0]=4 6605 B10R1.113 NC1CCOC(C(=O)O)C1 Amb26917330 [0,1,0,1,0,0|2,0,0]=4 6606 B10R1.113 NC1CCOC(C(=O)O)C1 Amb33338762 [0,1,0,1,0,0|2,0,0]=4 6607 B10R1.113 N[C@@H]1CCC[C@@H](C(=O)O)C1 Amb10873166 [0,1,0,1,0,0|2,0,0]=4 6608 B10R1.113 N[C@@H]1CCC[C@@H](C(=O)O)C1 Amb25989341 [0,1,0,1,0,0|2,0,0]=4 6609 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 Amb20241308 [0,1,0,1,0,0|2,0,0]=4 6610 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 Amb32643943 [0,1,0,1,0,0|2,0,0]=4 6611 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 Amb20241307 [0,1,0,1,0,0|2,0,0]=4 6612 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 Amb23439976 [0,1,0,1,0,0|2,0,0]=4 6613 B10R1.113 N[C@H]1CCC[C@H](C(=O)O)C1 Amb22746829 [0,1,0,1,0,0|2,0,0]=4 6614 B10R1.113 N[C@H]1CCC[C@H](C(=O)O)C1 Amb23439848 [0,1,0,1,0,0|2,0,0]=4 6615 B10R1.113 N[C@H]1CCO[C@H](C(=O)O)C1 Amb32992741 [0,1,0,1,0,0|2,0,0]=4 6616 B10R1.113 O=C(O)C1CC(Cl)CNN1 Amb27837992 [0,1,0,1,0,0|2,0,0]=4 6617 B10R1.113 O=C(O)C1CC(F)CCN1 Amb24423965 [0,1,0,1,0,0|1,0,0]=3 6618 B10R1.113 O=C(O)C1CC(O)CCN1 Amb24117443 [0,1,0,1,0,0|1,0,0]=3 6619 B10R1.113 O=C(O)C1CC(O)CCO1 Amb28246597 [0,1,0,1,0,0|2,0,0]=4 6620 B10R1.113 O=C(O)C1CCCC(F)C1 Amb26004039 [0,1,0,1,0,0|2,0,0]=4 6621 B10R1.113 O=C(O)C1CCCC(O)C1 Amb33544783 [0,1,0,1,0,0|2,0,0]=4 6622 B10R1.113 O=C(O)C1CCCC(S)C1 Amb32788453 [0,1,0,1,0,0|2,0,0]=4 6623 B10R1.113 O=C(O)C1CS(=O)CCN1 Amb26024462 [0,1,0,1,0,0|2,0,0]=4 6624 B10R1.113 O=C(O)C1CS(=O)CCN1 Amb33038317 [0,1,0,1,0,0|2,0,0]=4 6625 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](O)C1 Amb22899464 [0,1,0,1,0,0|2,0,0]=4 6626 B10R1.113 O=C(O)[C@@H]1CCC[C@H](Br)C1 Amb28053594 [0,1,0,1,0,0|2,0,0]=4 6627 B10R1.113 O=C(O)[C@@H]1CCC[C@H](O)C1 Amb28059041 [0,1,0,1,0,0|2,0,0]=4 6628 B10R1.113 O=C(O)[C@@H]1CS(=O)CCN1 Amb27444621 [0,1,0,1,0,0|2,0,0]=4 6629 B10R1.113 O=C(O)[C@@H]1C[C@@H](O)CCN1 Amb22388540 [0,1,0,1,0,0|1,0,0]=3 6630 B10R1.113 O=C(O)[C@@H]1C[C@H](F)CCN1 Amb27786906 [0,1,0,1,0,0|1,0,0]=3 6631 B10R1.113 O=C(O)[C@@H]1C[C@H](O)CCN1 Amb22386828 [0,1,0,1,0,0|1,0,0]=3 6632 B10R1.113 O=C(O)[C@@H]1C[C@H](O)CNN1 Amb25949203 [0,1,0,1,0,0|2,0,0]=4 6633 B10R1.113 O=C(O)[C@H]1CCC[C@@H](Cl)C1 Amb28436868 [0,1,0,1,0,0|2,0,0]=4 6634 B10R1.113 O=C(O)[C@H]1CCC[C@@H](O)C1 Amb22899465 [0,1,0,1,0,0|2,0,0]=4 6635 B10R1.113 O=C(O)[C@H]1CCC[C@H](Cl)C1 Amb28385610 [0,1,0,1,0,0|2,0,0]=4 6636 B10R1.113 O=C(O)[C@H]1C[C@@H](O)CCN1 Amb20241913 [0,1,0,1,0,0|1,0,0]=3 6637 B10R1.113 O=C(O)[C@H]1C[C@H](O)CCN1 Amb22748263 [0,1,0,1,0,0|1,0,0]=3 6638 B10R1.113 O=C(O)[C@H]1C[C@H](O)CCN1 Amb30982057 [0,1,0,1,0,0|1,0,0]=3 6639 B10R1.113 O=C(O)[C@H]1C[C@H](O)CNN1 Amb27450594 [0,1,0,1,0,0|2,0,0]=4 6640 B10R1.113 O=C1CCCC(C(=O)O)N1 Amb2697230 [0,1,0,1,0,0|1,0,1]=4 6641 B10R1.113 O=C1CCC[C@@H](C(=O)O)N1 Amb10576327 [0,1,0,1,0,0|1,0,1]=4 6642 B10R1.113 O=C1CCC[C@H](C(=O)O)N1 Amb8631220 [0,1,0,1,0,0|1,0,1]=4 6643 B10R1.113 O=C1CCNC(C(=O)O)C1 Amb13889088 [0,1,0,1,0,0|1,0,1]=4 6644 B10R1.113 O=C1CCNC(C(=O)O)C1 Amb13889089 [0,1,0,1,0,0|1,0,1]=4 6645 B10R1.113 O=C1CCN[C@@H](C(=O)O)C1 Amb27977165 [0,1,0,1,0,0|1,0,1]=4 6646 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 Amb13889084 [0,1,0,1,0,0|1,0,1]=4 6647 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 Amb2699956 [0,1,0,1,0,0|1,0,1]=4 6648 B10R1.113 O=C1CNC[C@H](C(=O)O)N1 Amb27398104 [0,1,0,1,0,0|2,0,0]=4 6649 B10R1.113 O=C1COCC(C(=O)O)N1 Amb18862478 [0,1,0,1,0,0|2,0,0]=4 6650 B10R1.113 O=C1COC[C@@H](C(=O)O)N1 Amb27164013 [0,1,0,1,0,0|2,0,0]=4 6651 B10R1.113 O=C1CSCC(C(=O)O)N1 Amb2693036 [0,1,0,1,0,0|2,0,0]=4 6652 B10R1.113 O=C1CSC[C@@H](C(=O)O)N1 Amb26516534 [0,1,0,1,0,0|2,0,0]=4 6653 B10R1.113 O=C1CSC[C@H](C(=O)O)N1 Amb27667984 [0,1,0,1,0,0|2,0,0]=4 6654 B10R1.113 O=C1NC(C(=O)O)CCO1 Amb28121893 [0,1,0,1,0,0|0,1,1]=4 6655 B10R1.113 O=C1NC(C(=O)O)CCS1 Amb28342373 [0,1,0,1,0,0|0,0,1]=3 6656 B10R1.116 CC1CCC1C(N)C(=O)O Amb35666629 [0,1,0,1,0,0|1,0,0]=3 6657 B10R1.116 CC1CCN1C(C)C(=O)O Amb27785364 [0,1,0,1,0,0|2,0,0]=4 6658 B10R1.116 NC(=O)C(N)C1CCC1O Amb33036780 [0,1,0,1,0,0|2,0,0]=4 6659 B10R1.116 NC(C(=O)O)C1CCC1O Amb33127592 [0,1,0,1,0,0|1,0,0]=3 6660 B10R1.116 N[C@@H](C(=O)O)C1CCC1O Amb33065605 [0,1,0,1,0,0|1,0,0]=3 6661 B10R1.116 N[C@H](C(=O)O)C1CCC1O Amb32788587 [0,1,0,1,0,0|1,0,0]=3 6662 B10R1.203 CC(CC1(C)CC1)C(=O)O Amb24426872 [0,1,0,1,0,0|2,0,0]=4 6663 B10R1.203 CC1(CC(N)C(=O)O)CC1 Amb24120612 [0,1,0,1,0,0|1,0,0]=3 6664 B10R1.203 CC1(CC(N)C(=O)O)N=N1 Amb25076040 [0,1,0,1,0,0|2,0,0]=4 6665 B10R1.203 CC1(CC(N)C(=O)O)N=N1 Amb32675324 [0,1,0,1,0,0|2,0,0]=4 6666 B10R1.203 CC1(CC(O)C(=O)O)CC1 Amb28428408 [0,1,0,1,0,0|2,0,0]=4 6667 B10R1.203 CC1(C[C@@H](N)C(=O)O)CC1 Amb32640164 [0,1,0,1,0,0|1,0,0]=3 6668 B10R1.203 CC1(C[C@@H](N)C(=O)O)N=N1 Amb26515641 [0,1,0,1,0,0|2,0,0]=4 6669 B10R1.203 CC1(C[C@@H](O)C(=O)O)CC1 Amb28050040 [0,1,0,1,0,0|2,0,0]=4 6670 B10R1.203 C[C@@H](CC1(C)CC1)C(=O)O Amb33749079 [0,1,0,1,0,0|2,0,0]=4 6671 B10R1.203 C[C@H](CC1(C)CC1)C(=O)O Amb33749389 [0,1,0,1,0,0|2,0,0]=4 6672 B10R1.204 CC(CC1CCC1)C(=O)O Amb27812387 [0,1,0,1,0,0|2,0,0]=4 6673 B10R1.204 CC(CC1CCO1)C(=O)O Amb33727407 [0,1,0,1,0,0|1,1,0]=4 6674 B10R1.204 CC(CN1CCC1)C(=O)O Amb28049704 [0,1,0,1,0,0|2,0,0]=4 6675 B10R1.204 CC(NC1CCC1)C(=O)O Amb18989323 [0,1,0,1,0,0|2,0,0]=4 6676 B10R1.204 CC(NC1COC1)C(=O)O Amb24397480 [0,1,0,1,0,0|1,1,0]=4 6677 B10R1.204 CC(NC1CSC1)C(N)=O Amb27641942 [0,1,0,1,0,0|2,0,0]=4 6678 B10R1.204 CC(OC1CCC1)C(=O)O Amb18977476 [0,1,0,1,0,0|2,0,0]=4 6679 B10R1.204 CC(OC1CNC1)C(=O)O Amb27207086 [0,1,0,1,0,0|2,0,0]=4 6680 B10R1.204 CC(OC1COC1)C(=O)O Amb24480855 [0,1,0,1,0,0|1,1,0]=4 6681 B10R1.204 C[C@@H](CC1CCC1)C(=O)O Amb33749526 [0,1,0,1,0,0|2,0,0]=4 6682 B10R1.204 C[C@@H](CC1CCO1)C(=O)O Amb33728832 [0,1,0,1,0,0|1,1,0]=4 6683 B10R1.204 C[C@@H](NC1CSC1)C(N)=O Amb28316048 [0,1,0,1,0,0|2,0,0]=4 6684 B10R1.204 C[C@H](CC1CCC1)C(=O)O Amb33738108 [0,1,0,1,0,0|2,0,0]=4 6685 B10R1.204 C[C@H](CC1CCO1)C(=O)O Amb33729204 [0,1,0,1,0,0|1,1,0]=4 6686 B10R1.204 C[C@H](NC1COC1)C(=O)O Amb28140810 [0,1,0,1,0,0|1,1,0]=4 6687 B10R1.204 C[C@H](OC1COC1)C(=O)O Amb27781129 [0,1,0,1,0,0|1,1,0]=4 6688 B10R1.204 NC(=O)C(N)CC1CCC1 Amb26618159 [0,1,0,1,0,0|2,0,0]=4 6689 B10R1.204 NC(=O)C(N)CC1CNC1 Amb27959203 [0,1,0,1,0,0|2,0,0]=4 6690 B10R1.204 NC(CC1=CCC1)C(=O)O Amb28239360 [0,1,0,1,0,0|1,0,1]=4 6691 B10R1.204 NC(CC1CCC1)C(=O)O Amb21963935 [0,1,0,1,0,0|1,0,0]=3 6692 B10R1.204 NC(CC1CCC1)C(=O)O Amb28896003 [0,1,0,1,0,0|1,0,0]=3 6693 B10R1.204 NC(CN1CCC1)C(=O)O Amb27402247 [0,1,0,1,0,0|1,0,0]=3 6694 B10R1.204 N[C@@H](CC1CCC1)C(=O)O Amb22641837 [0,1,0,1,0,0|1,0,0]=3 6695 B10R1.204 N[C@H](CC1CCC1)C(=O)O Amb19889667 [0,1,0,1,0,0|1,0,0]=3 6696 B10R1.204 O=C(O)C(F)CC1CCC1 Amb26324472 [0,1,0,1,0,0|2,0,0]=4 6697 B10R1.204 O=C(O)C(F)CN1CCC1 Amb27209852 [0,1,0,1,0,0|2,0,0]=4 6698 B10R1.204 O=C(O)C(F)OC1CCC1 Amb28410162 [0,1,0,1,0,0|2,0,0]=4 6699 B10R1.204 O=C(O)C(F)SC1COC1 Amb28063098 [0,1,0,1,0,0|1,1,0]=4 6700 B10R1.204 O=C(O)C(O)CC1CCC1 Amb25701846 [0,1,0,1,0,0|2,0,0]=4 6701 B10R1.204 O=C(O)C(O)CN1CCC1 Amb28049703 [0,1,0,1,0,0|2,0,0]=4 6702 B10R1.204 O=C(O)[C@@H](O)CC1CCC1 Amb27655656 [0,1,0,1,0,0|2,0,0]=4 6703 B10R1.204 O=C(O)[C@H](O)CC1CCC1 Amb27216981 [0,1,0,1,0,0|2,0,0]=4 6704 B10R1.235 CCC1(C)CC(C(=O)O)C1 Amb24687077 [0,1,0,1,0,0|2,0,0]=4 6705 B10R1.235 CCC1(F)CC(C(=O)O)C1 Amb31204710 [0,1,0,1,0,0|2,0,0]=4 6706 B10R1.235 CCC1(O)CC(C(=O)O)C1 Amb27455773 [0,1,0,1,0,0|2,0,0]=4 6707 B10R1.235 CC[C@]1(F)C[C@@H](C(=O)O)C1 Amb34146810 [0,1,0,1,0,0|2,0,0]=4 6708 B10R1.235 CC[C@]1(F)C[C@H](C(=O)O)C1 Amb34161784 [0,1,0,1,0,0|2,0,0]=4 6709 B10R1.244 CC1(CBr)CC(N)C(=O)O1 Amb27238585 [0,1,0,1,0,0|2,0,0]=4 6710 B10R1.244 C[C@]1(CO)C[C@@H](N)C(=O)O1 Amb27202516 [0,1,0,1,0,0|2,0,0]=4 6711 B10R1.277 CC1CCCC(N)C(=O)N1 Amb32455738 [0,1,0,1,0,0|2,0,0]=4 6712 B10R1.331 CC1CC(N)(C(=O)O)C1C Amb27464943 [0,1,0,1,0,0|1,0,0]=3 6713 B10R1.331 CC1CC(O)(C(=O)O)C1C Amb27602890 [0,1,0,1,0,0|2,0,0]=4 6714 B10R1.408 CCC(C)C1CC1C(=O)O Amb25887507 [0,1,0,1,0,0|2,0,0]=4 6715 B10R1.408 CCC(C)[C@@H]1C[C@H]1C(=O)O Amb33373888 [0,1,0,1,0,0|2,0,0]=4 6716 B10R1.408 COC(C)C1CC1C(=O)O Amb27212390 [0,1,0,1,0,0|1,1,0]=4 6717 B10R1.484 CCC1(C)CC1(N)C(=O)O Amb27845106 [0,1,0,1,0,0|1,0,0]=3 6718 B10R1.490 COC1CC(N)(C(=O)O)C1 Amb25054956 [0,1,0,1,0,0|0,1,0]=3 6719 B10R1.490 COC1CC(N)(C(=O)O)C1 Amb31217506 [0,1,0,1,0,0|0,1,0]=3 6720 B10R1.490 COC1CC(N)(C(N)=O)C1 Amb27839491 [0,1,0,1,0,0|1,1,0]=4 6721 B10R1.490 CO[C@H]1C[C@](N)(C(=O)O)C1 Amb33328630 [0,1,0,1,0,0|0,1,0]=3 6722 B10R1.490 CO[C@H]1C[C@](N)(C(=O)O)C1 Amb33328680 [0,1,0,1,0,0|0,1,0]=3 6723 B10R1.490 NC1(C(=O)O)CC(CF)C1 Amb26012303 [0,1,0,1,0,0|2,0,0]=4 6724 B10R1.490 NC1(C(=O)O)CC(CO)C1 Amb25223041 [0,1,0,1,0,0|2,0,0]=4 6725 B10R1.490 NCC1CC(N)(C(=O)O)C1 Amb28384594 [0,1,0,1,0,0|2,0,0]=4 6726 B10R1.490 NC[C@H]1C[C@@](N)(C(=O)O)C1 Amb27599840 [0,1,0,1,0,0|2,0,0]=4 6727 B10R1.490 N[C@]1(C(=O)O)C[C@@H](CF)C1 Amb24446551 [0,1,0,1,0,0|2,0,0]=4 6728 B10R1.490 N[C@]1(C(=O)O)C[C@@H](CO)C1 Amb25292195 [0,1,0,1,0,0|2,0,0]=4 6729 B10R1.490 N[C@]1(C(=O)O)C[C@H](CF)C1 Amb28046816 [0,1,0,1,0,0|2,0,0]=4 6730 B10R1.490 N[C@]1(C(=O)O)C[C@H](CO)C1 Amb28193273 [0,1,0,1,0,0|2,0,0]=4 6731 B10R1.490 N[C@]1(C(=O)O)C[C@H](CO)C1 Amb34912855 [0,1,0,1,0,0|2,0,0]=4 6732 B10R1.93 CCCC1CC(C(=O)O)C1 Amb23537724 [0,1,0,1,0,0|2,0,0]=4 6733 B10R1.93 CCC[C@H]1C[C@@H](C(=O)O)C1 Amb28423037 [0,1,0,1,0,0|2,0,0]=4 6734 B10R1.93 CCNC1CC(C(=O)O)C1 Amb20622657 [0,1,0,1,0,0|2,0,0]=4 6735 B10R1.93 CCN[C@H]1C[C@@H](C(=O)O)C1 Amb32671515 [0,1,0,1,0,0|2,0,0]=4 6736 B10R1.93 CCOC1CC(C(=O)O)C1 Amb23448945 [0,1,0,1,0,0|1,1,0]=4 6737 B10R1.93 COCC1CC(C(=O)O)C1 Amb25835213 [0,1,0,1,0,0|1,1,0]=4 6738 B10R1.93 COC[C@H]1C[C@@H](C(=O)O)C1 Amb28280247 [0,1,0,1,0,0|1,1,0]=4 6739 B10R1.131 CC1CC(CCBr)OC1=O Amb27619697 [0,1,0,1,0,0|2,0,0]=4 6740 B10R1.131 CC1CC(CCN)OC1=O Amb27816570 [0,1,0,1,0,0|2,0,0]=4 6741 B10R1.131 CCCC1OC(=O)C(C)O1 Amb4034550 [0,1,0,1,0,0|2,0,0]=4 6742 B10R1.131 CCCC1OC(=O)C(F)S1 Amb27838868 [0,1,0,1,0,0|2,0,0]=4 6743 B10R1.131 CCC[C@@H]1C[C@H](O)C(=O)O1 Amb27448038 [0,1,0,1,0,0|2,0,0]=4 6744 B10R1.131 CSCC1CN(C)C(=O)O1 Amb28253336 [0,1,0,1,0,0|2,0,0]=4 6745 B10R1.131 CSCC1CN(N)C(=O)O1 Amb17594038 [0,1,0,1,0,0|1,0,0]=3 6746 B10R1.131 N[C@H]1C[C@@H](CCCl)OC1=O Amb27629568 [0,1,0,1,0,0|1,0,0]=3 6747 B10R1.131 N[C@H]1C[C@@H](CCO)OC1=O Amb27629757 [0,1,0,1,0,0|1,0,0]=3 6748 B10R1.363 CC(=O)C1(C)CCCCN1 Amb27173872 [0,1,0,1,0,0|2,0,0]=4 6749 B10R1.363 CC(=O)C1(N)CCCCC1 Amb1091885 [0,1,0,1,0,0|2,0,0]=4 6750 B10R1.363 CC(=O)C1(N)CCCCC1 Amb22283957 [0,1,0,1,0,0|2,0,0]=4 6751 B10R1.363 CC(=O)C1(N)CCOCC1 Amb26381759 [0,1,0,1,0,0|1,1,0]=4 6752 B10R1.363 CC1(C(=O)O)CC=CCC1 Amb18643550 [0,1,0,1,0,0|2,0,0]=4 6753 B10R1.363 CC1(C(=O)O)CCCCC1 Amb2388313 [0,1,0,1,0,0|2,0,0]=4 6754 B10R1.363 CC1(C(=O)O)CCCCN1 Amb21959568 [0,1,0,1,0,0|1,0,0]=3 6755 B10R1.363 CC1(C(=O)O)CCCCN1 Amb2694988 [0,1,0,1,0,0|1,0,0]=3 6756 B10R1.363 CC1(C(=O)O)CCCCO1 Amb33542722 [0,1,0,1,0,0|2,0,0]=4 6757 B10R1.363 CC1(C(=O)O)CCCCS1 Amb28323348 [0,1,0,1,0,0|2,0,0]=4 6758 B10R1.363 CC1(C(=O)O)CCCNC1 Amb17622036 [0,1,0,1,0,0|2,0,0]=4 6759 B10R1.363 CC1(C(=O)O)CCCNC1 Amb19148847 [0,1,0,1,0,0|2,0,0]=4 6760 B10R1.363 CC1(C(=O)O)CCCOC1 Amb33532255 [0,1,0,1,0,0|1,1,0]=4 6761 B10R1.363 CC1(C(=O)O)CCNCC1 Amb15701613 [0,1,0,1,0,0|2,0,0]=4 6762 B10R1.363 CC1(C(=O)O)CCNCC1 Amb33549108 [0,1,0,1,0,0|2,0,0]=4 6763 B10R1.363 CC1(C(=O)O)CCOCC1 Amb10843981 [0,1,0,1,0,0|1,1,0]=4 6764 B10R1.363 CC1(C(=O)O)CCOCO1 Amb24648903 [0,1,0,1,0,0|1,1,0]=4 6765 B10R1.363 CC1(C(=O)O)CCSCC1 Amb10843982 [0,1,0,1,0,0|1,0,0]=3 6766 B10R1.363 CC1(C(=O)O)CNCCN1 Amb27830098 [0,1,0,1,0,0|2,0,0]=4 6767 B10R1.363 CC1(C(=O)O)CNCCO1 Amb32656211 [0,1,0,1,0,0|2,0,0]=4 6768 B10R1.363 CC1(C(=O)O)CNCCO1 Amb32988610 [0,1,0,1,0,0|2,0,0]=4 6769 B10R1.363 CC1(C(=O)O)COCCN1 Amb26021643 [0,1,0,1,0,0|1,1,0]=4 6770 B10R1.363 CC1(C(=O)O)COCCN1 Amb31291275 [0,1,0,1,0,0|1,1,0]=4 6771 B10R1.363 CC1(C(=O)O)COCCO1 Amb26485107 [0,1,0,1,0,0|1,1,0]=4 6772 B10R1.363 CC1(C(=O)O)COCOC1 Amb6336131 [0,1,0,1,0,0|1,1,0]=4 6773 B10R1.363 CC1(C(N)=O)CCCCN1 Amb26003815 [0,1,0,1,0,0|2,0,0]=4 6774 B10R1.363 CC1(C(N)=O)CCCCN1 Amb28896018 [0,1,0,1,0,0|2,0,0]=4 6775 B10R1.363 C[C@@]1(C(=O)O)CCCCN1 Amb22262937 [0,1,0,1,0,0|1,0,0]=3 6776 B10R1.363 C[C@@]1(C(=O)O)CCCNC1 Amb30594012 [0,1,0,1,0,0|2,0,0]=4 6777 B10R1.363 C[C@@]1(C(N)=O)CCCCN1 Amb27168600 [0,1,0,1,0,0|2,0,0]=4 6778 B10R1.363 C[C@]1(C(=O)O)CCCCN1 Amb22262934 [0,1,0,1,0,0|1,0,0]=3 6779 B10R1.363 C[C@]1(C(=O)O)CCCCN1 Amb33715562 [0,1,0,1,0,0|1,0,0]=3 6780 B10R1.363 C[C@]1(C(=O)O)CCCCO1 Amb24659158 [0,1,0,1,0,0|2,0,0]=4 6781 B10R1.363 C[C@]1(C(=O)O)COCCN1 Amb27857000 [0,1,0,1,0,0|1,1,0]=4 6782 B10R1.363 C[C@]1(C(N)=O)CCCCN1 Amb25147419 [0,1,0,1,0,0|2,0,0]=4 6783 B10R1.363 NC(=O)C1(N)CCCCC1 Amb6259495 [0,1,0,1,0,0|2,0,0]=4 6784 B10R1.363 NC(=O)C1(N)CCCCC1 Amb9178008 [0,1,0,1,0,0|2,0,0]=4 6785 B10R1.363 NC(=O)C1(N)CCCNC1 Amb26038224 [0,1,0,1,0,0|2,0,0]=4 6786 B10R1.363 NC(=O)C1(N)CCCNC1 Amb33328788 [0,1,0,1,0,0|2,0,0]=4 6787 B10R1.363 NC(=O)C1(N)CCCOC1 Amb22059476 [0,1,0,1,0,0|1,1,0]=4 6788 B10R1.363 NC(=O)C1(N)CCCOC1 Amb32693416 [0,1,0,1,0,0|1,1,0]=4 6789 B10R1.363 NC(=O)C1(N)CCNCC1 Amb18278418 [0,1,0,1,0,0|2,0,0]=4 6790 B10R1.363 NC(=O)C1(N)CCNCC1 Amb33483967 [0,1,0,1,0,0|2,0,0]=4 6791 B10R1.363 NC(=O)C1(N)CCOCC1 Amb18278286 [0,1,0,1,0,0|1,1,0]=4 6792 B10R1.363 NC(=O)C1(N)CCOCC1 Amb32667049 [0,1,0,1,0,0|1,1,0]=4 6793 B10R1.363 NC(=O)C1(N)CCSCC1 Amb18278809 [0,1,0,1,0,0|1,0,0]=3 6794 B10R1.363 NC(=O)C1(O)CCSCC1 Amb18800545 [0,1,0,1,0,0|2,0,0]=4 6795 B10R1.363 NC1(C(=O)O)CC=CCC1 Amb27816089 [0,1,0,1,0,0|1,0,0]=3 6796 B10R1.363 NC1(C(=O)O)CCCCC1 Amb1153058 [0,1,0,1,0,0|1,0,0]=3 6797 B10R1.363 NC1(C(=O)O)CCCCC1 Amb2720183 [0,1,0,1,0,0|1,0,0]=3 6798 B10R1.363 NC1(C(=O)O)CCCNC1 Amb20242317 [0,1,0,1,0,0|1,0,0]=3 6799 B10R1.363 NC1(C(=O)O)CCCNC1 Amb22756826 [0,1,0,1,0,0|1,0,0]=3 6800 B10R1.363 NC1(C(=O)O)CCCNC1 Amb28555533 [0,1,0,1,0,0|1,0,0]=3 6801 B10R1.363 NC1(C(=O)O)CCCOC1 Amb19958927 [0,1,0,1,0,0|0,1,0]=3 6802 B10R1.363 NC1(C(=O)O)CCCOC1 Amb22270206 [0,1,0,1,0,0|0,1,0]=3 6803 B10R1.363 NC1(C(=O)O)CCCSC1 Amb18948549 [0,1,0,1,0,0|0,0,0]=2 6804 B10R1.363 NC1(C(=O)O)CCNCC1 Amb16230706 [0,1,0,1,0,0|1,0,0]=3 6805 B10R1.363 NC1(C(=O)O)CCNCC1 Amb2695575 [0,1,0,1,0,0|1,0,0]=3 6806 B10R1.363 NC1(C(=O)O)CCNCC1 Amb2698793 [0,1,0,1,0,0|1,0,0]=3 6807 B10R1.363 NC1(C(=O)O)CCNCC1 Amb33549791 [0,1,0,1,0,0|1,0,0]=3 6808 B10R1.363 NC1(C(=O)O)CCOCC1 Amb2699136 [0,1,0,1,0,0|0,1,0]=3 6809 B10R1.363 NC1(C(=O)O)CCOCC1 Amb2699208 [0,1,0,1,0,0|0,1,0]=3 6810 B10R1.363 NC1(C(=O)O)CCSCC1 Amb17943831 [0,1,0,1,0,0|0,0,0]=2 6811 B10R1.363 O=C(Cl)C1(Cl)CCSCC1 Amb33128001 [0,1,0,1,0,0|2,0,0]=4 6812 B10R1.363 O=C(O)C1(Br)CCCCC1 Amb18130989 [0,1,0,1,0,0|2,0,0]=4 6813 B10R1.363 O=C(O)C1(Br)CCOCC1 Amb25828678 [0,1,0,1,0,0|1,1,0]=4 6814 B10R1.363 O=C(O)C1(Cl)CCCCC1 Amb8427953 [0,1,0,1,0,0|2,0,0]=4 6815 B10R1.363 O=C(O)C1(Cl)CCCOC1 Amb33127968 [0,1,0,1,0,0|1,1,0]=4 6816 B10R1.363 O=C(O)C1(Cl)CCOCC1 Amb18646184 [0,1,0,1,0,0|1,1,0]=4 6817 B10R1.363 O=C(O)C1(Cl)CCSCC1 Amb33127953 [0,1,0,1,0,0|1,0,0]=3 6818 B10R1.363 O=C(O)C1(F)CCCCC1 Amb10603425 [0,1,0,1,0,0|2,0,0]=4 6819 B10R1.363 O=C(O)C1(F)CCCNC1 Amb24062229 [0,1,0,1,0,0|2,0,0]=4 6820 B10R1.363 O=C(O)C1(F)CCCOC1 Amb25178890 [0,1,0,1,0,0|1,1,0]=4 6821 B10R1.363 O=C(O)C1(F)CCCSC1 Amb27441996 [0,1,0,1,0,0|1,0,0]=3 6822 B10R1.363 O=C(O)C1(F)CCNCC1 Amb17739849 [0,1,0,1,0,0|2,0,0]=4 6823 B10R1.363 O=C(O)C1(F)CCNCC1 Amb19374711 [0,1,0,1,0,0|2,0,0]=4 6824 B10R1.363 O=C(O)C1(F)CCOCC1 Amb16233480 [0,1,0,1,0,0|1,1,0]=4 6825 B10R1.363 O=C(O)C1(O)CCCCC1 Amb1159102 [0,1,0,1,0,0|2,0,0]=4 6826 B10R1.363 O=C(O)C1(O)CCCNC1 Amb18202374 [0,1,0,1,0,0|2,0,0]=4 6827 B10R1.363 O=C(O)C1(O)CCCNC1 Amb32671229 [0,1,0,1,0,0|2,0,0]=4 6828 B10R1.363 O=C(O)C1(O)CCNCC1 Amb10552861 [0,1,0,1,0,0|2,0,0]=4 6829 B10R1.363 O=C(O)C1(O)CCNCC1 Amb21961528 [0,1,0,1,0,0|2,0,0]=4 6830 B10R1.363 O=C(O)C1(O)CCOCC1 Amb18944710 [0,1,0,1,0,0|1,1,0]=4 6831 B10R1.363 O=C(O)C1(O)CCSCC1 Amb18945166 [0,1,0,1,0,0|1,0,0]=3 6832 B10R1.363 O=C(O)[C@@]1(F)CCCNC1 Amb24502317 [0,1,0,1,0,0|2,0,0]=4 6833 B10R1.363 [NH3+]C1(C(=O)O)CCCCC1 Amb4239236 [0,1,0,1,0,0|1,0,1]=4 6834 B10R1.451 NC1(C(=O)O)CCC1CO Amb27838150 [0,1,0,1,0,0|1,0,0]=3 6835 B10R1.451 N[C@@]1(C(=O)O)CC[C@@H]1CO Amb28456568 [0,1,0,1,0,0|1,0,0]=3 6836 B10R1.451 N[C@@]1(C(=O)O)CC[C@H]1CO Amb28057731 [0,1,0,1,0,0|1,0,0]=3 6837 B10R1.451 N[C@]1(C(=O)O)CC[C@@H]1CO Amb26017390 [0,1,0,1,0,0|1,0,0]=3 6838 B10R1.451 N[C@]1(C(=O)O)CC[C@H]1CO Amb24629045 [0,1,0,1,0,0|1,0,0]=3 6839 B10R1.333 CC1CC1C(C)(C)C(=O)O Amb33144655 [0,1,0,1,0,0|2,0,0]=4 6840 B10R1.333 CC1CC1C(C)(N)C(=O)O Amb27829470 [0,1,0,1,0,0|1,0,0]=3 6841 B10R1.333 CC1CC1C(F)(F)C(=O)O Amb32743273 [0,1,0,1,0,0|2,0,0]=4 6842 B10R1.354 CC(C)(C(=O)O)C1CCC1 Amb27448949 [0,1,0,1,0,0|2,0,0]=4 6843 B10R1.354 CC(C)(C(=O)O)C1CNC1 Amb26946519 [0,1,0,1,0,0|2,0,0]=4 6844 B10R1.354 CC(C)(C(=O)O)C1CNC1 Amb34136014 [0,1,0,1,0,0|2,0,0]=4 6845 B10R1.354 CC(N)(C(=O)O)C1CCC1 Amb2695786 [0,1,0,1,0,0|1,0,0]=3 6846 B10R1.354 CC(N)(C(=O)O)C1CCC1 Amb28555494 [0,1,0,1,0,0|1,0,0]=3 6847 B10R1.354 CC(N)(C(N)=O)C1COC1 Amb27621950 [0,1,0,1,0,0|1,1,0]=4 6848 B10R1.354 CC(O)(C(=O)O)C1CCC1 Amb18202406 [0,1,0,1,0,0|2,0,0]=4 6849 B10R1.354 CC(O)(C(=O)O)C1COC1 Amb35585383 [0,1,0,1,0,0|1,1,0]=4 6850 B10R1.354 O=C(O)C(F)(F)C1CCC1 Amb27622209 [0,1,0,1,0,0|2,0,0]=4 6851 B10R1.354 O=C(O)C(F)(F)C1COC1 Amb27263934 [0,1,0,1,0,0|1,1,0]=4 6852 B10R1.356 CC(C)(CC1CC1)C(=O)O Amb21962125 [0,1,0,1,0,0|2,0,0]=4 6853 B10R1.356 CC(F)(CC1CC1)C(=O)O Amb27481995 [0,1,0,1,0,0|2,0,0]=4 6854 B10R1.356 CC(O)(CC1CC1)C(=O)O Amb27147793 [0,1,0,1,0,0|2,0,0]=4 6855 B10R1.356 O=C(O)C(F)(F)CC1CC1 Amb25703701 [0,1,0,1,0,0|2,0,0]=4 6856 B10R2.61 O=C1CC2CCCC1N2 Amb26475846 [0,0,0,2,0,0|2,0,0]=4 6857 B10R2.61 O=C1CC2CCCC1N2 Amb34156512 [0,0,0,2,0,0|2,0,0]=4 6858 B10R2.61 O=C1NC2CCNC1C2 Amb25104840 [0,0,0,2,0,0|2,0,0]=4 6859 B10R2.61 O=C1N[C@H]2CCN[C@@H]1C2 Amb27655558 [0,0,0,2,0,0|2,0,0]=4 6860 B10R2.61 O=C1OC2CCCC1C2 Amb25888764 [0,0,0,2,0,0|2,0,0]=4 6861 B10R2.61 O=C1OC2CCNC1C2 Amb27792068 [0,0,0,2,0,0|1,0,0]=3 6862 B10R2.61 O=C1O[C@H]2CCC[C@@H]1C2 Amb26948688 [0,0,0,2,0,0|2,0,0]=4 6863 B10R2.61 O=C1O[C@H]2CCC[C@@H]1O2 Amb27434428 [0,0,0,2,0,0|2,0,0]=4 6864 B10R2.178 O=C1CCC2CCC1N2 Amb26052300 [0,0,0,2,0,0|2,0,0]=4 6865 B10R2.178 O=C1CCC2CCC1N2 Amb31307969 [0,0,0,2,0,0|2,0,0]=4 6866 B10R2.178 O=C1CC[C@H]2CC[C@@H]1N2 Amb34913579 [0,0,0,2,0,0|2,0,0]=4 6867 B10R2.178 O=C1NCC2CCC1N2 Amb18642437 [0,0,0,2,0,0|2,0,0]=4 6868 B10R2.178 O=C1NCC2CC[C@@H]1N2 Amb25135365 [0,0,0,2,0,0|2,0,0]=4 6869 B10R2.178 O=C1NCC2CC[C@H]1N2 Amb26943865 [0,0,0,2,0,0|2,0,0]=4 6870 B10R2.178 O=C1NC[C@@H]2CC[C@H]1N2 Amb24586924 [0,0,0,2,0,0|2,0,0]=4 6871 B10R2.178 O=C1NC[C@H]2CC[C@@H]1N2 Amb34913214 [0,0,0,2,0,0|2,0,0]=4 6872 B10R2.62 O=C1CC2CCC1NC2 Amb27220966 [0,0,0,2,0,0|2,0,0]=4 6873 B10R2.62 O=C1OC2CCC1CC2 Amb28146748 [0,0,0,2,0,0|2,0,0]=4 6874 B10R2.62 O=C1O[C@@H]2CC[C@H]1NC2 Amb28072753 [0,0,0,2,0,0|1,0,0]=3 6875 B10R2.344 NC(=O)C12CC1CCN2 Amb27482749 [0,0,0,2,0,0|2,0,0]=4 6876 B10R2.344 O=C(O)C12CC1CCN2 Amb17774958 [0,0,0,2,0,0|1,0,0]=3 6877 B10R2.344 O=C(O)C12CC1CCN2 Amb3226020 [0,0,0,2,0,0|1,0,0]=3 6878 B10R2.344 O=C(O)C12CC1CCO2 Amb28059490 [0,0,0,2,0,0|2,0,0]=4 6879 B10R2.344 O=C(O)C12CCCC1C2 Amb25127064 [0,0,0,2,0,0|2,0,0]=4 6880 B10R2.344 O=C(O)C12CCNC1C2 Amb10610567 [0,0,0,2,0,0|2,0,0]=4 6881 B10R2.344 O=C(O)C12CCNC1C2 Amb25737515 [0,0,0,2,0,0|2,0,0]=4 6882 B10R2.344 O=C(O)C12CNCC1C2 Amb10610568 [0,0,0,2,0,0|2,0,0]=4 6883 B10R2.344 O=C(O)C12CNCC1C2 Amb23439718 [0,0,0,2,0,0|2,0,0]=4 6884 B10R2.344 O=C(O)C12COCC1C2 Amb25968810 [0,0,0,2,0,0|1,1,0]=4 6885 B10R2.344 O=C(O)[C@@]12CC1CCN2 Amb25201805 [0,0,0,2,0,0|1,0,0]=3 6886 B10R2.344 O=C(O)[C@@]12CCCN1N2 Amb27874095 [0,0,0,2,0,0|2,0,0]=4 6887 B10R2.344 O=C(O)[C@@]12CNCC1C2 Amb27768794 [0,0,0,2,0,0|2,0,0]=4 6888 B10R2.344 O=C(O)[C@@]12CNC[C@@H]1C2 Amb31188182 [0,0,0,2,0,0|2,0,0]=4 6889 B10R2.344 O=C(O)[C@@]12CNC[C@@H]1C2 Amb33456195 [0,0,0,2,0,0|2,0,0]=4 6890 B10R2.344 O=C(O)[C@@]12CNC[C@H]1C2 Amb33038828 [0,0,0,2,0,0|2,0,0]=4 6891 B10R2.344 O=C(O)[C@@]12COC[C@@H]1C2 Amb26454501 [0,0,0,2,0,0|1,1,0]=4 6892 B10R2.344 O=C(O)[C@@]12C[C@@H]1CCN2 Amb23440603 [0,0,0,2,0,0|1,0,0]=3 6893 B10R2.344 O=C(O)[C@]12CC1CCN2 Amb17719275 [0,0,0,2,0,0|1,0,0]=3 6894 B10R2.344 O=C(O)[C@]12CC1CCN2 Amb2371887 [0,0,0,2,0,0|1,0,0]=3 6895 B10R2.344 O=C(O)[C@]12CCC[C@H]1C2 Amb28252539 [0,0,0,2,0,0|2,0,0]=4 6896 B10R2.344 O=C(O)[C@]12C[C@H]1CCN2 Amb27778135 [0,0,0,2,0,0|1,0,0]=3 6897 B10R2.344 O=C(O)[C@]12C[C@H]1CCN2 Amb7970105 [0,0,0,2,0,0|1,0,0]=3 6898 B10R2.347 O=C(O)C1CC2CCC21 Amb28121231 [0,0,0,2,0,0|2,0,0]=4 6899 B10R2.351 O=C(O)C1C2CCCC21 Amb9774978 [0,0,0,2,0,0|2,0,0]=4 6900 B10R2.351 O=C(O)C1C2CCCN21 Amb32681200 [0,0,0,2,0,0|1,0,0]=3 6901 B10R2.351 O=C(O)C1C2CNCC21 Amb18203279 [0,0,0,2,0,0|2,0,0]=4 6902 B10R2.351 O=C(O)C1C2CNCC21 Amb24277089 [0,0,0,2,0,0|2,0,0]=4 6903 B10R2.351 O=C(O)C1C2COCC21 Amb19957781 [0,0,0,2,0,0|1,1,0]=4 6904 B10R2.351 O=C(O)C1[C@@H]2CNC[C@@H]12 Amb34915598 [0,0,0,2,0,0|2,0,0]=4 6905 B10R2.351 O=C(O)C1[C@@H]2COC[C@@H]12 Amb28344159 [0,0,0,2,0,0|1,1,0]=4 6906 B10R2.351 O=C(O)C1[C@H]2CNC[C@H]12 Amb34916405 [0,0,0,2,0,0|2,0,0]=4 6907 B10R2.351 O=C(O)C1[C@H]2COC[C@@H]12 Amb27856193 [0,0,0,2,0,0|1,1,0]=4 6908 B10R2.351 O=C(O)C1[C@H]2COC[C@H]12 Amb34915658 [0,0,0,2,0,0|1,1,0]=4 6909 B10R2.351 O=C(O)[C@@H]1[C@H]2CNC[C@H]21 Amb22893495 [0,0,0,2,0,0|2,0,0]=4 6910 B10R2.351 O=C(O)[C@@H]1[C@H]2CNC[C@H]21 Amb7970107 [0,0,0,2,0,0|2,0,0]=4 6911 B10R2.351 O=C(O)[C@@H]1[C@H]2COC[C@H]21 Amb24183373 [0,0,0,2,0,0|1,1,0]=4 6912 B10R2.351 O=C(O)[C@H]1[C@H]2CNC[C@H]21 Amb24477697 [0,0,0,2,0,0|2,0,0]=4 6913 B10R2.351 O=C(O)[C@H]1[C@H]2CNC[C@H]21 Amb30526915 [0,0,0,2,0,0|2,0,0]=4 6914 B10R2.351 O=C(O)[C@H]1[C@H]2COC[C@H]21 Amb22748606 [0,0,0,2,0,0|1,1,0]=4 6915 B10R2.355 O=C(O)C1CCC2CC21 Amb27756554 [0,0,0,2,0,0|2,0,0]=4 6916 B10R2.355 O=C(O)C1NCC2CC21 Amb2444163 [0,0,0,2,0,0|1,0,0]=3 6917 B10R2.355 O=C(O)C1NCC2CC21 Amb30869339 [0,0,0,2,0,0|1,0,0]=3 6918 B10R2.355 O=C(O)C1NC[C@@H]2C[C@H]12 Amb27474270 [0,0,0,2,0,0|1,0,0]=3 6919 B10R2.355 O=C(O)C1SCC2CC21 Amb18202403 [0,0,0,2,0,0|2,0,0]=4 6920 B10R2.355 O=C(O)[C@@H]1CC[C@@H]2C[C@@H]21 Amb33734642 [0,0,0,2,0,0|2,0,0]=4 6921 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2C[C@@H]21 Amb22737256 [0,0,0,2,0,0|1,0,0]=3 6922 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2C[C@@H]21 Amb30869362 [0,0,0,2,0,0|1,0,0]=3 6923 B10R2.355 O=C(O)[C@@H]1NC[C@H]2C[C@H]21 Amb18792526 [0,0,0,2,0,0|1,0,0]=3 6924 B10R2.355 O=C(O)[C@@H]1NC[C@H]2C[C@H]21 Amb23440593 [0,0,0,2,0,0|1,0,0]=3 6925 B10R2.355 O=C(O)[C@H]1NC[C@@H]2CC12 Amb25924032 [0,0,0,2,0,0|1,0,0]=3 6926 B10R2.355 O=C(O)[C@H]1NC[C@@H]2C[C@@H]12 Amb27655855 [0,0,0,2,0,0|1,0,0]=3 6927 B10R2.355 O=C(O)[C@H]1NC[C@@H]2C[C@H]12 Amb17913042 [0,0,0,2,0,0|1,0,0]=3 6928 B10R2.355 O=C(O)[C@H]1NC[C@@H]2C[C@H]12 Amb2372045 [0,0,0,2,0,0|1,0,0]=3 6929 B10R2.355 O=C(O)[C@H]1NC[C@H]2C[C@H]21 Amb2372044 [0,0,0,2,0,0|1,0,0]=3 6930 B10R2.355 O=C(O)[C@H]1NC[C@H]2C[C@H]21 Amb33801121 [0,0,0,2,0,0|1,0,0]=3 6931 B10R2.357 NC(=O)C1CC2CC2N1 Amb25066699 [0,0,0,2,0,0|2,0,0]=4 6932 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb22504301 [0,0,0,2,0,0|2,0,0]=4 6933 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb22746576 [0,0,0,2,0,0|2,0,0]=4 6934 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb22746662 [0,0,0,2,0,0|2,0,0]=4 6935 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb22746663 [0,0,0,2,0,0|2,0,0]=4 6936 B10R2.357 NC(=O)[C@@H]1C[C@H]2C[C@H]2N1 Amb22745970 [0,0,0,2,0,0|2,0,0]=4 6937 B10R2.357 NC(=O)[C@@H]1C[C@H]2C[C@H]2N1 Amb22755779 [0,0,0,2,0,0|2,0,0]=4 6938 B10R2.357 NC(=O)[C@@H]1C[C@H]2C[C@H]2N1 Amb26843644 [0,0,0,2,0,0|2,0,0]=4 6939 B10R2.357 O=C(O)C1CC2CC2C1 Amb23439567 [0,0,0,2,0,0|2,0,0]=4 6940 B10R2.357 O=C(O)C1CC2CC2N1 Amb18203281 [0,0,0,2,0,0|1,0,0]=3 6941 B10R2.357 O=C(O)C1CC2CC2N1 Amb505664 [0,0,0,2,0,0|1,0,0]=3 6942 B10R2.357 O=C(O)C1CC2CC2S1 Amb18202402 [0,0,0,2,0,0|2,0,0]=4 6943 B10R2.357 O=C(O)C1C[C@@H]2C[C@@H]2C1 Amb26370565 [0,0,0,2,0,0|2,0,0]=4 6944 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2C1 Amb25887429 [0,0,0,2,0,0|2,0,0]=4 6945 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb18792527 [0,0,0,2,0,0|1,0,0]=3 6946 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb23439721 [0,0,0,2,0,0|1,0,0]=3 6947 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb2372541 [0,0,0,2,0,0|1,0,0]=3 6948 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 Amb17719277 [0,0,0,2,0,0|1,0,0]=3 6949 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 Amb2372046 [0,0,0,2,0,0|1,0,0]=3 6950 B10R2.357 O=C(O)[C@H]1C[C@@H]2O[C@@H]2C1 Amb28423513 [0,0,0,2,0,0|1,1,0]=4 6951 B10R2.357 O=C(O)[C@H]1C[C@H]2C[C@H]2N1 Amb33801107 [0,0,0,2,0,0|1,0,0]=3 6952 B10R2.19 NC12CCC(CC1=O)C2 Amb23580751 [0,0,0,2,0,0|2,0,0]=4 6953 B10R2.19 N[C@]12CC[C@H](CC1=O)C2 Amb27795818 [0,0,0,2,0,0|2,0,0]=4 6954 B10R2.308 C[C@@H]1C[C@@]2(C(=O)O)C[C@@H]12 Amb33802827 [0,0,0,2,0,0|2,0,0]=4 6955 B10R2.308 C[C@@H]1C[C@]2(C(=O)O)C[C@H]12 Amb33733821 [0,0,0,2,0,0|2,0,0]=4 6956 B10R2.346 O=C(O)C1NC2CC1C2 Amb25911733 [0,0,0,2,0,0|1,0,0]=3 6957 B10R2.346 O=C(O)[C@@H]1NC2CC1C2 Amb34141405 [0,0,0,2,0,0|1,0,0]=3 6958 B10R2.346 O=C(O)[C@H]1NC2CC1C2 Amb34141348 [0,0,0,2,0,0|1,0,0]=3 6959 B10R2.348 O=C(O)C12CCC(C1)C2 Amb17593309 [0,0,0,2,0,0|2,0,0]=4 6960 B10R2.348 O=C(O)C12CNC(C1)C2 Amb26446058 [0,0,0,2,0,0|2,0,0]=4 6961 B10R2.348 O=C(O)C12CNC(C1)C2 Amb35789732 [0,0,0,2,0,0|2,0,0]=4 6962 B10R2.348 O=C(O)C12COC(C1)C2 Amb25963787 [0,0,0,2,0,0|1,1,0]=4 6963 B10R2.633 O=C(O)C1CC1C2CC2 Amb18960095 [0,0,0,2,0,0|2,0,0]=4 6964 B10R2.633 O=C(O)[C@@H]1C[C@H]1C2CC2 Amb27874196 [0,0,0,2,0,0|2,0,0]=4 6965 B10R2.638 O=C(O)C1CC12CCC2 Amb2785198 [0,0,0,2,0,0|2,0,0]=4 6966 B10R2.638 O=C(O)C1CC12CNC2 Amb27808558 [0,0,0,2,0,0|2,0,0]=4 6967 B10R2.638 O=C(O)C1CC12CNC2 Amb32664978 [0,0,0,2,0,0|2,0,0]=4 6968 B10R2.638 O=C(O)C1CC12COC2 Amb30017841 [0,0,0,2,0,0|1,1,0]=4 6969 B10R2.296 NC12CC1C(=O)OC2=O Amb28382254 [0,0,0,2,0,0|2,0,0]=4 6970 B10R2.649 NC1(C(=O)O)CC12CC2 Amb27203306 [0,0,0,2,0,0|1,0,0]=3 6971 B10R2.649 N[C@]1(C(=O)O)CC12CC2 Amb24548839 [0,0,0,2,0,0|1,0,0]=3 6972 B10R2.646 O=C(O)C1CC2(CC2)C1 Amb23452520 [0,0,0,2,0,0|2,0,0]=4 6973 B10R2.311 NC1C(=O)SC12CCC2 Amb33330908 [0,0,0,2,0,0|1,1,0]=4 6974 B10R2.311 NC1C(=O)SC12CCC2 Amb33483534 [0,0,0,2,0,0|1,1,0]=4 6975 B10R0.78 CCCCC(C)C#CC(=O)O Amb27945976 [0,0,0,0,0,2|2,0,0]=4 6976 B10R0.78 CCCCC(C)CCC(=O)O Amb2689572 [0,0,0,0,0,2|2,0,0]=4 6977 B10R0.78 CCCCC(N)C#CC(=O)O Amb33168917 [0,0,0,0,0,2|1,0,0]=3 6978 B10R0.78 CCCCC(N)CCC(=O)O Amb33172614 [0,0,0,0,0,2|1,0,0]=3 6979 B10R0.78 CCCCC(O)CCC(=O)O Amb33539237 [0,0,0,0,0,2|2,0,0]=4 6980 B10R0.78 CCSCC(N)CCC(=O)O Amb33324077 [0,0,0,0,0,2|2,0,0]=4 6981 B10R0.78 COCCC(N)C#CC(=O)O Amb33168997 [0,0,0,0,0,2|0,1,0]=3 6982 B10R0.78 COCCC(N)CCC(=O)O Amb33377834 [0,0,0,0,0,2|0,1,0]=3 6983 B10R0.78 CSCCC(N)CCC(=O)O Amb33199123 [0,0,0,0,0,2|0,0,0]=2