0 B9R0.47 C#CCCCC(=O)C(O)=O Amb24592957 [0,0,0,0,0,0|2,0,2]=4 1 B9R0.47 C#CCCCC(O)C(O)=O Amb25221599 [0,0,0,0,0,0|2,0,1]=3 2 B9R0.47 C#CCCC[C@@H](N)C(O)=O Amb24077358 [0,0,0,0,0,0|1,0,1]=2 3 B9R0.47 C#CCCC[C@H](N)C(O)=O Amb24088878 [0,0,0,0,0,0|1,0,1]=2 4 B9R0.47 C#CCNCC(N)C(N)=O Amb24479662 [0,0,0,0,0,0|3,0,1]=4 5 B9R0.47 C#CCNCC(N)C(O)=O Amb24524538 [0,0,0,0,0,0|2,0,1]=3 6 B9R0.47 C#CCOCC(Cl)C(O)=O Amb25729496 [0,0,0,0,0,0|3,0,1]=4 7 B9R0.47 C#CCOCC(N)C(O)=O Amb25251552 [0,0,0,0,0,0|2,0,1]=3 8 B9R0.47 C#CCSC[C@@H](N)C(O)=O Amb18792078 [0,0,0,0,0,0|2,0,1]=3 9 B9R0.47 C#C\C=C\CC(N)C(O)=O Amb25147384 [0,0,0,0,0,0|1,0,3]=4 10 B9R0.47 C=C(CCCC#C)C(O)=O Amb25118890 [0,0,0,0,0,0|2,0,2]=4 11 B9R0.47 C=C(CCCC=C)C(O)=O Amb24585641 [0,0,0,0,0,0|2,0,2]=4 12 B9R0.47 C=C(CCCCO)C(O)=O Amb24479220 [0,0,0,0,0,0|2,0,1]=3 13 B9R0.47 C=C(CNCCO)C(O)=O Amb25091316 [0,0,0,0,0,0|3,0,1]=4 14 B9R0.47 C=C(CSCCN)C(O)=O Amb24411908 [0,0,0,0,0,0|2,0,1]=3 15 B9R0.47 C=CCCCC(=O)C(O)=O Amb24459619 [0,0,0,0,0,0|2,0,2]=4 16 B9R0.47 C=CCCCC(Cl)C(=O)Cl Amb24509720 [0,0,0,0,0,0|3,0,1]=4 17 B9R0.47 C=CCCCC(Cl)C(O)=O Amb18645742 [0,0,0,0,0,0|2,0,1]=3 18 B9R0.47 C=CCCCC(N)C(O)=O Amb22002149 [0,0,0,0,0,0|1,0,1]=2 19 B9R0.47 C=CCCC[C@@H](N)C(N)=O Amb25824644 [0,0,0,0,0,0|2,0,1]=3 20 B9R0.47 C=CCCC[C@@H](N)C(O)=O Amb22831130 [0,0,0,0,0,0|1,0,1]=2 21 B9R0.47 C=CCCC[C@@H](O)C(O)=O Amb24714998 [0,0,0,0,0,0|2,0,1]=3 22 B9R0.47 C=CCCC[C@H](O)C(O)=O Amb24763769 [0,0,0,0,0,0|2,0,1]=3 23 B9R0.47 C=CCCOC(F)C(O)=O Amb25683023 [0,0,0,0,0,0|3,0,1]=4 24 B9R0.47 C=CCNCC(N)C(N)=O Amb25711533 [0,0,0,0,0,0|3,0,1]=4 25 B9R0.47 C=CCNCC(O)C(O)=O Amb25344930 [0,0,0,0,0,0|3,0,1]=4 26 B9R0.47 C=CCOCC(Cl)C(O)=O Amb24589021 [0,0,0,0,0,0|3,0,1]=4 27 B9R0.47 C=CCOCC(O)C(O)=O Amb24655623 [0,0,0,0,0,0|3,0,1]=4 28 B9R0.47 C=CCOC[C@H](N)C(O)=O Amb24713287 [0,0,0,0,0,0|2,0,1]=3 29 B9R0.47 C=CCSCC(N)C(N)=O Amb25303041 [0,0,0,0,0,0|3,0,1]=4 30 B9R0.47 C=CCSC[C@@H](N)C(O)=O Amb22745979 [0,0,0,0,0,0|2,0,1]=3 31 B9R0.47 C=CCSC[C@H](N)C(O)=O Amb22231426 [0,0,0,0,0,0|2,0,1]=3 32 B9R0.47 C=CCSC[C@H](N)C(O)=O Amb22231427 [0,0,0,0,0,0|2,0,1]=3 33 B9R0.47 C=C\C=C\CC(N)C(O)=O Amb18643715 [0,0,0,0,0,0|1,0,3]=4 34 B9R0.47 CC#CCC[C@@H](N)C(N)=O Amb25789997 [0,0,0,0,0,0|2,0,2]=4 35 B9R0.47 CC#CCC[C@@H](N)C(O)=O Amb25835847 [0,0,0,0,0,0|1,0,2]=3 36 B9R0.47 CC#CSC[C@H](N)C(O)=O Amb24524580 [0,0,0,0,0,0|2,0,2]=4 37 B9R0.47 CC(=C)C(=O)CCCCN Amb24621760 [0,0,0,0,0,0|3,0,1]=4 38 B9R0.47 CC(=O)C(=C)CCCCC Amb24708779 [0,0,0,0,0,0|3,0,1]=4 39 B9R0.47 CC(=O)C(=O)CCCCCl Amb24480576 [0,0,0,0,0,0|3,0,1]=4 40 B9R0.47 CC(=O)C(=O)CCCCO Amb24524628 [0,0,0,0,0,0|3,0,1]=4 41 B9R0.47 CC(=O)C(Cl)CNCCCl Amb25295461 [0,0,0,0,0,0|4,0,0]=4 42 B9R0.47 CC(=O)C(N)CCCCN Amb18644167 [0,0,0,0,0,0|1,0,0]=1 43 B9R0.47 CC(=O)C(O)CCCC=C Amb24577858 [0,0,0,0,0,0|3,0,1]=4 44 B9R0.47 CC(=O)N(C)CCCCCl Amb24571275 [0,0,0,0,0,0|4,0,0]=4 45 B9R0.47 CC(=O)N(C)CCCCN Amb22490951 [0,0,0,0,0,0|3,0,0]=3 46 B9R0.47 CC(=O)N(C)CCCCO Amb24618666 [0,0,0,0,0,0|4,0,0]=4 47 B9R0.47 CC(=O)N(O)CCCCN Amb24445386 [0,0,0,0,0,0|3,0,0]=3 48 B9R0.47 CC(=O)[C@@H](N)CCCCN Amb25251380 [0,0,0,0,0,0|1,0,0]=1 49 B9R0.47 CC(C(=O)O)SCCC#N Amb17502364 [0,0,0,0,0,0|2,0,2]=4 50 B9R0.47 CC(C(=O)O)SCCCN Amb17500677 [0,0,0,0,0,0|2,0,0]=2 51 B9R0.47 CC(C)=C(C)CCCCN Amb25781308 [0,0,0,0,0,0|3,0,1]=4 52 B9R0.47 CC(C)C(C)CCCCN Amb24389393 [0,0,0,0,0,0|3,0,1]=4 53 B9R0.47 CC(C)C(N)CNCCN Amb24398455 [0,0,0,0,0,0|3,0,1]=4 54 B9R0.47 CC(C)[C@H](N)CNCCN Amb24443135 [0,0,0,0,0,0|3,0,1]=4 55 B9R0.47 CC(CCCC#C)C(O)=O Amb25824201 [0,0,0,0,0,0|2,0,1]=3 56 B9R0.47 CC(CCCC=C)C(O)=O Amb18643893 [0,0,0,0,0,0|2,0,1]=3 57 B9R0.47 CC(CCCC=O)C(=O)Cl Amb24448943 [0,0,0,0,0,0|3,0,1]=4 58 B9R0.47 CC(CCCC=O)C(C)=O Amb24478226 [0,0,0,0,0,0|3,0,1]=4 59 B9R0.47 CC(CCCCF)C(O)=O Amb24370978 [0,0,0,0,0,0|2,0,0]=2 60 B9R0.47 CC(CCCCN)C(O)=O Amb18644200 [0,0,0,0,0,0|1,0,0]=1 61 B9R0.47 CC(CCCCN)N(C)C Amb18202387 [0,0,0,0,0,0|4,0,0]=4 62 B9R0.47 CC(CCOC=O)C(O)=O Amb18644245 [0,0,0,0,0,0|3,0,1]=4 63 B9R0.47 CC(CNCCF)C(N)=O Amb24365709 [0,0,0,0,0,0|4,0,0]=4 64 B9R0.47 CC(CNCCF)C(O)=O Amb25061129 [0,0,0,0,0,0|3,0,0]=3 65 B9R0.47 CC(CSCC#C)C(O)=O Amb24703279 [0,0,0,0,0,0|3,0,1]=4 66 B9R0.47 CC(CSCCF)C(O)=O Amb25696347 [0,0,0,0,0,0|3,0,0]=3 67 B9R0.47 CC(CSCCN)C(O)=O Amb18788221 [0,0,0,0,0,0|2,0,0]=2 68 B9R0.47 CC(N)C(N)CCCCC Amb25147529 [0,0,0,0,0,0|3,0,1]=4 69 B9R0.47 CC(NCCC=C)C(O)=O Amb25309133 [0,0,0,0,0,0|3,0,1]=4 70 B9R0.47 CC(NCCCF)C(O)=O Amb24407596 [0,0,0,0,0,0|3,0,0]=3 71 B9R0.47 CC(NCCCN)C(C)O Amb25147428 [0,0,0,0,0,0|3,0,1]=4 72 B9R0.47 CC(NCCCN)C(N)=O Amb24761337 [0,0,0,0,0,0|3,0,0]=3 73 B9R0.47 CC(O)C(C)CCCCO Amb25854852 [0,0,0,0,0,0|3,0,1]=4 74 B9R0.47 CC(O)C(N)CCCCC Amb18644212 [0,0,0,0,0,0|2,0,1]=3 75 B9R0.47 CC(O)C(O)CCCCF Amb24747720 [0,0,0,0,0,0|3,0,1]=4 76 B9R0.47 CC(OCCC#C)C(O)=O Amb25685097 [0,0,0,0,0,0|3,0,1]=4 77 B9R0.47 CC(OCCC#N)C(O)=O Amb25777717 [0,0,0,0,0,0|2,0,2]=4 78 B9R0.47 CC(OCCCF)C(O)=O Amb24602795 [0,0,0,0,0,0|3,0,0]=3 79 B9R0.47 CC(OCCCN)C(C)=O Amb18111504 [0,0,0,0,0,0|3,0,0]=3 80 B9R0.47 CC(OCCCN)C(N)=O Amb25191408 [0,0,0,0,0,0|3,0,0]=3 81 B9R0.47 CC(OCCCN)C(O)=O Amb18111477 [0,0,0,0,0,0|2,0,0]=2 82 B9R0.47 CC(OCCCO)C(O)=O Amb25132795 [0,0,0,0,0,0|3,0,0]=3 83 B9R0.47 CC(SCCCF)C(N)=O Amb24482849 [0,0,0,0,0,0|4,0,0]=4 84 B9R0.47 CC(SCCCN)C(N)=O Amb25794386 [0,0,0,0,0,0|3,0,0]=3 85 B9R0.47 CC(SCCCO)C(C)=O Amb24724359 [0,0,0,0,0,0|4,0,0]=4 86 B9R0.47 CC(SCCCS)C(O)=O Amb18648366 [0,0,0,0,0,0|3,0,0]=3 87 B9R0.47 CC=C=CCC(N)C(O)=O Amb24427636 [0,0,0,0,0,0|1,0,3]=4 88 B9R0.47 CCC#CCC(C)C(O)=O Amb24392620 [0,0,0,0,0,0|2,0,2]=4 89 B9R0.47 CCC#CC[C@H](C)C(O)=O Amb25843119 [0,0,0,0,0,0|2,0,2]=4 90 B9R0.47 CCCC#CC(O)C(O)=O Amb24480403 [0,0,0,0,0,0|2,0,2]=4 91 B9R0.47 CCCCCC(=C)C(N)=O Amb25774332 [0,0,0,0,0,0|3,0,1]=4 92 B9R0.47 CCCCCC(=C)C(O)=O Amb18643927 [0,0,0,0,0,0|2,0,1]=3 93 B9R0.47 CCCCCC(=O)C(=O)C Amb15693393 [0,0,0,0,0,0|3,0,1]=4 94 B9R0.47 CCCCCC(=O)C(=O)Cl Amb24647840 [0,0,0,0,0,0|3,0,1]=4 95 B9R0.47 CCCCCC(=O)C(O)=O Amb18644122 [0,0,0,0,0,0|2,0,1]=3 96 B9R0.47 CCCCCC(Br)C(C)=C Amb25338082 [0,0,0,0,0,0|4,0,0]=4 97 B9R0.47 CCCCCC(Br)C(N)=O Amb25857400 [0,0,0,0,0,0|3,0,0]=3 98 B9R0.47 CCCCCC(Br)C(O)=O Amb18130346 [0,0,0,0,0,0|2,0,0]=2 99 B9R0.47 CCCCCC(C(=O)O)F Amb17593693 [0,0,0,0,0,0|2,0,0]=2 100 B9R0.47 CCCCCC(C)C(=O)Cl Amb25127828 [0,0,0,0,0,0|3,0,0]=3 101 B9R0.47 CCCCCC(C)C(C)O Amb24478011 [0,0,0,0,0,0|3,0,1]=4 102 B9R0.47 CCCCCC(C)C(N)=N Amb24477154 [0,0,0,0,0,0|4,0,0]=4 103 B9R0.47 CCCCCC(C)C(N)=O Amb24568260 [0,0,0,0,0,0|3,0,0]=3 104 B9R0.47 CCCCCC(C)P(O)=O Amb25287382 [0,0,0,0,0,0|3,0,0]=3 105 B9R0.47 CCCCCC(C)[N+]([O-])=O Amb25059956 [0,0,0,0,0,0|3,0,1]=4 106 B9R0.47 CCCCCC(Cl)C(C)=C Amb24509526 [0,0,0,0,0,0|4,0,0]=4 107 B9R0.47 CCCCCC(Cl)C(N)=O Amb18800736 [0,0,0,0,0,0|3,0,0]=3 108 B9R0.47 CCCCCC(Cl)C(O)=O Amb18646187 [0,0,0,0,0,0|2,0,0]=2 109 B9R0.47 CCCCCC(F)C(C)=O Amb25763258 [0,0,0,0,0,0|3,0,0]=3 110 B9R0.47 CCCCCC(F)C(N)=O Amb25147451 [0,0,0,0,0,0|3,0,0]=3 111 B9R0.47 CCCCCC(N)C(C)=C Amb24431216 [0,0,0,0,0,0|3,0,0]=3 112 B9R0.47 CCCCCC(N)C(C)=O Amb24446263 [0,0,0,0,0,0|2,0,0]=2 113 B9R0.47 CCCCCC(N)C(N)=O Amb25843277 [0,0,0,0,0,0|2,0,0]=2 114 B9R0.47 CCCCCC(O)C(C)=C Amb24350676 [0,0,0,0,0,0|4,0,0]=4 115 B9R0.47 CCCCCC(O)C(N)=O Amb24478096 [0,0,0,0,0,0|3,0,0]=3 116 B9R0.47 CCCCCC(O)C(O)=O Amb17778103 [0,0,0,0,0,0|2,0,0]=2 117 B9R0.47 CCCCCN(C)C(=O)Cl Amb25032287 [0,0,0,0,0,0|4,0,0]=4 118 B9R0.47 CCCCCN(C)C(C)=O Amb24621351 [0,0,0,0,0,0|4,0,0]=4 119 B9R0.47 CCCCCN(N)C(N)=N Amb24542721 [0,0,0,0,0,0|4,0,0]=4 120 B9R0.47 CCCCC[C@@H](C(=O)O)C Amb10844510 [0,0,0,0,0,0|2,0,0]=2 121 B9R0.47 CCCCC[C@@H](N)C(O)=O Amb22745982 [0,0,0,0,0,0|1,0,0]=1 122 B9R0.47 CCCCC[C@@H](O)C(C)=O Amb24480618 [0,0,0,0,0,0|3,0,0]=3 123 B9R0.47 CCCCC[C@H](Br)C(C)=O Amb25187962 [0,0,0,0,0,0|3,0,0]=3 124 B9R0.47 CCCCC[C@H](C(=O)O)C Amb10844515 [0,0,0,0,0,0|2,0,0]=2 125 B9R0.47 CCCCC[C@H](C)C(C)=O Amb25134138 [0,0,0,0,0,0|3,0,0]=3 126 B9R0.47 CCCCC[C@H](N)C(N)=O Amb24502148 [0,0,0,0,0,0|2,0,0]=2 127 B9R0.47 CCCCC[C@H](N)C(O)=O Amb17943098 [0,0,0,0,0,0|1,0,0]=1 128 B9R0.47 CCCCC[C@H](O)C(O)=O Amb25728353 [0,0,0,0,0,0|2,0,0]=2 129 B9R0.47 CCCCNC(=N)C(O)=O Amb24746786 [0,0,0,0,0,0|2,0,2]=4 130 B9R0.47 CCCCNC(C)C(C)=O Amb25294138 [0,0,0,0,0,0|4,0,0]=4 131 B9R0.47 CCCCOC(Cl)C(=O)Cl Amb24626835 [0,0,0,0,0,0|4,0,0]=4 132 B9R0.47 CCCCO[C@H](C)C(O)=O Amb24480807 [0,0,0,0,0,0|3,0,0]=3 133 B9R0.47 CCCCSC(C)C(N)=O Amb18183483 [0,0,0,0,0,0|4,0,0]=4 134 B9R0.47 CCCCS[C@H](C)C(O)=O Amb24725214 [0,0,0,0,0,0|3,0,0]=3 135 B9R0.47 CCCC\C=C(/N)\C(N)=O Amb24640945 [0,0,0,0,0,0|2,0,2]=4 136 B9R0.47 CCCC\C=C(\Cl)/C(O)=O Amb25299436 [0,0,0,0,0,0|2,0,2]=4 137 B9R0.47 CCCNCC(=C)C(O)=O Amb24479657 [0,0,0,0,0,0|3,0,1]=4 138 B9R0.47 CCCNCC(O)C(O)=O Amb24734975 [0,0,0,0,0,0|3,0,0]=3 139 B9R0.47 CCCOCC(C)C(C)=O Amb24725662 [0,0,0,0,0,0|4,0,0]=4 140 B9R0.47 CCCOCC(Cl)C(O)=O Amb25713951 [0,0,0,0,0,0|3,0,0]=3 141 B9R0.47 CCCOCC(N)C(C)=C Amb24375016 [0,0,0,0,0,0|4,0,0]=4 142 B9R0.47 CCCOCC(N)C(O)=O Amb24621740 [0,0,0,0,0,0|2,0,0]=2 143 B9R0.47 CCCOCC(O)C(O)=O Amb25098725 [0,0,0,0,0,0|3,0,0]=3 144 B9R0.47 CCCONC(C)C(O)=O Amb25664130 [0,0,0,0,0,0|4,0,0]=4 145 B9R0.47 CCCSCC(N)C(N)=O Amb18788146 [0,0,0,0,0,0|3,0,0]=3 146 B9R0.47 CCCSC[C@@H](N)C(O)=O Amb18792511 [0,0,0,0,0,0|2,0,0]=2 147 B9R0.47 CCCSC[C@H](O)C(O)=O Amb24482234 [0,0,0,0,0,0|3,0,0]=3 148 B9R0.47 CCC\C=C\C(C)C(O)=O Amb25687429 [0,0,0,0,0,0|2,0,2]=4 149 B9R0.47 CCC\C=C\C(N)C(O)=O Amb24656860 [0,0,0,0,0,0|1,0,2]=3 150 B9R0.47 CCC\C=C\C(O)C(O)=O Amb25113481 [0,0,0,0,0,0|2,0,2]=4 151 B9R0.47 CCC\C=C\[C@H](N)C(O)=O Amb24547580 [0,0,0,0,0,0|1,0,2]=3 152 B9R0.47 CCC\C=N\[C@@H](C)C(O)=O Amb24401135 [0,0,0,0,0,0|3,0,1]=4 153 B9R0.47 CCOCCC(Cl)C(C)=O Amb24407317 [0,0,0,0,0,0|4,0,0]=4 154 B9R0.47 CCOCCC(N)C(C)=C Amb25836049 [0,0,0,0,0,0|4,0,0]=4 155 B9R0.47 CCOCCC(N)C(N)=O Amb25354003 [0,0,0,0,0,0|3,0,0]=3 156 B9R0.47 CCOCC[C@H](C)C(O)=O Amb25791629 [0,0,0,0,0,0|3,0,0]=3 157 B9R0.47 CCOCSC(C)C(O)=O Amb24456124 [0,0,0,0,0,0|4,0,0]=4 158 B9R0.47 CCONCC(N)C(O)=O Amb25350611 [0,0,0,0,0,0|3,0,0]=3 159 B9R0.47 CCSCCC(C(=O)O)C Amb10844082 [0,0,0,0,0,0|3,0,0]=3 160 B9R0.47 CCSCCC(C(=O)O)N Amb2137050 [0,0,0,0,0,0|2,0,0]=2 161 B9R0.47 CCSCCC(N)C(N)=O Amb18177774 [0,0,0,0,0,0|3,0,0]=3 162 B9R0.47 CCSCCC(N)C(O)=O Amb22904200 [0,0,0,0,0,0|2,0,0]=2 163 B9R0.47 CCSCCC(O)C(O)=O Amb24482157 [0,0,0,0,0,0|3,0,0]=3 164 B9R0.47 CCSCC[C@@H](C(=O)O)N Amb17613844 [0,0,0,0,0,0|2,0,0]=2 165 B9R0.47 CCSCC[C@H](C(=O)O)N Amb17613843 [0,0,0,0,0,0|2,0,0]=2 166 B9R0.47 CC[Se]CCC(C(=O)O)N Amb17620056 [0,0,0,0,0,0|2,0,0]=2 167 B9R0.47 CC\C=C\CC(N)C(O)=O Amb25255710 [0,0,0,0,0,0|1,0,2]=3 168 B9R0.47 CC\C=C\CC(O)C(O)=O Amb24480470 [0,0,0,0,0,0|2,0,2]=4 169 B9R0.47 CC\C=C\C[C@H](N)C(O)=O Amb24617272 [0,0,0,0,0,0|1,0,2]=3 170 B9R0.47 CN(CCCCCl)C(=O)Cl Amb22338609 [0,0,0,0,0,0|4,0,0]=4 171 B9R0.47 CN(CCCCN)C(N)=O Amb24635990 [0,0,0,0,0,0|3,0,0]=3 172 B9R0.47 CNCCCC(C)C(O)=O Amb25313872 [0,0,0,0,0,0|3,0,0]=3 173 B9R0.47 CNCCCC(N)C(O)=O Amb18644279 [0,0,0,0,0,0|2,0,0]=2 174 B9R0.47 CNCCC[C@H](N)C(O)=O Amb24377155 [0,0,0,0,0,0|2,0,0]=2 175 B9R0.47 CNCCOC(C)C(O)=O Amb18630742 [0,0,0,0,0,0|4,0,0]=4 176 B9R0.47 CNCCSC(F)C(O)=O Amb24601985 [0,0,0,0,0,0|4,0,0]=4 177 B9R0.47 CNOCCC(N)C(O)=O Amb24477008 [0,0,0,0,0,0|3,0,0]=3 178 B9R0.47 COCCCC(Cl)C(C)=O Amb25708322 [0,0,0,0,0,0|4,0,0]=4 179 B9R0.47 COCCCC(N)C(C)=O Amb24628741 [0,0,0,0,0,0|3,0,0]=3 180 B9R0.47 COCCCC(N)C(O)=O Amb20628315 [0,0,0,0,0,0|2,0,0]=2 181 B9R0.47 COCCCC(N)C(O)=O Amb22058809 [0,0,0,0,0,0|2,0,0]=2 182 B9R0.47 COCCC[C@@H](N)C(O)=O Amb25081508 [0,0,0,0,0,0|2,0,0]=2 183 B9R0.47 COCCC[C@H](N)C(O)=O Amb25378737 [0,0,0,0,0,0|2,0,0]=2 184 B9R0.47 COCCSC(F)C(O)=O Amb25342930 [0,0,0,0,0,0|4,0,0]=4 185 B9R0.47 COCOC[C@@H](C)C(O)=O Amb24505310 [0,0,0,0,0,0|4,0,0]=4 186 B9R0.47 COCSCC(N)C(O)=O Amb25287934 [0,0,0,0,0,0|3,0,0]=3 187 B9R0.47 COCSC[C@@H](N)C(O)=O Amb25225221 [0,0,0,0,0,0|3,0,0]=3 188 B9R0.47 COCSC[C@H](N)C(O)=O Amb25275942 [0,0,0,0,0,0|3,0,0]=3 189 B9R0.47 CONCCC(N)C(O)=O Amb25311314 [0,0,0,0,0,0|3,0,0]=3 190 B9R0.47 CSCCCC(C(=O)O)N Amb17594057 [0,0,0,0,0,0|2,0,0]=2 191 B9R0.47 CSCCCC(O)C(O)=O Amb25169340 [0,0,0,0,0,0|3,0,0]=3 192 B9R0.47 CSCCNC(C)C(O)=O Amb25805024 [0,0,0,0,0,0|4,0,0]=4 193 B9R0.47 CSCCN[C@@H](C)C(O)=O Amb24554487 [0,0,0,0,0,0|4,0,0]=4 194 B9R0.47 CSCCN[C@H](C)C(O)=O Amb25027967 [0,0,0,0,0,0|4,0,0]=4 195 B9R0.47 CSCCOC(C)C(O)=O Amb24482366 [0,0,0,0,0,0|4,0,0]=4 196 B9R0.47 CSCCOC(F)C(O)=O Amb25683225 [0,0,0,0,0,0|4,0,0]=4 197 B9R0.47 CSCCO[C@@H](C)C(O)=O Amb25146944 [0,0,0,0,0,0|4,0,0]=4 198 B9R0.47 CSCSC[C@@H](N)C(O)=O Amb25360905 [0,0,0,0,0,0|3,0,0]=3 199 B9R0.47 CSSCC[C@H](N)C(O)=O Amb25111241 [0,0,0,0,0,0|3,0,0]=3 200 B9R0.47 C[C@@H](NCCC=C)C(O)=O Amb25702627 [0,0,0,0,0,0|3,0,1]=4 201 B9R0.47 C[C@@H](NCCCF)C(O)=O Amb25049576 [0,0,0,0,0,0|3,0,0]=3 202 B9R0.47 C[C@@H](NCCCN)C(O)=O Amb25710680 [0,0,0,0,0,0|2,0,0]=2 203 B9R0.47 C[C@@H](O)[C@H](F)CCCCC Amb25788166 [0,0,0,0,0,0|3,0,1]=4 204 B9R0.47 C[C@@H](O)[C@H](N)CCCCC Amb24679627 [0,0,0,0,0,0|2,0,1]=3 205 B9R0.47 C[C@@H](O)[C@H](O)CCCCC Amb25842141 [0,0,0,0,0,0|3,0,1]=4 206 B9R0.47 C[C@@H](OCCCF)C(O)=O Amb25146943 [0,0,0,0,0,0|3,0,0]=3 207 B9R0.47 C[C@@H](OCCCO)C(O)=O Amb24692362 [0,0,0,0,0,0|3,0,0]=3 208 B9R0.47 C[C@H](CCN=[N+]=[N-])C(O)=O Amb25202068 [0,0,0,0,0,0|3,0,1]=4 209 B9R0.47 C[C@H](NCCC#N)C(O)=O Amb25090098 [0,0,0,0,0,0|2,0,2]=4 210 B9R0.47 C[C@H](NCCCF)C(O)=O Amb25300818 [0,0,0,0,0,0|3,0,0]=3 211 B9R0.47 C[C@H](NCCCN)C(O)=O Amb24653332 [0,0,0,0,0,0|2,0,0]=2 212 B9R0.47 C[C@H](O)[C@@H](O)CCCCC Amb25115950 [0,0,0,0,0,0|3,0,1]=4 213 B9R0.47 C[C@H](OCCC#C)C(O)=O Amb25265806 [0,0,0,0,0,0|3,0,1]=4 214 B9R0.47 C[C@H](OCCCN)C(O)=O Amb25146951 [0,0,0,0,0,0|2,0,0]=2 215 B9R0.47 C[C@H](OCCCO)C(O)=O Amb25720488 [0,0,0,0,0,0|3,0,0]=3 216 B9R0.47 C\C(=C/CCCC)\C(O)=O Amb18643947 [0,0,0,0,0,0|2,0,2]=4 217 B9R0.47 C\C(=C/CCCCl)\C(O)=O Amb24462748 [0,0,0,0,0,0|2,0,2]=4 218 B9R0.47 C\C=C/SC[C@H](N)C(O)=O Amb24602399 [0,0,0,0,0,0|2,0,2]=4 219 B9R0.47 C\C=C\SCC(N)C(O)=O Amb24355928 [0,0,0,0,0,0|2,0,2]=4 220 B9R0.47 N#CCCCC(C(=O)O)Cl Amb17594023 [0,0,0,0,0,0|1,0,2]=3 221 B9R0.47 NC(=O)C(=O)NCCCN Amb24612365 [0,0,0,0,0,0|3,0,1]=4 222 B9R0.47 NC(CCCC#N)C(O)=O Amb25242567 [0,0,0,0,0,0|0,0,2]=2 223 B9R0.47 NC(CCCCBr)P(O)=O Amb25706143 [0,0,0,0,0,0|2,0,0]=2 224 B9R0.47 NC(CCCCCl)C(O)=O Amb25141944 [0,0,0,0,0,0|1,0,0]=1 225 B9R0.47 NC(CCCCF)C(F)F Amb25224839 [0,0,0,0,0,0|3,0,1]=4 226 B9R0.47 NC(CCCCS)C(O)=O Amb25363159 [0,0,0,0,0,0|1,0,0]=1 227 B9R0.47 NC(CCCNO)C(O)=O Amb24722710 [0,0,0,0,0,0|2,0,0]=2 228 B9R0.47 NC(CCC[13CH2][15NH2])C(O)=O Amb22351283 [0,0,0,0,0,0|0,0,0]=0 229 B9R0.47 NC(CCNC=O)C(O)=O Amb24355941 [0,0,0,0,0,0|2,0,1]=3 230 B9R0.47 NC(CCNCO)C(O)=O Amb25701616 [0,0,0,0,0,0|2,0,0]=2 231 B9R0.47 NC(CCSCF)C(O)=O Amb24610565 [0,0,0,0,0,0|2,0,0]=2 232 B9R0.47 NC(CNCCF)C(N)=O Amb25132328 [0,0,0,0,0,0|3,0,0]=3 233 B9R0.47 NC(CNCCO)C(O)=O Amb25073329 [0,0,0,0,0,0|2,0,0]=2 234 B9R0.47 NC(COCCCl)C(O)=O Amb18126477 [0,0,0,0,0,0|2,0,0]=2 235 B9R0.47 NC(CSCCCl)C(O)=O Amb18129288 [0,0,0,0,0,0|2,0,0]=2 236 B9R0.47 NC(CSCCF)C(O)=O Amb25054114 [0,0,0,0,0,0|2,0,0]=2 237 B9R0.47 NC(CSCCO)C(N)=O Amb18788315 [0,0,0,0,0,0|3,0,0]=3 238 B9R0.47 NC(C\C=C\CO)C(O)=O Amb25253501 [0,0,0,0,0,0|1,0,2]=3 239 B9R0.47 NC(\C=C\CCO)C(O)=O Amb25228356 [0,0,0,0,0,0|1,0,2]=3 240 B9R0.47 NCC#CCC(N)C(O)=O Amb25369913 [0,0,0,0,0,0|0,0,2]=2 241 B9R0.47 NCC#CC[C@@H](N)C(O)=O Amb24118079 [0,0,0,0,0,0|0,0,2]=2 242 B9R0.47 NCC#CC[C@@H](N)C(O)=O Amb24611313 [0,0,0,0,0,0|0,0,2]=2 243 B9R0.47 NCCCCC(=O)C(O)=O Amb25703573 [0,0,0,0,0,0|1,0,1]=2 244 B9R0.47 NCCCCC(C(=O)N)N Amb17593646 [0,0,0,0,0,0|1,0,0]=1 245 B9R0.47 NCCCCC(Cl)C(O)=O Amb24540314 [0,0,0,0,0,0|1,0,0]=1 246 B9R0.47 NCCCCC(F)=C(F)F Amb24580081 [0,0,0,0,0,0|3,0,1]=4 247 B9R0.47 NCCCCC(F)C(O)=O Amb25147460 [0,0,0,0,0,0|1,0,0]=1 248 B9R0.47 NCCCCC(N)C(=O)Cl Amb24678769 [0,0,0,0,0,0|1,0,0]=1 249 B9R0.47 NCCCCC(N)C(O)=O Amb22349470 [0,0,0,0,0,0|0,0,0]=0 250 B9R0.47 NCCCCC(N)C(O)=O Amb22489521 [0,0,0,0,0,0|0,0,0]=0 251 B9R0.47 NCCCCC(N)P(O)=O Amb25337348 [0,0,0,0,0,0|1,0,0]=1 252 B9R0.47 NCCCCC(N)[13C](O)=O Amb22338743 [0,0,0,0,0,0|0,0,0]=0 253 B9R0.47 NCCCCC(O)C(O)=O Amb18644320 [0,0,0,0,0,0|1,0,0]=1 254 B9R0.47 NCCCCC(S)C(O)=O Amb24652524 [0,0,0,0,0,0|1,0,0]=1 255 B9R0.47 NCCCCC([15NH2])C(O)=O Amb22351358 [0,0,0,0,0,0|0,0,0]=0 256 B9R0.47 NCCCC[13CH](N)C(O)=O Amb22351886 [0,0,0,0,0,0|0,0,0]=0 257 B9R0.47 NCCCC[13CH](N)[13C](O)=O Amb22336528 [0,0,0,0,0,0|0,0,0]=0 258 B9R0.47 NCCCC[C@@H](C(=O)O)C Amb10844513 [0,0,0,0,0,0|1,0,0]=1 259 B9R0.47 NCCCC[C@@H](N)C(N)=O Amb22800869 [0,0,0,0,0,0|1,0,0]=1 260 B9R0.47 NCCCC[C@@H](N)C(O)=O Amb22744766 [0,0,0,0,0,0|0,0,0]=0 261 B9R0.47 NCCCC[C@@H](N)C(O)=O Amb22746247 [0,0,0,0,0,0|0,0,0]=0 262 B9R0.47 NCCCC[C@@H](N)C(O)=O Amb22750565 [0,0,0,0,0,0|0,0,0]=0 263 B9R0.47 NCCCC[C@H](C(=O)O)N Amb10072417 [0,0,0,0,0,0|0,0,0]=0 264 B9R0.47 NCCCC[C@H](N)C(N)=O Amb25738519 [0,0,0,0,0,0|1,0,0]=1 265 B9R0.47 NCCCC[C@H](O)C(O)=O Amb25303562 [0,0,0,0,0,0|1,0,0]=1 266 B9R0.47 NCCCC[C@H]([15NH2])C(O)=O Amb22354049 [0,0,0,0,0,0|0,0,0]=0 267 B9R0.47 NCCCO[C@H](N)C(O)=O Amb25111856 [0,0,0,0,0,0|1,0,0]=1 268 B9R0.47 NCCCSC(F)C(O)=O Amb24717365 [0,0,0,0,0,0|2,0,0]=2 269 B9R0.47 NCCCSC(N)C(O)=O Amb24443705 [0,0,0,0,0,0|1,0,0]=1 270 B9R0.47 NCCC\C=C(\O)/C(O)=O Amb25077106 [0,0,0,0,0,0|1,0,2]=3 271 B9R0.47 NCCNCC(N)C(O)=O Amb25032175 [0,0,0,0,0,0|1,0,0]=1 272 B9R0.47 NCCNCC(O)C(N)=O Amb25307230 [0,0,0,0,0,0|3,0,0]=3 273 B9R0.47 NCCNCC(O)C(O)=O Amb25135297 [0,0,0,0,0,0|2,0,0]=2 274 B9R0.47 NCCNC[C@@H](N)C(O)=O Amb25147420 [0,0,0,0,0,0|1,0,0]=1 275 B9R0.47 NCCNC[C@H](N)C(O)=O Amb24580529 [0,0,0,0,0,0|1,0,0]=1 276 B9R0.47 NCCOC[C@@H](N)C(O)=O Amb22799590 [0,0,0,0,0,0|1,0,0]=1 277 B9R0.47 NCCOC[C@@H](N)C(O)=O Amb25679129 [0,0,0,0,0,0|1,0,0]=1 278 B9R0.47 NCCOC[C@H](N)C(O)=O Amb22231353 [0,0,0,0,0,0|1,0,0]=1 279 B9R0.47 NCCSCC(N)C(N)=O Amb24368331 [0,0,0,0,0,0|2,0,0]=2 280 B9R0.47 NCCSCC(N)C(O)=O Amb18126410 [0,0,0,0,0,0|1,0,0]=1 281 B9R0.47 NCCSC[C@@H](N)C(O)=O Amb22800706 [0,0,0,0,0,0|1,0,0]=1 282 B9R0.47 NCCSC[C@H](N)C(O)=O Amb22362775 [0,0,0,0,0,0|1,0,0]=1 283 B9R0.47 NC\C=C\CC(N)C(O)=O Amb22800680 [0,0,0,0,0,0|0,0,2]=2 284 B9R0.47 NC\C=C\C[C@H](N)C(O)=O Amb25339391 [0,0,0,0,0,0|0,0,2]=2 285 B9R0.47 NNCCCC(N)C(O)=O Amb24378076 [0,0,0,0,0,0|1,0,0]=1 286 B9R0.47 NNCCC[C@H](N)C(O)=O Amb24623157 [0,0,0,0,0,0|1,0,0]=1 287 B9R0.47 NOCCCC(N)C(O)=O Amb24117962 [0,0,0,0,0,0|1,0,0]=1 288 B9R0.47 N[13CH2]CCCC(N)C(O)=O Amb22367560 [0,0,0,0,0,0|0,0,0]=0 289 B9R0.47 N[13CH2][13CH2][13CH2][13CH2][13C@H](N)[13C](O)=O Amb22337497 [0,0,0,0,0,0|0,0,0]=0 290 B9R0.47 N[14CH2][14CH2][14CH2][14CH2][14CH](N)[14C](O)=O Amb22349598 [0,0,0,0,0,0|0,0,0]=0 291 B9R0.47 N[C@@H](C(=O)O)CSCC=C Amb10843878 [0,0,0,0,0,0|2,0,1]=3 292 B9R0.47 N[C@@H](CC#CCO)C(O)=O Amb24479056 [0,0,0,0,0,0|1,0,2]=3 293 B9R0.47 N[C@@H](CCCCO)C(O)=O Amb22900800 [0,0,0,0,0,0|1,0,0]=1 294 B9R0.47 N[C@@H](CCCCS)C(O)=O Amb25729289 [0,0,0,0,0,0|1,0,0]=1 295 B9R0.47 N[C@@H](CCCC[NH3+])C(O)=O Amb22801419 [0,0,0,0,0,0|0,0,1]=1 296 B9R0.47 N[C@@H](CCCNO)C(O)=O Amb25075377 [0,0,0,0,0,0|2,0,0]=2 297 B9R0.47 N[C@@H](CCNC#N)C(O)=O Amb24505130 [0,0,0,0,0,0|1,0,2]=3 298 B9R0.47 N[C@@H](CCNC=O)C(O)=O Amb24692356 [0,0,0,0,0,0|2,0,1]=3 299 B9R0.47 N[C@@H](CCNCO)C(O)=O Amb24760325 [0,0,0,0,0,0|2,0,0]=2 300 B9R0.47 N[C@@H](CCSC#N)C(O)=O Amb24482177 [0,0,0,0,0,0|1,0,2]=3 301 B9R0.47 N[C@@H](CCSN=O)C(O)=O Amb24665147 [0,0,0,0,0,0|3,0,0]=3 302 B9R0.47 N[C@@H](CNCCO)C(O)=O Amb25146307 [0,0,0,0,0,0|2,0,0]=2 303 B9R0.47 N[C@@H](COCCO)C(O)=O Amb24479093 [0,0,0,0,0,0|2,0,0]=2 304 B9R0.47 N[C@@H](CSCC#C)C(O)=O Amb17935864 [0,0,0,0,0,0|2,0,1]=3 305 B9R0.47 N[C@@H](CSCC#N)C(O)=O Amb18179968 [0,0,0,0,0,0|1,0,2]=3 306 B9R0.47 N[C@@H](CSSC#N)C(O)=O Amb24482252 [0,0,0,0,0,0|2,0,2]=4 307 B9R0.47 N[C@@H](CS\C=C\Cl)C(O)=O Amb24384379 [0,0,0,0,0,0|2,0,2]=4 308 B9R0.47 N[C@H](CNCCO)C(O)=O Amb24617539 [0,0,0,0,0,0|2,0,0]=2 309 B9R0.47 N[C@H](COCCCl)C(O)=O Amb24426914 [0,0,0,0,0,0|2,0,0]=2 310 B9R0.47 N[C@H](CSCC#N)C(O)=O Amb25837533 [0,0,0,0,0,0|1,0,2]=3 311 B9R0.47 N[C@H](\C=C\CCO)C(O)=O Amb24603441 [0,0,0,0,0,0|1,0,2]=3 312 B9R0.47 O=C(Cl)C(Br)CCCCCl Amb24716966 [0,0,0,0,0,0|3,0,0]=3 313 B9R0.47 O=CCCCC(C(=O)O)N Amb17619026 [0,0,0,0,0,0|1,0,1]=2 314 B9R0.47 OC(=O)C(=O)CCCC=O Amb25789953 [0,0,0,0,0,0|2,0,2]=4 315 B9R0.47 OC(=O)C(=O)CCCCF Amb25259949 [0,0,0,0,0,0|2,0,1]=3 316 B9R0.47 OC(=O)C(=O)NCCCO Amb24371547 [0,0,0,0,0,0|3,0,1]=4 317 B9R0.47 OC(=O)C(Br)CCCCBr Amb21964537 [0,0,0,0,0,0|2,0,0]=2 318 B9R0.47 OC(=O)C(Cl)CCCCCl Amb24442431 [0,0,0,0,0,0|2,0,0]=2 319 B9R0.47 OC(=O)C(F)CCCCF Amb24482414 [0,0,0,0,0,0|2,0,0]=2 320 B9R0.47 OC(CCNC=O)C(O)=O Amb24480985 [0,0,0,0,0,0|3,0,1]=4 321 B9R0.47 OCCCCC(O)C(O)=O Amb18644356 [0,0,0,0,0,0|2,0,0]=2 322 B9R0.47 OCCCC[C@H](O)C(O)=O Amb24480682 [0,0,0,0,0,0|2,0,0]=2 323 B9R0.47 OCCCSC(F)C(O)=O Amb24659088 [0,0,0,0,0,0|3,0,0]=3 324 B9R0.47 OCCNC[C@H](O)C(O)=O Amb25316160 [0,0,0,0,0,0|3,0,0]=3 325 B9R0.47 OCCSCC(O)C(O)=O Amb25211640 [0,0,0,0,0,0|3,0,0]=3 326 B9R0.47 O[C@@H](CCNC=O)C(O)=O Amb24481075 [0,0,0,0,0,0|3,0,1]=4 327 B9R0.47 [15NH2]CCCCC([15NH2])C(O)=O Amb22363194 [0,0,0,0,0,0|0,0,0]=0 328 B9R0.47 [15NH2]CCCC[C@H]([15NH2])C(O)=O Amb22353587 [0,0,0,0,0,0|0,0,0]=0 329 B9R0.47 [2H][13CH2]SCC[C@H](N)C(O)=O Amb22337395 [0,0,0,0,0,0|2,0,0]=2 330 B9R0.47 [N-]=[N+]=NCCC(N)C(O)=O Amb25766449 [0,0,0,0,0,0|2,0,1]=3 331 B9R0.47 [N-]=[N+]=NCCC(O)C(O)=O Amb25695933 [0,0,0,0,0,0|3,0,1]=4 332 B9R0.47 [N-]=[N+]=NCCC(S)C(O)=O Amb24398840 [0,0,0,0,0,0|3,0,1]=4 333 B9R0.47 [N-]=[N+]=NCC[C@@H](C(=O)O)N Amb16183915 [0,0,0,0,0,0|2,0,1]=3 334 B9R0.47 [N-]=[N+]=NCC[C@@H](N)C(O)=O Amb19130389 [0,0,0,0,0,0|2,0,1]=3 335 B8R0.6 C#CCCCC(N)C=O Amb25327827 [1,0,0,0,0,0|1,0,1]=3 336 B8R0.6 C#CCCC[C@H](N)CO Amb24550563 [1,0,0,0,0,0|1,0,2]=4 337 B8R0.6 C=C(CCCCBr)C=O Amb24480109 [1,0,0,0,0,0|2,0,1]=4 338 B8R0.6 C=CCCCC(N)C=C Amb18642351 [1,0,0,0,0,0|2,0,1]=4 339 B8R0.6 C=CCCCC(N)CO Amb25147202 [1,0,0,0,0,0|1,0,2]=4 340 B8R0.6 CC(C=C)NCCCN Amb25787465 [1,0,0,0,0,0|3,0,0]=4 341 B8R0.6 CC(C=C)OCCCN Amb25326104 [1,0,0,0,0,0|3,0,0]=4 342 B8R0.6 CC(C=C)SCCCN Amb25185108 [1,0,0,0,0,0|3,0,0]=4 343 B8R0.6 CC(CCCC#C)C=O Amb24478639 [1,0,0,0,0,0|2,0,1]=4 344 B8R0.6 CC(CCCC=O)C=O Amb18642651 [1,0,0,0,0,0|2,0,1]=4 345 B8R0.6 CC(CCCCBr)C=C Amb25690382 [1,0,0,0,0,0|3,0,0]=4 346 B8R0.6 CC(CCCCCl)C=O Amb24428839 [1,0,0,0,0,0|2,0,0]=3 347 B8R0.6 CC(CCCCO)C=O Amb25072654 [1,0,0,0,0,0|2,0,0]=3 348 B8R0.6 CC(CO)CCCCBr Amb24649978 [1,0,0,0,0,0|2,0,1]=4 349 B8R0.6 CC(CO)CNCCN Amb24481852 [1,0,0,0,0,0|2,0,1]=4 350 B8R0.6 CC(CO)COCCN Amb24524218 [1,0,0,0,0,0|2,0,1]=4 351 B8R0.6 CC(CO)CSCCN Amb25188927 [1,0,0,0,0,0|2,0,1]=4 352 B8R0.6 CC(CO)OCCCN Amb25083614 [1,0,0,0,0,0|2,0,1]=4 353 B8R0.6 CCC(C)CCCCN Amb25146190 [1,0,0,0,0,0|2,0,1]=4 354 B8R0.6 CCC(N)CCCCF Amb24482006 [1,0,0,0,0,0|2,0,1]=4 355 B8R0.6 CCC(N)CSCCN Amb25828304 [1,0,0,0,0,0|2,0,1]=4 356 B8R0.6 CCC(O)CCCCN Amb24411425 [1,0,0,0,0,0|2,0,1]=4 357 B8R0.6 CCCCCC(=C)C=O Amb18642442 [1,0,0,0,0,0|2,0,1]=4 358 B8R0.6 CCCCCC(=O)C=O Amb18642604 [1,0,0,0,0,0|2,0,1]=4 359 B8R0.6 CCCCCC(Br)C=C Amb17666912 [1,0,0,0,0,0|3,0,0]=4 360 B8R0.6 CCCCCC(C)CO Amb21618749 [1,0,0,0,0,0|2,0,1]=4 361 B8R0.6 CCCCCC(C=O)Br Amb17595055 [1,0,0,0,0,0|2,0,0]=3 362 B8R0.6 CCCCCC(C=O)C Amb17593349 [1,0,0,0,0,0|2,0,0]=3 363 B8R0.6 CCCCCC(Cl)C=C Amb24340311 [1,0,0,0,0,0|3,0,0]=4 364 B8R0.6 CCCCCC(Cl)C=O Amb18643792 [1,0,0,0,0,0|2,0,0]=3 365 B8R0.6 CCCCCC(F)CO Amb24724495 [1,0,0,0,0,0|2,0,1]=4 366 B8R0.6 CCCCCC(N)C=C Amb18642554 [1,0,0,0,0,0|2,0,0]=3 367 B8R0.6 CCCCCC(N)CO Amb24524295 [1,0,0,0,0,0|1,0,1]=3 368 B8R0.6 CCCCCC(O)C=O Amb18642802 [1,0,0,0,0,0|2,0,0]=3 369 B8R0.6 CCCCCC(O)CO Amb22227711 [1,0,0,0,0,0|2,0,1]=4 370 B8R0.6 CCCCCN(C)C=O Amb24524171 [1,0,0,0,0,0|3,0,0]=4 371 B8R0.6 CCCCC[C@@H](N)CO Amb24473164 [1,0,0,0,0,0|1,0,1]=3 372 B8R0.6 CCCCC[C@@H](O)C=O Amb24653719 [1,0,0,0,0,0|2,0,0]=3 373 B8R0.6 CCCCC[C@H](C)C=O Amb25717736 [1,0,0,0,0,0|2,0,0]=3 374 B8R0.6 CCCCC[C@H](F)CO Amb25222193 [1,0,0,0,0,0|2,0,1]=4 375 B8R0.6 CCCCC[C@H](N)C#C Amb25742849 [1,0,0,0,0,0|2,0,1]=4 376 B8R0.6 CCCCOC(C)C=O Amb18642805 [1,0,0,0,0,0|3,0,0]=4 377 B8R0.6 CCCCSC(C)C=O Amb18644295 [1,0,0,0,0,0|3,0,0]=4 378 B8R0.6 CCCOCC(N)C=C Amb24478664 [1,0,0,0,0,0|3,0,0]=4 379 B8R0.6 CCCOCC(N)CO Amb24681930 [1,0,0,0,0,0|2,0,1]=4 380 B8R0.6 CCCOCC(O)C=O Amb25217476 [1,0,0,0,0,0|3,0,0]=4 381 B8R0.6 CCCOC[C@@H](N)CO Amb25363717 [1,0,0,0,0,0|2,0,1]=4 382 B8R0.6 CCCSCC(N)C=C Amb25706335 [1,0,0,0,0,0|3,0,0]=4 383 B8R0.6 CCOCCC(N)C=C Amb25026264 [1,0,0,0,0,0|3,0,0]=4 384 B8R0.6 CCOCCC(N)C=O Amb25743805 [1,0,0,0,0,0|2,0,0]=3 385 B8R0.6 CCOCCC(N)CO Amb24388796 [1,0,0,0,0,0|2,0,1]=4 386 B8R0.6 CCSCCC(N)CO Amb25820753 [1,0,0,0,0,0|2,0,1]=4 387 B8R0.6 CC[C@H](C)CCCCN Amb24466420 [1,0,0,0,0,0|2,0,1]=4 388 B8R0.6 CNC(C)CCCCN Amb25709671 [1,0,0,0,0,0|3,0,0]=4 389 B8R0.6 COCCCC(O)C=O Amb25792325 [1,0,0,0,0,0|3,0,0]=4 390 B8R0.6 C[C@@H](CCCCBr)C=C Amb24432223 [1,0,0,0,0,0|3,0,0]=4 391 B8R0.6 C[C@H](CCCCO)CO Amb24407518 [1,0,0,0,0,0|2,0,1]=4 392 B8R0.6 NC(CCCCO)=NO Amb25250686 [1,0,0,0,0,0|2,0,1]=4 393 B8R0.6 NC(CO)CCCCF Amb24689590 [1,0,0,0,0,0|1,0,1]=3 394 B8R0.6 NC(CO)COCCF Amb25732255 [1,0,0,0,0,0|2,0,1]=4 395 B8R0.6 NCCCCC(=O)NO Amb24333337 [1,0,0,0,0,0|2,0,1]=4 396 B8R0.6 NCCCCC(N)C#N Amb24477887 [1,0,0,0,0,0|1,0,1]=3 397 B8R0.6 NCCCCC(N)CBr Amb24480286 [1,0,0,0,0,0|1,0,1]=3 398 B8R0.6 NCCCCC(N)CF Amb24746288 [1,0,0,0,0,0|1,0,1]=3 399 B8R0.6 NCCCCC(O)CN Amb25237523 [1,0,0,0,0,0|2,0,1]=4 400 B8R0.6 NCCCCC(O)CO Amb25146035 [1,0,0,0,0,0|1,0,1]=3 401 B8R0.6 NCCCCC(OC)C Amb17569941 [1,0,0,0,0,0|3,0,0]=4 402 B8R0.6 NCCCC[C@@H](N)CO Amb22745902 [1,0,0,0,0,0|0,0,1]=2 403 B8R0.6 NCCCC[C@@H](N)CO Amb22899644 [1,0,0,0,0,0|0,0,1]=2 404 B8R0.6 NCCCC[C@@H](N)CO Amb22899645 [1,0,0,0,0,0|0,0,1]=2 405 B8R0.6 NCCCC[C@@H](N)CS Amb25303104 [1,0,0,0,0,0|0,1,1]=3 406 B8R0.6 NCCCC[C@H](N)CBr Amb24557770 [1,0,0,0,0,0|1,0,1]=3 407 B8R0.6 NCCOCC(O)CO Amb25707105 [1,0,0,0,0,0|2,0,1]=4 408 B8R0.6 NCCSCC(O)CO Amb21978836 [1,0,0,0,0,0|2,0,1]=4 409 B8R0.6 N[C@@H](CCCCO)CO Amb25146173 [1,0,0,0,0,0|1,0,1]=3 410 B8R0.6 N[C@@H](CO)COCCF Amb24666126 [1,0,0,0,0,0|2,0,1]=4 411 B8R0.6 N[C@H](COCCO)CO Amb24451328 [1,0,0,0,0,0|2,0,1]=4 412 B8R0.6 O=CC(Cl)COCCCl Amb24480060 [1,0,0,0,0,0|3,0,0]=4 413 B8R0.6 OC(CCCC=O)C=O Amb18642788 [1,0,0,0,0,0|2,0,1]=4 414 B8R0.6 OCC(F)CCCCCl Amb24480364 [1,0,0,0,0,0|2,0,1]=4 415 B8R0.6 OCCCCC(CO)N Amb17593402 [1,0,0,0,0,0|1,0,1]=3 416 B8R0.6 OCCCC[C@@H](O)CO Amb25800817 [1,0,0,0,0,0|2,0,1]=4 417 B8R0.6 OC[C@@H](F)CCCCCl Amb25068378 [1,0,0,0,0,0|2,0,1]=4 418 B8R0.7 BrCCCCCC(=O)O Amb2081955 [1,0,0,0,0,0|1,0,0]=2 419 B8R0.7 C#CCCCCC(N)=O Amb25112030 [1,0,0,0,0,0|2,0,1]=4 420 B8R0.7 C=C(Br)CNCCCN Amb18330318 [1,0,0,0,0,0|3,0,0]=4 421 B8R0.7 C=C(Br)COCCCN Amb18324685 [1,0,0,0,0,0|3,0,0]=4 422 B8R0.7 C=C(Cl)CNCCCN Amb25180017 [1,0,0,0,0,0|3,0,0]=4 423 B8R0.7 C=C(Cl)CSCCCN Amb25094992 [1,0,0,0,0,0|3,0,0]=4 424 B8R0.7 C=CCCCCC(=O)Cl Amb24528269 [1,0,0,0,0,0|2,0,1]=4 425 B8R0.7 C=CCCNCC(O)=O Amb25308652 [1,0,0,0,0,0|2,0,1]=4 426 B8R0.7 C=CNCCCC(O)=O Amb25146209 [1,0,0,0,0,0|2,0,1]=4 427 B8R0.7 CC(=C)CCCCCN Amb24481805 [1,0,0,0,0,0|2,0,0]=3 428 B8R0.7 CC(=C)CCNCCN Amb24481806 [1,0,0,0,0,0|3,0,0]=4 429 B8R0.7 CC(=N)NCCCCN Amb25716162 [1,0,0,0,0,0|3,0,0]=4 430 B8R0.7 CC(=O)CCCCC#C Amb25303675 [1,0,0,0,0,0|2,0,1]=4 431 B8R0.7 CC(=O)CCCCC#N Amb18642300 [1,0,0,0,0,0|1,0,2]=4 432 B8R0.7 CC(=O)CCCCC=C Amb24546961 [1,0,0,0,0,0|2,0,1]=4 433 B8R0.7 CC(=O)CCCCC=O Amb18642609 [1,0,0,0,0,0|2,0,1]=4 434 B8R0.7 CC(=O)CCCCCF Amb25373197 [1,0,0,0,0,0|2,0,0]=3 435 B8R0.7 CC(=O)CCCCCN Amb22641918 [1,0,0,0,0,0|1,0,0]=2 436 B8R0.7 CC(=O)CCCCCN Amb24113384 [1,0,0,0,0,0|1,0,0]=2 437 B8R0.7 CC(=O)CCNCCO Amb24481900 [1,0,0,0,0,0|3,0,0]=4 438 B8R0.7 CC(=O)CCOCCN Amb18628609 [1,0,0,0,0,0|2,0,0]=3 439 B8R0.7 CC(=O)CCOCCO Amb24691100 [1,0,0,0,0,0|3,0,0]=4 440 B8R0.7 CC(=O)COCCCF Amb24696366 [1,0,0,0,0,0|3,0,0]=4 441 B8R0.7 CC(=O)COCCCN Amb18630475 [1,0,0,0,0,0|2,0,0]=3 442 B8R0.7 CC(=O)NCCCCN Amb21520291 [1,0,0,0,0,0|2,0,0]=3 443 B8R0.7 CC(=O)NNCCCN Amb25726088 [1,0,0,0,0,0|3,0,0]=4 444 B8R0.7 CC(=O)OCCCCF Amb24393797 [1,0,0,0,0,0|3,0,0]=4 445 B8R0.7 CC(=O)OCCCCN Amb24657282 [1,0,0,0,0,0|2,0,0]=3 446 B8R0.7 CC(=O)OCCCCO Amb25714960 [1,0,0,0,0,0|3,0,0]=4 447 B8R0.7 CC(=O)OCCCCS Amb24431588 [1,0,0,0,0,0|3,0,0]=4 448 B8R0.7 CC(=O)SCCCCBr Amb22641871 [1,0,0,0,0,0|3,0,0]=4 449 B8R0.7 CC(=O)SCCCCN Amb24117263 [1,0,0,0,0,0|2,0,0]=3 450 B8R0.7 CC(=O)SCCCCO Amb25049205 [1,0,0,0,0,0|3,0,0]=4 451 B8R0.7 CC(C)CCCCCN Amb18124327 [1,0,0,0,0,0|2,0,1]=4 452 B8R0.7 CC(N)CCCCCN Amb24401531 [1,0,0,0,0,0|2,0,1]=4 453 B8R0.7 CC(O)CCCCCN Amb24761457 [1,0,0,0,0,0|1,0,1]=3 454 B8R0.7 CC(O)CCSCCN Amb25347026 [1,0,0,0,0,0|2,0,1]=4 455 B8R0.7 CC(O)CSCCCN Amb25188929 [1,0,0,0,0,0|2,0,1]=4 456 B8R0.7 CCCC#CCC(=O)O Amb17593307 [1,0,0,0,0,0|1,0,2]=4 457 B8R0.7 CCCC/C=C/C(O)=O Amb17778752 [1,0,0,0,0,0|1,0,2]=4 458 B8R0.7 CCCCCCC(N)O Amb25368398 [1,0,0,0,0,0|2,0,1]=4 459 B8R0.7 CCCCCCC([O-])=O Amb22729026 [1,0,0,0,0,0|1,0,1]=3 460 B8R0.7 CCCCCCS(O)=O Amb25213753 [1,0,0,0,0,0|2,0,0]=3 461 B8R0.7 CCCCCC[N+](=O)[O-] Amb17618424 [1,0,0,0,0,0|2,0,1]=4 462 B8R0.7 CCCCCNC(=O)Cl Amb25087634 [1,0,0,0,0,0|3,0,0]=4 463 B8R0.7 CCCCCNC(C)=O Amb17797593 [1,0,0,0,0,0|3,0,0]=4 464 B8R0.7 CCCCCOC(=O)Cl Amb10844803 [1,0,0,0,0,0|3,0,0]=4 465 B8R0.7 CCCCCOC(C)=O Amb22351262 [1,0,0,0,0,0|3,0,0]=4 466 B8R0.7 CCCCCOS(O)=O Amb22730504 [1,0,0,0,0,0|3,0,0]=4 467 B8R0.7 CCCCNCC(=O)N Amb1126543 [1,0,0,0,0,0|3,0,0]=4 468 B8R0.7 CCCCOCC(=O)Cl Amb25806749 [1,0,0,0,0,0|3,0,0]=4 469 B8R0.7 CCCCSCC(=O)O Amb1138789 [1,0,0,0,0,0|2,0,0]=3 470 B8R0.7 CCCNCCC(=O)O Amb2372065 [1,0,0,0,0,0|2,0,0]=3 471 B8R0.7 CCCNCCC(C)=O Amb24700442 [1,0,0,0,0,0|3,0,0]=4 472 B8R0.7 CCCNCCC(N)=O Amb19960057 [1,0,0,0,0,0|3,0,0]=4 473 B8R0.7 CCCNCCC(O)=O Amb18633174 [1,0,0,0,0,0|2,0,0]=3 474 B8R0.7 CCCSCCC(N)=O Amb24333543 [1,0,0,0,0,0|3,0,0]=4 475 B8R0.7 CCCSSCC(O)=O Amb25209982 [1,0,0,0,0,0|3,0,0]=4 476 B8R0.7 CCC\C=C\CC(O)=O Amb18642602 [1,0,0,0,0,0|1,0,2]=4 477 B8R0.7 CCNCCCC(C)=O Amb24093735 [1,0,0,0,0,0|3,0,0]=4 478 B8R0.7 CCNCCCC(N)=O Amb24709859 [1,0,0,0,0,0|3,0,0]=4 479 B8R0.7 CCOCCCC(N)=O Amb25841206 [1,0,0,0,0,0|3,0,0]=4 480 B8R0.7 CCOCOCC(O)=O Amb25682215 [1,0,0,0,0,0|3,0,0]=4 481 B8R0.7 CCOCSCC(O)=O Amb25147004 [1,0,0,0,0,0|3,0,0]=4 482 B8R0.7 CC\C=C/CCC(O)=O Amb25831265 [1,0,0,0,0,0|1,0,2]=4 483 B8R0.7 CC\C=C\CCC(O)=O Amb18642608 [1,0,0,0,0,0|1,0,2]=4 484 B8R0.7 CNCCCCC(=O)O Amb10605773 [1,0,0,0,0,0|2,0,0]=3 485 B8R0.7 CNCCCCC(C)=O Amb18642717 [1,0,0,0,0,0|3,0,0]=4 486 B8R0.7 CNCCCCC(O)=O Amb24340485 [1,0,0,0,0,0|2,0,0]=3 487 B8R0.7 CNCCNCC(O)=O Amb25211792 [1,0,0,0,0,0|3,0,0]=4 488 B8R0.7 CNCCOCC(O)=O Amb18630741 [1,0,0,0,0,0|3,0,0]=4 489 B8R0.7 COCCNCC(O)=O Amb19514667 [1,0,0,0,0,0|3,0,0]=4 490 B8R0.7 CONCCCC(O)=O Amb24647348 [1,0,0,0,0,0|3,0,0]=4 491 B8R0.7 CS(=O)CCCCCN Amb25133466 [1,0,0,0,0,0|2,0,0]=3 492 B8R0.7 CS(=O)CCCCCO Amb25243806 [1,0,0,0,0,0|3,0,0]=4 493 B8R0.7 CS(=O)CCNCCN Amb25140378 [1,0,0,0,0,0|3,0,0]=4 494 B8R0.7 CS(=O)NCCCCN Amb24565136 [1,0,0,0,0,0|3,0,0]=4 495 B8R0.7 CSCCCCC(=O)O Amb17503764 [1,0,0,0,0,0|2,0,0]=3 496 B8R0.7 CSCCNCC(O)=O Amb24401934 [1,0,0,0,0,0|3,0,0]=4 497 B8R0.7 CSSCCCC(O)=O Amb25269470 [1,0,0,0,0,0|3,0,0]=4 498 B8R0.7 C\C=C/CCCC(O)=O Amb25314407 [1,0,0,0,0,0|1,0,2]=4 499 B8R0.7 C\C=C\CCCC(O)=O Amb18642615 [1,0,0,0,0,0|1,0,2]=4 500 B8R0.7 ClCCCCCC(=O)Cl Amb10844967 [1,0,0,0,0,0|2,0,0]=3 501 B8R0.7 N#CCCCCC(=O)O Amb17593332 [1,0,0,0,0,0|0,0,2]=3 502 B8R0.7 N#CCCCCC(=O)[Zn+] Amb24062904 [1,0,0,0,0,0|1,0,2]=4 503 B8R0.7 N#CCCSCC(=O)O Amb17502363 [1,0,0,0,0,0|1,0,2]=4 504 B8R0.7 NC(=N)CCCCCF Amb24693216 [1,0,0,0,0,0|3,0,0]=4 505 B8R0.7 NC(=O)CCCCC#N Amb24108037 [1,0,0,0,0,0|1,0,2]=4 506 B8R0.7 NC(=O)CCCCCO Amb22524369 [1,0,0,0,0,0|2,0,0]=3 507 B8R0.7 NC(=O)CCNCCF Amb25073678 [1,0,0,0,0,0|3,0,0]=4 508 B8R0.7 NC(=O)CCNCCO Amb19960060 [1,0,0,0,0,0|3,0,0]=4 509 B8R0.7 NC(=O)CCNCCS Amb18644377 [1,0,0,0,0,0|3,0,0]=4 510 B8R0.7 NC(=O)CCSCCS Amb25248299 [1,0,0,0,0,0|3,0,0]=4 511 B8R0.7 NC(=O)CNCCCF Amb24687040 [1,0,0,0,0,0|3,0,0]=4 512 B8R0.7 NC(=O)NCCCCO Amb25146104 [1,0,0,0,0,0|3,0,0]=4 513 B8R0.7 NC(=S)CCCCCBr Amb24596794 [1,0,0,0,0,0|2,1,0]=4 514 B8R0.7 NC(=S)CCCCCO Amb24562810 [1,0,0,0,0,0|2,1,0]=4 515 B8R0.7 NCCCCC=C(Cl)Cl Amb25786790 [1,0,0,0,0,0|2,0,1]=4 516 B8R0.7 NCCCCC=C(F)F Amb25063284 [1,0,0,0,0,0|2,0,1]=4 517 B8R0.7 NCCCCCB(O)O Amb25049233 [1,0,0,0,0,0|1,0,1]=3 518 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [1,0,0,0,0,0|1,0,0]=2 519 B8R0.7 NCCCCCC(=O)O Amb17607928 [1,0,0,0,0,0|0,0,0]=1 520 B8R0.7 NCCCCCC(=O)O Amb1905625 [1,0,0,0,0,0|0,0,0]=1 521 B8R0.7 NCCCCCC(Cl)Cl Amb25188938 [1,0,0,0,0,0|2,0,1]=4 522 B8R0.7 NCCCCN=C(N)N Amb16184046 [1,0,0,0,0,0|3,0,0]=4 523 B8R0.7 NCCCCNC(=O)C Amb17053700 [1,0,0,0,0,0|2,0,0]=3 524 B8R0.7 NCCCCNC(=O)S Amb25328775 [1,0,0,0,0,0|1,1,0]=3 525 B8R0.7 NCCCCNC(N)=N Amb19929571 [1,0,0,0,0,0|3,0,0]=4 526 B8R0.7 NCCCCNC(N)=N Amb22264641 [1,0,0,0,0,0|3,0,0]=4 527 B8R0.7 NCCCCNC(N)=O Amb19026975 [1,0,0,0,0,0|2,0,0]=3 528 B8R0.7 NCCCCNC(N)=O Amb19374296 [1,0,0,0,0,0|2,0,0]=3 529 B8R0.7 NCCCCOC(=O)Cl Amb25320806 [1,0,0,0,0,0|2,0,0]=3 530 B8R0.7 NCCCCSC(N)=N Amb25349389 [1,0,0,0,0,0|3,0,0]=4 531 B8R0.7 NCCCNCC(O)=O Amb22733138 [1,0,0,0,0,0|1,0,0]=2 532 B8R0.7 NCCCNCC(O)=O Amb25848815 [1,0,0,0,0,0|1,0,0]=2 533 B8R0.7 NCCCOCC(N)=O Amb24433775 [1,0,0,0,0,0|2,0,0]=3 534 B8R0.7 NCCCOCC(O)=O Amb18111435 [1,0,0,0,0,0|1,0,0]=2 535 B8R0.7 NCCCSCC(=C)C Amb17500707 [1,0,0,0,0,0|3,0,0]=4 536 B8R0.7 NCCCSCC(=O)O Amb17500676 [1,0,0,0,0,0|1,0,0]=2 537 B8R0.7 NCCCSCC(N)=O Amb25194513 [1,0,0,0,0,0|2,0,0]=3 538 B8R0.7 NCCC\C=C\C(O)=O Amb22054306 [1,0,0,0,0,0|0,0,2]=3 539 B8R0.7 NCCC\C=C\C(O)=O Amb25221789 [1,0,0,0,0,0|0,0,2]=3 540 B8R0.7 NCCNCCC(O)=O Amb20668304 [1,0,0,0,0,0|1,0,0]=2 541 B8R0.7 NCCNCCC(O)=O Amb22058790 [1,0,0,0,0,0|1,0,0]=2 542 B8R0.7 NCCNOCC(N)=O Amb25257314 [1,0,0,0,0,0|3,0,0]=4 543 B8R0.7 NCCOCCC(O)=O Amb18630461 [1,0,0,0,0,0|1,0,0]=2 544 B8R0.7 NCCSCCB(O)O Amb25041580 [1,0,0,0,0,0|2,0,1]=4 545 B8R0.7 NCCSCCC(O)=O Amb21988844 [1,0,0,0,0,0|1,0,0]=2 546 B8R0.7 NCCS\C=C\C(O)=O Amb18644341 [1,0,0,0,0,0|1,0,2]=4 547 B8R0.7 NC\C=C\CCC(O)=O Amb24411351 [1,0,0,0,0,0|0,0,2]=3 548 B8R0.7 NOCCCCC(=O)O Amb10975955 [1,0,0,0,0,0|1,0,0]=2 549 B8R0.7 NOCCCNC(=O)C Amb17138378 [1,0,0,0,0,0|3,0,0]=4 550 B8R0.7 O=C(Cl)CCSCCCl Amb25361104 [1,0,0,0,0,0|3,0,0]=4 551 B8R0.7 O=C(Cl)COCCCCl Amb25059159 [1,0,0,0,0,0|3,0,0]=4 552 B8R0.7 O=C(Cl)CSCCCCl Amb24479935 [1,0,0,0,0,0|3,0,0]=4 553 B8R0.7 O=C(F)OCCCCCl Amb24416872 [1,0,0,0,0,0|3,0,0]=4 554 B8R0.7 OB(O)CCCCCBr Amb21856239 [1,0,0,0,0,0|2,0,1]=4 555 B8R0.7 OB(O)CCCCCCl Amb25047934 [1,0,0,0,0,0|2,0,1]=4 556 B8R0.7 OC(=O)C#CCCCCl Amb24347497 [1,0,0,0,0,0|1,0,2]=4 557 B8R0.7 OC(=O)CCCCC=O Amb18642763 [1,0,0,0,0,0|1,0,1]=3 558 B8R0.7 OC(=O)CCCCCCl Amb18796646 [1,0,0,0,0,0|1,0,0]=2 559 B8R0.7 OC(=O)CCCCCI Amb22736492 [1,0,0,0,0,0|1,0,0]=2 560 B8R0.7 OC(=O)CCCCCS Amb18644374 [1,0,0,0,0,0|1,0,0]=2 561 B8R0.7 OC(=O)CCCNC=O Amb18305404 [1,0,0,0,0,0|2,0,1]=4 562 B8R0.7 OC(=O)CCC\C=C\Br Amb24518554 [1,0,0,0,0,0|1,0,2]=4 563 B8R0.7 OC(=O)CCC\C=C\Cl Amb18644381 [1,0,0,0,0,0|1,0,2]=4 564 B8R0.7 OC(=O)CCNCN=O Amb25311838 [1,0,0,0,0,0|3,0,0]=4 565 B8R0.7 OC(=O)CCOCCBr Amb24057757 [1,0,0,0,0,0|2,0,0]=3 566 B8R0.7 OC(=O)CCSCCCl Amb24097450 [1,0,0,0,0,0|2,0,0]=3 567 B8R0.7 OC(=O)CCSCCS Amb18126456 [1,0,0,0,0,0|2,0,0]=3 568 B8R0.7 OC(=O)CC\C=C\CBr Amb24635578 [1,0,0,0,0,0|1,0,2]=4 569 B8R0.7 OC(=O)CNCCCBr Amb25765814 [1,0,0,0,0,0|2,0,0]=3 570 B8R0.7 OC(=O)CNCCCS Amb25268354 [1,0,0,0,0,0|2,0,0]=3 571 B8R0.7 OC(=O)COCCCBr Amb24594816 [1,0,0,0,0,0|2,0,0]=3 572 B8R0.7 OC(=O)COCCCF Amb24481828 [1,0,0,0,0,0|2,0,0]=3 573 B8R0.7 OC(=O)CSCCCBr Amb25771711 [1,0,0,0,0,0|2,0,0]=3 574 B8R0.7 OC(=O)CSCCCCl Amb18126548 [1,0,0,0,0,0|2,0,0]=3 575 B8R0.7 OC(=O)CSCCCF Amb25676986 [1,0,0,0,0,0|2,0,0]=3 576 B8R0.7 OC(=O)\C=C\CCCBr Amb24446659 [1,0,0,0,0,0|1,0,2]=4 577 B8R0.7 OC(=O)\C=C\CCCCl Amb18644386 [1,0,0,0,0,0|1,0,2]=4 578 B8R0.7 OCCCCNC(=O)C Amb17102977 [1,0,0,0,0,0|3,0,0]=4 579 B8R0.7 OCCCSCC(=O)C Amb17502845 [1,0,0,0,0,0|3,0,0]=4 580 B8R0.7 OCCC\C=C\C(O)=O Amb18642790 [1,0,0,0,0,0|1,0,2]=4 581 B8R0.7 OCCNCCC(=O)O Amb1110010 [1,0,0,0,0,0|2,0,0]=3 582 B8R0.7 OC\C=C\CCC(O)=O Amb24639124 [1,0,0,0,0,0|1,0,2]=4 583 B8R0.7 OP(=O)OCCCCBr Amb25322865 [1,0,0,0,0,0|3,0,0]=4 584 B8R0.7 [N-]=[N+]=NCCCC(=O)O Amb10575820 [1,0,0,0,0,0|2,0,1]=4 585 B8R0.7 [O-]C(=O)CCCCCO Amb22491268 [1,0,0,0,0,0|1,0,1]=3 586 B8R0.8 C#CCCC(N)C(N)=O Amb25703121 [1,0,0,0,0,0|1,0,2]=4 587 B8R0.8 C#CCC[C@@H](N)C(N)=O Amb25368154 [1,0,0,0,0,0|1,0,2]=4 588 B8R0.8 C#CCC[C@@H](N)C(O)=O Amb24088809 [1,0,0,0,0,0|0,0,2]=3 589 B8R0.8 C#CCC[C@H](N)C(O)=O Amb24088866 [1,0,0,0,0,0|0,0,2]=3 590 B8R0.8 C=C(CCCN)C(O)=O Amb18642697 [1,0,0,0,0,0|1,0,1]=3 591 B8R0.8 C=C(CCON)C(O)=O Amb25859256 [1,0,0,0,0,0|2,0,1]=4 592 B8R0.8 C=C=CCC(N)C(O)=O Amb25843448 [1,0,0,0,0,0|0,0,3]=4 593 B8R0.8 C=C=CC[C@H](N)C(O)=O Amb24355608 [1,0,0,0,0,0|0,0,3]=4 594 B8R0.8 C=CCCC(Cl)C(O)=O Amb25041973 [1,0,0,0,0,0|1,0,2]=4 595 B8R0.8 C=CCCC(N)C(N)=O Amb24333721 [1,0,0,0,0,0|1,0,2]=4 596 B8R0.8 C=CCCC(N)C(O)=O Amb24383848 [1,0,0,0,0,0|0,0,2]=3 597 B8R0.8 C=CCC[C@@H](N)C(O)=O Amb23439045 [1,0,0,0,0,0|0,0,2]=3 598 B8R0.8 CC#CCC(N)C(N)=O Amb25793338 [1,0,0,0,0,0|1,0,2]=4 599 B8R0.8 CC#CCC(N)C(O)=O Amb18988250 [1,0,0,0,0,0|0,0,2]=3 600 B8R0.8 CC#CCC(O)C(O)=O Amb25213344 [1,0,0,0,0,0|1,0,2]=4 601 B8R0.8 CC#CC[C@@H](C)C(O)=O Amb24589724 [1,0,0,0,0,0|1,0,2]=4 602 B8R0.8 CC#CC[C@@H](N)C(N)=O Amb25324867 [1,0,0,0,0,0|1,0,2]=4 603 B8R0.8 CC#CC[C@@H](N)C(O)=O Amb22746783 [1,0,0,0,0,0|0,0,2]=3 604 B8R0.8 CC(=O)C(Br)CCCO Amb25146214 [1,0,0,0,0,0|3,0,0]=4 605 B8R0.8 CC(=O)C(Cl)CCCCl Amb24340131 [1,0,0,0,0,0|3,0,0]=4 606 B8R0.8 CC(=O)C(O)CCCO Amb24364072 [1,0,0,0,0,0|3,0,0]=4 607 B8R0.8 CC(C(=O)O)CNCC Amb13952782 [1,0,0,0,0,0|2,0,0]=3 608 B8R0.8 CC(C(=O)O)SCCN Amb17500447 [1,0,0,0,0,0|2,0,0]=3 609 B8R0.8 CC(C)[C@H](N)CCCC Amb25103904 [1,0,0,0,0,0|2,0,1]=4 610 B8R0.8 CC(CCC#N)C(O)=O Amb24462559 [1,0,0,0,0,0|1,0,2]=4 611 B8R0.8 CC(CCC=C)C(O)=O Amb18642656 [1,0,0,0,0,0|1,0,2]=4 612 B8R0.8 CC(CCC=O)C(O)=O Amb18642767 [1,0,0,0,0,0|2,0,1]=4 613 B8R0.8 CC(CCCBr)C(=O)Cl Amb24722839 [1,0,0,0,0,0|3,0,0]=4 614 B8R0.8 CC(CCCBr)C(C)=O Amb25362168 [1,0,0,0,0,0|3,0,0]=4 615 B8R0.8 CC(CCCBr)C(O)=O Amb25321670 [1,0,0,0,0,0|2,0,0]=3 616 B8R0.8 CC(CCCF)C(O)=O Amb25244585 [1,0,0,0,0,0|2,0,0]=3 617 B8R0.8 CC(CCCN)C(C)=O Amb25774001 [1,0,0,0,0,0|2,0,0]=3 618 B8R0.8 CC(CCCN)C(O)=O Amb25146072 [1,0,0,0,0,0|1,0,0]=2 619 B8R0.8 CC(CCCO)C(=O)S Amb25221473 [1,0,0,0,0,0|2,1,0]=4 620 B8R0.8 CC(CCCS)C(C)=O Amb25807409 [1,0,0,0,0,0|3,0,0]=4 621 B8R0.8 CC(N)C(N)CCCC Amb25162797 [1,0,0,0,0,0|2,0,1]=4 622 B8R0.8 CC(NCCCl)C(O)=O Amb25145942 [1,0,0,0,0,0|3,0,0]=4 623 B8R0.8 CC(NCCN)C(O)=O Amb18523860 [1,0,0,0,0,0|2,0,0]=3 624 B8R0.8 CC(O)C(N)CCCC Amb24351619 [1,0,0,0,0,0|1,0,1]=3 625 B8R0.8 CC(O)C(O)CCCC Amb25128970 [1,0,0,0,0,0|2,0,1]=4 626 B8R0.8 CC(OCCCl)C(O)=O Amb24481693 [1,0,0,0,0,0|3,0,0]=4 627 B8R0.8 CC(OCCN)C(C)=O Amb18111235 [1,0,0,0,0,0|3,0,0]=4 628 B8R0.8 CC(OCCN)C(N)=O Amb19020756 [1,0,0,0,0,0|3,0,0]=4 629 B8R0.8 CC(OCCN)C(O)=O Amb18630157 [1,0,0,0,0,0|2,0,0]=3 630 B8R0.8 CC(OCCN)C(O)=O Amb22546285 [1,0,0,0,0,0|2,0,0]=3 631 B8R0.8 CC(SCCF)C(O)=O Amb25314013 [1,0,0,0,0,0|3,0,0]=4 632 B8R0.8 CCC#CC(O)C(O)=O Amb25245439 [1,0,0,0,0,0|1,0,2]=4 633 B8R0.8 CCCCC(=C)C(N)=O Amb24574376 [1,0,0,0,0,0|2,0,1]=4 634 B8R0.8 CCCCC(=C)C(O)=O Amb18642649 [1,0,0,0,0,0|1,0,1]=3 635 B8R0.8 CCCCC(=O)C(O)=O Amb18642761 [1,0,0,0,0,0|1,0,1]=3 636 B8R0.8 CCCCC(=O)C(O)=O Amb22348245 [1,0,0,0,0,0|1,0,1]=3 637 B8R0.8 CCCCC(Br)C(=O)Br Amb22347914 [1,0,0,0,0,0|2,0,0]=3 638 B8R0.8 CCCCC(Br)C(C)=C Amb25718999 [1,0,0,0,0,0|3,0,0]=4 639 B8R0.8 CCCCC(Br)C(N)=N Amb25109246 [1,0,0,0,0,0|3,0,0]=4 640 B8R0.8 CCCCC(Br)C(N)=O Amb19514624 [1,0,0,0,0,0|2,0,0]=3 641 B8R0.8 CCCCC(Br)[N+]([O-])=O Amb24626944 [1,0,0,0,0,0|2,0,1]=4 642 B8R0.8 CCCCC(C(=O)C)N Amb1099238 [1,0,0,0,0,0|1,0,0]=2 643 B8R0.8 CCCCC(C(=O)Cl)Br Amb17569836 [1,0,0,0,0,0|2,0,0]=3 644 B8R0.8 CCCCC(C(=O)O)Cl Amb17593750 [1,0,0,0,0,0|1,0,0]=2 645 B8R0.8 CCCCC(C)C(N)=N Amb24452705 [1,0,0,0,0,0|3,0,0]=4 646 B8R0.8 CCCCC(Cl)B(O)O Amb25102593 [1,0,0,0,0,0|2,0,1]=4 647 B8R0.8 CCCCC(Cl)C(=O)Cl Amb24634189 [1,0,0,0,0,0|2,0,0]=3 648 B8R0.8 CCCCC(F)C(O)=O Amb25238781 [1,0,0,0,0,0|1,0,0]=2 649 B8R0.8 CCCCC(I)C(C)=O Amb25314130 [1,0,0,0,0,0|2,0,0]=3 650 B8R0.8 CCCCC(N)C(C)=C Amb24353636 [1,0,0,0,0,0|2,0,0]=3 651 B8R0.8 CCCCC(N)C(C)=O Amb22284085 [1,0,0,0,0,0|1,0,0]=2 652 B8R0.8 CCCCC(N)C(N)=O Amb18303664 [1,0,0,0,0,0|1,0,0]=2 653 B8R0.8 CCCCC(N)C(N)=S Amb24764229 [1,0,0,0,0,0|1,1,0]=3 654 B8R0.8 CCCCC(N)P(O)O Amb24433379 [1,0,0,0,0,0|1,0,1]=3 655 B8R0.8 CCCCC(O)C(=C)Cl Amb24379883 [1,0,0,0,0,0|3,0,0]=4 656 B8R0.8 CCCCC(O)C(N)=O Amb24116640 [1,0,0,0,0,0|2,0,0]=3 657 B8R0.8 CCCCC(S)C(O)=O Amb25323873 [1,0,0,0,0,0|1,0,0]=2 658 B8R0.8 CCCCN(Cl)C(N)=O Amb25147019 [1,0,0,0,0,0|3,0,0]=4 659 B8R0.8 CCCCN(N)C(N)=S Amb24383128 [1,0,0,0,0,0|2,1,0]=4 660 B8R0.8 CCCC[C@@H](Br)C(=O)Cl Amb24695956 [1,0,0,0,0,0|2,0,0]=3 661 B8R0.8 CCCC[C@@H](Br)C(O)=O Amb24377169 [1,0,0,0,0,0|1,0,0]=2 662 B8R0.8 CCCC[C@@H](C(=O)O)N Amb1995007 [1,0,0,0,0,0|0,0,0]=1 663 B8R0.8 CCCC[C@@H](C)C(C)=O Amb25318801 [1,0,0,0,0,0|2,0,0]=3 664 B8R0.8 CCCC[C@@H](C)C(O)=O Amb24590691 [1,0,0,0,0,0|1,0,0]=2 665 B8R0.8 CCCC[C@@H](C)[C@@H](C)O Amb24332094 [1,0,0,0,0,0|2,0,1]=4 666 B8R0.8 CCCC[C@@H](N)C(N)=O Amb23438981 [1,0,0,0,0,0|1,0,0]=2 667 B8R0.8 CCCC[C@@H](S)C(O)=O Amb24478188 [1,0,0,0,0,0|1,0,0]=2 668 B8R0.8 CCCC[C@H](C(=O)O)N Amb1995006 [1,0,0,0,0,0|0,0,0]=1 669 B8R0.8 CCCC[C@H](C)C(C)=O Amb25767789 [1,0,0,0,0,0|2,0,0]=3 670 B8R0.8 CCCC[C@H](C)C(O)=O Amb25850678 [1,0,0,0,0,0|1,0,0]=2 671 B8R0.8 CCCC[C@H](N)C(N)=O Amb25361837 [1,0,0,0,0,0|1,0,0]=2 672 B8R0.8 CCCC[C@H](O)C(C)=O Amb24691364 [1,0,0,0,0,0|2,0,0]=3 673 B8R0.8 CCCNC(C)C(C)=O Amb18642716 [1,0,0,0,0,0|3,0,0]=4 674 B8R0.8 CCCOC(=C)C(O)=O Amb18642781 [1,0,0,0,0,0|2,0,1]=4 675 B8R0.8 CCCO[C@H](C)C(O)=O Amb25721817 [1,0,0,0,0,0|2,0,0]=3 676 B8R0.8 CCC\C=C(/N)\C(N)=O Amb25146004 [1,0,0,0,0,0|1,0,2]=4 677 B8R0.8 CCC\C=C(\N)/C(N)=O Amb24515061 [1,0,0,0,0,0|1,0,2]=4 678 B8R0.8 CCNCC(=C)C(O)=O Amb24368916 [1,0,0,0,0,0|2,0,1]=4 679 B8R0.8 CCNCC(C)C(C)=O Amb18642729 [1,0,0,0,0,0|3,0,0]=4 680 B8R0.8 CCNCC(N)C(N)=O Amb25841908 [1,0,0,0,0,0|2,0,0]=3 681 B8R0.8 CCOCC(C)C(C)=O Amb24621069 [1,0,0,0,0,0|3,0,0]=4 682 B8R0.8 CCOCC(Cl)C(O)=O Amb24481790 [1,0,0,0,0,0|2,0,0]=3 683 B8R0.8 CCOCC(O)C(O)=O Amb25804394 [1,0,0,0,0,0|2,0,0]=3 684 B8R0.8 CCOC[C@@H](C)C(O)=O Amb25790635 [1,0,0,0,0,0|2,0,0]=3 685 B8R0.8 CCOC[C@H](N)C(O)=O Amb22737184 [1,0,0,0,0,0|1,0,0]=2 686 B8R0.8 CCOC[C@H](N)C(O)=O Amb24478577 [1,0,0,0,0,0|1,0,0]=2 687 B8R0.8 CCOC[C@H](O)C(O)=O Amb24340099 [1,0,0,0,0,0|2,0,0]=3 688 B8R0.8 CCSCC(=O)C(O)=O Amb24670679 [1,0,0,0,0,0|2,0,1]=4 689 B8R0.8 CCSCC(N)C(N)=O Amb24761235 [1,0,0,0,0,0|2,0,0]=3 690 B8R0.8 CCSC[C@@H](N)C(O)=O Amb22800347 [1,0,0,0,0,0|1,0,0]=2 691 B8R0.8 CCSC[C@H](N)C(N)=O Amb24393154 [1,0,0,0,0,0|2,0,0]=3 692 B8R0.8 CC\C=C\C(C)C(O)=O Amb18642633 [1,0,0,0,0,0|1,0,2]=4 693 B8R0.8 CC\C=C\C(N)C(O)=O Amb18642708 [1,0,0,0,0,0|0,0,2]=3 694 B8R0.8 CN(C(=O)Cl)CCCC Amb17563097 [1,0,0,0,0,0|3,0,0]=4 695 B8R0.8 CNCCC(C)C(O)=O Amb24641803 [1,0,0,0,0,0|2,0,0]=3 696 B8R0.8 CNCCC(O)C(O)=O Amb24540612 [1,0,0,0,0,0|2,0,0]=3 697 B8R0.8 CNCC[C@H](N)C(O)=O Amb24427654 [1,0,0,0,0,0|1,0,0]=2 698 B8R0.8 COCCC(C)C(N)=O Amb24760323 [1,0,0,0,0,0|3,0,0]=4 699 B8R0.8 COCCC(C)C(O)=O Amb18523823 [1,0,0,0,0,0|2,0,0]=3 700 B8R0.8 COCCC(Cl)C(C)=O Amb25707829 [1,0,0,0,0,0|3,0,0]=4 701 B8R0.8 COCCC(N)C(C)=C Amb24532850 [1,0,0,0,0,0|3,0,0]=4 702 B8R0.8 COCCC(N)C(C)=O Amb24496676 [1,0,0,0,0,0|2,0,0]=3 703 B8R0.8 COCCC(N)C(N)=O Amb18311365 [1,0,0,0,0,0|2,0,0]=3 704 B8R0.8 COCCC(O)C(=O)Cl Amb25781911 [1,0,0,0,0,0|3,0,0]=4 705 B8R0.8 COCC[C@@H](C(=O)O)N Amb16183872 [1,0,0,0,0,0|1,0,0]=2 706 B8R0.8 COCC[C@H](C(=O)O)N Amb16183870 [1,0,0,0,0,0|1,0,0]=2 707 B8R0.8 COCC[C@H](C)C(O)=O Amb24392969 [1,0,0,0,0,0|2,0,0]=3 708 B8R0.8 COCC[C@H](N)C(O)=O Amb24054991 [1,0,0,0,0,0|1,0,0]=2 709 B8R0.8 COCO[C@@H](C)C(O)=O Amb25682837 [1,0,0,0,0,0|3,0,0]=4 710 B8R0.8 COCO[C@H](C)C(O)=O Amb25706272 [1,0,0,0,0,0|3,0,0]=4 711 B8R0.8 CONCC(N)C(O)=O Amb24392137 [1,0,0,0,0,0|2,0,0]=3 712 B8R0.8 CONC[C@H](N)C(O)=O Amb25376688 [1,0,0,0,0,0|2,0,0]=3 713 B8R0.8 CO\C=C\C(N)C(O)=O Amb18642835 [1,0,0,0,0,0|1,0,2]=4 714 B8R0.8 CO\C=C\[C@H](N)C(O)=O Amb24478831 [1,0,0,0,0,0|1,0,2]=4 715 B8R0.8 CPOCC(N)C(O)=O Amb24423934 [1,0,0,0,0,0|2,0,0]=3 716 B8R0.8 CSCCC(=O)C(O)=O Amb18643588 [1,0,0,0,0,0|2,0,1]=4 717 B8R0.8 CSCCC(=O)C(O)=O Amb22274154 [1,0,0,0,0,0|2,0,1]=4 718 B8R0.8 CSCCC(Br)C(O)=O Amb24682715 [1,0,0,0,0,0|2,0,0]=3 719 B8R0.8 CSCCC(C(=O)Cl)N Amb17142908 [1,0,0,0,0,0|2,0,0]=3 720 B8R0.8 CSCCC(C(=O)N)N Amb17142872 [1,0,0,0,0,0|2,0,0]=3 721 B8R0.8 CSCCC(C(=O)O)N Amb1154122 [1,0,0,0,0,0|1,0,0]=2 722 B8R0.8 CSCCC(C)C(C)=O Amb24650560 [1,0,0,0,0,0|3,0,0]=4 723 B8R0.8 CSCCC(C)C(O)=O Amb24739356 [1,0,0,0,0,0|2,0,0]=3 724 B8R0.8 CSCCC(Cl)C(N)=O Amb18185555 [1,0,0,0,0,0|3,0,0]=4 725 B8R0.8 CSCCC(N)C(=O)S Amb24407336 [1,0,0,0,0,0|1,1,0]=3 726 B8R0.8 CSCCC(N)C(C)=C Amb25042760 [1,0,0,0,0,0|3,0,0]=4 727 B8R0.8 CSCCC(N)C(O)=O Amb22168296 [1,0,0,0,0,0|1,0,0]=2 728 B8R0.8 CSCCC(N)C(O)=O Amb22732346 [1,0,0,0,0,0|1,0,0]=2 729 B8R0.8 CSCCC(N)P(O)=O Amb25362071 [1,0,0,0,0,0|2,0,0]=3 730 B8R0.8 CSCCC(N)P(O)O Amb24594969 [1,0,0,0,0,0|2,0,1]=4 731 B8R0.8 CSCCC(N)[13C](O)=O Amb22336208 [1,0,0,0,0,0|1,0,0]=2 732 B8R0.8 CSCCC(O)C(C)=O Amb24741882 [1,0,0,0,0,0|3,0,0]=4 733 B8R0.8 CSCCC(O)C(N)=O Amb20669403 [1,0,0,0,0,0|3,0,0]=4 734 B8R0.8 CSCCC(O)C(O)=O Amb18304609 [1,0,0,0,0,0|2,0,0]=3 735 B8R0.8 CSCC[C@@H](Cl)C(=O)Cl Amb24544524 [1,0,0,0,0,0|3,0,0]=4 736 B8R0.8 CSCC[C@@H](N)C(N)=O Amb18035930 [1,0,0,0,0,0|2,0,0]=3 737 B8R0.8 CSCC[C@@H](N)C(N)=O Amb22750575 [1,0,0,0,0,0|2,0,0]=3 738 B8R0.8 CSCC[C@@H](O)C(O)=O Amb25124092 [1,0,0,0,0,0|2,0,0]=3 739 B8R0.8 CSCC[C@@H](S)C(O)=O Amb24340077 [1,0,0,0,0,0|2,0,0]=3 740 B8R0.8 CSCC[C@H](Br)C(O)=O Amb25239326 [1,0,0,0,0,0|2,0,0]=3 741 B8R0.8 CSCC[C@H](Cl)C(=O)Cl Amb25135376 [1,0,0,0,0,0|3,0,0]=4 742 B8R0.8 CSCC[C@H](N)C(O)=O Amb17942996 [1,0,0,0,0,0|1,0,0]=2 743 B8R0.8 CSCC[C@H](N)C(O)=O Amb22351191 [1,0,0,0,0,0|1,0,0]=2 744 B8R0.8 CSCC[C@H](N)P(O)=O Amb25826489 [1,0,0,0,0,0|2,0,0]=3 745 B8R0.8 CSCC[C@H]([15NH2])C(O)=O Amb22353588 [1,0,0,0,0,0|1,0,0]=2 746 B8R0.8 CSOC[C@H](N)C(O)=O Amb24428229 [1,0,0,0,0,0|2,0,0]=3 747 B8R0.8 CS[13CH2][13CH2][13CH]([13C](=O)O)O Amb17615592 [1,0,0,0,0,0|2,0,0]=3 748 B8R0.8 C[C@@H](CCCBr)C(O)=O Amb24480227 [1,0,0,0,0,0|2,0,0]=3 749 B8R0.8 C[C@@H](O)[C@H](Br)CCCC Amb25124035 [1,0,0,0,0,0|2,0,1]=4 750 B8R0.8 C[C@H](C(=O)O)CSCC Amb10844108 [1,0,0,0,0,0|2,0,0]=3 751 B8R0.8 C[C@H](CCC#N)C(O)=O Amb25790580 [1,0,0,0,0,0|1,0,2]=4 752 B8R0.8 C[C@H](CCC=C)C(O)=O Amb24337306 [1,0,0,0,0,0|1,0,2]=4 753 B8R0.8 C[C@H](CCCBr)C(O)=O Amb24480175 [1,0,0,0,0,0|2,0,0]=3 754 B8R0.8 C[C@H](N)[C@@H](N)CCCC Amb25341415 [1,0,0,0,0,0|2,0,1]=4 755 B8R0.8 C[C@H](O)[C@@H](O)CCCC Amb24334203 [1,0,0,0,0,0|2,0,1]=4 756 B8R0.8 C[C@H](O)[C@H](Br)CCCC Amb25064520 [1,0,0,0,0,0|2,0,1]=4 757 B8R0.8 C[C@H](O)[C@H](N)CCCC Amb25378726 [1,0,0,0,0,0|1,0,1]=3 758 B8R0.8 C[Se]CCC(N)C(O)=O Amb20619393 [1,0,0,0,0,0|1,0,0]=2 759 B8R0.8 C[Se]CC[C@H](C(=O)O)N Amb10601590 [1,0,0,0,0,0|1,0,0]=2 760 B8R0.8 C\C(=C/CCC)\C(=O)O Amb10844998 [1,0,0,0,0,0|1,0,2]=4 761 B8R0.8 C\C(=C\CCC)\C(O)=O Amb25032199 [1,0,0,0,0,0|1,0,2]=4 762 B8R0.8 C\C=C/C[C@H](N)C(O)=O Amb24713154 [1,0,0,0,0,0|0,0,2]=3 763 B8R0.8 C\C=C\CC(C)C(O)=O Amb18642630 [1,0,0,0,0,0|1,0,2]=4 764 B8R0.8 C\C=C\CC(O)C(O)=O Amb18642742 [1,0,0,0,0,0|1,0,2]=4 765 B8R0.8 C\C=C\C[C@@H](N)C(O)=O Amb24632390 [1,0,0,0,0,0|0,0,2]=3 766 B8R0.8 NC(=O)C(Cl)CCCCl Amb24480056 [1,0,0,0,0,0|3,0,0]=4 767 B8R0.8 NC(=O)C(O)CCCO Amb25104583 [1,0,0,0,0,0|3,0,0]=4 768 B8R0.8 NC(=O)[C@@H](O)CCCO Amb25804971 [1,0,0,0,0,0|3,0,0]=4 769 B8R0.8 NC(C#CCO)C(O)=O Amb24585112 [1,0,0,0,0,0|1,0,2]=4 770 B8R0.8 NC(C(=O)O)CCON Amb17593409 [1,0,0,0,0,0|1,0,0]=2 771 B8R0.8 NC(C(=O)O)CSC#N Amb17593655 [1,0,0,0,0,0|1,0,2]=4 772 B8R0.8 NC(CCC#N)C(O)=O Amb18642589 [1,0,0,0,0,0|0,0,2]=3 773 B8R0.8 NC(CCC=O)C(O)=O Amb24340141 [1,0,0,0,0,0|1,0,1]=3 774 B8R0.8 NC(CCCBr)B(O)O Amb24607340 [1,0,0,0,0,0|2,0,1]=4 775 B8R0.8 NC(CCCBr)C(O)=O Amb24480263 [1,0,0,0,0,0|1,0,0]=2 776 B8R0.8 NC(CCCBr)P(O)=O Amb24377501 [1,0,0,0,0,0|2,0,0]=3 777 B8R0.8 NC(CCCCl)C(O)=O Amb24472387 [1,0,0,0,0,0|1,0,0]=2 778 B8R0.8 NC(CCCF)C(O)=O Amb25366994 [1,0,0,0,0,0|1,0,0]=2 779 B8R0.8 NC(CCCN)C(F)F Amb24763746 [1,0,0,0,0,0|2,0,1]=4 780 B8R0.8 NC(CCCO)C(O)=O Amb18642915 [1,0,0,0,0,0|1,0,0]=2 781 B8R0.8 NC(CCCO)C(O)=O Amb22900028 [1,0,0,0,0,0|1,0,0]=2 782 B8R0.8 NC(CCCO)P(O)=O Amb25726221 [1,0,0,0,0,0|2,0,0]=3 783 B8R0.8 NC(CN=C=O)C(O)=O Amb24423805 [1,0,0,0,0,0|2,0,1]=4 784 B8R0.8 NC(COCO)C(O)=O Amb24731952 [1,0,0,0,0,0|2,0,0]=3 785 B8R0.8 NC(CSC=O)C(O)=O Amb24670042 [1,0,0,0,0,0|2,0,1]=4 786 B8R0.8 NC(\C=C\CO)C(O)=O Amb24586215 [1,0,0,0,0,0|1,0,2]=4 787 B8R0.8 NC(\C=C\CP)C(O)=O Amb24351617 [1,0,0,0,0,0|0,1,2]=4 788 B8R0.8 NCCCC(=O)C(O)=O Amb24081348 [1,0,0,0,0,0|1,0,1]=3 789 B8R0.8 NCCCC(C(=O)O)Br Amb17595166 [1,0,0,0,0,0|1,0,0]=2 790 B8R0.8 NCCCC(Cl)C(O)=O Amb24626933 [1,0,0,0,0,0|1,0,0]=2 791 B8R0.8 NCCCC(N)C(N)=O Amb24118008 [1,0,0,0,0,0|1,0,0]=2 792 B8R0.8 NCCCC(N)C(O)=O Amb22489477 [1,0,0,0,0,0|0,0,0]=1 793 B8R0.8 NCCCC(N)C(O)=O Amb22492665 [1,0,0,0,0,0|0,0,0]=1 794 B8R0.8 NCCCC(O)C(O)=O Amb18124377 [1,0,0,0,0,0|1,0,0]=2 795 B8R0.8 NCCC[C@@H](N)C(O)=O Amb22801212 [1,0,0,0,0,0|0,0,0]=1 796 B8R0.8 NCCC[C@@H](O)C(O)=O Amb24459740 [1,0,0,0,0,0|1,0,0]=2 797 B8R0.8 NCCC[C@@H]([NH3+])C(=O)O Amb10807472 [1,0,0,0,0,0|0,0,1]=2 798 B8R0.8 NCCC[C@H](N)C(N)=O Amb24658293 [1,0,0,0,0,0|1,0,0]=2 799 B8R0.8 NCCC[C@H](N)C(O)=O Amb20240598 [1,0,0,0,0,0|0,0,0]=1 800 B8R0.8 NCCNC(=O)C(O)=O Amb18977789 [1,0,0,0,0,0|2,0,1]=4 801 B8R0.8 NCCSC(F)C(O)=O Amb24478685 [1,0,0,0,0,0|2,0,0]=3 802 B8R0.8 NC\C=C\C(N)C(O)=O Amb18642793 [1,0,0,0,0,0|0,0,2]=3 803 B8R0.8 NC\C=C\[C@H](N)C(O)=O Amb24580033 [1,0,0,0,0,0|0,0,2]=3 804 B8R0.8 NOCCC(N)C(O)=O Amb21858490 [1,0,0,0,0,0|1,0,0]=2 805 B8R0.8 NOCC[C@@H](N)C(O)=O Amb22745427 [1,0,0,0,0,0|1,0,0]=2 806 B8R0.8 NOCC[C@@H](N)C(O)=O Amb22751695 [1,0,0,0,0,0|1,0,0]=2 807 B8R0.8 N[C@@H](CCC=O)C(O)=O Amb25378080 [1,0,0,0,0,0|1,0,1]=3 808 B8R0.8 N[C@@H](CCCN)C(O)=O Amb22746434 [1,0,0,0,0,0|0,0,0]=1 809 B8R0.8 N[C@@H](CCNO)C(O)=O Amb24117852 [1,0,0,0,0,0|2,0,0]=3 810 B8R0.8 N[C@@H](CCNO)C(O)=O Amb24666196 [1,0,0,0,0,0|2,0,0]=3 811 B8R0.8 N[C@@H](CN=C=S)C(O)=O Amb24473247 [1,0,0,0,0,0|2,0,1]=4 812 B8R0.8 N[C@@H](CNC#N)C(O)=O Amb24551015 [1,0,0,0,0,0|1,0,2]=4 813 B8R0.8 N[C@@H](C\C=C\Cl)C(O)=O Amb25774032 [1,0,0,0,0,0|1,0,2]=4 814 B8R0.8 N[C@H](C(=O)O)CCC#N Amb16183912 [1,0,0,0,0,0|0,0,2]=3 815 B8R0.8 N[C@H](CCC#N)C(O)=O Amb25063958 [1,0,0,0,0,0|0,0,2]=3 816 B8R0.8 N[C@H](CCC=O)C(O)=O Amb24477812 [1,0,0,0,0,0|1,0,1]=3 817 B8R0.8 N[C@H](C\C=C\Cl)C(O)=O Amb25114338 [1,0,0,0,0,0|1,0,2]=4 818 B8R0.8 O=C(Cl)C(Br)CCCBr Amb24387005 [1,0,0,0,0,0|3,0,0]=4 819 B8R0.8 OC(=O)C(=O)CCCBr Amb24711405 [1,0,0,0,0,0|2,0,1]=4 820 B8R0.8 OC(=O)C(=O)CCCCl Amb25274323 [1,0,0,0,0,0|2,0,1]=4 821 B8R0.8 OC(=O)C(Br)CCCBr Amb22001929 [1,0,0,0,0,0|2,0,0]=3 822 B8R0.8 OC(=O)C(CCCCl)Br Amb17595866 [1,0,0,0,0,0|2,0,0]=3 823 B8R0.8 OC(=O)C(F)CCCCl Amb24683810 [1,0,0,0,0,0|2,0,0]=3 824 B8R0.8 OCCCC(Cl)C(O)=O Amb25760339 [1,0,0,0,0,0|2,0,0]=3 825 B8R0.8 OCCCC(O)C(O)=O Amb18642939 [1,0,0,0,0,0|2,0,0]=3 826 B8R0.8 OCCC[C@@H](C(=O)O)N Amb16183887 [1,0,0,0,0,0|1,0,0]=2 827 B8R0.8 OCCC[C@H](O)C(O)=O Amb24744314 [1,0,0,0,0,0|2,0,0]=3 828 B8R0.8 [13CH3]SCCC(N)C(O)=O Amb22351494 [1,0,0,0,0,0|1,0,0]=2 829 B8R0.8 [13CH3][Se]CCC(N)C(O)=O Amb22367237 [1,0,0,0,0,0|1,0,0]=2 830 B8R0.8 [N-]=[N+]=NC[C@H](N)C(O)=O Amb25072668 [1,0,0,0,0,0|2,0,1]=4 831 B10R0.26 C#CCS(=O)CC(N)C(O)=O Amb25386041 [0,1,0,0,0,0|2,0,1]=4 832 B10R0.26 C=CC[S@+]([O-])C[C@H](N)C(O)=O Amb22352986 [0,1,0,0,0,0|2,0,1]=4 833 B10R0.26 CC(CCC)CC(N)C(O)=O Amb18183357 [0,1,0,0,0,0|1,0,0]=2 834 B10R0.26 CC(CCN)NC(=O)C(O)=O Amb24756218 [0,1,0,0,0,0|2,0,1]=4 835 B10R0.26 CC(NC(=O)CCN)C(O)=O Amb18304954 [0,1,0,0,0,0|2,0,1]=4 836 B10R0.26 CCCC(C)CC(C)C(C)=O Amb18183114 [0,1,0,0,0,0|3,0,0]=4 837 B10R0.26 CCCS(=O)C[C@@H](N)C(O)=O Amb22904243 [0,1,0,0,0,0|2,0,0]=3 838 B10R0.26 CCNC(=O)C[C@@H](N)C(O)=O Amb25382161 [0,1,0,0,0,0|2,0,1]=4 839 B10R0.26 C[C@@H](NC(=O)CCN)C(O)=O Amb18179956 [0,1,0,0,0,0|2,0,1]=4 840 B10R0.26 NC(C(=O)O)CS(=O)CC=C Amb10845211 [0,1,0,0,0,0|2,0,1]=4 841 B10R0.26 NC(CC(=O)NCO)C(O)=O Amb25386046 [0,1,0,0,0,0|2,0,1]=4 842 B10R0.26 N[C@@H](C(=O)O)CS(=O)CC=C Amb16193379 [0,1,0,0,0,0|2,0,1]=4 843 B10R0.26 N[C@@H](C[S@@](=O)CC=C)C(O)=O Amb17772364 [0,1,0,0,0,0|2,0,1]=4 844 B10R0.26 N[C@H](CS(=O)CC#N)C(O)=O Amb25383719 [0,1,0,0,0,0|1,0,2]=4 845 B10R0.26 [O-][S+](CC=C)CC(C(=O)O)N Amb10549967 [0,1,0,0,0,0|2,0,1]=4 846 B10R0.42 CC(C)(CCCC=C)C(O)=O Amb22228238 [0,1,0,0,0,0|2,0,1]=4 847 B10R0.42 CC(C)(OCCCN)C(O)=O Amb18111566 [0,1,0,0,0,0|2,0,0]=3 848 B10R0.42 CC(N)(\C=C/CCN)C(O)=O Amb25382976 [0,1,0,0,0,0|0,0,2]=3 849 B10R0.42 CCCCCC(C)(C)C(O)=O Amb18182373 [0,1,0,0,0,0|2,0,0]=3 850 B10R0.42 CCCCSC(C(=O)O)(C)C Amb17501482 [0,1,0,0,0,0|3,0,0]=4 851 B10R0.42 C[C@@](N)(C\C=C\CN)C(O)=O Amb24763008 [0,1,0,0,0,0|0,0,2]=3 852 B10R0.42 C[C@](N)(C\C=C\CN)C(O)=O Amb25383154 [0,1,0,0,0,0|0,0,2]=3 853 B10R0.42 NCCCSC(C(=O)O)(C)C Amb17500718 [0,1,0,0,0,0|2,0,0]=3 854 B10R0.42 OCCCCC(O)(O)C(O)=O Amb24113204 [0,1,0,0,0,0|2,0,0]=3 855 B10R0.42 OCCCSC(C(=O)O)(C)C Amb17502859 [0,1,0,0,0,0|3,0,0]=4 856 B10R0.75 BrCCCCCC(=O)C(=O)O Amb10072070 [0,1,0,0,0,0|2,0,1]=4 857 B10R0.75 C=CCCCC[C@@H](N)C(O)=O Amb22747247 [0,1,0,0,0,0|1,0,0]=2 858 B10R0.75 C=CCCCC[C@H](N)C(O)=O Amb22270014 [0,1,0,0,0,0|1,0,0]=2 859 B10R0.75 CC#CCCCC(C)C(O)=O Amb25380144 [0,1,0,0,0,0|2,0,1]=4 860 B10R0.75 CC#CCCCC(N)C(N)=O Amb24762939 [0,1,0,0,0,0|2,0,1]=4 861 B10R0.75 CC#CCCC[C@@H](N)C(O)=O Amb25383152 [0,1,0,0,0,0|1,0,1]=3 862 B10R0.75 CC#CCCC[C@H](N)C(O)=O Amb25382982 [0,1,0,0,0,0|1,0,1]=3 863 B10R0.75 CC#CCSCC(N)C(O)=O Amb18183766 [0,1,0,0,0,0|1,0,2]=4 864 B10R0.75 CC#CCSC[C@@H](N)C(O)=O Amb18803385 [0,1,0,0,0,0|1,0,2]=4 865 B10R0.75 CC(C(=O)O)SCCCCN Amb17500920 [0,1,0,0,0,0|1,0,0]=2 866 B10R0.75 CCCCC#CC(C)C(O)=O Amb24484963 [0,1,0,0,0,0|2,0,1]=4 867 B10R0.75 CCCCC#CC(O)C(O)=O Amb24538170 [0,1,0,0,0,0|2,0,1]=4 868 B10R0.75 CCCCCCC(=O)C(O)=O Amb22228909 [0,1,0,0,0,0|2,0,1]=4 869 B10R0.75 CCCCCCC(Br)C(=O)Br Amb24061160 [0,1,0,0,0,0|3,0,0]=4 870 B10R0.75 CCCCCCC(C(=O)O)C Amb10843971 [0,1,0,0,0,0|2,0,0]=3 871 B10R0.75 CCCCCC[C@H](C(=O)O)N Amb16183913 [0,1,0,0,0,0|1,0,0]=2 872 B10R0.75 CCCCCC[C@H]([C@H](O)C)N Amb17608215 [0,1,0,0,0,0|2,0,1]=4 873 B10R0.75 C[C@@H](O)[C@@H](N)CCCCCC Amb19130477 [0,1,0,0,0,0|2,0,1]=4 874 B10R0.75 NCCCCNC(=O)C(O)=O Amb24068933 [0,1,0,0,0,0|1,0,1]=3 875 B10R0.75 NCCCSC[C@@H](N)C(O)=O Amb22454567 [0,1,0,0,0,0|0,0,0]=1 876 B10R0.75 NCCOCCC(N)C(O)=O Amb24081026 [0,1,0,0,0,0|0,0,0]=1 877 B10R0.75 NCCO\C=C\[C@@H](N)C(O)=O Amb22801026 [0,1,0,0,0,0|0,0,2]=3 878 B10R0.75 NCCO\C=C\[C@H](N)C(O)=O Amb22226789 [0,1,0,0,0,0|0,0,2]=3 879 B10R0.75 N[C@@H](CCC#CCCl)C(O)=O Amb25132299 [0,1,0,0,0,0|1,0,1]=3 880 B10R0.75 N[C@@H](CSCCC#N)C(O)=O Amb19131338 [0,1,0,0,0,0|0,0,2]=3 881 B10R0.81 CC(CCC#C)C(C)C(O)=O Amb24762084 [0,1,0,0,0,0|2,0,1]=4 882 B10R0.82 C#CC(N)CCC(N)C(O)=O Amb24762938 [0,1,0,0,0,0|1,0,1]=3 883 B10R0.82 CC(C#N)SCC(N)C(O)=O Amb19018858 [0,1,0,0,0,0|1,0,2]=4 884 B10R0.82 CC(C#N)SC[C@@H](N)C(O)=O Amb18180438 [0,1,0,0,0,0|1,0,2]=4 885 B10R0.82 CC(C#N)SC[C@H](N)C(O)=O Amb25380043 [0,1,0,0,0,0|1,0,2]=4 886 B10R0.82 CC(CNC(=O)CN)C(O)=O Amb18313397 [0,1,0,0,0,0|2,0,1]=4 887 B10R0.82 CC(CO)=CCC(N)C(O)=O Amb25385007 [0,1,0,0,0,0|1,0,2]=4 888 B10R0.82 CC(CO)=CC[C@H](N)C(O)=O Amb25384231 [0,1,0,0,0,0|1,0,2]=4 889 B10R0.82 CCC(=O)NC[C@H](N)C(O)=O Amb25383897 [0,1,0,0,0,0|2,0,1]=4 890 B10R0.82 CCC(C)CCC(C)C(O)=O Amb22641847 [0,1,0,0,0,0|2,0,0]=3 891 B10R0.82 CCS(=O)CCC(N)C(O)=O Amb22730104 [0,1,0,0,0,0|2,0,0]=3 892 B10R0.82 CN=[N+]([O-])CCC(N)C(O)=O Amb25384605 [0,1,0,0,0,0|3,0,0]=4 893 B10R0.82 CN=[N+]([O-])CC[C@H](N)C(O)=O Amb25384249 [0,1,0,0,0,0|3,0,0]=4 894 B10R0.82 CNC(=O)CCC(N)C(O)=O Amb18645293 [0,1,0,0,0,0|2,0,1]=4 895 B10R0.82 COC(=O)CC[C@@H](N)C(O)=O Amb22746068 [0,1,0,0,0,0|2,0,1]=4 896 B10R0.82 COC(=O)CC[C@H](C(=O)O)N Amb16183875 [0,1,0,0,0,0|2,0,1]=4 897 B10R0.82 COC(=O)CC[C@H](N)C(O)=O Amb22336436 [0,1,0,0,0,0|2,0,1]=4 898 B10R0.82 C[C@H](CC)SCC(N)C(O)=O Amb22802432 [0,1,0,0,0,0|2,0,0]=3 899 B10R0.82 C\C(\CO)=C/C[C@H](N)C(O)=O Amb24763010 [0,1,0,0,0,0|1,0,2]=4 900 B10R0.82 C\N=[N+](\[O-])/CC[C@H](N)C(O)=O Amb25379956 [0,1,0,0,0,0|3,0,0]=4 901 B10R0.82 NC(CCC(=O)CCl)C(O)=O Amb21929315 [0,1,0,0,0,0|1,0,1]=3 902 B10R0.82 NC(CCC(=O)NO)C(O)=O Amb22350145 [0,1,0,0,0,0|2,0,1]=4 903 B10R0.82 NC(CCP(=O)CO)C([O-])=O Amb22167951 [0,1,0,0,0,0|2,0,1]=4 904 B10R0.82 NC(C\C=C(\Cl)/CO)C(O)=O Amb25386044 [0,1,0,0,0,0|1,0,2]=4 905 B10R0.82 NCC(CCC(C(=O)O)N)F Amb10839781 [0,1,0,0,0,0|0,0,0]=1 906 B10R0.82 NNC(=O)CC[C@@H](N)C(O)=O Amb22800002 [0,1,0,0,0,0|1,0,1]=3 907 B10R0.82 NNC(=O)CC[C@H](N)C(O)=O Amb25379957 [0,1,0,0,0,0|1,0,1]=3 908 B10R0.82 N[C@@H](CCC(F)CN)C(O)=O Amb24087707 [0,1,0,0,0,0|0,0,0]=1 909 B10R0.82 N[C@@H](CC[C@@H](O)CN)C(O)=O Amb22369708 [0,1,0,0,0,0|0,0,0]=1 910 B10R0.82 N[C@@H](CC[C@@H](O)CN)C(O)=O Amb22747912 [0,1,0,0,0,0|0,0,0]=1 911 B10R0.82 N[C@@H](CC[C@@H](O)CN)C(O)=O Amb24121192 [0,1,0,0,0,0|0,0,0]=1 912 B10R0.82 N[C@@H](CC[C@H](O)CN)C(O)=O Amb24117040 [0,1,0,0,0,0|0,0,0]=1 913 B10R0.82 N[C@@H](CNC(=O)CCl)C(O)=O Amb25386345 [0,1,0,0,0,0|2,0,1]=4 914 B10R0.82 N[C@@H](CNC(=O)CI)C(O)=O Amb25383795 [0,1,0,0,0,0|2,0,1]=4 915 B10R0.83 CCCC#CC(N)C(=O)OC Amb25258632 [0,1,0,0,0,0|1,0,2]=4 916 B10R0.83 CCCCCC(N)C(=O)OC Amb18792090 [0,1,0,0,0,0|1,0,0]=2 917 B10R0.83 CCCCCC(N)C(=O)OC Amb20622672 [0,1,0,0,0,0|1,0,0]=2 918 B10R0.83 CCCCCC(O)C(=O)OC Amb18183408 [0,1,0,0,0,0|2,0,0]=3 919 B10R0.83 CNC(=O)C(N)CCCCN Amb23443536 [0,1,0,0,0,0|1,0,0]=2 920 B10R0.83 COC(=O)C(Br)CCCCBr Amb22367977 [0,1,0,0,0,0|2,0,0]=3 921 B10R0.83 COC(=O)C(N)CCCCN Amb22349641 [0,1,0,0,0,0|0,0,0]=1 922 B10R0.83 COC(=O)[C@@H](N)CCCCN Amb19930733 [0,1,0,0,0,0|0,0,0]=1 923 B10R0.83 COC(=O)[C@@H](N)CCCCN Amb22230819 [0,1,0,0,0,0|0,0,0]=1 924 B10R0.83 NCCCC[C@@H](N)C(=O)NO Amb22800930 [0,1,0,0,0,0|0,0,0]=1 925 B10R0.86 CCC(OCCCN)C(O)=O Amb18628658 [0,1,0,0,0,0|2,0,0]=3 926 B10R0.86 CCCCCC(CC)C(O)=O Amb18791930 [0,1,0,0,0,0|2,0,0]=3 927 B10R0.86 OCCCSC(C(=O)O)CC Amb17501362 [0,1,0,0,0,0|3,0,0]=4 928 B10R0.98 CC(=O)NCCC(N)C(O)=O Amb25385160 [0,1,0,0,0,0|2,0,1]=4 929 B10R0.98 CC(=O)OCC[C@@H](N)C(O)=O Amb19130288 [0,1,0,0,0,0|2,0,1]=4 930 B10R0.98 CC(C(=O)O)NCCC(C)C Amb10609116 [0,1,0,0,0,0|3,0,0]=4 931 B10R0.98 CC(C)=CCC[C@H](N)C(O)=O Amb25383796 [0,1,0,0,0,0|1,0,2]=4 932 B10R0.98 CC(C)CCC[C@@H](N)C(O)=O Amb22745714 [0,1,0,0,0,0|1,0,0]=2 933 B10R0.98 CC(CCCC(C)N)C(O)=O Amb19337779 [0,1,0,0,0,0|1,0,0]=2 934 B10R0.98 CC(CCCC(C)N)C(O)=O Amb22059651 [0,1,0,0,0,0|1,0,0]=2 935 B10R0.98 CC(CCCC(O)=O)C(O)=O Amb18645273 [0,1,0,0,0,0|2,0,1]=4 936 B10R0.98 CC(N)CCNC(=O)C(O)=O Amb24756130 [0,1,0,0,0,0|2,0,1]=4 937 B10R0.98 NC(=N)NCCC(C(=O)O)N Amb16233058 [0,1,0,0,0,0|1,0,1]=3 938 B10R0.98 NC(=N)NCC[C@@H](N)C(O)=O Amb22745595 [0,1,0,0,0,0|1,0,1]=3 939 B10R0.98 NC(=N)NCC[C@H](N)C(O)=O Amb20240584 [0,1,0,0,0,0|1,0,1]=3 940 B10R0.98 NC(=N)NOC[C@H](N)C(O)=O Amb25383805 [0,1,0,0,0,0|2,0,1]=4 941 B10R0.98 NC(=O)CCCC(C(=O)O)N Amb17614984 [0,1,0,0,0,0|0,0,1]=2 942 B10R0.98 NC(=O)NCCC(N)C(O)=O Amb25386183 [0,1,0,0,0,0|1,0,1]=3 943 B10R0.98 NC(=O)NCCC(S)C(O)=O Amb25385685 [0,1,0,0,0,0|2,0,1]=4 944 B10R0.98 NC(=O)NCC[C@@H](N)C(O)=O Amb25385246 [0,1,0,0,0,0|1,0,1]=3 945 B10R0.98 NC(=O)NCC[C@H](N)C(O)=O Amb25386286 [0,1,0,0,0,0|1,0,1]=3 946 B10R0.98 NC(=O)NCC[C@H](S)C(O)=O Amb25385201 [0,1,0,0,0,0|2,0,1]=4 947 B10R0.98 NC(CCCC(O)=O)C(O)=O Amb22740152 [0,1,0,0,0,0|1,0,1]=3 948 B10R0.98 NC(CCCC([O-])=O)C([O-])=O Amb22053651 [0,1,0,0,0,0|1,0,2]=4 949 B10R0.98 NC(CSCC(O)=O)C(O)=O Amb23566716 [0,1,0,0,0,0|2,0,1]=4 950 B10R0.98 NC(N)=NCCC(N)C(O)=O Amb22492813 [0,1,0,0,0,0|1,0,1]=3 951 B10R0.98 N[C@H](CSCC(O)=O)C(O)=O Amb22745445 [0,1,0,0,0,0|2,0,1]=4 952 B10R0.98 OC(=O)CCCC(O)C(O)=O Amb21963897 [0,1,0,0,0,0|2,0,1]=4 953 B10R0.98 OC(=O)CCC[C@H](O)C(O)=O Amb22270000 [0,1,0,0,0,0|2,0,1]=4 954 B10R0.98 OC(=O)CSC[C@@H](C(=O)O)N Amb16232500 [0,1,0,0,0,0|2,0,1]=4 955 B10R1.7 C[C@@H]1CCCCCCC1=O Amb25146833 [0,0,0,1,0,0|3,0,0]=4 956 B10R1.7 N[C@H]1CCCCCNC1=O Amb24561675 [0,0,0,1,0,0|2,0,0]=3 957 B10R1.7 O=C1CCCCCCC1Cl Amb22228745 [0,0,0,1,0,0|3,0,0]=4 958 B10R1.7 O=C1NCCCCCC1Cl Amb25706288 [0,0,0,1,0,0|3,0,0]=4 959 B10R1.7 OC1CCCCCCC1=O Amb22896567 [0,0,0,1,0,0|3,0,0]=4 960 B10R1.7 O[C@@H]1CCCCCCC1=O Amb24481235 [0,0,0,1,0,0|3,0,0]=4 961 B10R1.23 C=C(C1CCCC1)C(O)=O Amb18124595 [0,0,0,1,0,0|2,0,1]=4 962 B10R1.23 CC(=C)C(N)C1CCCS1 Amb25067746 [0,0,0,1,0,0|3,0,0]=4 963 B10R1.23 CC(=C)C(O)C1CCCN1 Amb25692055 [0,0,0,1,0,0|3,0,0]=4 964 B10R1.23 CC(=O)C(=O)C1CCCN1 Amb24470443 [0,0,0,1,0,0|2,0,1]=4 965 B10R1.23 CC(=O)C(N)C1CCCC1 Amb25146248 [0,0,0,1,0,0|2,0,0]=3 966 B10R1.23 CC(=O)C(O)C1CCCC1 Amb25129517 [0,0,0,1,0,0|3,0,0]=4 967 B10R1.23 CC(C(=O)O)C1CCCC1 Amb17087540 [0,0,0,1,0,0|2,0,0]=3 968 B10R1.23 CC(C(O)=O)C=1CCCC1 Amb18643557 [0,0,0,1,0,0|2,0,1]=4 969 B10R1.23 CC(C(O)=O)N1CCCC1 Amb21953997 [0,0,0,1,0,0|3,0,0]=4 970 B10R1.23 CC(C(O)=O)N1CCCN1 Amb24581383 [0,0,0,1,0,0|2,0,0]=3 971 B10R1.23 CC(C(O)=O)N1CCCO1 Amb25178346 [0,0,0,1,0,0|3,0,0]=4 972 B10R1.23 CC(C1CCC=C1)C(O)=O Amb18643571 [0,0,0,1,0,0|2,0,1]=4 973 B10R1.23 CC(C1CCCC1)C(C)=O Amb24703306 [0,0,0,1,0,0|3,0,0]=4 974 B10R1.23 CC(C1CCCN1)C(O)=O Amb18202477 [0,0,0,1,0,0|1,0,0]=2 975 B10R1.23 CC(C1CCCO1)C(C)=O Amb25331406 [0,0,0,1,0,0|3,0,0]=4 976 B10R1.23 CC(C1CCNC1)C(O)=O Amb18831577 [0,0,0,1,0,0|3,0,0]=4 977 B10R1.23 CC(C1CCOC1)C(O)=O Amb18831507 [0,0,0,1,0,0|3,0,0]=4 978 B10R1.23 CC(C1NCCS1)C(O)=O Amb18126276 [0,0,0,1,0,0|2,0,0]=3 979 B10R1.23 CC(O)C(N)C1CCCC1 Amb25352887 [0,0,0,1,0,0|2,0,1]=4 980 B10R1.23 CC([C@@H]1CCCN1)C(O)=O Amb24744490 [0,0,0,1,0,0|1,0,0]=2 981 B10R1.23 C[C@@H](N1CCCC1)C(O)=O Amb17935706 [0,0,0,1,0,0|3,0,0]=4 982 B10R1.23 C[C@@H](O)[C@@H](N)C1CCCC1 Amb24531656 [0,0,0,1,0,0|2,0,1]=4 983 B10R1.23 C[C@@H]([C@@H]1CCCN1)C(O)=O Amb25366363 [0,0,0,1,0,0|1,0,0]=2 984 B10R1.23 C[C@@H]([C@H]1CCC=C1)C(O)=O Amb24599562 [0,0,0,1,0,0|2,0,1]=4 985 B10R1.23 C[C@H](O)[C@@H](N)C1CCCC1 Amb24568266 [0,0,0,1,0,0|2,0,1]=4 986 B10R1.23 C[C@H](O)[C@H](N)C1CCCC1 Amb25305368 [0,0,0,1,0,0|2,0,1]=4 987 B10R1.23 C[C@H]([C@H]1CCC=C1)C(O)=O Amb24599500 [0,0,0,1,0,0|2,0,1]=4 988 B10R1.23 NC(=O)C(Br)C1CCCC1 Amb24451468 [0,0,0,1,0,0|3,0,0]=4 989 B10R1.23 NC(=O)C(Cl)C1CCCC1 Amb18800595 [0,0,0,1,0,0|3,0,0]=4 990 B10R1.23 NC(C1C=CCN1)C(O)=O Amb25344825 [0,0,0,1,0,0|0,0,2]=3 991 B10R1.23 NC(C1CC=CC1)C(O)=O Amb24470260 [0,0,0,1,0,0|1,0,2]=4 992 B10R1.23 NC(C1CCC=C1)C(O)=O Amb18643720 [0,0,0,1,0,0|1,0,1]=3 993 B10R1.23 NC(C1CCCC1)C(N)=O Amb18958717 [0,0,0,1,0,0|2,0,0]=3 994 B10R1.23 NC(C1CCCC1)C(O)=O Amb19373068 [0,0,0,1,0,0|1,0,0]=2 995 B10R1.23 NC(C1CCCC1)P(O)=O Amb24739738 [0,0,0,1,0,0|2,0,0]=3 996 B10R1.23 NC(C1CCCN1)C(O)=O Amb25336088 [0,0,0,1,0,0|0,0,0]=1 997 B10R1.23 NC(C1CCCO1)C(O)=O Amb18644193 [0,0,0,1,0,0|1,0,0]=2 998 B10R1.23 NC(C1CCSC1)C(O)=O Amb25837887 [0,0,0,1,0,0|2,0,0]=3 999 B10R1.23 NC(C1COCC1)C(N)=O Amb18950565 [0,0,0,1,0,0|3,0,0]=4 1000 B10R1.23 N[C@@H](C1CC=CC1)C(O)=O Amb25722994 [0,0,0,1,0,0|1,0,2]=4 1001 B10R1.23 N[C@@H](C1CCCC1)C(N)=O Amb24376349 [0,0,0,1,0,0|2,0,0]=3 1002 B10R1.23 N[C@@H](C1CCOC1)C(O)=O Amb24353330 [0,0,0,1,0,0|2,0,0]=3 1003 B10R1.23 N[C@@H]([C@@H]1C=CCO1)C(O)=O Amb25291629 [0,0,0,1,0,0|1,0,2]=4 1004 B10R1.23 N[C@@H]([C@@H]1CCOC1)C(O)=O Amb24621873 [0,0,0,1,0,0|2,0,0]=3 1005 B10R1.23 N[C@@H]([C@H]1CCCO1)C(O)=O Amb24641550 [0,0,0,1,0,0|1,0,0]=2 1006 B10R1.23 N[C@@H]([C@H]1CCOC1)C(O)=O Amb24621874 [0,0,0,1,0,0|2,0,0]=3 1007 B10R1.23 N[C@H](C1CCOC1)C(O)=O Amb24437668 [0,0,0,1,0,0|2,0,0]=3 1008 B10R1.23 N[C@H]([C@@H]1C=CCO1)C(O)=O Amb25238689 [0,0,0,1,0,0|1,0,2]=4 1009 B10R1.23 N[C@H]([C@@H]1CCOC1)C(O)=O Amb25237857 [0,0,0,1,0,0|2,0,0]=3 1010 B10R1.23 OC(=O)C(=O)C1CCCC1 Amb18643845 [0,0,0,1,0,0|2,0,1]=4 1011 B10R1.23 OC(=O)C(Br)C1CCCC1 Amb18130988 [0,0,0,1,0,0|2,0,0]=3 1012 B10R1.23 OC(=O)C(Cl)C1CCCC1 Amb18126355 [0,0,0,1,0,0|2,0,0]=3 1013 B10R1.23 OC(=O)C(Cl)C1CCOC1 Amb25789695 [0,0,0,1,0,0|3,0,0]=4 1014 B10R1.23 OC(=O)C(F)C1CCNC1 Amb25135110 [0,0,0,1,0,0|3,0,0]=4 1015 B10R1.23 OC(=O)C(O)C=1CCCC1 Amb25777821 [0,0,0,1,0,0|2,0,1]=4 1016 B10R1.23 OC(C1CCC=C1)C(O)=O Amb24564337 [0,0,0,1,0,0|2,0,1]=4 1017 B10R1.23 OC(C1CCCC1)C(O)=O Amb18958313 [0,0,0,1,0,0|2,0,0]=3 1018 B10R1.23 OC(C1CNCC1)C(O)=O Amb18124721 [0,0,0,1,0,0|3,0,0]=4 1019 B10R1.23 OC(C1COCC1)C(O)=O Amb18952019 [0,0,0,1,0,0|3,0,0]=4 1020 B10R1.23 OC(C1CSCC1)C(O)=O Amb25788192 [0,0,0,1,0,0|3,0,0]=4 1021 B10R1.23 O[C@H]([C@@H]1CCCN1)C(O)=O Amb25344945 [0,0,0,1,0,0|1,0,0]=2 1022 B10R1.31 C=CC1CC(CC1)C(O)=O Amb18643554 [0,0,0,1,0,0|2,0,1]=4 1023 B10R1.31 C=CC1CCC(N1)C(O)=O Amb24477091 [0,0,0,1,0,0|1,0,1]=3 1024 B10R1.31 C=C[C@@H]1C[C@@H](CC1)C(O)=O Amb25259819 [0,0,0,1,0,0|2,0,1]=4 1025 B10R1.31 CC(=O)C1CCC(CO)O1 Amb25146767 [0,0,0,1,0,0|3,0,0]=4 1026 B10R1.31 CC(=O)C1CC[C@@H](CBr)O1 Amb25137166 [0,0,0,1,0,0|3,0,0]=4 1027 B10R1.31 CC(=O)N1CC(CN)CC1 Amb18278707 [0,0,0,1,0,0|3,0,0]=4 1028 B10R1.31 CCC1CC(CO1)C(O)=O Amb25127111 [0,0,0,1,0,0|3,0,0]=4 1029 B10R1.31 CCC1CC(NC1)C(O)=O Amb22496300 [0,0,0,1,0,0|3,0,0]=4 1030 B10R1.31 CCC1CCC(N1)C(N)=O Amb18643962 [0,0,0,1,0,0|2,0,0]=3 1031 B10R1.31 CCC1CCC(N1)C(O)=O Amb24694112 [0,0,0,1,0,0|1,0,0]=2 1032 B10R1.31 CCC1CCC(O1)C(O)=O Amb20668759 [0,0,0,1,0,0|2,0,0]=3 1033 B10R1.31 CCC1CC[C@H](N1)C(O)=O Amb24376251 [0,0,0,1,0,0|1,0,0]=2 1034 B10R1.31 CCC1N[C@@H](CS1)C(O)=O Amb18792350 [0,0,0,1,0,0|2,0,0]=3 1035 B10R1.31 CCC=1CCC(N1)C(O)=O Amb23560251 [0,0,0,1,0,0|1,0,2]=4 1036 B10R1.31 CCN1CCC(C1)C(=O)O Amb10607746 [0,0,0,1,0,0|3,0,0]=4 1037 B10R1.31 CCN1C[C@@H](CC1)C(O)=O Amb24733745 [0,0,0,1,0,0|3,0,0]=4 1038 B10R1.31 CC[C@@H]1C[C@@H](CC1)C(C)=O Amb24577776 [0,0,0,1,0,0|3,0,0]=4 1039 B10R1.31 CC[C@@H]1C[C@H](NC1)C(O)=O Amb24629222 [0,0,0,1,0,0|3,0,0]=4 1040 B10R1.31 CC[C@@H]1N[C@@H](CS1)C(O)=O Amb25176269 [0,0,0,1,0,0|2,0,0]=3 1041 B10R1.31 CC[C@H]1CC[C@H](N1)C(N)=O Amb24700371 [0,0,0,1,0,0|2,0,0]=3 1042 B10R1.31 CC[C@H]1C[C@@H](CC1)C(C)=O Amb24575928 [0,0,0,1,0,0|3,0,0]=4 1043 B10R1.31 CC[C@H]1N[C@@H](CS1)C(O)=O Amb24760726 [0,0,0,1,0,0|2,0,0]=3 1044 B10R1.31 CNC1CC(CC1)C(O)=O Amb23454119 [0,0,0,1,0,0|3,0,0]=4 1045 B10R1.31 COC1CC(CC1)C(O)=O Amb24399167 [0,0,0,1,0,0|3,0,0]=4 1046 B10R1.31 N#CC1CCC(N1)C(O)=O Amb25342936 [0,0,0,1,0,0|0,0,2]=3 1047 B10R1.31 NC(=O)C1CCC(CO)O1 Amb25147557 [0,0,0,1,0,0|3,0,0]=4 1048 B10R1.31 NC(=O)[C@@H]1CC[C@H](CO)C1 Amb25708732 [0,0,0,1,0,0|3,0,0]=4 1049 B10R1.31 NCC1=NC(CS1)C(O)=O Amb25731909 [0,0,0,1,0,0|1,0,2]=4 1050 B10R1.31 NCC1CC(CO1)C(N)=O Amb19373933 [0,0,0,1,0,0|3,0,0]=4 1051 B10R1.31 NCC1CCC(O1)C(N)=O Amb20669131 [0,0,0,1,0,0|2,0,0]=3 1052 B10R1.31 NCC1CCC(O1)C(N)=O Amb22157199 [0,0,0,1,0,0|2,0,0]=3 1053 B10R1.31 NCC1CN(CC1)C(N)=O Amb18279605 [0,0,0,1,0,0|3,0,0]=4 1054 B10R1.31 NC[C@@H]1CC[C@@H](C1)C(=O)O Amb10066951 [0,0,0,1,0,0|1,0,0]=2 1055 B10R1.31 NC[C@@H]1CC[C@@H](O1)C(N)=O Amb25175709 [0,0,0,1,0,0|2,0,0]=3 1056 B10R1.31 NC[C@@H]1CC[C@H](C1)C(=O)O Amb10066932 [0,0,0,1,0,0|1,0,0]=2 1057 B10R1.31 NC[C@@H]1C[C@H](NC1)C(O)=O Amb24117205 [0,0,0,1,0,0|2,0,0]=3 1058 B10R1.31 NC[C@H]1CC[C@@H](C1)C(=O)O Amb10066933 [0,0,0,1,0,0|1,0,0]=2 1059 B10R1.31 NC[C@H]1CC[C@H](C1)C(=O)O Amb10066930 [0,0,0,1,0,0|1,0,0]=2 1060 B10R1.31 NC[C@H]1CC[C@H](O1)C(N)=O Amb25235917 [0,0,0,1,0,0|2,0,0]=3 1061 B10R1.31 NC[C@H]1C[C@H](NC1)C(O)=O Amb24117206 [0,0,0,1,0,0|2,0,0]=3 1062 B10R1.31 NN=C1CCC(C1)C(O)=O Amb25734466 [0,0,0,1,0,0|2,0,1]=4 1063 B10R1.31 NOC1CNC(C1)C(O)=O Amb24356547 [0,0,0,1,0,0|3,0,0]=4 1064 B10R1.31 NO[C@@H]1CN[C@@H](C1)C(O)=O Amb25188204 [0,0,0,1,0,0|3,0,0]=4 1065 B10R1.31 N\N=C\1/CCC(C1)C(O)=O Amb23453110 [0,0,0,1,0,0|2,0,1]=4 1066 B10R1.31 OC(=O)C1CCC(CS)O1 Amb18285066 [0,0,0,1,0,0|2,0,0]=3 1067 B10R1.31 OC(=O)C1CCC(CS)S1 Amb25689446 [0,0,0,1,0,0|2,0,0]=3 1068 B10R1.31 OC(=O)C1CSC(CS)C1 Amb24482254 [0,0,0,1,0,0|3,0,0]=4 1069 B10R1.31 OCC1CC(CC1)C(O)=O Amb25697003 [0,0,0,1,0,0|2,0,0]=3 1070 B10R1.31 OCC1CC(NC1)C(O)=O Amb25685963 [0,0,0,1,0,0|3,0,0]=4 1071 B10R1.31 OCC1CCC(N1)C(O)=O Amb24502434 [0,0,0,1,0,0|1,0,0]=2 1072 B10R1.31 OCC1CCC(O1)C(O)=O Amb18285041 [0,0,0,1,0,0|2,0,0]=3 1073 B10R1.31 OCC1N[C@@H](CS1)C(O)=O Amb24594995 [0,0,0,1,0,0|2,0,0]=3 1074 B10R1.31 OC[C@@H]1CC[C@@H](N1)C(O)=O Amb25328970 [0,0,0,1,0,0|1,0,0]=2 1075 B10R1.31 OC[C@@H]1C[C@@H](CC1)C(=O)Cl Amb24658298 [0,0,0,1,0,0|3,0,0]=4 1076 B10R1.31 OC[C@@H]1C[C@H](NC1)C(O)=O Amb24514873 [0,0,0,1,0,0|3,0,0]=4 1077 B10R1.31 OC[C@H]1CC[C@H](N1)C(O)=O Amb25213618 [0,0,0,1,0,0|1,0,0]=2 1078 B10R1.31 OC[C@H]1C[C@@H](CC1)C(O)=O Amb24514835 [0,0,0,1,0,0|2,0,0]=3 1079 B10R1.31 OC[C@H]1C[C@H](NC1)C(O)=O Amb25304927 [0,0,0,1,0,0|3,0,0]=4 1080 B10R1.37 CCCCCC1CCC1=O Amb24631207 [0,0,0,1,0,0|3,0,0]=4 1081 B10R1.93 CCCC1CC(C1)C(O)=O Amb23537724 [0,0,0,1,0,0|2,0,0]=3 1082 B10R1.93 CCCN1CC(C1)C(O)=O Amb24353714 [0,0,0,1,0,0|3,0,0]=4 1083 B10R1.93 CCNC1CC(C1)C(O)=O Amb20622657 [0,0,0,1,0,0|3,0,0]=4 1084 B10R1.93 CCOC1CC(C1)C(O)=O Amb23448945 [0,0,0,1,0,0|3,0,0]=4 1085 B10R1.93 COCC1CC(C1)C(O)=O Amb25835213 [0,0,0,1,0,0|3,0,0]=4 1086 B10R1.93 NCCC1CC(C1)C(N)=O Amb25178892 [0,0,0,1,0,0|2,0,0]=3 1087 B10R1.93 NCCC1CN(C1)C(N)=O Amb25218385 [0,0,0,1,0,0|3,0,0]=4 1088 B10R1.93 NCCN1CC(C1)C(O)=O Amb24479180 [0,0,0,1,0,0|2,0,0]=3 1089 B10R1.93 OCCN1CC(C1)C(O)=O Amb24716807 [0,0,0,1,0,0|3,0,0]=4 1090 B10R1.113 C=C1CC(CCC1)C(O)=O Amb24480810 [0,0,0,1,0,0|2,0,1]=4 1091 B10R1.113 CC(=O)C1CCCC(O)C1 Amb25859196 [0,0,0,1,0,0|3,0,0]=4 1092 B10R1.113 CC(=O)C1CCCC(O)O1 Amb25295371 [0,0,0,1,0,0|3,0,0]=4 1093 B10R1.113 CC(=O)N1C[C@@H](N)CCC1 Amb22227519 [0,0,0,1,0,0|3,0,0]=4 1094 B10R1.113 CC(=O)N1C[C@H](N)CCC1 Amb22227486 [0,0,0,1,0,0|3,0,0]=4 1095 B10R1.113 CC(=O)[C@@H]1CCC[C@@H](O)C1 Amb24533315 [0,0,0,1,0,0|3,0,0]=4 1096 B10R1.113 CC1CC(CCC1)C(=O)Cl Amb25715458 [0,0,0,1,0,0|3,0,0]=4 1097 B10R1.113 CC1CC(CCC1)C(N)=O Amb24680794 [0,0,0,1,0,0|3,0,0]=4 1098 B10R1.113 CC1CC(CCN1)C(O)=O Amb18831574 [0,0,0,1,0,0|3,0,0]=4 1099 B10R1.113 CC1CC(CNC1)C(O)=O Amb18643998 [0,0,0,1,0,0|3,0,0]=4 1100 B10R1.113 CC1CC(NCC1)C(=O)O Amb13886199 [0,0,0,1,0,0|3,0,0]=4 1101 B10R1.113 CC1CC(NCC1)C(O)=O Amb19375550 [0,0,0,1,0,0|3,0,0]=4 1102 B10R1.113 CC1CC(OCC1)C(O)=O Amb25266110 [0,0,0,1,0,0|3,0,0]=4 1103 B10R1.113 CC1CCCC(=C1)C(O)=O Amb24446315 [0,0,0,1,0,0|2,0,1]=4 1104 B10R1.113 CC1CCCC(C1)C(C)=O Amb24505220 [0,0,0,1,0,0|3,0,0]=4 1105 B10R1.113 CC1CCCC(N1)C(O)=O Amb19959953 [0,0,0,1,0,0|1,0,0]=2 1106 B10R1.113 CC1CCCC(O1)C(C)=O Amb24408940 [0,0,0,1,0,0|3,0,0]=4 1107 B10R1.113 CC1CCCC(O1)C(O)=O Amb24529278 [0,0,0,1,0,0|2,0,0]=3 1108 B10R1.113 CC1CCNC(O1)C(O)=O Amb25702339 [0,0,0,1,0,0|3,0,0]=4 1109 B10R1.113 CC1CCOC(O1)C(O)=O Amb24524607 [0,0,0,1,0,0|3,0,0]=4 1110 B10R1.113 CC1COCC(N1)C(N)=O Amb23585370 [0,0,0,1,0,0|3,0,0]=4 1111 B10R1.113 CC1COCC(N1)C(O)=O Amb23585511 [0,0,0,1,0,0|2,0,0]=3 1112 B10R1.113 CC1CSCC(N1)C(O)=O Amb18645533 [0,0,0,1,0,0|2,0,0]=3 1113 B10R1.113 CC1NC(CCS1)C(O)=O Amb18278331 [0,0,0,1,0,0|2,0,0]=3 1114 B10R1.113 CC1OC(CCO1)C(O)=O Amb24502216 [0,0,0,1,0,0|3,0,0]=4 1115 B10R1.113 CC=1CCCC(N1)C(O)=O Amb25300583 [0,0,0,1,0,0|1,0,2]=4 1116 B10R1.113 CC=1CCC[C@H](N1)C(O)=O Amb24549209 [0,0,0,1,0,0|1,0,2]=4 1117 B10R1.113 CN1C[C@@H](CCC1)C(O)=O Amb22751960 [0,0,0,1,0,0|3,0,0]=4 1118 B10R1.113 CS(=O)C1CCCC(N)C1 Amb25777618 [0,0,0,1,0,0|3,0,0]=4 1119 B10R1.113 C[C@@H]1CCCC(C1)C(C)=O Amb25358902 [0,0,0,1,0,0|3,0,0]=4 1120 B10R1.113 C[C@@H]1CCC[C@@H](C1)C(=O)O Amb10843963 [0,0,0,1,0,0|2,0,0]=3 1121 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(O)=O Amb25168905 [0,0,0,1,0,0|1,0,0]=2 1122 B10R1.113 C[C@@H]1CCC[C@H](C1)C(C)=O Amb24736673 [0,0,0,1,0,0|3,0,0]=4 1123 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(O)=O Amb25378882 [0,0,0,1,0,0|3,0,0]=4 1124 B10R1.113 C[C@@H]1COC[C@@H](N1)C(O)=O Amb25102766 [0,0,0,1,0,0|2,0,0]=3 1125 B10R1.113 C[C@@H]1CSC[C@H](N1)C(O)=O Amb24565699 [0,0,0,1,0,0|2,0,0]=3 1126 B10R1.113 C[C@@H]1C[C@@H](NCC1)C(O)=O Amb24725617 [0,0,0,1,0,0|3,0,0]=4 1127 B10R1.113 C[C@@H]1C[C@H](CNC1)C(O)=O Amb25095251 [0,0,0,1,0,0|3,0,0]=4 1128 B10R1.113 C[C@@H]1C[C@H](NCC1)C(O)=O Amb22744764 [0,0,0,1,0,0|3,0,0]=4 1129 B10R1.113 C[C@H]1CC(CCC1)C(N)=O Amb24650556 [0,0,0,1,0,0|3,0,0]=4 1130 B10R1.113 C[C@H]1CC(CCC1)C(O)=O Amb25824115 [0,0,0,1,0,0|2,0,0]=3 1131 B10R1.113 C[C@H]1CCC[C@H](O1)C(O)=O Amb24622482 [0,0,0,1,0,0|2,0,0]=3 1132 B10R1.113 C[C@H]1C[C@@H](CCC1)C(O)=O Amb24657322 [0,0,0,1,0,0|2,0,0]=3 1133 B10R1.113 C[C@H]1C[C@@H](OCC1)C(O)=O Amb25168475 [0,0,0,1,0,0|3,0,0]=4 1134 B10R1.113 N=C1N[C@@H](CCN1)C(O)=O Amb25123864 [0,0,0,1,0,0|1,0,2]=4 1135 B10R1.113 NC(=O)C1CCCC(=O)N1 Amb24480756 [0,0,0,1,0,0|2,0,1]=4 1136 B10R1.113 NC(=O)C1CCCC(O)C1 Amb25067304 [0,0,0,1,0,0|3,0,0]=4 1137 B10R1.113 NC(=O)C1CN(N)CCC1 Amb19663672 [0,0,0,1,0,0|3,0,0]=4 1138 B10R1.113 NC(=O)N1CC(N)CCC1 Amb19149223 [0,0,0,1,0,0|3,0,0]=4 1139 B10R1.113 NC(=O)[C@@H]1CCCC(=O)N1 Amb24753146 [0,0,0,1,0,0|2,0,1]=4 1140 B10R1.113 NC1=NC(CCS1)C(O)=O Amb25756997 [0,0,0,1,0,0|1,0,2]=4 1141 B10R1.113 NC1CC(COC1)C(O)=O Amb25088866 [0,0,0,1,0,0|2,0,0]=3 1142 B10R1.113 NC1CC(NCC1)C(O)=O Amb25111737 [0,0,0,1,0,0|2,0,0]=3 1143 B10R1.113 NC1CCCC(C1)C(=O)N Amb1132450 [0,0,0,1,0,0|2,0,0]=3 1144 B10R1.113 NC1CCCC(C1)C(N)=O Amb20669500 [0,0,0,1,0,0|2,0,0]=3 1145 B10R1.113 NC1CCOC(C1)C(N)=O Amb25223919 [0,0,0,1,0,0|3,0,0]=4 1146 B10R1.113 NC1CN(CCC1)C(N)=O Amb18278018 [0,0,0,1,0,0|3,0,0]=4 1147 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)N Amb10873178 [0,0,0,1,0,0|2,0,0]=3 1148 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O Amb10873166 [0,0,0,1,0,0|1,0,0]=2 1149 B10R1.113 N[C@@H]1C[C@@H](CCC1)C(O)=O Amb20241307 [0,0,0,1,0,0|1,0,0]=2 1150 B10R1.113 N[C@@H]1C[C@@H](CCC1)C(O)=O Amb23439976 [0,0,0,1,0,0|1,0,0]=2 1151 B10R1.113 N[C@@H]1C[C@@H](CNC1)C(O)=O Amb24587389 [0,0,0,1,0,0|2,0,0]=3 1152 B10R1.113 N[C@@H]1C[C@H](C=CC1)C(O)=O Amb24639997 [0,0,0,1,0,0|1,0,2]=4 1153 B10R1.113 N[C@@H]1C[C@H](CCC1)C(O)=O Amb22746829 [0,0,0,1,0,0|1,0,0]=2 1154 B10R1.113 N[C@@H]1C[C@H](CCC1)C(O)=O Amb23439848 [0,0,0,1,0,0|1,0,0]=2 1155 B10R1.113 N[C@H]1C[C@@H](C=CC1)C(O)=O Amb25230595 [0,0,0,1,0,0|1,0,2]=4 1156 B10R1.113 N[C@H]1C[C@@H](CC=C1)C(O)=O Amb24573259 [0,0,0,1,0,0|1,0,2]=4 1157 B10R1.113 N[C@H]1C[C@@H](NCC1)C(O)=O Amb25305570 [0,0,0,1,0,0|2,0,0]=3 1158 B10R1.113 N[C@H]1C[C@H](CC=C1)C(O)=O Amb24612043 [0,0,0,1,0,0|1,0,2]=4 1159 B10R1.113 N[C@H]1C[C@H](CCC1)C(O)=O Amb20241308 [0,0,0,1,0,0|1,0,0]=2 1160 B10R1.113 O=C1CCC[C@H](N1)C(=O)O Amb10576327 [0,0,0,1,0,0|1,0,1]=3 1161 B10R1.113 OC(=O)C1CC(Cl)CCN1 Amb24441476 [0,0,0,1,0,0|3,0,0]=4 1162 B10R1.113 OC(=O)C1CC(F)CCN1 Amb24423965 [0,0,0,1,0,0|3,0,0]=4 1163 B10R1.113 OC(=O)C1CC(F)CNC1 Amb13889096 [0,0,0,1,0,0|3,0,0]=4 1164 B10R1.113 OC(=O)C1CCCC(=O)S1 Amb25774954 [0,0,0,1,0,0|2,0,1]=4 1165 B10R1.113 OC(=O)C1CCCC(Br)C1 Amb24478263 [0,0,0,1,0,0|2,0,0]=3 1166 B10R1.113 OC(=O)C1CCCC(Cl)C1 Amb18126349 [0,0,0,1,0,0|2,0,0]=3 1167 B10R1.113 OC(=O)C1CCNC(=O)N1 Amb24659979 [0,0,0,1,0,0|2,0,1]=4 1168 B10R1.113 OC(=O)C1CN(Cl)CCC1 Amb25046169 [0,0,0,1,0,0|3,0,0]=4 1169 B10R1.113 OC(=O)C1CNCC(=O)N1 Amb22235985 [0,0,0,1,0,0|2,0,1]=4 1170 B10R1.113 OC(=O)C1COCC(=O)N1 Amb18862478 [0,0,0,1,0,0|2,0,1]=4 1171 B10R1.113 OC(=O)[C@@H]1CC(=O)CCC1 Amb24460815 [0,0,0,1,0,0|2,0,1]=4 1172 B10R1.113 OC(=O)[C@@H]1CCC[C@@H](Br)C1 Amb25366201 [0,0,0,1,0,0|2,0,0]=3 1173 B10R1.113 OC(=O)[C@@H]1CCC[C@H](Cl)C1 Amb24511905 [0,0,0,1,0,0|2,0,0]=3 1174 B10R1.113 OC(=O)[C@@H]1CCOC(=O)N1 Amb24745665 [0,0,0,1,0,0|2,0,1]=4 1175 B10R1.113 OC(=O)[C@@H]1CNCC(=O)N1 Amb22746774 [0,0,0,1,0,0|2,0,1]=4 1176 B10R1.113 OC(=O)[C@@H]1C[C@@H](F)CCN1 Amb25214695 [0,0,0,1,0,0|3,0,0]=4 1177 B10R1.113 OC(=O)[C@H]1CCNC(=O)N1 Amb24479098 [0,0,0,1,0,0|2,0,1]=4 1178 B10R1.113 OC(=O)[C@H]1CNC[C@@H](F)C1 Amb24737294 [0,0,0,1,0,0|3,0,0]=4 1179 B10R1.113 OC(=O)[C@H]1COCC(=O)N1 Amb25235172 [0,0,0,1,0,0|2,0,1]=4 1180 B10R1.113 OC1CCCC(C1)C(O)=O Amb18644123 [0,0,0,1,0,0|2,0,0]=3 1181 B10R1.113 OC1CCCC(O1)C(O)=O Amb24426494 [0,0,0,1,0,0|2,0,0]=3 1182 B10R1.113 OC1CCC[C@H](N1)C(O)=O Amb24479127 [0,0,0,1,0,0|1,0,0]=2 1183 B10R1.113 OC1CCNC(C1)C(O)=O Amb24117443 [0,0,0,1,0,0|3,0,0]=4 1184 B10R1.113 O[C@@H]1CCC[C@@H](C1)C(O)=O Amb22899465 [0,0,0,1,0,0|2,0,0]=3 1185 B10R1.113 O[C@@H]1CCC[C@H](C1)C(O)=O Amb22899464 [0,0,0,1,0,0|2,0,0]=3 1186 B10R1.113 O[C@@H]1CCNC(C1)C(O)=O Amb25296203 [0,0,0,1,0,0|3,0,0]=4 1187 B10R1.113 O[C@@H]1CCN[C@@H](C1)C(=O)O Amb10606703 [0,0,0,1,0,0|3,0,0]=4 1188 B10R1.113 O[C@@H]1CCN[C@@H](C1)C(O)=O Amb22386828 [0,0,0,1,0,0|3,0,0]=4 1189 B10R1.113 O[C@@H]1CCN[C@H](C1)C(O)=O Amb22748263 [0,0,0,1,0,0|3,0,0]=4 1190 B10R1.113 O[C@H]1CCC[C@@H](C1)C(O)=O Amb24546990 [0,0,0,1,0,0|2,0,0]=3 1191 B10R1.113 O[C@H]1CCN[C@@H](C1)C(O)=O Amb22388540 [0,0,0,1,0,0|3,0,0]=4 1192 B10R1.113 O[C@H]1CCN[C@H](C1)C(O)=O Amb20241913 [0,0,0,1,0,0|3,0,0]=4 1193 B10R1.114 CC1(C)C(N)CCCC1N Amb23455503 [0,0,0,1,0,0|2,0,1]=4 1194 B10R1.116 CC1CCC1C(O)C(O)=O Amb25042981 [0,0,0,1,0,0|2,0,0]=3 1195 B10R1.116 C[C@H]([C@@H]1CC[C@@H]1F)C(C)=O Amb25179577 [0,0,0,1,0,0|3,0,0]=4 1196 B10R1.116 OC(=O)[C@@H](O)[C@H]1CCC1=O Amb24615393 [0,0,0,1,0,0|2,0,1]=4 1197 B10R1.116 OC(=O)[C@H](O)[C@@H]1CCC1=O Amb25246299 [0,0,0,1,0,0|2,0,1]=4 1198 B10R1.131 C=C1CC(CCBr)OC1=O Amb24477347 [0,0,0,1,0,0|2,0,1]=4 1199 B10R1.131 C=CCC1CC(O)C(=O)O1 Amb25028031 [0,0,0,1,0,0|2,0,1]=4 1200 B10R1.131 CCCC1CC(O)C(=O)O1 Amb25306351 [0,0,0,1,0,0|2,0,0]=3 1201 B10R1.131 CCCC1OC(=O)C(=O)C1 Amb17593586 [0,0,0,1,0,0|2,0,1]=4 1202 B10R1.131 CN1CC(CCBr)OC1=O Amb24502359 [0,0,0,1,0,0|3,0,0]=4 1203 B10R1.131 CN1CC(CCN)CC1=O Amb25739570 [0,0,0,1,0,0|3,0,0]=4 1204 B10R1.131 CN1CC(CCN)OC1=O Amb18831496 [0,0,0,1,0,0|2,0,0]=3 1205 B10R1.131 CN1CC(CCO)OC1=O Amb25332400 [0,0,0,1,0,0|3,0,0]=4 1206 B10R1.131 CSCC1CN(C(=O)O1)N Amb17594038 [0,0,0,1,0,0|3,0,0]=4 1207 B10R1.131 NC1CC(CCN)OC1=O Amb24351646 [0,0,0,1,0,0|0,0,0]=1 1208 B10R1.131 NC1CC(CCO)OC1=O Amb24596483 [0,0,0,1,0,0|1,0,0]=2 1209 B10R1.131 NCCC1C[C@H](O)[C@@H](O)C1 Amb24739877 [0,0,0,1,0,0|2,0,1]=4 1210 B10R1.131 N[C@H]1C[C@@H](CCN)OC1=O Amb25224176 [0,0,0,1,0,0|0,0,0]=1 1211 B10R1.144 C=CCCC1CC1C(O)=O Amb25702406 [0,0,0,1,0,0|2,0,1]=4 1212 B10R1.144 C=CCC[C@@H]1C[C@@H]1C(O)=O Amb25378851 [0,0,0,1,0,0|2,0,1]=4 1213 B10R1.144 CC(=O)C1OC1CCCO Amb24706695 [0,0,0,1,0,0|3,0,0]=4 1214 B10R1.144 CCCCC1=CC1C(O)=O Amb24568035 [0,0,0,1,0,0|2,0,1]=4 1215 B10R1.144 CCCCC1CC1C(=O)C Amb17593552 [0,0,0,1,0,0|3,0,0]=4 1216 B10R1.144 CCCCC1CC1C(=O)O Amb10608641 [0,0,0,1,0,0|2,0,0]=3 1217 B10R1.144 CCCC[C@@H]1O[C@H]1C(O)=O Amb24585157 [0,0,0,1,0,0|2,0,0]=3 1218 B10R1.144 CCCC[C@H]1O[C@@H]1C(O)=O Amb24562255 [0,0,0,1,0,0|2,0,0]=3 1219 B10R1.144 NC\C=C\C1CC1C(O)=O Amb25139490 [0,0,0,1,0,0|1,0,2]=4 1220 B10R1.144 NC\C=C\[C@@H]1C[C@H]1C(O)=O Amb25348808 [0,0,0,1,0,0|1,0,2]=4 1221 B10R1.155 CC[C@@H]1C[C@H]1[C@@H](N)C(O)=O Amb25245291 [0,0,0,1,0,0|1,0,0]=2 1222 B10R1.155 NC([C@H]1C[C@H]1CO)C(O)=O Amb24606173 [0,0,0,1,0,0|1,0,0]=2 1223 B10R1.176 CC1CCC(CC)NC1=O Amb24479045 [0,0,0,1,0,0|3,0,0]=4 1224 B10R1.176 CC1CC[C@H](CO)OC1=O Amb24466202 [0,0,0,1,0,0|2,0,0]=3 1225 B10R1.176 CN1CCC(CN)CC1=O Amb18908367 [0,0,0,1,0,0|3,0,0]=4 1226 B10R1.176 CN1CCC(CN)CC1=O Amb23439152 [0,0,0,1,0,0|3,0,0]=4 1227 B10R1.176 CN1CCC(CN)OC1=O Amb25806038 [0,0,0,1,0,0|2,0,0]=3 1228 B10R1.176 C[C@@H]1CC[C@@H](CC1=O)CC Amb24737246 [0,0,0,1,0,0|3,0,0]=4 1229 B10R1.176 C[C@@H]1CC[C@@H](CCl)NC1=O Amb24519721 [0,0,0,1,0,0|3,0,0]=4 1230 B10R1.176 C[C@H]1CC[C@@H](CC1=O)CC Amb24631309 [0,0,0,1,0,0|3,0,0]=4 1231 B10R1.176 C[C@H]1CC[C@@H](CO)NC1=O Amb25175008 [0,0,0,1,0,0|3,0,0]=4 1232 B10R1.190 C=C1CC1CC(N)C(O)=O Amb22730075 [0,0,0,1,0,0|1,0,1]=3 1233 B10R1.190 C=C1CC1CC(N)C(O)=O Amb24117524 [0,0,0,1,0,0|1,0,1]=3 1234 B10R1.190 C=C1CC1C[C@@H](N)C(O)=O Amb24640688 [0,0,0,1,0,0|1,0,1]=3 1235 B10R1.190 C=C1CC1C[C@H](N)C(O)=O Amb25235396 [0,0,0,1,0,0|1,0,1]=3 1236 B10R1.190 C=C1C[C@H]1C[C@H](N)C(O)=O Amb24597968 [0,0,0,1,0,0|1,0,1]=3 1237 B10R1.190 CC(NC1CC1C)C(O)=O Amb25040323 [0,0,0,1,0,0|3,0,0]=4 1238 B10R1.190 CC1CC1CC(N)C(O)=O Amb25147396 [0,0,0,1,0,0|1,0,0]=2 1239 B10R1.190 CC1CC1C[C@H](N)C(O)=O Amb25305763 [0,0,0,1,0,0|1,0,0]=2 1240 B10R1.190 C[C@@H]1S[C@@H]1C[C@H](N)C(O)=O Amb25202932 [0,0,0,1,0,0|2,0,0]=3 1241 B10R1.190 NC(CC1CC1=O)C(O)=O Amb24477414 [0,0,0,1,0,0|1,0,1]=3 1242 B10R1.190 NC(CC1CC1N)C(O)=O Amb23571908 [0,0,0,1,0,0|0,0,0]=1 1243 B10R1.190 N[C@@H](C[C@@H]1C[C@H]1N)C(O)=O Amb25302205 [0,0,0,1,0,0|0,0,0]=1 1244 B10R1.190 N[C@@H](C[C@H]1C[C@@H]1N)C(O)=O Amb25245233 [0,0,0,1,0,0|0,0,0]=1 1245 B10R1.190 N[C@H](C(=O)O)C[C@H]1CC1=C Amb17615983 [0,0,0,1,0,0|1,0,1]=3 1246 B10R1.204 C=C(CC1CCC1)C(O)=O Amb25740739 [0,0,0,1,0,0|2,0,1]=4 1247 B10R1.204 CC(=C)C(N)CC1CCC1 Amb25247658 [0,0,0,1,0,0|3,0,0]=4 1248 B10R1.204 CC(CC1CCN1)C(O)=O Amb24651293 [0,0,0,1,0,0|1,0,0]=2 1249 B10R1.204 CC(NC1CCC1)C(O)=O Amb18989323 [0,0,0,1,0,0|3,0,0]=4 1250 B10R1.204 CC(OC1CCC1)C(O)=O Amb18977476 [0,0,0,1,0,0|3,0,0]=4 1251 B10R1.204 CC(SC1CCC1)C(O)=O Amb24396553 [0,0,0,1,0,0|3,0,0]=4 1252 B10R1.204 C[C@@H](NC1CCC1)C(O)=O Amb24529168 [0,0,0,1,0,0|3,0,0]=4 1253 B10R1.204 C[C@@H](OC1CCC1)C(O)=O Amb25808190 [0,0,0,1,0,0|3,0,0]=4 1254 B10R1.204 C[C@H](NC1CCC1)C(O)=O Amb22641924 [0,0,0,1,0,0|3,0,0]=4 1255 B10R1.204 NC(CC1CCC1)C(O)=O Amb21963935 [0,0,0,1,0,0|1,0,0]=2 1256 B10R1.204 NC(CC1COC1)C(N)=O Amb25072501 [0,0,0,1,0,0|3,0,0]=4 1257 B10R1.204 NC(CC1CSC1)C(N)=O Amb25212560 [0,0,0,1,0,0|3,0,0]=4 1258 B10R1.204 NC(CN1CCC1)C(N)=O Amb25125098 [0,0,0,1,0,0|3,0,0]=4 1259 B10R1.204 N[C@@H](CC1CCC1)C(O)=O Amb22641837 [0,0,0,1,0,0|1,0,0]=2 1260 B10R1.204 N[C@H](CC1CCC1)C(O)=O Amb19889667 [0,0,0,1,0,0|1,0,0]=2 1261 B10R1.204 N[C@H](CC1COC1)C(N)=O Amb25320681 [0,0,0,1,0,0|3,0,0]=4 1262 B10R1.204 OC(CC1CCC1)C(O)=O Amb25701846 [0,0,0,1,0,0|2,0,0]=3 1263 B10R1.205 CC(=C)C(N)CCC1CC1 Amb25299618 [0,0,0,1,0,0|3,0,0]=4 1264 B10R1.205 C[C@@H](NCC1CC1)C(O)=O Amb25118332 [0,0,0,1,0,0|3,0,0]=4 1265 B10R1.205 C[C@@H](OCC1CC1)C(O)=O Amb25282110 [0,0,0,1,0,0|3,0,0]=4 1266 B10R1.205 C[C@H](NCC1CC1)C(O)=O Amb24474543 [0,0,0,1,0,0|3,0,0]=4 1267 B10R1.205 C[C@H](OCC1CC1)C(O)=O Amb24384555 [0,0,0,1,0,0|3,0,0]=4 1268 B10R1.205 NC(=O)C(O)CCC1CC1 Amb24626755 [0,0,0,1,0,0|3,0,0]=4 1269 B10R1.205 NC(CCC1CC1)C(N)=O Amb25284806 [0,0,0,1,0,0|2,0,0]=3 1270 B10R1.205 NC(CCC1CC1)C(O)=O Amb18831582 [0,0,0,1,0,0|1,0,0]=2 1271 B10R1.205 NC(CNC1CC1)C(N)=O Amb25214047 [0,0,0,1,0,0|3,0,0]=4 1272 B10R1.205 N[C@@H](CCC1CC1)C(O)=O Amb25236249 [0,0,0,1,0,0|1,0,0]=2 1273 B10R1.205 OC(CCC1CC1)C(O)=O Amb25187335 [0,0,0,1,0,0|2,0,0]=3 1274 B10R1.217 CCCCC1CC(=O)C1Br Amb25827168 [0,0,0,1,0,0|3,0,0]=4 1275 B10R1.217 CCCC[C@@H]1NC(=O)[C@@H]1O Amb25367857 [0,0,0,1,0,0|3,0,0]=4 1276 B10R1.217 CCCC[C@H]1NC(=O)[C@@H]1O Amb24517360 [0,0,0,1,0,0|3,0,0]=4 1277 B10R1.277 CC1CCCC(C)NC1=O Amb19335341 [0,0,0,1,0,0|3,0,0]=4 1278 B10R1.277 C[C@@H]1CC(=O)C(C)CCC1 Amb25146718 [0,0,0,1,0,0|3,0,0]=4 1279 B10R1.277 C[C@H]1CC(=O)C(C)CCC1 Amb25094452 [0,0,0,1,0,0|3,0,0]=4 1280 B10R1.291 CC(=O)C1(C)COCC1N Amb24586865 [0,0,0,1,0,0|3,0,0]=4 1281 B10R1.291 CC1(CCCC1=C)C(O)=O Amb18643555 [0,0,0,1,0,0|2,0,1]=4 1282 B10R1.291 CC1(CCCC1N)C(O)=O Amb18643994 [0,0,0,1,0,0|1,0,0]=2 1283 B10R1.291 CC1(CCCC1O)C(O)=O Amb18644145 [0,0,0,1,0,0|2,0,0]=3 1284 B10R1.291 CC1(COCC1N)C(O)=O Amb25202537 [0,0,0,1,0,0|2,0,0]=3 1285 B10R1.291 CC1CCCC1(C)C(C)=O Amb25859185 [0,0,0,1,0,0|3,0,0]=4 1286 B10R1.291 CC1CCCC1(C)C(O)=O Amb18643950 [0,0,0,1,0,0|2,0,0]=3 1287 B10R1.291 CC1CCCC1(O)C(O)=O Amb24505300 [0,0,0,1,0,0|2,0,0]=3 1288 B10R1.291 CC1CSCC1(N)C(O)=O Amb24340085 [0,0,0,1,0,0|2,0,0]=3 1289 B10R1.291 CC1CSCC1(O)C(O)=O Amb24602284 [0,0,0,1,0,0|3,0,0]=4 1290 B10R1.291 CC1NCCC1(O)C(O)=O Amb25212774 [0,0,0,1,0,0|3,0,0]=4 1291 B10R1.291 CC1SCCC1(N)C(O)=O Amb25275870 [0,0,0,1,0,0|2,0,0]=3 1292 B10R1.291 CN1CCCC1(O)C(O)=O Amb24746682 [0,0,0,1,0,0|3,0,0]=4 1293 B10R1.291 CN1CCC[C@@]1(C)C(O)=O Amb25068442 [0,0,0,1,0,0|3,0,0]=4 1294 B10R1.291 C[C@@H]1CCC[C@@]1(C)C(N)=O Amb24628418 [0,0,0,1,0,0|3,0,0]=4 1295 B10R1.291 C[C@@H]1CCC[C@@]1(C)C(O)=O Amb24715474 [0,0,0,1,0,0|2,0,0]=3 1296 B10R1.291 C[C@@H]1CCC[C@]1(C)C(O)=O Amb24580792 [0,0,0,1,0,0|2,0,0]=3 1297 B10R1.291 C[C@@H]1CCC[C@]1(N)C(N)=O Amb25214323 [0,0,0,1,0,0|2,0,0]=3 1298 B10R1.291 C[C@@H]1CCC[C@]1(N)C(O)=O Amb24562232 [0,0,0,1,0,0|1,0,0]=2 1299 B10R1.291 C[C@@H]1CSC[C@@]1(N)C(O)=O Amb24512166 [0,0,0,1,0,0|2,0,0]=3 1300 B10R1.291 C[C@@]1(CCC[C@@H]1N)C(O)=O Amb24580091 [0,0,0,1,0,0|1,0,0]=2 1301 B10R1.291 C[C@H]1CCC[C@@]1(C)C(N)=O Amb24744676 [0,0,0,1,0,0|3,0,0]=4 1302 B10R1.291 C[C@H]1CCC[C@@]1(C)C(O)=O Amb25340524 [0,0,0,1,0,0|2,0,0]=3 1303 B10R1.291 C[C@H]1CCC[C@]1(C)C(C)=O Amb25263064 [0,0,0,1,0,0|3,0,0]=4 1304 B10R1.291 C[C@H]1CCC[C@]1(N)C(O)=O Amb24585699 [0,0,0,1,0,0|1,0,0]=2 1305 B10R1.291 C[C@H]1SCC[C@]1(O)C(O)=O Amb25240625 [0,0,0,1,0,0|3,0,0]=4 1306 B10R1.291 C[C@]1(CCC[C@@H]1N)C(O)=O Amb22504290 [0,0,0,1,0,0|1,0,0]=2 1307 B10R1.291 C[C@]1(CCC[C@H]1N)C(O)=O Amb25268531 [0,0,0,1,0,0|1,0,0]=2 1308 B10R1.291 NC1(COCC1F)C(O)=O Amb24722195 [0,0,0,1,0,0|2,0,0]=3 1309 B10R1.291 NC1CCCC1(N)C(N)=O Amb25703148 [0,0,0,1,0,0|1,0,0]=2 1310 B10R1.291 NC1CCCC1(O)C(O)=O Amb25368393 [0,0,0,1,0,0|1,0,0]=2 1311 B10R1.291 N[C@@H]1CCC[C@@]1(O)C(O)=O Amb25175063 [0,0,0,1,0,0|1,0,0]=2 1312 B10R1.291 N[C@@]1(CCC[C@@H]1O)C(O)=O Amb24597165 [0,0,0,1,0,0|1,0,0]=2 1313 B10R1.291 N[C@@]1(CCC[C@H]1F)C(O)=O Amb24761477 [0,0,0,1,0,0|1,0,0]=2 1314 B10R1.291 N[C@@]1(CCC[C@H]1O)C(O)=O Amb24604346 [0,0,0,1,0,0|1,0,0]=2 1315 B10R1.291 N[C@]1(CCCC1O)C(O)=O Amb24459542 [0,0,0,1,0,0|1,0,0]=2 1316 B10R1.291 N[C@]1(CCC[C@@H]1O)C(O)=O Amb24579395 [0,0,0,1,0,0|1,0,0]=2 1317 B10R1.291 N[C@]1(CCC[C@H]1O)C(O)=O Amb25174849 [0,0,0,1,0,0|1,0,0]=2 1318 B10R1.291 N[C@]1(COC[C@@H]1F)C(O)=O Amb24542712 [0,0,0,1,0,0|2,0,0]=3 1319 B10R1.291 OC(=O)C1(F)CCCC1F Amb24654072 [0,0,0,1,0,0|2,0,0]=3 1320 B10R1.291 OC(=O)C1(F)CNCC1F Amb24559376 [0,0,0,1,0,0|3,0,0]=4 1321 B10R1.291 OC(=O)C1(O)CCCN1Cl Amb24482390 [0,0,0,1,0,0|3,0,0]=4 1322 B10R1.319 CCCC1CC1(N)C(O)=O Amb24391690 [0,0,0,1,0,0|1,0,0]=2 1323 B10R1.319 CCC[C@@H]1C[C@]1(N)C(O)=O Amb24610769 [0,0,0,1,0,0|1,0,0]=2 1324 B10R1.319 CCC[C@@H]1O[C@@]1(C)C(O)=O Amb25340484 [0,0,0,1,0,0|3,0,0]=4 1325 B10R1.319 CSC[C@@H]1C[C@@]1(N)C(O)=O Amb24600099 [0,0,0,1,0,0|2,0,0]=3 1326 B10R1.319 CSC[C@@H]1C[C@]1(N)C(O)=O Amb25353330 [0,0,0,1,0,0|2,0,0]=3 1327 B10R1.319 N[C@]1(C[C@H]1CCO)C(O)=O Amb24598165 [0,0,0,1,0,0|1,0,0]=2 1328 B10R1.348 CC(=O)C1CCCCC=C1 Amb25125700 [0,0,0,1,0,0|3,0,0]=4 1329 B10R1.348 CC(=O)C1CCCCCC1 Amb24407172 [0,0,0,1,0,0|3,0,0]=4 1330 B10R1.348 CC(=O)C1CCCCCN1 Amb25169359 [0,0,0,1,0,0|2,0,0]=3 1331 B10R1.348 CC(=O)C1COCCCC1 Amb24511806 [0,0,0,1,0,0|3,0,0]=4 1332 B10R1.348 CC(O)C1CCCCCN1 Amb25146271 [0,0,0,1,0,0|2,0,1]=4 1333 B10R1.348 NC(=O)C1CCCCCC1 Amb24182051 [0,0,0,1,0,0|3,0,0]=4 1334 B10R1.348 NC(=O)C1CCCCCN1 Amb23596651 [0,0,0,1,0,0|2,0,0]=3 1335 B10R1.348 NC(=O)C1CCNCCN1 Amb24680938 [0,0,0,1,0,0|3,0,0]=4 1336 B10R1.348 NC(=O)C1CNCCCN1 Amb25147425 [0,0,0,1,0,0|3,0,0]=4 1337 B10R1.348 NC(=O)C1CNCCCO1 Amb24482569 [0,0,0,1,0,0|3,0,0]=4 1338 B10R1.348 NC(=O)C1CNCCOC1 Amb20062256 [0,0,0,1,0,0|3,0,0]=4 1339 B10R1.348 NC(=O)C1COCCCN1 Amb25271527 [0,0,0,1,0,0|3,0,0]=4 1340 B10R1.348 O=C(Cl)C1CCCCCC1 Amb18797932 [0,0,0,1,0,0|3,0,0]=4 1341 B10R1.348 OC(=O)C1CC=CCCC1 Amb25791623 [0,0,0,1,0,0|2,0,1]=4 1342 B10R1.348 OC(=O)C1CCCCC=C1 Amb25230619 [0,0,0,1,0,0|2,0,0]=3 1343 B10R1.348 OC(=O)C1CCCNC=N1 Amb25343002 [0,0,0,1,0,0|2,0,1]=4 1344 B10R1.348 OC(=O)C1CCCNCC1 Amb18831588 [0,0,0,1,0,0|3,0,0]=4 1345 B10R1.348 OC(=O)C1CCCOCC1 Amb18831505 [0,0,0,1,0,0|3,0,0]=4 1346 B10R1.348 OC(=O)C1CCCSCC1 Amb18199262 [0,0,0,1,0,0|3,0,0]=4 1347 B10R1.348 OC(=O)C1CNCCCO1 Amb17739810 [0,0,0,1,0,0|2,0,0]=3 1348 B10R1.348 OC(=O)C1CNCCCO1 Amb22523333 [0,0,0,1,0,0|2,0,0]=3 1349 B10R1.348 OC(=O)C1CNCCCS1 Amb25350672 [0,0,0,1,0,0|2,0,0]=3 1350 B10R1.348 OC(=O)C1CSCCCN1 Amb24374437 [0,0,0,1,0,0|2,0,0]=3 1351 B10R1.348 OC(=O)C=1CCCCCN1 Amb24671301 [0,0,0,1,0,0|1,0,2]=4 1352 B10R1.348 OC(=O)[C@@H]1CCCCC[NH2+]1 Amb10576587 [0,0,0,1,0,0|1,0,1]=3 1353 B10R1.348 OC(=O)[C@H]1CCCNCC1 Amb24479341 [0,0,0,1,0,0|3,0,0]=4 1354 B10R1.348 OC(=O)[C@H]1COCCCN1 Amb24730670 [0,0,0,1,0,0|2,0,0]=3 1355 B10R1.363 CC(=O)C1(C)CCCCC1 Amb25825155 [0,0,0,1,0,0|3,0,0]=4 1356 B10R1.363 CC(=O)C1(Cl)CCCCC1 Amb25310657 [0,0,0,1,0,0|3,0,0]=4 1357 B10R1.363 CC(=O)C1(F)CCCCC1 Amb25359078 [0,0,0,1,0,0|3,0,0]=4 1358 B10R1.363 CC(=O)C1(N)CCCCC1 Amb1091885 [0,0,0,1,0,0|2,0,0]=3 1359 B10R1.363 CC(=O)C1(N)CCCCC1 Amb22283957 [0,0,0,1,0,0|2,0,0]=3 1360 B10R1.363 CC(=O)C1(S)CCCCC1 Amb25130567 [0,0,0,1,0,0|3,0,0]=4 1361 B10R1.363 CC1(CCCCC1)C(N)=O Amb17674284 [0,0,0,1,0,0|3,0,0]=4 1362 B10R1.363 CC1(CCCCN1)C(O)=O Amb21959568 [0,0,0,1,0,0|1,0,0]=2 1363 B10R1.363 CC1(CCCCO1)C(=O)Cl Amb25047171 [0,0,0,1,0,0|3,0,0]=4 1364 B10R1.363 CC1(CCNCC1)C(O)=O Amb19891294 [0,0,0,1,0,0|3,0,0]=4 1365 B10R1.363 CC1(CCOCO1)C(O)=O Amb24648903 [0,0,0,1,0,0|3,0,0]=4 1366 B10R1.363 CC1(CNCCC1)C(O)=O Amb19148847 [0,0,0,1,0,0|3,0,0]=4 1367 B10R1.363 CC1(COCCC1)C(O)=O Amb18949055 [0,0,0,1,0,0|3,0,0]=4 1368 B10R1.363 C[C@@]1(CCCC=C1)C(O)=O Amb24505174 [0,0,0,1,0,0|2,0,1]=4 1369 B10R1.363 C[C@@]1(CCCCN1)C(N)=O Amb25147419 [0,0,0,1,0,0|2,0,0]=3 1370 B10R1.363 C[C@@]1(CCCCN1)C(O)=O Amb22262934 [0,0,0,1,0,0|1,0,0]=2 1371 B10R1.363 C[C@@]1(CCCCO1)C(O)=O Amb24659158 [0,0,0,1,0,0|2,0,0]=3 1372 B10R1.363 C[C@]1(CCCCN1)C(O)=O Amb22262937 [0,0,0,1,0,0|1,0,0]=2 1373 B10R1.363 C[C@]1(COCCN1)C(O)=O Amb25320322 [0,0,0,1,0,0|2,0,0]=3 1374 B10R1.363 NC(=O)C1(N)CCNCC1 Amb18278418 [0,0,0,1,0,0|3,0,0]=4 1375 B10R1.363 NC(=O)C1(N)CCOCC1 Amb18278286 [0,0,0,1,0,0|3,0,0]=4 1376 B10R1.363 NC(=O)C1(N)CCSCC1 Amb18278809 [0,0,0,1,0,0|3,0,0]=4 1377 B10R1.363 NC(=O)C1(N)COCCC1 Amb22059476 [0,0,0,1,0,0|3,0,0]=4 1378 B10R1.363 NC(=O)C1(N)CSCCC1 Amb18948520 [0,0,0,1,0,0|3,0,0]=4 1379 B10R1.363 NC(=O)C1(O)CCCCC1 Amb24116820 [0,0,0,1,0,0|3,0,0]=4 1380 B10R1.363 NC1(CCCCC1)C(O)=O Amb22406331 [0,0,0,1,0,0|1,0,0]=2 1381 B10R1.363 NC1(CCCCC1)P(O)=O Amb25723526 [0,0,0,1,0,0|2,0,0]=3 1382 B10R1.363 NC1(CCNCC1)C(O)=O Amb22168380 [0,0,0,1,0,0|2,0,0]=3 1383 B10R1.363 NC1(CCSCC1)C(O)=O Amb17943831 [0,0,0,1,0,0|2,0,0]=3 1384 B10R1.363 NC1(CNCCC1)C(O)=O Amb20242317 [0,0,0,1,0,0|2,0,0]=3 1385 B10R1.363 NC1(CNCCC1)C(O)=O Amb22756826 [0,0,0,1,0,0|2,0,0]=3 1386 B10R1.363 NC1(COCCC1)C(O)=O Amb19958927 [0,0,0,1,0,0|2,0,0]=3 1387 B10R1.363 NC1(COCCC1)C(O)=O Amb22270206 [0,0,0,1,0,0|2,0,0]=3 1388 B10R1.363 NC1(CSCCC1)C(O)=O Amb18948549 [0,0,0,1,0,0|2,0,0]=3 1389 B10R1.363 N[C@@]1(CSCCC1)C(O)=O Amb25116300 [0,0,0,1,0,0|2,0,0]=3 1390 B10R1.363 N[C@]1(COCCC1)C(O)=O Amb20241217 [0,0,0,1,0,0|2,0,0]=3 1391 B10R1.363 N[C@]1(CSCCC1)C(O)=O Amb25347561 [0,0,0,1,0,0|2,0,0]=3 1392 B10R1.363 O=C(Cl)C1(Br)CCCCC1 Amb24444760 [0,0,0,1,0,0|3,0,0]=4 1393 B10R1.363 OC(=O)C1(Br)CCCCC1 Amb18130989 [0,0,0,1,0,0|2,0,0]=3 1394 B10R1.363 OC(=O)C1(Br)CCOCC1 Amb25828678 [0,0,0,1,0,0|3,0,0]=4 1395 B10R1.363 OC(=O)C1(C)CCCCC1 Amb1148788 [0,0,0,1,0,0|2,0,0]=3 1396 B10R1.363 OC(=O)C1(C)CCCCC1 Amb2388313 [0,0,0,1,0,0|2,0,0]=3 1397 B10R1.363 OC(=O)C1(C)CCCCO1 Amb10072964 [0,0,0,1,0,0|2,0,0]=3 1398 B10R1.363 OC(=O)C1(C)CCCNC1 Amb17622036 [0,0,0,1,0,0|3,0,0]=4 1399 B10R1.363 OC(=O)C1(C)CCNCC1 Amb15701613 [0,0,0,1,0,0|3,0,0]=4 1400 B10R1.363 OC(=O)C1(C)CCOCC1 Amb10843981 [0,0,0,1,0,0|3,0,0]=4 1401 B10R1.363 OC(=O)C1(C)CCSCC1 Amb10843982 [0,0,0,1,0,0|3,0,0]=4 1402 B10R1.363 OC(=O)C1(Cl)CCOCC1 Amb18646184 [0,0,0,1,0,0|3,0,0]=4 1403 B10R1.363 OC(=O)C1(F)CCCCC1 Amb10603425 [0,0,0,1,0,0|2,0,0]=3 1404 B10R1.363 OC(=O)C1(F)CCNCC1 Amb17739849 [0,0,0,1,0,0|3,0,0]=4 1405 B10R1.363 OC(=O)C1(F)CCNCC1 Amb19374711 [0,0,0,1,0,0|3,0,0]=4 1406 B10R1.363 OC(=O)C1(F)CCOCC1 Amb16233480 [0,0,0,1,0,0|3,0,0]=4 1407 B10R1.363 OC(=O)C1(F)CCSCC1 Amb25218006 [0,0,0,1,0,0|3,0,0]=4 1408 B10R1.363 OC(=O)C1(F)CNCCC1 Amb24062229 [0,0,0,1,0,0|3,0,0]=4 1409 B10R1.363 OC(=O)C1(F)COCCC1 Amb25178890 [0,0,0,1,0,0|3,0,0]=4 1410 B10R1.363 OC(=O)C1(N)CCCCC1 Amb1153058 [0,0,0,1,0,0|1,0,0]=2 1411 B10R1.363 OC(=O)C1(N)CCNCC1 Amb16230706 [0,0,0,1,0,0|2,0,0]=3 1412 B10R1.363 OC(=O)C1(O)CCCCC1 Amb1159102 [0,0,0,1,0,0|2,0,0]=3 1413 B10R1.363 OC(=O)C1(O)CCCCN1 Amb24669624 [0,0,0,1,0,0|1,0,0]=2 1414 B10R1.363 OC(=O)C1(O)CCNCC1 Amb10552861 [0,0,0,1,0,0|3,0,0]=4 1415 B10R1.363 OC(=O)C1(O)CCNCC1 Amb21961528 [0,0,0,1,0,0|3,0,0]=4 1416 B10R1.363 OC(=O)C1(O)CCOCC1 Amb18944710 [0,0,0,1,0,0|3,0,0]=4 1417 B10R1.363 OC(=O)C1(O)CCSCC1 Amb18945166 [0,0,0,1,0,0|3,0,0]=4 1418 B10R1.363 OC(=O)C1(O)CNCCC1 Amb18202374 [0,0,0,1,0,0|3,0,0]=4 1419 B10R1.363 OC(=O)C1(O)COCCC1 Amb24568440 [0,0,0,1,0,0|3,0,0]=4 1420 B10R1.363 OC(=O)C1(O)CSCCC1 Amb18948510 [0,0,0,1,0,0|3,0,0]=4 1421 B10R1.363 OC(=O)C1(S)CCCCC1 Amb22499381 [0,0,0,1,0,0|2,0,0]=3 1422 B10R1.363 OC(=O)C1([NH3+])CCCCC1 Amb16204277 [0,0,0,1,0,0|1,0,1]=3 1423 B10R1.363 OC(=O)[C@]1(F)CNCCC1 Amb24502317 [0,0,0,1,0,0|3,0,0]=4 1424 B10R1.451 N[C@@]1(CC[C@H]1CO)C(O)=O Amb24629045 [0,0,0,1,0,0|1,0,0]=2 1425 B10R0.6 CCCCCC(C)CC(O)=O Amb19375410 [0,0,0,0,0,1|2,0,0]=3 1426 B10R0.6 CCCCCC(C)NC(C)=O Amb17798194 [0,0,0,0,0,1|3,0,0]=4 1427 B10R0.6 CCCCCC(N)CC(O)=O Amb21857987 [0,0,0,0,0,1|1,0,0]=2 1428 B10R0.6 CCCCCC(O)CC(O)=O Amb18797787 [0,0,0,0,0,1|2,0,0]=3 1429 B10R0.6 C[C@H](CCCCCl)OC(C)=O Amb22338716 [0,0,0,0,0,1|3,0,0]=4 1430 B10R0.6 NCCCC[C@@H](N)CC(O)=O Amb22746256 [0,0,0,0,0,1|0,0,0]=1 1431 B10R0.6 NCCCC[C@H](N)CC(O)=O Amb22369388 [0,0,0,0,0,1|0,0,0]=1 1432 B7R0.1 BrCCCCCC=C Amb16234121 [2,0,0,0,0,0|2,0,0]=4 1433 B7R0.1 C#CCCCCC=O Amb25743704 [2,0,0,0,0,0|1,0,1]=4 1434 B7R0.1 C#CCCCCCN Amb24481464 [2,0,0,0,0,0|1,0,1]=4 1435 B7R0.1 C=CCCCCCI Amb24483139 [2,0,0,0,0,0|2,0,0]=4 1436 B7R0.1 C=CCCCCCN Amb18641754 [2,0,0,0,0,0|1,0,0]=3 1437 B7R0.1 C=CCCCCNN Amb25244349 [2,0,0,0,0,0|2,0,0]=4 1438 B7R0.1 C=CCCCCON Amb25781717 [2,0,0,0,0,0|2,0,0]=4 1439 B7R0.1 C=CCCNCCN Amb25699590 [2,0,0,0,0,0|2,0,0]=4 1440 B7R0.1 C=CCCOCCN Amb22059113 [2,0,0,0,0,0|2,0,0]=4 1441 B7R0.1 C=CCOCCCN Amb25190295 [2,0,0,0,0,0|2,0,0]=4 1442 B7R0.1 CC=NCCCCN Amb25746482 [2,0,0,0,0,0|2,0,0]=4 1443 B7R0.1 CCCCCCC=N Amb24634610 [2,0,0,0,0,0|2,0,0]=4 1444 B7R0.1 CCCCCCNO Amb24591654 [2,0,0,0,0,0|2,0,0]=4 1445 B7R0.1 CCCCCC[14CH2]O Amb22350258 [2,0,0,0,0,0|1,0,1]=4 1446 B7R0.1 CCCCCNC=O Amb22360637 [2,0,0,0,0,0|2,0,0]=4 1447 B7R0.1 CCNCCCC=O Amb24481334 [2,0,0,0,0,0|2,0,0]=4 1448 B7R0.1 CNCCCCCN Amb23448496 [2,0,0,0,0,0|2,0,0]=4 1449 B7R0.1 CSCCCCC=O Amb25760866 [2,0,0,0,0,0|2,0,0]=4 1450 B7R0.1 CSCCCCCN Amb24271082 [2,0,0,0,0,0|2,0,0]=4 1451 B7R0.1 ClCCCCCC=O Amb16185781 [2,0,0,0,0,0|1,0,0]=3 1452 B7R0.1 NCCCCCC=O Amb25680164 [2,0,0,0,0,0|0,0,0]=2 1453 B7R0.1 NCCCCCCBr Amb17610010 [2,0,0,0,0,0|1,0,1]=4 1454 B7R0.1 NCCCCCCBr Amb18648322 [2,0,0,0,0,0|1,0,1]=4 1455 B7R0.1 NCCCCCCBr Amb22831848 [2,0,0,0,0,0|1,0,1]=4 1456 B7R0.1 NCCCCCCCl Amb22831847 [2,0,0,0,0,0|1,0,1]=4 1457 B7R0.1 NCCCCCCI Amb25088255 [2,0,0,0,0,0|1,0,1]=4 1458 B7R0.1 NCCCCCCN Amb22347970 [2,0,0,0,0,0|1,0,1]=4 1459 B7R0.1 NCCCCCCN Amb2553272 [2,0,0,0,0,0|1,0,1]=4 1460 B7R0.1 NCCCCCCN Amb2573303 [2,0,0,0,0,0|1,0,1]=4 1461 B7R0.1 NCCCCCCS Amb18642745 [2,0,0,0,0,0|0,1,1]=4 1462 B7R0.1 NCCCCCCS Amb24099361 [2,0,0,0,0,0|0,1,1]=4 1463 B7R0.1 NCCCCCNO Amb24381036 [2,0,0,0,0,0|1,0,0]=3 1464 B7R0.1 NCCCCCOC Amb13951647 [2,0,0,0,0,0|2,0,0]=4 1465 B7R0.1 NCCCCNC=O Amb18641902 [2,0,0,0,0,0|1,0,0]=3 1466 B7R0.1 NCCCNCC=C Amb17315274 [2,0,0,0,0,0|2,0,0]=4 1467 B7R0.1 NCCCSCC=C Amb17500693 [2,0,0,0,0,0|2,0,0]=4 1468 B7R0.1 NCCNCCCO Amb22732348 [2,0,0,0,0,0|1,0,1]=4 1469 B7R0.1 NNCCCCCO Amb24660104 [2,0,0,0,0,0|1,0,1]=4 1470 B7R0.1 N[13CH2]CCCC[13CH2]N Amb22336714 [2,0,0,0,0,0|1,0,1]=4 1471 B7R0.1 O=CCCCCC#N Amb17593149 [2,0,0,0,0,0|0,0,2]=4 1472 B7R0.1 O=CCCCCC=O Amb17593185 [2,0,0,0,0,0|1,0,1]=4 1473 B7R0.1 O=CCCCCCBr Amb18127461 [2,0,0,0,0,0|1,0,0]=3 1474 B7R0.1 O=CCCCCCF Amb24533888 [2,0,0,0,0,0|1,0,0]=3 1475 B7R0.1 O=CCCOCCBr Amb24693863 [2,0,0,0,0,0|2,0,0]=4 1476 B7R0.1 O=CCCOCCCl Amb24472908 [2,0,0,0,0,0|2,0,0]=4 1477 B7R0.1 O=CNCCCCBr Amb25300317 [2,0,0,0,0,0|2,0,0]=4 1478 B7R0.1 O=COCCCCCl Amb24599108 [2,0,0,0,0,0|2,0,0]=4 1479 B7R0.1 OCCCCCC=O Amb18641885 [2,0,0,0,0,0|1,0,0]=3 1480 B7R0.1 OCCCCCCBr Amb24063183 [2,0,0,0,0,0|1,0,1]=4 1481 B7R0.1 OCCCCCCCl Amb24063192 [2,0,0,0,0,0|1,0,1]=4 1482 B7R0.1 OCCCCCCF Amb24428671 [2,0,0,0,0,0|1,0,1]=4 1483 B7R0.1 OCCCCCCO Amb22336515 [2,0,0,0,0,0|1,0,1]=4 1484 B7R0.1 OCCCCCCO Amb22338595 [2,0,0,0,0,0|1,0,1]=4 1485 B7R0.1 OCCCCCCO Amb22338770 [2,0,0,0,0,0|1,0,1]=4 1486 B7R0.1 OCCCCOC=O Amb25244169 [2,0,0,0,0,0|2,0,0]=4 1487 B7R0.1 OCCOCCC=O Amb18641946 [2,0,0,0,0,0|2,0,0]=4 1488 B7R0.1 OCCSCCC=O Amb25077144 [2,0,0,0,0,0|2,0,0]=4 1489 B7R0.1 [15NH2]CCCCCC[15NH2] Amb22353416 [2,0,0,0,0,0|1,0,1]=4 1490 B7R0.1 [C-]#[N+]CCCCC=O Amb25713544 [2,0,0,0,0,0|2,0,0]=4 1491 B7R0.3 C#CC(N)CCCN Amb24560663 [2,0,0,0,0,0|1,0,1]=4 1492 B7R0.3 C#CCCC(N)C=O Amb25233211 [2,0,0,0,0,0|0,0,2]=4 1493 B7R0.3 C#C[C@H](N)CCCN Amb24461724 [2,0,0,0,0,0|1,0,1]=4 1494 B7R0.3 C=CC(O)CCCN Amb25715133 [2,0,0,0,0,0|2,0,0]=4 1495 B7R0.3 CC(C=O)CCCC Amb17593191 [2,0,0,0,0,0|1,0,0]=3 1496 B7R0.3 CC(CCCCl)C=O Amb24376628 [2,0,0,0,0,0|2,0,0]=4 1497 B7R0.3 CC(CCCN)NO Amb25339843 [2,0,0,0,0,0|2,0,0]=4 1498 B7R0.3 CC(CCCO)C=O Amb24690170 [2,0,0,0,0,0|2,0,0]=4 1499 B7R0.3 CCCCC(=O)C=O Amb18124252 [2,0,0,0,0,0|1,0,1]=4 1500 B7R0.3 CCCCC(Br)C=C Amb25758328 [2,0,0,0,0,0|2,0,0]=4 1501 B7R0.3 CCCCC(C)C=C Amb22641469 [2,0,0,0,0,0|2,0,0]=4 1502 B7R0.3 CCCCC(C=O)Br Amb17594581 [2,0,0,0,0,0|1,0,0]=3 1503 B7R0.3 CCCCC(CO)C Amb17593205 [2,0,0,0,0,0|1,0,1]=4 1504 B7R0.3 CCCCC(CO)N Amb2236185 [2,0,0,0,0,0|0,0,1]=3 1505 B7R0.3 CCCCC(Cl)C=C Amb24647663 [2,0,0,0,0,0|2,0,0]=4 1506 B7R0.3 CCCCC(Cl)C=O Amb18642973 [2,0,0,0,0,0|1,0,0]=3 1507 B7R0.3 CCCCC(Cl)CO Amb25760827 [2,0,0,0,0,0|1,0,1]=4 1508 B7R0.3 CCCCC(F)CO Amb25134893 [2,0,0,0,0,0|1,0,1]=4 1509 B7R0.3 CCCCC(N)C#C Amb25798992 [2,0,0,0,0,0|1,0,1]=4 1510 B7R0.3 CCCCC(N)C#N Amb18975861 [2,0,0,0,0,0|1,0,1]=4 1511 B7R0.3 CCCCC(N)C=C Amb24677154 [2,0,0,0,0,0|1,0,0]=3 1512 B7R0.3 CCCCC(N)CN Amb19009750 [2,0,0,0,0,0|1,0,1]=4 1513 B7R0.3 CCCC[C@@H](N)C=C Amb25710927 [2,0,0,0,0,0|1,0,0]=3 1514 B7R0.3 CCCC[C@@H](N)CO Amb23440322 [2,0,0,0,0,0|0,0,1]=3 1515 B7R0.3 CCCC[C@@H](O)C=C Amb24731913 [2,0,0,0,0,0|2,0,0]=4 1516 B7R0.3 CCCC[C@@H](O)C=O Amb24481527 [2,0,0,0,0,0|1,0,0]=3 1517 B7R0.3 CCCC[C@@H](O)CO Amb25315976 [2,0,0,0,0,0|1,0,1]=4 1518 B7R0.3 CCCC[C@H](F)C=O Amb25143375 [2,0,0,0,0,0|1,0,0]=3 1519 B7R0.3 CCCC[C@H](N)CN Amb25725218 [2,0,0,0,0,0|1,0,1]=4 1520 B7R0.3 CCCC[C@H](O)C=C Amb24591765 [2,0,0,0,0,0|2,0,0]=4 1521 B7R0.3 CCCSC(C)C=O Amb18124367 [2,0,0,0,0,0|2,0,0]=4 1522 B7R0.3 CCNCC(O)C=O Amb24399473 [2,0,0,0,0,0|2,0,0]=4 1523 B7R0.3 CCSCC(N)CO Amb18643038 [2,0,0,0,0,0|1,0,1]=4 1524 B7R0.3 CCSC[C@H](O)C=O Amb25844429 [2,0,0,0,0,0|2,0,0]=4 1525 B7R0.3 CSCCC(N)C=O Amb25367403 [2,0,0,0,0,0|1,0,0]=3 1526 B7R0.3 CSCCC(O)C=O Amb25107714 [2,0,0,0,0,0|2,0,0]=4 1527 B7R0.3 CSCC[C@@H](N)CO Amb22753875 [2,0,0,0,0,0|1,0,1]=4 1528 B7R0.3 CSCC[C@@H](O)C=O Amb24481522 [2,0,0,0,0,0|2,0,0]=4 1529 B7R0.3 NC(CCCO)CO Amb18641979 [2,0,0,0,0,0|1,0,1]=4 1530 B7R0.3 NCCCC(CO)C Amb17569904 [2,0,0,0,0,0|1,0,1]=4 1531 B7R0.3 NCCCC(N)C#N Amb25789549 [2,0,0,0,0,0|1,0,1]=4 1532 B7R0.3 NCCCC(N)C=O Amb24653292 [2,0,0,0,0,0|0,0,0]=2 1533 B7R0.3 NOCCC(N)CO Amb24531346 [2,0,0,0,0,0|1,0,1]=4 1534 B7R0.3 N[C@@H](CCCO)CO Amb24117047 [2,0,0,0,0,0|1,0,1]=4 1535 B7R0.3 N[C@H](CO)CCCF Amb25198873 [2,0,0,0,0,0|1,0,1]=4 1536 B7R0.3 OCC(CCSC)N Amb2236184 [2,0,0,0,0,0|1,0,1]=4 1537 B7R0.3 OCCCC(Br)C=O Amb25765431 [2,0,0,0,0,0|2,0,0]=4 1538 B7R0.3 OCCCC(F)C=O Amb24553890 [2,0,0,0,0,0|2,0,0]=4 1539 B7R0.3 OCCCC(O)C=O Amb18641948 [2,0,0,0,0,0|2,0,0]=4 1540 B7R0.3 OCCC[C@H](O)C=O Amb24570447 [2,0,0,0,0,0|2,0,0]=4 1541 B7R0.4 BrCCCCC(=O)C Amb16234126 [2,0,0,0,0,0|2,0,0]=4 1542 B7R0.4 CC(=C)CCCCN Amb25142976 [2,0,0,0,0,0|1,0,1]=4 1543 B7R0.4 CC(=N)CCCCN Amb25076530 [2,0,0,0,0,0|2,0,0]=4 1544 B7R0.4 CC(=O)COCCN Amb18630459 [2,0,0,0,0,0|2,0,0]=4 1545 B7R0.4 CC(=O)NCCCN Amb10610286 [2,0,0,0,0,0|2,0,0]=4 1546 B7R0.4 CC(=O)OCCCN Amb18641920 [2,0,0,0,0,0|2,0,0]=4 1547 B7R0.4 CC(=O)SCCCN Amb25368304 [2,0,0,0,0,0|2,0,0]=4 1548 B7R0.4 CC(C)CCCCN Amb19374781 [2,0,0,0,0,0|1,0,1]=4 1549 B7R0.4 CC(N)CCCCN Amb25214697 [2,0,0,0,0,0|0,0,1]=3 1550 B7R0.4 CC(O)CCCCBr Amb24552945 [2,0,0,0,0,0|2,0,0]=4 1551 B7R0.4 CC(O)CCCCCl Amb24462574 [2,0,0,0,0,0|2,0,0]=4 1552 B7R0.4 CC(O)CCCCO Amb22227757 [2,0,0,0,0,0|2,0,0]=4 1553 B7R0.4 CC(O)CCCON Amb24412992 [2,0,0,0,0,0|2,0,0]=4 1554 B7R0.4 CC(O)CSCCN Amb18304010 [2,0,0,0,0,0|2,0,0]=4 1555 B7R0.4 CCCCCB(O)O Amb2447470 [2,0,0,0,0,0|1,0,1]=4 1556 B7R0.4 CCCCCC(C)N Amb21962698 [2,0,0,0,0,0|1,0,1]=4 1557 B7R0.4 CCCCCC(N)=N Amb19890171 [2,0,0,0,0,0|2,0,0]=4 1558 B7R0.4 CCCCCC(N)C Amb10843721 [2,0,0,0,0,0|1,0,1]=4 1559 B7R0.4 CCCCCC(N)O Amb24673933 [2,0,0,0,0,0|1,0,0]=3 1560 B7R0.4 CCCCCC([O-])=O Amb22337624 [2,0,0,0,0,0|0,0,1]=3 1561 B7R0.4 CCCCCC([O-])=O Amb22525161 [2,0,0,0,0,0|0,0,1]=3 1562 B7R0.4 CCCCCC([O-])=O Amb22730527 [2,0,0,0,0,0|0,0,1]=3 1563 B7R0.4 CCCCCC([O-])=O Amb22731343 [2,0,0,0,0,0|0,0,1]=3 1564 B7R0.4 CCCCC[13C](O)=O Amb22353417 [2,0,0,0,0,0|0,0,0]=2 1565 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [2,0,0,0,0,0|1,0,1]=4 1566 B7R0.4 CCCCC[N+]([O-])=O Amb22227991 [2,0,0,0,0,0|1,0,1]=4 1567 B7R0.4 CCCCNC(=O)Cl Amb24574309 [2,0,0,0,0,0|2,0,0]=4 1568 B7R0.4 CCCCOC(=O)F Amb24710483 [2,0,0,0,0,0|2,0,0]=4 1569 B7R0.4 CCCCSC(=O)C Amb10552685 [2,0,0,0,0,0|2,0,0]=4 1570 B7R0.4 CCCCSC(=O)Cl Amb22352826 [2,0,0,0,0,0|2,0,0]=4 1571 B7R0.4 CCCCSC(N)=O Amb24533653 [2,0,0,0,0,0|2,0,0]=4 1572 B7R0.4 CCCC[13CH2][13C](O)=O Amb22367381 [2,0,0,0,0,0|0,0,0]=2 1573 B7R0.4 CCCNCC(=O)N Amb1124632 [2,0,0,0,0,0|2,0,0]=4 1574 B7R0.4 CCCNCC(=O)O Amb10609640 [2,0,0,0,0,0|1,0,0]=3 1575 B7R0.4 CCCNCC(=O)O Amb1110628 [2,0,0,0,0,0|1,0,0]=3 1576 B7R0.4 CCCSCC(=O)O Amb1137113 [2,0,0,0,0,0|1,0,0]=3 1577 B7R0.4 CCNCCC(C)=O Amb18641851 [2,0,0,0,0,0|2,0,0]=4 1578 B7R0.4 CCOCCC(=O)Cl Amb20672027 [2,0,0,0,0,0|2,0,0]=4 1579 B7R0.4 CCSSCC(O)=O Amb25233433 [2,0,0,0,0,0|2,0,0]=4 1580 B7R0.4 CNCCCC(=O)O Amb1153115 [2,0,0,0,0,0|1,0,0]=3 1581 B7R0.4 CNCCCC(N)=O Amb18303611 [2,0,0,0,0,0|2,0,0]=4 1582 B7R0.4 CNCCCS(O)=O Amb24656214 [2,0,0,0,0,0|2,0,0]=4 1583 B7R0.4 COCCCC(=O)Cl Amb24481572 [2,0,0,0,0,0|2,0,0]=4 1584 B7R0.4 COCCCC(N)=O Amb24670109 [2,0,0,0,0,0|2,0,0]=4 1585 B7R0.4 CONCCC(O)=O Amb24441275 [2,0,0,0,0,0|2,0,0]=4 1586 B7R0.4 CSCCCC(=O)O Amb17503622 [2,0,0,0,0,0|1,0,0]=3 1587 B7R0.4 CSCCCC(C)=O Amb25122381 [2,0,0,0,0,0|2,0,0]=4 1588 B7R0.4 CSCCCC(N)=O Amb19129736 [2,0,0,0,0,0|2,0,0]=4 1589 B7R0.4 C[C@@H](O)CCCCN Amb22896886 [2,0,0,0,0,0|1,0,0]=3 1590 B7R0.4 C[C@@H](O)CNCCN Amb25689140 [2,0,0,0,0,0|2,0,0]=4 1591 B7R0.4 C[C@H](O)CCCCCl Amb25715881 [2,0,0,0,0,0|2,0,0]=4 1592 B7R0.4 C[C@H](O)CNCCN Amb25777107 [2,0,0,0,0,0|2,0,0]=4 1593 B7R0.4 C[Se]CCCC(O)=O Amb22347334 [2,0,0,0,0,0|1,0,0]=3 1594 B7R0.4 C\C=C\CCC(=O)O Amb10071500 [2,0,0,0,0,0|0,0,2]=4 1595 B7R0.4 N#CCCCC(O)=O Amb18560874 [2,0,0,0,0,0|0,0,2]=4 1596 B7R0.4 NC(=O)CCCCI Amb25788033 [2,0,0,0,0,0|1,0,1]=4 1597 B7R0.4 NCCCCC(N)=N Amb25714813 [2,0,0,0,0,0|1,0,1]=4 1598 B7R0.4 NCCCCC(N)=O Amb18641897 [2,0,0,0,0,0|0,0,1]=3 1599 B7R0.4 NCCCCC(N)=S Amb24481404 [2,0,0,0,0,0|0,1,1]=4 1600 B7R0.4 NCCCCC(N)O Amb24333310 [2,0,0,0,0,0|0,0,0]=2 1601 B7R0.4 NCCCCC(O)C Amb17569903 [2,0,0,0,0,0|1,0,0]=3 1602 B7R0.4 NCCCCC([O-])=O Amb22753853 [2,0,0,0,0,0|0,0,1]=3 1603 B7R0.4 NCCCCP(O)=O Amb24520720 [2,0,0,0,0,0|1,0,0]=3 1604 B7R0.4 NCCCCS(=O)C Amb17617794 [2,0,0,0,0,0|2,0,0]=4 1605 B7R0.4 NCCCNC(N)=O Amb18296186 [2,0,0,0,0,0|1,0,1]=4 1606 B7R0.4 NCCCNC(N)=O Amb20622408 [2,0,0,0,0,0|1,0,1]=4 1607 B7R0.4 NCCCNC(O)=O Amb24093884 [2,0,0,0,0,0|1,0,0]=3 1608 B7R0.4 NCCNCC(=O)O Amb17608063 [2,0,0,0,0,0|1,0,0]=3 1609 B7R0.4 NCCNCC(O)=O Amb19958818 [2,0,0,0,0,0|1,0,0]=3 1610 B7R0.4 NCCOCC(N)=O Amb18523830 [2,0,0,0,0,0|1,0,1]=4 1611 B7R0.4 NCCOCC(N)=O Amb20631066 [2,0,0,0,0,0|1,0,1]=4 1612 B7R0.4 NCCOCC(O)=O Amb18630146 [2,0,0,0,0,0|1,0,0]=3 1613 B7R0.4 NCCOCC(O)=O Amb22751540 [2,0,0,0,0,0|1,0,0]=3 1614 B7R0.4 NCCSCC(=O)C Amb17500454 [2,0,0,0,0,0|2,0,0]=4 1615 B7R0.4 NCCSCC(=O)O Amb17500446 [2,0,0,0,0,0|1,0,0]=3 1616 B7R0.4 NCCSCC(O)=O Amb20622325 [2,0,0,0,0,0|1,0,0]=3 1617 B7R0.4 NCC\C=C\C(O)=O Amb25266868 [2,0,0,0,0,0|0,0,2]=4 1618 B7R0.4 NC\C=C\CC(O)=O Amb18641825 [2,0,0,0,0,0|0,0,2]=4 1619 B7R0.4 NNCCCC(O)=O Amb24455803 [2,0,0,0,0,0|1,0,0]=3 1620 B7R0.4 NOCCCC(=O)O Amb10975956 [2,0,0,0,0,0|1,0,0]=3 1621 B7R0.4 NOCCCC(O)=O Amb22011795 [2,0,0,0,0,0|1,0,0]=3 1622 B7R0.4 O=C(F)CCCCCl Amb24472276 [2,0,0,0,0,0|2,0,0]=4 1623 B7R0.4 O=CCCCC(=O)O Amb17593198 [2,0,0,0,0,0|1,0,1]=4 1624 B7R0.4 OC(=O)CNCCS Amb18124468 [2,0,0,0,0,0|2,0,0]=4 1625 B7R0.4 OC(=O)COCCBr Amb24057760 [2,0,0,0,0,0|2,0,0]=4 1626 B7R0.4 OC(=O)COCCCl Amb21857870 [2,0,0,0,0,0|2,0,0]=4 1627 B7R0.4 OC(=O)CSCCCl Amb18644703 [2,0,0,0,0,0|2,0,0]=4 1628 B7R0.4 OC(=O)CSCCS Amb24711400 [2,0,0,0,0,0|2,0,0]=4 1629 B7R0.4 OCCCCC(=O)C Amb10603864 [2,0,0,0,0,0|2,0,0]=4 1630 B7R0.4 OCCCCC(=O)[O-] Amb13952763 [2,0,0,0,0,0|1,0,1]=4 1631 B7R0.4 OCCCCC(N)C Amb17569907 [2,0,0,0,0,0|1,0,1]=4 1632 B7R0.4 OCCCCC(O)=O Amb22351244 [2,0,0,0,0,0|1,0,0]=3 1633 B7R0.4 OCCCCC(O)O Amb25204642 [2,0,0,0,0,0|2,0,0]=4 1634 B7R0.4 OCCCC[C@H](O)C Amb10605245 [2,0,0,0,0,0|2,0,0]=4 1635 B7R0.4 OCCSCC(=O)O Amb1110090 [2,0,0,0,0,0|2,0,0]=4 1636 B7R0.4 SCCCCC(=O)O Amb17503767 [2,0,0,0,0,0|1,0,0]=3 1637 B7R0.4 [O-]C(=O)CCCCO Amb22749314 [2,0,0,0,0,0|1,0,1]=4 1638 B7R0.5 C#CCC(N)C(O)=O Amb19944472 [2,0,0,0,0,0|0,0,2]=4 1639 B7R0.5 C#CC[C@@H](N)C(O)=O Amb22748688 [2,0,0,0,0,0|0,0,2]=4 1640 B7R0.5 C=CCC(N)C(O)=O Amb21856826 [2,0,0,0,0,0|0,0,2]=4 1641 B7R0.5 C=CC[C@@H](N)C(O)=O Amb22745310 [2,0,0,0,0,0|0,0,2]=4 1642 B7R0.5 CC(=O)C(N)CCO Amb25087112 [2,0,0,0,0,0|2,0,0]=4 1643 B7R0.5 CC(C(=O)O)CNC Amb13952364 [2,0,0,0,0,0|2,0,0]=4 1644 B7R0.5 CC(CCF)C(O)=O Amb24678386 [2,0,0,0,0,0|2,0,0]=4 1645 B7R0.5 CC(CCN)C(C)=O Amb18251071 [2,0,0,0,0,0|2,0,0]=4 1646 B7R0.5 CC(CCN)C(N)=O Amb18641900 [2,0,0,0,0,0|2,0,0]=4 1647 B7R0.5 CC(CCN)C(O)=O Amb20667970 [2,0,0,0,0,0|1,0,0]=3 1648 B7R0.5 CC(CCO)C(O)=O Amb18641949 [2,0,0,0,0,0|2,0,0]=4 1649 B7R0.5 CC(CCS)C(O)=O Amb25133689 [2,0,0,0,0,0|2,0,0]=4 1650 B7R0.5 CC(O)C(N)CCC Amb24656798 [2,0,0,0,0,0|1,0,1]=4 1651 B7R0.5 CCCC(=C)C(O)=O Amb18641779 [2,0,0,0,0,0|1,0,1]=4 1652 B7R0.5 CCCC(=O)C(O)=O Amb22347924 [2,0,0,0,0,0|1,0,1]=4 1653 B7R0.5 CCCC(=O)C(O)=O Amb22733540 [2,0,0,0,0,0|1,0,1]=4 1654 B7R0.5 CCCC(Br)C(=O)Br Amb24369503 [2,0,0,0,0,0|2,0,0]=4 1655 B7R0.5 CCCC(C(=O)Cl)Br Amb17569837 [2,0,0,0,0,0|2,0,0]=4 1656 B7R0.5 CCCC(C(=O)O)Cl Amb17593470 [2,0,0,0,0,0|1,0,0]=3 1657 B7R0.5 CCCC(C(=O)O)O Amb2582532 [2,0,0,0,0,0|1,0,0]=3 1658 B7R0.5 CCCC(Cl)C(N)=O Amb25024550 [2,0,0,0,0,0|2,0,0]=4 1659 B7R0.5 CCCC(F)C(O)=O Amb25842008 [2,0,0,0,0,0|1,0,0]=3 1660 B7R0.5 CCCC(N)C(=O)S Amb25378817 [2,0,0,0,0,0|0,1,0]=3 1661 B7R0.5 CCCC(N)C(C)=C Amb24643425 [2,0,0,0,0,0|2,0,0]=4 1662 B7R0.5 CCCC(N)C(N)=O Amb22284825 [2,0,0,0,0,0|1,0,0]=3 1663 B7R0.5 CCCC(N)P(O)O Amb24401110 [2,0,0,0,0,0|1,0,1]=4 1664 B7R0.5 CCCC(O)C(C)=O Amb22495823 [2,0,0,0,0,0|2,0,0]=4 1665 B7R0.5 CCCC(O)C(N)=O Amb24116553 [2,0,0,0,0,0|2,0,0]=4 1666 B7R0.5 CCCC(O)C([O-])=O Amb22731263 [2,0,0,0,0,0|1,0,1]=4 1667 B7R0.5 CCCC(O)P(O)=O Amb25143218 [2,0,0,0,0,0|2,0,0]=4 1668 B7R0.5 CCCC(S)C(C)=O Amb24689502 [2,0,0,0,0,0|2,0,0]=4 1669 B7R0.5 CCCC(S)C(O)=O Amb18124440 [2,0,0,0,0,0|1,0,0]=3 1670 B7R0.5 CCC[C@@H](C)C(C)=O Amb24631887 [2,0,0,0,0,0|2,0,0]=4 1671 B7R0.5 CCC[C@@H](C)C(N)=O Amb25257881 [2,0,0,0,0,0|2,0,0]=4 1672 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [2,0,0,0,0,0|1,0,0]=3 1673 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [2,0,0,0,0,0|1,0,0]=3 1674 B7R0.5 CCC[C@@H](O)C(C)=O Amb24432580 [2,0,0,0,0,0|2,0,0]=4 1675 B7R0.5 CCC[C@@H](O)C(O)=O Amb22746731 [2,0,0,0,0,0|1,0,0]=3 1676 B7R0.5 CCC[C@H](C)C(N)=O Amb25305606 [2,0,0,0,0,0|2,0,0]=4 1677 B7R0.5 CCC[C@H](F)C(O)=O Amb24657412 [2,0,0,0,0,0|1,0,0]=3 1678 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [2,0,0,0,0,0|2,0,0]=4 1679 B7R0.5 CCC[C@H](O)C(N)=O Amb25082239 [2,0,0,0,0,0|2,0,0]=4 1680 B7R0.5 CCC[C@H](O)C(O)=O Amb22226514 [2,0,0,0,0,0|1,0,0]=3 1681 B7R0.5 CCN[C@H](C)C(O)=O Amb24351099 [2,0,0,0,0,0|2,0,0]=4 1682 B7R0.5 CCOC(O)C(O)=O Amb24680848 [2,0,0,0,0,0|2,0,0]=4 1683 B7R0.5 CCO[C@H](C)C(O)=O Amb24660035 [2,0,0,0,0,0|2,0,0]=4 1684 B7R0.5 CCSC(O)C(O)=O Amb24444218 [2,0,0,0,0,0|2,0,0]=4 1685 B7R0.5 CCS[C@@H](C)C(O)=O Amb25083211 [2,0,0,0,0,0|2,0,0]=4 1686 B7R0.5 CCS[C@H](C)C(O)=O Amb25259517 [2,0,0,0,0,0|2,0,0]=4 1687 B7R0.5 CC\C=C(\N)/C(O)=O Amb24349496 [2,0,0,0,0,0|0,0,2]=4 1688 B7R0.5 CNCC(C(=O)O)N Amb10071505 [2,0,0,0,0,0|1,0,0]=3 1689 B7R0.5 CNCC(C(=O)O)N Amb10845350 [2,0,0,0,0,0|1,0,0]=3 1690 B7R0.5 CNCC(F)C(O)=O Amb24666017 [2,0,0,0,0,0|2,0,0]=4 1691 B7R0.5 CNCC(N)C(N)=O Amb25316352 [2,0,0,0,0,0|2,0,0]=4 1692 B7R0.5 CNC[C@@H](C(=O)O)N Amb17617148 [2,0,0,0,0,0|1,0,0]=3 1693 B7R0.5 CNC[C@@H](N)C(O)=O Amb19133072 [2,0,0,0,0,0|1,0,0]=3 1694 B7R0.5 CNC[C@@H](N)C(O)=O Amb22746009 [2,0,0,0,0,0|1,0,0]=3 1695 B7R0.5 CNC[C@@H](N)C(O)=O Amb22748835 [2,0,0,0,0,0|1,0,0]=3 1696 B7R0.5 CNC[C@H](N)C(O)=O Amb19892230 [2,0,0,0,0,0|1,0,0]=3 1697 B7R0.5 CNC[C@H](O)C(O)=O Amb25689188 [2,0,0,0,0,0|2,0,0]=4 1698 B7R0.5 COCC(C(=O)O)Br Amb17594709 [2,0,0,0,0,0|2,0,0]=4 1699 B7R0.5 COCC(C(=O)O)Cl Amb10068384 [2,0,0,0,0,0|2,0,0]=4 1700 B7R0.5 COCC(F)C(O)=O Amb24526772 [2,0,0,0,0,0|2,0,0]=4 1701 B7R0.5 COCC(N)C(N)=O Amb18984372 [2,0,0,0,0,0|2,0,0]=4 1702 B7R0.5 COCC(O)C(O)=O Amb18124273 [2,0,0,0,0,0|2,0,0]=4 1703 B7R0.5 COC[C@@H](N)C(N)=O Amb25211762 [2,0,0,0,0,0|2,0,0]=4 1704 B7R0.5 COC[C@@H](N)C(O)=O Amb22744762 [2,0,0,0,0,0|1,0,0]=3 1705 B7R0.5 COC[C@@H](O)C(O)=O Amb25829059 [2,0,0,0,0,0|2,0,0]=4 1706 B7R0.5 COC[C@H](C(=O)O)N Amb10604051 [2,0,0,0,0,0|1,0,0]=3 1707 B7R0.5 CSCC(C)C(O)=O Amb18967825 [2,0,0,0,0,0|2,0,0]=4 1708 B7R0.5 CSCC(N)C(N)=O Amb18294390 [2,0,0,0,0,0|2,0,0]=4 1709 B7R0.5 CSCC(O)C(O)=O Amb25131873 [2,0,0,0,0,0|2,0,0]=4 1710 B7R0.5 CSC[C@H](O)C(O)=O Amb24435256 [2,0,0,0,0,0|2,0,0]=4 1711 B7R0.5 C[C@@H](C(=O)O)CCC Amb10844028 [2,0,0,0,0,0|1,0,0]=3 1712 B7R0.5 C[C@@H](CCS)C(O)=O Amb25786376 [2,0,0,0,0,0|2,0,0]=4 1713 B7R0.5 C[C@@H](O)[C@H](N)CCC Amb25328641 [2,0,0,0,0,0|1,0,1]=4 1714 B7R0.5 C[C@H](C(=O)O)CCC Amb10844037 [2,0,0,0,0,0|1,0,0]=3 1715 B7R0.5 C[C@H](C(=O)O)CCN Amb10844043 [2,0,0,0,0,0|1,0,0]=3 1716 B7R0.5 C[C@H](C(=O)O)COC Amb10844266 [2,0,0,0,0,0|2,0,0]=4 1717 B7R0.5 C[C@H](CCO)C(O)=O Amb24483065 [2,0,0,0,0,0|2,0,0]=4 1718 B7R0.5 C[C@H](O)[C@H](N)CCC Amb24604367 [2,0,0,0,0,0|1,0,1]=4 1719 B7R0.5 C[Se]C[C@@H](C(=O)O)N Amb10601626 [2,0,0,0,0,0|1,0,0]=3 1720 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22350259 [2,0,0,0,0,0|1,0,0]=3 1721 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22745692 [2,0,0,0,0,0|1,0,0]=3 1722 B7R0.5 C\C=C\C(N)C(O)=O Amb24481451 [2,0,0,0,0,0|0,0,2]=4 1723 B7R0.5 NC(C(=O)O)CCBr Amb10576584 [2,0,0,0,0,0|1,0,0]=3 1724 B7R0.5 NC(CC#N)C(O)=O Amb18641766 [2,0,0,0,0,0|0,0,2]=4 1725 B7R0.5 NC(CCBr)C(O)=O Amb21858417 [2,0,0,0,0,0|1,0,0]=3 1726 B7R0.5 NC(CCF)C(N)=O Amb24391278 [2,0,0,0,0,0|2,0,0]=4 1727 B7R0.5 NC(CCI)C(O)=O Amb25339674 [2,0,0,0,0,0|1,0,0]=3 1728 B7R0.5 NC(CCO)C(N)=O Amb24481392 [2,0,0,0,0,0|2,0,0]=4 1729 B7R0.5 NC(CCS)C(N)=O Amb24599383 [2,0,0,0,0,0|2,0,0]=4 1730 B7R0.5 NC(CCS)C(O)=O Amb19267093 [2,0,0,0,0,0|1,0,0]=3 1731 B7R0.5 NC(CS=O)C(O)=O Amb24557184 [2,0,0,0,0,0|2,0,0]=4 1732 B7R0.5 NC(CSCl)C(O)=O Amb24482298 [2,0,0,0,0,0|2,0,0]=4 1733 B7R0.5 NC(CSO)C(O)=O Amb24746797 [2,0,0,0,0,0|2,0,0]=4 1734 B7R0.5 NC(CSS)C(O)=O Amb24614616 [2,0,0,0,0,0|2,0,0]=4 1735 B7R0.5 NCCC(=O)C(O)=O Amb25724685 [2,0,0,0,0,0|1,0,1]=4 1736 B7R0.5 NCCC(C(=O)O)F Amb10838221 [2,0,0,0,0,0|1,0,0]=3 1737 B7R0.5 NCCC(C(=O)O)O Amb16232090 [2,0,0,0,0,0|1,0,0]=3 1738 B7R0.5 NCCC(Cl)C(O)=O Amb18124502 [2,0,0,0,0,0|1,0,0]=3 1739 B7R0.5 NCCC(F)C(O)=O Amb22229524 [2,0,0,0,0,0|1,0,0]=3 1740 B7R0.5 NCCC(N)C(N)=O Amb24634873 [2,0,0,0,0,0|1,0,0]=3 1741 B7R0.5 NCCC(N)C(O)=O Amb17678762 [2,0,0,0,0,0|0,0,0]=2 1742 B7R0.5 NCCC(N)C(O)=O Amb22348212 [2,0,0,0,0,0|0,0,0]=2 1743 B7R0.5 NCCC(S)C(O)=O Amb25083375 [2,0,0,0,0,0|1,0,0]=3 1744 B7R0.5 NCC[C@@H](Cl)C(O)=O Amb24481492 [2,0,0,0,0,0|1,0,0]=3 1745 B7R0.5 NCC[C@@H](F)C(O)=O Amb24055858 [2,0,0,0,0,0|1,0,0]=3 1746 B7R0.5 NCC[C@@H](N)C(O)=O Amb22750574 [2,0,0,0,0,0|0,0,0]=2 1747 B7R0.5 NCC[C@@H](N)C(O)=O Amb23438994 [2,0,0,0,0,0|0,0,0]=2 1748 B7R0.5 NCC[C@@H](O)C(O)=O Amb22225364 [2,0,0,0,0,0|1,0,0]=3 1749 B7R0.5 NCC[C@@H](O)C(O)=O Amb22748225 [2,0,0,0,0,0|1,0,0]=3 1750 B7R0.5 NCC[C@H](F)C(O)=O Amb24055857 [2,0,0,0,0,0|1,0,0]=3 1751 B7R0.5 NCC[C@H](N)C(O)=O Amb22886961 [2,0,0,0,0,0|0,0,0]=2 1752 B7R0.5 NOCC(N)C(N)=O Amb24388788 [2,0,0,0,0,0|2,0,0]=4 1753 B7R0.5 NOCC(N)C(O)=O Amb24184086 [2,0,0,0,0,0|1,0,0]=3 1754 B7R0.5 NOC[C@@H](N)C(O)=O Amb25791301 [2,0,0,0,0,0|1,0,0]=3 1755 B7R0.5 NOC[C@H](N)C(O)=O Amb24548229 [2,0,0,0,0,0|1,0,0]=3 1756 B7R0.5 N[C@@H](C(=O)O)CC#C Amb16183954 [2,0,0,0,0,0|0,0,2]=4 1757 B7R0.5 N[C@@H](C(=O)O)CCN Amb16183852 [2,0,0,0,0,0|0,0,0]=2 1758 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22746780 [2,0,0,0,0,0|1,0,1]=4 1759 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22748768 [2,0,0,0,0,0|1,0,1]=4 1760 B7R0.5 N[C@@H](CCBr)C(O)=O Amb22748283 [2,0,0,0,0,0|1,0,0]=3 1761 B7R0.5 N[C@@H](CCO)C(O)=O Amb20242705 [2,0,0,0,0,0|1,0,0]=3 1762 B7R0.5 N[C@@H](CCS)P(O)=O Amb24594746 [2,0,0,0,0,0|2,0,0]=4 1763 B7R0.5 N[C@@H](CCS)S(O)=O Amb25784628 [2,0,0,0,0,0|2,0,0]=4 1764 B7R0.5 N[C@@H](CNO)C(O)=O Amb24481412 [2,0,0,0,0,0|2,0,0]=4 1765 B7R0.5 N[C@@H](CO[SiH3])C(O)=O Amb24526864 [2,0,0,0,0,0|1,1,0]=4 1766 B7R0.5 N[C@@H](CSCl)C(O)=O Amb25055747 [2,0,0,0,0,0|2,0,0]=4 1767 B7R0.5 N[C@@H](CSO)C(O)=O Amb24481432 [2,0,0,0,0,0|2,0,0]=4 1768 B7R0.5 N[C@H](C(=O)O)CC#N Amb16183916 [2,0,0,0,0,0|0,0,2]=4 1769 B7R0.5 N[C@H](C(=O)O)CC=C Amb10982568 [2,0,0,0,0,0|0,0,2]=4 1770 B7R0.5 N[C@H](C(=O)O)CCN Amb16183862 [2,0,0,0,0,0|0,0,0]=2 1771 B7R0.5 N[C@H](CCS)C(O)=O Amb22230515 [2,0,0,0,0,0|1,0,0]=3 1772 B7R0.5 N[C@H](CNO)C(O)=O Amb24745929 [2,0,0,0,0,0|2,0,0]=4 1773 B7R0.5 O=CCC(C(=O)O)N Amb16232081 [2,0,0,0,0,0|1,0,1]=4 1774 B7R0.5 OC(=O)C(Br)CCBr Amb19889695 [2,0,0,0,0,0|2,0,0]=4 1775 B7R0.5 OC(=O)C(Br)CCF Amb25073798 [2,0,0,0,0,0|2,0,0]=4 1776 B7R0.5 OC(=O)C(Cl)CCCl Amb18126030 [2,0,0,0,0,0|2,0,0]=4 1777 B7R0.5 OC(=O)[C@H](S)CCS Amb24483251 [2,0,0,0,0,0|2,0,0]=4 1778 B7R0.5 OC(CCS)C(O)=O Amb24586206 [2,0,0,0,0,0|2,0,0]=4 1779 B7R0.5 OCCC(O)C(O)=O Amb24689942 [2,0,0,0,0,0|2,0,0]=4 1780 B7R0.5 O[15NH]CC(C(=O)O)N Amb17608097 [2,0,0,0,0,0|2,0,0]=4 1781 B7R0.5 O[C@@H](CCF)C(O)=O Amb24481351 [2,0,0,0,0,0|2,0,0]=4 1782 B9R0.1 CC(C)CCCC(C)C=O Amb18124610 [1,1,0,0,0,0|2,0,0]=4 1783 B9R0.1 CC(C)CCCC(O)C=O Amb24479252 [1,1,0,0,0,0|2,0,0]=4 1784 B9R0.1 NC(CCCC(O)=O)C=O Amb25075707 [1,1,0,0,0,0|1,0,1]=4 1785 B9R0.5 C=CCC(N)CCCCO Amb24409650 [1,1,0,0,0,0|2,0,0]=4 1786 B9R0.5 C=CC[C@@H](N)CCCCO Amb24674311 [1,1,0,0,0,0|2,0,0]=4 1787 B9R0.5 CC(CCCCCl)CC=O Amb24446627 [1,1,0,0,0,0|2,0,0]=4 1788 B9R0.5 CC(CCO)CCCCN Amb24375720 [1,1,0,0,0,0|1,0,1]=4 1789 B9R0.5 CCCCCC(C)CC=O Amb21953169 [1,1,0,0,0,0|2,0,0]=4 1790 B9R0.5 CCCCCC(Cl)C=NO Amb25361059 [1,1,0,0,0,0|2,0,0]=4 1791 B9R0.5 CCCCCC(N)CC=C Amb24480685 [1,1,0,0,0,0|2,0,0]=4 1792 B9R0.5 CCCCCC(O)C=NO Amb24473413 [1,1,0,0,0,0|2,0,0]=4 1793 B9R0.5 CCCCC[C@@H](N)CCO Amb25147424 [1,1,0,0,0,0|1,0,1]=4 1794 B9R0.5 CCCCC[C@@H](O)CC=O Amb24680284 [1,1,0,0,0,0|2,0,0]=4 1795 B9R0.5 NCCCC[C@H](N)\C=C/F Amb25368309 [1,1,0,0,0,0|1,0,0]=3 1796 B9R0.8 CC(C=O)C(O)CCCC Amb25713646 [1,1,0,0,0,0|2,0,0]=4 1797 B9R0.8 CC(CCCC)C(Cl)C=O Amb24482248 [1,1,0,0,0,0|2,0,0]=4 1798 B9R0.8 CC(CCCC)C(F)C=O Amb24646581 [1,1,0,0,0,0|2,0,0]=4 1799 B9R0.8 CC(CCCC)C(N)C=C Amb25356730 [1,1,0,0,0,0|2,0,0]=4 1800 B9R0.8 C[C@H](C=O)[C@@H](O)CCCC Amb25075641 [1,1,0,0,0,0|2,0,0]=4 1801 B9R0.8 C[C@H](CCCC)[C@H](F)C=O Amb24361895 [1,1,0,0,0,0|2,0,0]=4 1802 B9R0.8 NCCCC(=O)C(N)CO Amb24697914 [1,1,0,0,0,0|0,0,2]=4 1803 B9R0.20 CC(C)(CCCCBr)C=O Amb25104302 [1,1,0,0,0,0|2,0,0]=4 1804 B9R0.20 CC(C)(CCCCCl)C=O Amb18126358 [1,1,0,0,0,0|2,0,0]=4 1805 B9R0.20 CC(C)(CCCCF)C=O Amb24424782 [1,1,0,0,0,0|2,0,0]=4 1806 B9R0.20 CC(F)(CCCCN)C=C Amb25192520 [1,1,0,0,0,0|2,0,0]=4 1807 B9R0.20 CCCCCC(Br)(Br)C=O Amb25103759 [1,1,0,0,0,0|2,0,0]=4 1808 B9R0.20 CCCCCC(C)(Cl)C=O Amb25290277 [1,1,0,0,0,0|2,0,0]=4 1809 B9R0.20 CCCCCC(C)(O)C=O Amb25763423 [1,1,0,0,0,0|2,0,0]=4 1810 B9R0.24 CCC(O)CCC(N)CO Amb25368410 [1,1,0,0,0,0|1,0,1]=4 1811 B9R0.24 OCC(O)CCC(O)C=O Amb25713052 [1,1,0,0,0,0|2,0,0]=4 1812 B9R0.24 OC[C@H](O)CC[C@@H](O)C=O Amb25059567 [1,1,0,0,0,0|2,0,0]=4 1813 B9R0.24 OC[C@H](O)CC[C@H](O)C=O Amb24456857 [1,1,0,0,0,0|2,0,0]=4 1814 B9R0.34 CC(CCC)CC(O)C=O Amb25778304 [1,1,0,0,0,0|2,0,0]=4 1815 B9R0.34 CCCC(C)CC(C)C=O Amb25375062 [1,1,0,0,0,0|2,0,0]=4 1816 B9R0.34 CCC[C@H](C)C[C@H](C)C=O Amb25717745 [1,1,0,0,0,0|2,0,0]=4 1817 B9R0.34 C[C@H](CCO)C[C@@H](C)C=O Amb24686545 [1,1,0,0,0,0|2,0,0]=4 1818 B9R0.46 C=CCCCC[C@@H](Cl)C=O Amb25362713 [1,1,0,0,0,0|2,0,0]=4 1819 B9R0.46 CC(C=C)OCCCCN Amb24515942 [1,1,0,0,0,0|2,0,0]=4 1820 B9R0.46 CC(CCCCC#C)C=O Amb25147694 [1,1,0,0,0,0|2,0,0]=4 1821 B9R0.46 CC(CO)COCCCN Amb24466356 [1,1,0,0,0,0|1,0,1]=4 1822 B9R0.46 CC(COCCCO)C=O Amb25105169 [1,1,0,0,0,0|2,0,0]=4 1823 B9R0.46 CCCCCCC(C=O)C Amb10603627 [1,1,0,0,0,0|2,0,0]=4 1824 B9R0.46 CCCCCCC(F)C=O Amb25069121 [1,1,0,0,0,0|2,0,0]=4 1825 B9R0.46 CCCCCCC(O)C=O Amb25820734 [1,1,0,0,0,0|2,0,0]=4 1826 B9R0.46 CCCCCC[C@H](C)C=O Amb24374798 [1,1,0,0,0,0|2,0,0]=4 1827 B9R0.46 CCCCCC[C@H](Cl)C=O Amb25109926 [1,1,0,0,0,0|2,0,0]=4 1828 B9R0.46 CCCCCC[C@H](F)C=O Amb24424433 [1,1,0,0,0,0|2,0,0]=4 1829 B9R0.46 CCCCCC[C@H](O)C=O Amb25285757 [1,1,0,0,0,0|2,0,0]=4 1830 B9R0.46 CCCCOCC(Cl)C=O Amb25138639 [1,1,0,0,0,0|2,0,0]=4 1831 B9R0.46 CCCCSCC(N)CO Amb24480393 [1,1,0,0,0,0|1,0,1]=4 1832 B9R0.46 CCCCSC[C@H](N)CO Amb24581523 [1,1,0,0,0,0|1,0,1]=4 1833 B9R0.46 CCCOCCC(C)C=O Amb24581823 [1,1,0,0,0,0|2,0,0]=4 1834 B9R0.46 CNCCCCC(N)CO Amb25217030 [1,1,0,0,0,0|0,0,1]=3 1835 B9R0.46 COCCCCC(C)C=O Amb24356335 [1,1,0,0,0,0|2,0,0]=4 1836 B9R0.46 N#CCCCCC(Br)C=O Amb25805260 [1,1,0,0,0,0|1,0,1]=4 1837 B9R0.46 NC(CCCCCO)CO Amb25323751 [1,1,0,0,0,0|1,0,1]=4 1838 B9R0.46 NC(CO)CCCCCF Amb24704903 [1,1,0,0,0,0|1,0,1]=4 1839 B9R0.46 NC(CO)COCCCF Amb25855212 [1,1,0,0,0,0|1,0,1]=4 1840 B9R0.46 NC(CSCCCO)CO Amb24549825 [1,1,0,0,0,0|1,0,1]=4 1841 B9R0.46 NCCCCCC(N)CBr Amb25857899 [1,1,0,0,0,0|1,0,1]=4 1842 B9R0.46 NCCCNCC(O)CO Amb24395671 [1,1,0,0,0,0|1,0,1]=4 1843 B9R0.46 NCCCNC[C@H](N)CO Amb25848603 [1,1,0,0,0,0|0,0,1]=3 1844 B9R0.46 NCCCOCC(O)CO Amb24654813 [1,1,0,0,0,0|1,0,1]=4 1845 B9R0.50 CCC(CCCCCl)C=O Amb25213058 [1,1,0,0,0,0|2,0,0]=4 1846 B9R0.50 CCC(CCCCN)CN Amb25253768 [1,1,0,0,0,0|1,0,1]=4 1847 B9R0.50 CCCCCC(C=C)C=O Amb24383091 [1,1,0,0,0,0|2,0,0]=4 1848 B9R0.50 CCCCCC(C=O)C#N Amb24333051 [1,1,0,0,0,0|1,0,1]=4 1849 B9R0.50 CCCCCC(C=O)C=O Amb25119282 [1,1,0,0,0,0|2,0,0]=4 1850 B9R0.50 CCCCCC(C=O)OC Amb25195889 [1,1,0,0,0,0|2,0,0]=4 1851 B9R0.50 CCCCCC(CO)NC Amb24444104 [1,1,0,0,0,0|1,0,1]=4 1852 B9R0.50 CCCCC[C@@H](CC)C=O Amb24559168 [1,1,0,0,0,0|2,0,0]=4 1853 B9R0.50 CCCCC\C(=C\N)\C=O Amb25117739 [1,1,0,0,0,0|1,0,1]=4 1854 B9R0.2 BrCCCCCCC(=O)O Amb10071514 [1,1,0,0,0,0|1,0,0]=3 1855 B9R0.2 C#CCCCCCC(O)=O Amb22232010 [1,1,0,0,0,0|1,0,0]=3 1856 B9R0.2 C#CCCCNCC(O)=O Amb25284826 [1,1,0,0,0,0|1,0,1]=4 1857 B9R0.2 C#CCSCCCC(=O)O Amb17503626 [1,1,0,0,0,0|1,0,1]=4 1858 B9R0.2 C=CCCCCCC(N)=O Amb25113258 [1,1,0,0,0,0|2,0,0]=4 1859 B9R0.2 C=NCCCCCC(O)=O Amb25111950 [1,1,0,0,0,0|0,0,1]=3 1860 B9R0.2 CC(=O)CCCCCC#N Amb24570407 [1,1,0,0,0,0|1,0,1]=4 1861 B9R0.2 CC(=O)CCCCCC=C Amb24117120 [1,1,0,0,0,0|2,0,0]=4 1862 B9R0.2 CC(=O)CCCCCC=O Amb25290329 [1,1,0,0,0,0|2,0,0]=4 1863 B9R0.2 CC(=O)CCCCCCBr Amb24436166 [1,1,0,0,0,0|2,0,0]=4 1864 B9R0.2 CC(=O)CCCCCCF Amb25050277 [1,1,0,0,0,0|2,0,0]=4 1865 B9R0.2 CC(=O)CCCCCCN Amb25147578 [1,1,0,0,0,0|1,0,0]=3 1866 B9R0.2 CC(=O)CCCCCCO Amb25728037 [1,1,0,0,0,0|2,0,0]=4 1867 B9R0.2 CC(=O)CCCOCCO Amb25265612 [1,1,0,0,0,0|2,0,0]=4 1868 B9R0.2 CC(=O)CCNCCCO Amb24704454 [1,1,0,0,0,0|2,0,0]=4 1869 B9R0.2 CC(=O)CCOCCCBr Amb25274435 [1,1,0,0,0,0|2,0,0]=4 1870 B9R0.2 CC(=O)CCOCCCN Amb18111574 [1,1,0,0,0,0|1,0,0]=3 1871 B9R0.2 CC(=O)CCOCCCO Amb25094277 [1,1,0,0,0,0|2,0,0]=4 1872 B9R0.2 CC(=O)CSCCCCO Amb24504843 [1,1,0,0,0,0|2,0,0]=4 1873 B9R0.2 CC(=O)NCCCCCBr Amb24477078 [1,1,0,0,0,0|2,0,0]=4 1874 B9R0.2 CC(=O)NCCCCCCl Amb25709577 [1,1,0,0,0,0|2,0,0]=4 1875 B9R0.2 CC(=O)NCCCCCN Amb18102716 [1,1,0,0,0,0|1,0,0]=3 1876 B9R0.2 CC(=O)NCCOCCN Amb16233780 [1,1,0,0,0,0|2,0,0]=4 1877 B9R0.2 CC(=O)OCCCCCF Amb25346117 [1,1,0,0,0,0|2,0,0]=4 1878 B9R0.2 CC(=O)OCCCCCI Amb25304053 [1,1,0,0,0,0|2,0,0]=4 1879 B9R0.2 CC(=O)OCCCCCN Amb25228426 [1,1,0,0,0,0|1,0,0]=3 1880 B9R0.2 CC(=O)SCCCCCCl Amb24443095 [1,1,0,0,0,0|2,0,0]=4 1881 B9R0.2 CC(O)CCCSCCN Amb25676264 [1,1,0,0,0,0|1,0,1]=4 1882 B9R0.2 CC(O)CCNCCCN Amb25111706 [1,1,0,0,0,0|1,0,1]=4 1883 B9R0.2 CC(O)CCOCCCN Amb24630914 [1,1,0,0,0,0|1,0,1]=4 1884 B9R0.2 CC(O)CCSCCCN Amb25108386 [1,1,0,0,0,0|1,0,1]=4 1885 B9R0.2 CCCCCCCC(=O)S Amb10561702 [1,1,0,0,0,0|1,1,0]=4 1886 B9R0.2 CCCCCCCC(O)=O Amb22352272 [1,1,0,0,0,0|1,0,0]=3 1887 B9R0.2 CCCCCCCC(O)=O Amb22353407 [1,1,0,0,0,0|1,0,0]=3 1888 B9R0.2 CCCCCCCC([O-])=O Amb22045472 [1,1,0,0,0,0|1,0,1]=4 1889 B9R0.2 CCCCCCCC([O-])=O Amb22731641 [1,1,0,0,0,0|1,0,1]=4 1890 B9R0.2 CCCCCCCC([O-])=O Amb22732291 [1,1,0,0,0,0|1,0,1]=4 1891 B9R0.2 CCCCCCCC([O-])=O Amb22732747 [1,1,0,0,0,0|1,0,1]=4 1892 B9R0.2 CCCCCCC[13C](O)=O Amb20243497 [1,1,0,0,0,0|1,0,0]=3 1893 B9R0.2 CCCCCCC[13C]([O-])=O Amb22366893 [1,1,0,0,0,0|1,0,1]=4 1894 B9R0.2 CCCCCCNC(N)=O Amb23569596 [1,1,0,0,0,0|2,0,0]=4 1895 B9R0.2 CCCCCCNC(O)=S Amb24375451 [1,1,0,0,0,0|1,1,0]=4 1896 B9R0.2 CCCCCCOC(=O)Cl Amb10070637 [1,1,0,0,0,0|2,0,0]=4 1897 B9R0.2 CCCCCCOC(N)=O Amb22495526 [1,1,0,0,0,0|2,0,0]=4 1898 B9R0.2 CCCCCCSC(N)=O Amb25765687 [1,1,0,0,0,0|2,0,0]=4 1899 B9R0.2 CCCCCC[13CH2]C(O)=O Amb22367410 [1,1,0,0,0,0|1,0,0]=3 1900 B9R0.2 CCCCCC[13CH2][13C](O)=O Amb22367490 [1,1,0,0,0,0|1,0,0]=3 1901 B9R0.2 CCCCCNCC(=O)Cl Amb25248398 [1,1,0,0,0,0|2,0,0]=4 1902 B9R0.2 CCCCCOCC(N)=O Amb25770302 [1,1,0,0,0,0|2,0,0]=4 1903 B9R0.2 CCCCCSCC(N)=O Amb24524402 [1,1,0,0,0,0|2,0,0]=4 1904 B9R0.2 CCCCSCCC(=O)O Amb1032992 [1,1,0,0,0,0|1,0,0]=3 1905 B9R0.2 CCCCSCCC(N)=O Amb18798040 [1,1,0,0,0,0|2,0,0]=4 1906 B9R0.2 CCCC[13CH2][13CH2][13CH2][13C](O)=O Amb22351826 [1,1,0,0,0,0|1,0,0]=3 1907 B9R0.2 CCCNCCCC(=O)O Amb1109953 [1,1,0,0,0,0|1,0,0]=3 1908 B9R0.2 CCCNCCCC(N)=O Amb24513695 [1,1,0,0,0,0|2,0,0]=4 1909 B9R0.2 CCC\C=C\CCC(O)=O Amb25378821 [1,1,0,0,0,0|1,0,1]=4 1910 B9R0.2 CCNCCCCC(O)=O Amb24385094 [1,1,0,0,0,0|1,0,0]=3 1911 B9R0.2 CCNCCNCC(O)=O Amb24568313 [1,1,0,0,0,0|2,0,0]=4 1912 B9R0.2 CCNCCOCC(O)=O Amb18111801 [1,1,0,0,0,0|2,0,0]=4 1913 B9R0.2 CCSCCNCC(O)=O Amb24652163 [1,1,0,0,0,0|2,0,0]=4 1914 B9R0.2 CCSCCOCC(O)=O Amb24716269 [1,1,0,0,0,0|2,0,0]=4 1915 B9R0.2 CC\C=C\CCCC(O)=O Amb18643886 [1,1,0,0,0,0|1,0,1]=4 1916 B9R0.2 CNCCCCCC(C)=O Amb25728176 [1,1,0,0,0,0|1,0,0]=3 1917 B9R0.2 CNCCCCCC(O)=O Amb25704769 [1,1,0,0,0,0|0,0,0]=2 1918 B9R0.2 CNCCCCCS(C)=O Amb24538468 [1,1,0,0,0,0|2,0,0]=4 1919 B9R0.2 CNCCCNCC(O)=O Amb25292252 [1,1,0,0,0,0|1,0,0]=3 1920 B9R0.2 CNCCOCCC(C)=O Amb18630756 [1,1,0,0,0,0|2,0,0]=4 1921 B9R0.2 CNCCOCCC(O)=O Amb18111840 [1,1,0,0,0,0|1,0,0]=3 1922 B9R0.2 CNCCSCCC(N)=O Amb25024456 [1,1,0,0,0,0|2,0,0]=4 1923 B9R0.2 COCCCCCC(=O)O Amb10607872 [1,1,0,0,0,0|1,0,0]=3 1924 B9R0.2 COCCCOCC(O)=O Amb25304314 [1,1,0,0,0,0|2,0,0]=4 1925 B9R0.2 COCCCSCC(O)=O Amb18798347 [1,1,0,0,0,0|2,0,0]=4 1926 B9R0.2 CONCCCCC(O)=O Amb25694999 [1,1,0,0,0,0|2,0,0]=4 1927 B9R0.2 CS(=O)CCCNCCN Amb25788907 [1,1,0,0,0,0|2,0,0]=4 1928 B9R0.2 CS(=O)CCOCCCN Amb25346823 [1,1,0,0,0,0|2,0,0]=4 1929 B9R0.2 CSCCNCCC(O)=O Amb25055507 [1,1,0,0,0,0|2,0,0]=4 1930 B9R0.2 CSCCOCCC(O)=O Amb25173504 [1,1,0,0,0,0|2,0,0]=4 1931 B9R0.2 CSCCSCCC(O)=O Amb25798868 [1,1,0,0,0,0|2,0,0]=4 1932 B9R0.2 CSSCCCCC(O)=O Amb24429106 [1,1,0,0,0,0|2,0,0]=4 1933 B9R0.2 C[13CH2]CCCCCC(O)=O Amb22367488 [1,1,0,0,0,0|1,0,0]=3 1934 B9R0.2 C[C@H](O)CCCCCCN Amb25045097 [1,1,0,0,0,0|1,0,1]=4 1935 B9R0.2 C\C=C\CCCCC(O)=O Amb18643887 [1,1,0,0,0,0|1,0,1]=4 1936 B9R0.2 ClCCCCCCC(=O)O Amb17594087 [1,1,0,0,0,0|1,0,0]=3 1937 B9R0.2 N#CCCCCCC(O)=O Amb18643705 [1,1,0,0,0,0|0,0,1]=3 1938 B9R0.2 N#CCCCSCC(=O)O Amb1109771 [1,1,0,0,0,0|0,0,2]=4 1939 B9R0.2 N#CCCNCCC(=O)O Amb17315318 [1,1,0,0,0,0|0,0,2]=4 1940 B9R0.2 N#CCCOCCC(O)=O Amb24409319 [1,1,0,0,0,0|0,0,2]=4 1941 B9R0.2 N#CCCSCCC(O)=O Amb18927741 [1,1,0,0,0,0|0,0,2]=4 1942 B9R0.2 N#CCSCCCC(=O)O Amb17501766 [1,1,0,0,0,0|0,0,2]=4 1943 B9R0.2 NC(=O)CCCCCC#N Amb24568680 [1,1,0,0,0,0|1,0,1]=4 1944 B9R0.2 NC(=O)CCCNCCF Amb25772120 [1,1,0,0,0,0|2,0,0]=4 1945 B9R0.2 NC(=O)CCCNCCO Amb24432464 [1,1,0,0,0,0|2,0,0]=4 1946 B9R0.2 NC(=O)CCNCCCO Amb19959936 [1,1,0,0,0,0|2,0,0]=4 1947 B9R0.2 NC(=O)CNCCCCF Amb25694790 [1,1,0,0,0,0|2,0,0]=4 1948 B9R0.2 NC(=O)CNCCCCO Amb25140635 [1,1,0,0,0,0|2,0,0]=4 1949 B9R0.2 NC(=O)CSCCCCBr Amb25853094 [1,1,0,0,0,0|2,0,0]=4 1950 B9R0.2 NC(=O)OCCCCCBr Amb24479497 [1,1,0,0,0,0|2,0,0]=4 1951 B9R0.2 NC(=O)OCCCCCCl Amb25378803 [1,1,0,0,0,0|2,0,0]=4 1952 B9R0.2 NCCCCCC=C(Cl)Cl Amb25299275 [1,1,0,0,0,0|2,0,0]=4 1953 B9R0.2 NCCCCCCC(=O)O Amb1151254 [1,1,0,0,0,0|0,0,0]=2 1954 B9R0.2 NCCCCCCC(=O)O Amb16232099 [1,1,0,0,0,0|0,0,0]=2 1955 B9R0.2 NCCCCNCC(N)=O Amb25840017 [1,1,0,0,0,0|1,0,0]=3 1956 B9R0.2 NCCCCOCC(N)=O Amb24515943 [1,1,0,0,0,0|1,0,0]=3 1957 B9R0.2 NCCCCSCC(=C)C Amb17500961 [1,1,0,0,0,0|2,0,0]=4 1958 B9R0.2 NCCCCSCC(=O)C Amb17500952 [1,1,0,0,0,0|1,0,0]=3 1959 B9R0.2 NCCCCSCC(=O)N Amb17500917 [1,1,0,0,0,0|1,0,0]=3 1960 B9R0.2 NCCCCSCC(=O)O Amb17500919 [1,1,0,0,0,0|0,0,0]=2 1961 B9R0.2 NCCCC\C=C\C(O)=O Amb24502157 [1,1,0,0,0,0|0,0,1]=3 1962 B9R0.2 NCCCNCCC(N)=O Amb24360847 [1,1,0,0,0,0|1,0,0]=3 1963 B9R0.2 NCCCNOCC(N)=O Amb25678871 [1,1,0,0,0,0|2,0,0]=4 1964 B9R0.2 NCCCN\C=C\C(O)=O Amb25834729 [1,1,0,0,0,0|0,0,2]=4 1965 B9R0.2 NCCCOCCC(O)=O Amb18111494 [1,1,0,0,0,0|0,0,0]=2 1966 B9R0.2 NCCCSCCC(O)=O Amb24496605 [1,1,0,0,0,0|0,0,0]=2 1967 B9R0.2 NCCNCCCC(N)=O Amb25216041 [1,1,0,0,0,0|1,0,0]=3 1968 B9R0.2 NCCNCCNC(O)=O Amb24069145 [1,1,0,0,0,0|1,0,0]=3 1969 B9R0.2 NCCNC\C=C\C(O)=O Amb24595620 [1,1,0,0,0,0|0,0,2]=4 1970 B9R0.2 NCCOCCCC(N)=O Amb24554840 [1,1,0,0,0,0|1,0,0]=3 1971 B9R0.2 NCCOCCCC(O)=O Amb18111467 [1,1,0,0,0,0|0,0,0]=2 1972 B9R0.2 NCCSCCCC(=O)O Amb17500468 [1,1,0,0,0,0|0,0,0]=2 1973 B9R0.2 NCCSC\C=C\C(O)=O Amb25089810 [1,1,0,0,0,0|0,0,2]=4 1974 B9R0.2 NCCSSCCC(=O)O Amb17608062 [1,1,0,0,0,0|1,0,0]=3 1975 B9R0.2 NOCCCCCC(=O)O Amb10975958 [1,1,0,0,0,0|0,0,0]=2 1976 B9R0.2 O=C(Cl)CCCCCCCl Amb24703296 [1,1,0,0,0,0|2,0,0]=4 1977 B9R0.2 O=C(Cl)CCSCCCCl Amb24477286 [1,1,0,0,0,0|2,0,0]=4 1978 B9R0.2 OC(=O)CCCC#CCBr Amb24477271 [1,1,0,0,0,0|1,0,1]=4 1979 B9R0.2 OC(=O)CCCCC#CBr Amb25758884 [1,1,0,0,0,0|1,0,1]=4 1980 B9R0.2 OC(=O)CCCCCCF Amb25132501 [1,1,0,0,0,0|1,0,0]=3 1981 B9R0.2 OC(=O)CCCCCCS Amb24710334 [1,1,0,0,0,0|1,0,0]=3 1982 B9R0.2 OC(=O)CCCCN=C=O Amb24505309 [1,1,0,0,0,0|1,0,1]=4 1983 B9R0.2 OC(=O)CCCCN=C=S Amb25685363 [1,1,0,0,0,0|1,0,1]=4 1984 B9R0.2 OC(=O)CCCNCCF Amb25312142 [1,1,0,0,0,0|1,0,0]=3 1985 B9R0.2 OC(=O)CCOCCCBr Amb25207601 [1,1,0,0,0,0|1,0,0]=3 1986 B9R0.2 OC(=O)CCOCCCF Amb25794478 [1,1,0,0,0,0|1,0,0]=3 1987 B9R0.2 OC(=O)CNCCCCCl Amb24505281 [1,1,0,0,0,0|1,0,0]=3 1988 B9R0.2 OC(=O)CNCCCCF Amb24588093 [1,1,0,0,0,0|1,0,0]=3 1989 B9R0.2 OC(=O)\C=C\CCCCBr Amb18130981 [1,1,0,0,0,0|1,0,1]=4 1990 B9R0.2 OC(=O)\C=C\CCCCCl Amb18645743 [1,1,0,0,0,0|1,0,1]=4 1991 B9R0.2 OCCC#CCCC(O)=O Amb25716100 [1,1,0,0,0,0|1,0,1]=4 1992 B9R0.2 OCCCCCNC(=O)C Amb15769972 [1,1,0,0,0,0|2,0,0]=4 1993 B9R0.2 OCCCCSCC(O)=O Amb18798269 [1,1,0,0,0,0|1,0,0]=3 1994 B9R0.2 OCCCC\C=C\C(O)=O Amb18644146 [1,1,0,0,0,0|1,0,1]=4 1995 B9R0.2 OCCCOCCC(O)=O Amb24476864 [1,1,0,0,0,0|1,0,0]=3 1996 B9R0.2 OCCCSSCC(O)=O Amb25053922 [1,1,0,0,0,0|2,0,0]=4 1997 B9R0.2 OCCSSCCC(=O)O Amb17615366 [1,1,0,0,0,0|2,0,0]=4 1998 B9R0.2 OC\C=C\CCCC(O)=O Amb24568323 [1,1,0,0,0,0|1,0,1]=4 1999 B9R0.2 ON=CCCCCC(O)=O Amb24480769 [1,1,0,0,0,0|0,0,2]=4 2000 B9R0.2 ONCCCCCC(O)=O Amb25354224 [1,1,0,0,0,0|0,0,0]=2 2001 B9R0.2 [13CH3]CCCCCCC(O)=O Amb22367137 [1,1,0,0,0,0|1,0,0]=3 2002 B9R0.2 [13CH3][13CH2]CCCCCC(O)=O Amb22367489 [1,1,0,0,0,0|1,0,0]=3 2003 B9R0.2 [N-]=[N+]=NCCCCC(O)=O Amb19516609 [1,1,0,0,0,0|1,0,1]=4 2004 B9R0.4 C=CCCC(N)CC(O)=O Amb22641959 [1,1,0,0,0,0|1,0,1]=4 2005 B9R0.4 C=CCCC(O)CC(O)=O Amb24763775 [1,1,0,0,0,0|1,0,1]=4 2006 B9R0.4 C=CCC[C@@H](CC(=O)O)N Amb10066917 [1,1,0,0,0,0|1,0,1]=4 2007 B9R0.4 C=CCC[C@H](CC(=O)O)N Amb10066925 [1,1,0,0,0,0|1,0,1]=4 2008 B9R0.4 CC(=O)CC(O)CCCCl Amb24502163 [1,1,0,0,0,0|2,0,0]=4 2009 B9R0.4 CC(CC(O)=O)CCC#N Amb25789692 [1,1,0,0,0,0|0,0,2]=4 2010 B9R0.4 CC(CC(O)=O)CCC=C Amb18643923 [1,1,0,0,0,0|1,0,1]=4 2011 B9R0.4 CC(CC(O)=O)NCCCl Amb25806095 [1,1,0,0,0,0|2,0,0]=4 2012 B9R0.4 CC(CC(O)=O)SCCF Amb24399399 [1,1,0,0,0,0|2,0,0]=4 2013 B9R0.4 CC(CC(O)=O)SCCN Amb18788220 [1,1,0,0,0,0|1,0,0]=3 2014 B9R0.4 CC(CCCCl)CC(O)=O Amb18646190 [1,1,0,0,0,0|1,0,0]=3 2015 B9R0.4 CC(CCCN)CC(O)=O Amb24761313 [1,1,0,0,0,0|0,0,0]=2 2016 B9R0.4 CC(CCCN)NC(C)=O Amb25765187 [1,1,0,0,0,0|2,0,0]=4 2017 B9R0.4 CC(CCCN)NC(N)=O Amb25084805 [1,1,0,0,0,0|2,0,0]=4 2018 B9R0.4 CCCCC(=C)CC(O)=O Amb18643896 [1,1,0,0,0,0|1,0,1]=4 2019 B9R0.4 CCCCC(C)CC(C)=O Amb25051695 [1,1,0,0,0,0|2,0,0]=4 2020 B9R0.4 CCCCC(C)CC(N)=O Amb24761512 [1,1,0,0,0,0|2,0,0]=4 2021 B9R0.4 CCCCC(CC(=O)O)N Amb1993866 [1,1,0,0,0,0|1,0,0]=3 2022 B9R0.4 CCCCC(Cl)CC(=O)Cl Amb24563246 [1,1,0,0,0,0|2,0,0]=4 2023 B9R0.4 CCCCC(N)CC(N)=O Amb24638916 [1,1,0,0,0,0|2,0,0]=4 2024 B9R0.4 CCCCC(O)CC(N)=O Amb24563459 [1,1,0,0,0,0|2,0,0]=4 2025 B9R0.4 CCCCC(O)CC(O)=O Amb22388888 [1,1,0,0,0,0|1,0,0]=3 2026 B9R0.4 CCCCS(=O)CC(O)=O Amb18792577 [1,1,0,0,0,0|2,0,0]=4 2027 B9R0.4 CCCC[C@@H](O)CC(N)=O Amb24549040 [1,1,0,0,0,0|2,0,0]=4 2028 B9R0.4 CCCC[C@@H](O)CC(O)=O Amb24350627 [1,1,0,0,0,0|1,0,0]=3 2029 B9R0.4 CCCC[C@H](N)CC(N)=O Amb25147366 [1,1,0,0,0,0|2,0,0]=4 2030 B9R0.4 CCCC[C@H](O)CC(C)=O Amb25245692 [1,1,0,0,0,0|2,0,0]=4 2031 B9R0.4 CCCO[C@H](C)CC(O)=O Amb24450437 [1,1,0,0,0,0|2,0,0]=4 2032 B9R0.4 CCOCC(C)CC(O)=O Amb18202330 [1,1,0,0,0,0|2,0,0]=4 2033 B9R0.4 CCOCC(Cl)CC(O)=O Amb24426131 [1,1,0,0,0,0|2,0,0]=4 2034 B9R0.4 CN(CCCF)CC(O)=O Amb24340278 [1,1,0,0,0,0|2,0,0]=4 2035 B9R0.4 CN(CCCN)CC(O)=O Amb25794990 [1,1,0,0,0,0|1,0,0]=3 2036 B9R0.4 CNCCC(C)CC(O)=O Amb24694269 [1,1,0,0,0,0|2,0,0]=4 2037 B9R0.4 CNCC[C@@H](N)CC(O)=O Amb24117036 [1,1,0,0,0,0|2,0,0]=4 2038 B9R0.4 CNCC[C@H](N)CC(O)=O Amb25789535 [1,1,0,0,0,0|2,0,0]=4 2039 B9R0.4 CSCCC(N)CC(O)=O Amb22353181 [1,1,0,0,0,0|2,0,0]=4 2040 B9R0.4 CSCCC(O)CC(O)=O Amb18798349 [1,1,0,0,0,0|2,0,0]=4 2041 B9R0.4 CSCC[C@@H](CC(=O)O)N Amb16184019 [1,1,0,0,0,0|2,0,0]=4 2042 B9R0.4 CSCC[C@H](N)CC(O)=O Amb22352993 [1,1,0,0,0,0|2,0,0]=4 2043 B9R0.4 C[C@@H](CCCN)CC(O)=O Amb24744945 [1,1,0,0,0,0|0,0,0]=2 2044 B9R0.4 C[C@H](CC(O)=O)CCC#C Amb25064050 [1,1,0,0,0,0|1,0,1]=4 2045 B9R0.4 C[C@H](CC(O)=O)CCC=C Amb24674116 [1,1,0,0,0,0|1,0,1]=4 2046 B9R0.4 C[C@H](CC(O)=O)OCCO Amb24713383 [1,1,0,0,0,0|2,0,0]=4 2047 B9R0.4 C[C@H](CCCN)CC(O)=O Amb24715301 [1,1,0,0,0,0|0,0,0]=2 2048 B9R0.4 C[C@H](CCCS)CC(O)=O Amb24358051 [1,1,0,0,0,0|1,0,0]=3 2049 B9R0.4 NC(CCCS)CC(O)=O Amb24524306 [1,1,0,0,0,0|1,0,0]=3 2050 B9R0.4 NCCCC(N)CC(O)=O Amb18644278 [1,1,0,0,0,0|0,0,0]=2 2051 B9R0.4 NCCC[C@@H](N)CC(N)=O Amb25794069 [1,1,0,0,0,0|1,0,0]=3 2052 B9R0.4 NCCC[C@@H](N)CC(O)=O Amb24117039 [1,1,0,0,0,0|0,0,0]=2 2053 B9R0.4 NCCC[C@@H](N)CC(O)=O Amb24117927 [1,1,0,0,0,0|0,0,0]=2 2054 B9R0.4 NCCC[C@H](N)CC(O)=O Amb25757485 [1,1,0,0,0,0|0,0,0]=2 2055 B9R0.4 OC(=O)CS(=O)CCCF Amb25117795 [1,1,0,0,0,0|2,0,0]=4 2056 B9R0.4 O[C@@H](CCCBr)CC(O)=O Amb24605609 [1,1,0,0,0,0|1,0,0]=3 2057 B9R0.38 CCCCCCS(O)(=O)=O Amb25138206 [1,1,0,0,0,0|2,0,0]=4 2058 B9R0.38 CS(=O)(=O)CCCCCN Amb18828014 [1,1,0,0,0,0|1,0,1]=4 2059 B9R0.38 NCCCCCP(O)(O)=O Amb24729548 [1,1,0,0,0,0|1,0,0]=3 2060 B9R0.38 NCCNCCP(O)(O)=O Amb25826546 [1,1,0,0,0,0|2,0,0]=4 2061 B9R0.38 NCCNCCS(O)(=O)=O Amb24080637 [1,1,0,0,0,0|2,0,0]=4 2062 B9R0.38 NNCCCCS(O)(=O)=O Amb24741182 [1,1,0,0,0,0|2,0,0]=4 2063 B9R0.38 OCCCCCS(O)(=O)=O Amb25127860 [1,1,0,0,0,0|2,0,0]=4 2064 B9R0.38 OS(=O)(=O)CCCCCBr Amb19130974 [1,1,0,0,0,0|2,0,0]=4 2065 B9R0.48 C#CCC(O)CCC(O)=O Amb25077171 [1,1,0,0,0,0|1,0,1]=4 2066 B9R0.48 C=CCC(N)CCC(O)=O Amb25132628 [1,1,0,0,0,0|1,0,1]=4 2067 B9R0.48 C=CC[C@@H](N)CCC(O)=O Amb25308063 [1,1,0,0,0,0|1,0,1]=4 2068 B9R0.48 CC(CC#C)CCC(O)=O Amb25331115 [1,1,0,0,0,0|1,0,1]=4 2069 B9R0.48 CC(CC#N)CCC(O)=O Amb25826195 [1,1,0,0,0,0|0,0,2]=4 2070 B9R0.48 CC(CCN)CCC(C)=C Amb25067186 [1,1,0,0,0,0|2,0,0]=4 2071 B9R0.48 CC(CCN)CCC(N)=O Amb19515543 [1,1,0,0,0,0|1,0,0]=3 2072 B9R0.48 CC(CCN)CCC(O)=O Amb18124749 [1,1,0,0,0,0|0,0,0]=2 2073 B9R0.48 CC(CCN)CCS(C)=O Amb24585879 [1,1,0,0,0,0|2,0,0]=4 2074 B9R0.48 CC(CCO)SCC(O)=O Amb25056289 [1,1,0,0,0,0|2,0,0]=4 2075 B9R0.48 CCCC(Br)CCC(O)=O Amb24469305 [1,1,0,0,0,0|1,0,0]=3 2076 B9R0.48 CCCC(C)OCC(O)=O Amb18124782 [1,1,0,0,0,0|2,0,0]=4 2077 B9R0.48 CCCC(CCC(=O)C)C Amb10807385 [1,1,0,0,0,0|2,0,0]=4 2078 B9R0.48 CCCC(CCC(=O)N)O Amb17593642 [1,1,0,0,0,0|2,0,0]=4 2079 B9R0.48 CCCC(CCC(=O)O)N Amb1014101 [1,1,0,0,0,0|1,0,0]=3 2080 B9R0.48 CCCC(CCC(=O)[O-])O Amb2386295 [1,1,0,0,0,0|1,0,1]=4 2081 B9R0.48 CCCC(Cl)CCC(O)=O Amb23590328 [1,1,0,0,0,0|1,0,0]=3 2082 B9R0.48 CCCC(F)CCC(C)=O Amb25723377 [1,1,0,0,0,0|2,0,0]=4 2083 B9R0.48 CCCC(O)CCC(O)=O Amb17689110 [1,1,0,0,0,0|1,0,0]=3 2084 B9R0.48 CCCC(O)CCC([O-])=O Amb17778117 [1,1,0,0,0,0|1,0,1]=4 2085 B9R0.48 CCCN(C)CCC(O)=O Amb19280988 [1,1,0,0,0,0|2,0,0]=4 2086 B9R0.48 CCCS(=O)CCC(O)=O Amb18792575 [1,1,0,0,0,0|2,0,0]=4 2087 B9R0.48 CCC[C@@H](C)CCC(O)=O Amb24548514 [1,1,0,0,0,0|1,0,0]=3 2088 B9R0.48 CCC[C@H](C)CCC(O)=O Amb24446759 [1,1,0,0,0,0|1,0,0]=3 2089 B9R0.48 CCC[C@H](N)CCC(O)=O Amb25211817 [1,1,0,0,0,0|1,0,0]=3 2090 B9R0.48 CCNC(C)CCC(O)=O Amb24394614 [1,1,0,0,0,0|2,0,0]=4 2091 B9R0.48 CCOC(C)CCC(O)=O Amb24690847 [1,1,0,0,0,0|2,0,0]=4 2092 B9R0.48 CCSC(C)CCC(O)=O Amb18800669 [1,1,0,0,0,0|2,0,0]=4 2093 B9R0.48 CN(CCF)CCC(O)=O Amb25054517 [1,1,0,0,0,0|2,0,0]=4 2094 B9R0.48 CN(CCN)CCC(N)=O Amb24355517 [1,1,0,0,0,0|2,0,0]=4 2095 B9R0.48 CNCC(O)CCC(O)=O Amb24745159 [1,1,0,0,0,0|2,0,0]=4 2096 B9R0.48 COCC(C)CCC(O)=O Amb25340432 [1,1,0,0,0,0|2,0,0]=4 2097 B9R0.48 C[C@@H](CC=O)CCC(O)=O Amb24505022 [1,1,0,0,0,0|1,0,1]=4 2098 B9R0.48 C[C@@H](CCS)CCC(O)=O Amb24693959 [1,1,0,0,0,0|1,0,0]=3 2099 B9R0.48 C[C@H](CCBr)CCC(O)=O Amb24585993 [1,1,0,0,0,0|1,0,0]=3 2100 B9R0.48 C[C@H](CCO)CCC(C)=O Amb25319945 [1,1,0,0,0,0|2,0,0]=4 2101 B9R0.48 NC(CC#N)CCC(O)=O Amb24595715 [1,1,0,0,0,0|0,0,2]=4 2102 B9R0.48 NC(CCS)CCC(O)=O Amb24453471 [1,1,0,0,0,0|1,0,0]=3 2103 B9R0.48 NCCC(=O)CCC(O)=O Amb25790735 [1,1,0,0,0,0|0,0,1]=3 2104 B9R0.48 NCCS(=O)CCC(N)=O Amb25737235 [1,1,0,0,0,0|2,0,0]=4 2105 B9R0.48 NN(CCO)CCC(O)=O Amb25259231 [1,1,0,0,0,0|2,0,0]=4 2106 B9R0.48 N[C@@H](CCO)CCC(O)=O Amb25756968 [1,1,0,0,0,0|1,0,0]=3 2107 B9R0.48 N[C@H](CC#N)CCC(O)=O Amb24541852 [1,1,0,0,0,0|0,0,2]=4 2108 B9R0.48 OC(=O)CCC(=O)CCO Amb25265246 [1,1,0,0,0,0|1,0,1]=4 2109 B9R0.48 OC(=O)CCS(=O)CCF Amb25040432 [1,1,0,0,0,0|2,0,0]=4 2110 B9R0.48 OC(CCS)CCC(O)=O Amb25320980 [1,1,0,0,0,0|1,0,0]=3 2111 B9R0.48 OCC[C@H](O)CCC(O)=O Amb25843738 [1,1,0,0,0,0|1,0,0]=3 2112 B9R0.55 CC(=O)CCCCC(N)=O Amb24505160 [1,1,0,0,0,0|1,0,1]=4 2113 B9R0.55 CC(Br)CCCCC(O)=O Amb25309392 [1,1,0,0,0,0|1,0,0]=3 2114 B9R0.55 CC(C)CCCCC(=O)Cl Amb25067489 [1,1,0,0,0,0|2,0,0]=4 2115 B9R0.55 CC(C)CCCCC([O-])=O Amb22732968 [1,1,0,0,0,0|1,0,1]=4 2116 B9R0.55 CC(CCCCC(=O)O)C Amb10576144 [1,1,0,0,0,0|1,0,0]=3 2117 B9R0.55 CC(CCNCC(=O)O)C Amb1111021 [1,1,0,0,0,0|2,0,0]=4 2118 B9R0.55 CC(CCSCC(=O)O)C Amb1137397 [1,1,0,0,0,0|2,0,0]=4 2119 B9R0.55 CC(CNCCC(=O)O)C Amb10609230 [1,1,0,0,0,0|2,0,0]=4 2120 B9R0.55 CC(CNCCC(=O)O)C Amb2372367 [1,1,0,0,0,0|2,0,0]=4 2121 B9R0.55 CC(Cl)CCCCC(=O)Cl Amb24633993 [1,1,0,0,0,0|2,0,0]=4 2122 B9R0.55 CC(Cl)CCCCC(O)=O Amb18646185 [1,1,0,0,0,0|1,0,0]=3 2123 B9R0.55 CC(F)CCCCC(C)=O Amb25145595 [1,1,0,0,0,0|2,0,0]=4 2124 B9R0.55 CC(F)COCCC(O)=O Amb25268355 [1,1,0,0,0,0|2,0,0]=4 2125 B9R0.55 CC(N)CCCCC(C)=C Amb24394573 [1,1,0,0,0,0|2,0,0]=4 2126 B9R0.55 CC(N)CCCCC(N)=O Amb19515544 [1,1,0,0,0,0|1,0,0]=3 2127 B9R0.55 CC(N)CCCCC(O)=O Amb18644199 [1,1,0,0,0,0|0,0,0]=2 2128 B9R0.55 CC(N)CCCCC(O)=O Amb19515386 [1,1,0,0,0,0|0,0,0]=2 2129 B9R0.55 CC(N)CCCCS(C)=O Amb24539207 [1,1,0,0,0,0|2,0,0]=4 2130 B9R0.55 CC(N)CCCNC(C)=O Amb24481145 [1,1,0,0,0,0|2,0,0]=4 2131 B9R0.55 CC(N)CCCNC(N)=O Amb25136886 [1,1,0,0,0,0|2,0,0]=4 2132 B9R0.55 CC(N)CSCCC(O)=O Amb24435179 [1,1,0,0,0,0|1,0,0]=3 2133 B9R0.55 CC(NCCCC(=O)O)C Amb1111231 [1,1,0,0,0,0|2,0,0]=4 2134 B9R0.55 CC(O)CCCCC(O)=O Amb18644264 [1,1,0,0,0,0|1,0,0]=3 2135 B9R0.55 CC(O)CCNCC(O)=O Amb25369892 [1,1,0,0,0,0|2,0,0]=4 2136 B9R0.55 CC(O)COCCC(O)=O Amb24746704 [1,1,0,0,0,0|2,0,0]=4 2137 B9R0.55 CC(O)CSCCC(O)=O Amb18792572 [1,1,0,0,0,0|2,0,0]=4 2138 B9R0.55 CN(C)CCCCC(O)=O Amb19275569 [1,1,0,0,0,0|2,0,0]=4 2139 B9R0.55 CP(=O)CCCCC(O)=O Amb25765822 [1,1,0,0,0,0|2,0,0]=4 2140 B9R0.55 CS(=O)CCCCC(O)=O Amb18788305 [1,1,0,0,0,0|2,0,0]=4 2141 B9R0.55 C[C@@H](O)CCCCC(C)=O Amb25114746 [1,1,0,0,0,0|2,0,0]=4 2142 B9R0.55 C[C@@H](O)CCCCC(O)=O Amb24427549 [1,1,0,0,0,0|1,0,0]=3 2143 B9R0.55 C[C@H](N)CCCCC(O)=O Amb25229790 [1,1,0,0,0,0|0,0,0]=2 2144 B9R0.55 C[C@H](O)CCCCC(O)=O Amb24671333 [1,1,0,0,0,0|1,0,0]=3 2145 B9R0.55 NC(=N)CCCCC(O)=O Amb25147486 [1,1,0,0,0,0|0,0,1]=3 2146 B9R0.55 NC(=N)CNCCC(O)=O Amb24394430 [1,1,0,0,0,0|1,0,1]=4 2147 B9R0.55 NC(=O)CCOCC(O)=O Amb25146949 [1,1,0,0,0,0|1,0,1]=4 2148 B9R0.55 OC(=O)CCCCC(Cl)Cl Amb24482330 [1,1,0,0,0,0|1,0,0]=3 2149 B9R0.55 OC(=O)CCCCC(O)=O Amb22043229 [1,1,0,0,0,0|1,0,1]=4 2150 B9R0.55 OC(=O)CCCCC(O)=O Amb22167453 [1,1,0,0,0,0|1,0,1]=4 2151 B9R0.55 OC(=O)CCCCC(O)=O Amb22336279 [1,1,0,0,0,0|1,0,1]=4 2152 B9R0.55 OC(=O)CCCCC(O)=O Amb22338188 [1,1,0,0,0,0|1,0,1]=4 2153 B9R0.55 OC(=O)CCCCC(O)=O Amb22351345 [1,1,0,0,0,0|1,0,1]=4 2154 B9R0.55 OC(=O)CCCCC(O)=O Amb22351401 [1,1,0,0,0,0|1,0,1]=4 2155 B9R0.55 OC(=O)CCCCC(O)=O Amb22351452 [1,1,0,0,0,0|1,0,1]=4 2156 B9R0.55 OC(=O)CCCCC(O)=O Amb22351586 [1,1,0,0,0,0|1,0,1]=4 2157 B9R0.55 OC(=O)CCCCC(O)=O Amb22353360 [1,1,0,0,0,0|1,0,1]=4 2158 B9R0.55 OC(=O)CCCCC(O)=O Amb22363211 [1,1,0,0,0,0|1,0,1]=4 2159 B9R0.55 OC(=O)CCCNC(=O)N Amb1104859 [1,1,0,0,0,0|1,0,1]=4 2160 B9R0.55 OC(=O)CCCSC(C)C Amb17503621 [1,1,0,0,0,0|2,0,0]=4 2161 B9R0.55 OC(=O)CCNCC(F)F Amb18179466 [1,1,0,0,0,0|2,0,0]=4 2162 B9R0.55 OC(=O)CCSCC(F)F Amb18793590 [1,1,0,0,0,0|2,0,0]=4 2163 B9R0.55 OC(=O)CNCCC(F)F Amb24721262 [1,1,0,0,0,0|2,0,0]=4 2164 B9R0.55 OC(=O)CSCCC(=S)N Amb17503232 [1,1,0,0,0,0|1,0,1]=4 2165 B9R0.55 O[13C](=O)CCCC[13C](O)=O Amb22338172 [1,1,0,0,0,0|1,0,1]=4 2166 B9R0.55 [O-]C(=O)CCCCC(O)=O Amb21934396 [1,1,0,0,0,0|1,0,1]=4 2167 B9R0.55 [O-][N+](=O)CCCCC(O)=O Amb24596293 [1,1,0,0,0,0|2,0,0]=4 2168 B9R0.3 CCCCC(O)P(O)(O)=O Amb25356317 [1,1,0,0,0,0|2,0,0]=4 2169 B9R0.6 C=CC[C@@H](O)[C@H](N)C(O)=O Amb24459826 [1,1,0,0,0,0|0,0,2]=4 2170 B9R0.6 CC#C[C@H](O)[C@H](N)C(O)=O Amb25313389 [1,1,0,0,0,0|0,0,2]=4 2171 B9R0.6 CC(C(C)CNC)C(O)=O Amb25379230 [1,1,0,0,0,0|2,0,0]=4 2172 B9R0.6 CC(C(N)CCC)C(O)=O Amb24763852 [1,1,0,0,0,0|1,0,0]=3 2173 B9R0.6 CC(C(O)=O)N(C)CCN Amb19028451 [1,1,0,0,0,0|2,0,0]=4 2174 B9R0.6 CC(C(O)CCC)C(O)=O Amb18310700 [1,1,0,0,0,0|1,0,0]=3 2175 B9R0.6 CC(CCC)C(Br)C(N)=O Amb24451592 [1,1,0,0,0,0|2,0,0]=4 2176 B9R0.6 CC(CCC)C(Cl)C(N)=O Amb18800738 [1,1,0,0,0,0|2,0,0]=4 2177 B9R0.6 CC(CCC)C(F)C(C)=O Amb25146866 [1,1,0,0,0,0|2,0,0]=4 2178 B9R0.6 CC(CCC)C(N)C(C)=C Amb25357806 [1,1,0,0,0,0|2,0,0]=4 2179 B9R0.6 CC(CCC)C(N)C(O)=O Amb20622789 [1,1,0,0,0,0|0,0,0]=2 2180 B9R0.6 CC(CCC)C(S)C(O)=O Amb24438702 [1,1,0,0,0,0|1,0,0]=3 2181 B9R0.6 CC(CCCl)C(N)C(O)=O Amb25803640 [1,1,0,0,0,0|1,0,0]=3 2182 B9R0.6 CC(CCN)C(N)C(O)=O Amb25309114 [1,1,0,0,0,0|0,0,0]=2 2183 B9R0.6 CC(CCO)C(N)C(O)=O Amb25054791 [1,1,0,0,0,0|1,0,0]=3 2184 B9R0.6 CC(CCO)C(O)C(O)=O Amb24392760 [1,1,0,0,0,0|2,0,0]=4 2185 B9R0.6 CC(CCO)[C@H](N)C(O)=O Amb24744497 [1,1,0,0,0,0|1,0,0]=3 2186 B9R0.6 CC(COC)C(N)C(N)=O Amb24468545 [1,1,0,0,0,0|2,0,0]=4 2187 B9R0.6 CC(COC)C(N)C(O)=O Amb24116980 [1,1,0,0,0,0|1,0,0]=3 2188 B9R0.6 CC(COC)[C@H](N)C(O)=O Amb25729786 [1,1,0,0,0,0|1,0,0]=3 2189 B9R0.6 CC(CSC)[C@@H](N)C(O)=O Amb24482316 [1,1,0,0,0,0|1,0,0]=3 2190 B9R0.6 CC(NCC)C(O)C(O)=O Amb25679409 [1,1,0,0,0,0|2,0,0]=4 2191 B9R0.6 CC(OCC)C(Br)C(O)=O Amb24416715 [1,1,0,0,0,0|2,0,0]=4 2192 B9R0.6 CC(OCC)[C@H](S)C(O)=O Amb25053429 [1,1,0,0,0,0|2,0,0]=4 2193 B9R0.6 CC(OCO)C(N)C(O)=O Amb24567906 [1,1,0,0,0,0|2,0,0]=4 2194 B9R0.6 CC([C@H](N)CCC)C(O)=O Amb25238448 [1,1,0,0,0,0|1,0,0]=3 2195 B9R0.6 CCCC(Br)C(O)C(O)=O Amb25229083 [1,1,0,0,0,0|1,0,0]=3 2196 B9R0.6 CCCC(C(C(=O)C)C)O Amb17593628 [1,1,0,0,0,0|2,0,0]=4 2197 B9R0.6 CCCC(C(C(=O)O)N)F Amb10839857 [1,1,0,0,0,0|0,0,0]=2 2198 B9R0.6 CCCC(C)C(=O)C(O)=O Amb24747027 [1,1,0,0,0,0|1,0,1]=4 2199 B9R0.6 CCCC(C)C(C)C(C)=O Amb24396748 [1,1,0,0,0,0|2,0,0]=4 2200 B9R0.6 CCCC(C)C(C)C(N)=O Amb25361926 [1,1,0,0,0,0|2,0,0]=4 2201 B9R0.6 CCCC(N)C(O)C(N)=O Amb20247342 [1,1,0,0,0,0|2,0,0]=4 2202 B9R0.6 CCCC(N)C(O)C(O)=O Amb20242874 [1,1,0,0,0,0|1,0,0]=3 2203 B9R0.6 CCCC(O)C(=C)C(O)=O Amb25131217 [1,1,0,0,0,0|1,0,1]=4 2204 B9R0.6 CCCC(O)C(Br)C(O)=O Amb24633342 [1,1,0,0,0,0|1,0,0]=3 2205 B9R0.6 CCCC(O)C(N)C(N)=O Amb25375285 [1,1,0,0,0,0|1,0,0]=3 2206 B9R0.6 CCCC(O)C(N)C(O)=O Amb18124815 [1,1,0,0,0,0|0,0,0]=2 2207 B9R0.6 CCCC(O)[C@@H](N)C(O)=O Amb25268432 [1,1,0,0,0,0|0,0,0]=2 2208 B9R0.6 CCCC(S)[C@H](N)C(O)=O Amb24359854 [1,1,0,0,0,0|0,0,0]=2 2209 B9R0.6 CCCN(C)[C@@H](C)C(O)=O Amb25834811 [1,1,0,0,0,0|2,0,0]=4 2210 B9R0.6 CCCS(=O)C(C)C(O)=O Amb18304634 [1,1,0,0,0,0|2,0,0]=4 2211 B9R0.6 CCC[C@@H](N)[C@@H](O)C(O)=O Amb22747816 [1,1,0,0,0,0|1,0,0]=3 2212 B9R0.6 CCC[C@@H](N)[C@H](O)C(O)=O Amb22747809 [1,1,0,0,0,0|1,0,0]=3 2213 B9R0.6 CCC[C@@H](O)[C@@H](N)C(O)=O Amb25367288 [1,1,0,0,0,0|0,0,0]=2 2214 B9R0.6 CCC[C@@H](O)[C@H](N)C(O)=O Amb24715802 [1,1,0,0,0,0|0,0,0]=2 2215 B9R0.6 CCC[C@@H](O)[C@H](O)C(C)=O Amb25282703 [1,1,0,0,0,0|2,0,0]=4 2216 B9R0.6 CCC[C@@H](O)[C@H](O)C(O)=O Amb24480722 [1,1,0,0,0,0|1,0,0]=3 2217 B9R0.6 CCC[C@H](N)C(O)C(N)=O Amb25303990 [1,1,0,0,0,0|2,0,0]=4 2218 B9R0.6 CCC[C@H](N)[C@H](O)C(O)=O Amb25084552 [1,1,0,0,0,0|1,0,0]=3 2219 B9R0.6 CCC[C@H](O)[C@@H](Br)C(O)=O Amb25309541 [1,1,0,0,0,0|1,0,0]=3 2220 B9R0.6 CCC[C@H](O)[C@H](Br)C(O)=O Amb24727027 [1,1,0,0,0,0|1,0,0]=3 2221 B9R0.6 CCC[C@H](O)[C@H](N)C(O)=O Amb25113866 [1,1,0,0,0,0|0,0,0]=2 2222 B9R0.6 COCC(O)C(N)C(O)=O Amb25147551 [1,1,0,0,0,0|1,0,0]=3 2223 B9R0.6 CSCC(O)C(N)C(O)=O Amb18646340 [1,1,0,0,0,0|1,0,0]=3 2224 B9R0.6 C[C@@H](CCC)[C@H](O)C(O)=O Amb25368297 [1,1,0,0,0,0|1,0,0]=3 2225 B9R0.6 C[C@@H](CCF)[C@H](N)C(O)=O Amb25147533 [1,1,0,0,0,0|1,0,0]=3 2226 B9R0.6 C[C@@H](CCO)[C@H](N)C(O)=O Amb25709206 [1,1,0,0,0,0|1,0,0]=3 2227 B9R0.6 C[C@@H](OCC)[C@@H](N)C(O)=O Amb22747686 [1,1,0,0,0,0|1,0,0]=3 2228 B9R0.6 C[C@@H]([C@@H](C(=O)O)N)OCC Amb10807408 [1,1,0,0,0,0|1,0,0]=3 2229 B9R0.6 C[C@@H]([C@@H](O)CCC)C(O)=O Amb24445556 [1,1,0,0,0,0|1,0,0]=3 2230 B9R0.6 C[C@@H]([C@H](O)CCC)C(O)=O Amb24529277 [1,1,0,0,0,0|1,0,0]=3 2231 B9R0.6 C[C@H](C(O)CCC)C(O)=O Amb25096562 [1,1,0,0,0,0|1,0,0]=3 2232 B9R0.6 C[C@H](CC=C)[C@H](N)C(O)=O Amb25347201 [1,1,0,0,0,0|0,0,2]=4 2233 B9R0.6 C[C@H](CCC)[C@H](N)C(O)=O Amb25062732 [1,1,0,0,0,0|0,0,0]=2 2234 B9R0.6 C[C@H](CCC)[C@H](O)C(O)=O Amb25786123 [1,1,0,0,0,0|1,0,0]=3 2235 B9R0.6 C[C@H](CCF)[C@H](N)C(O)=O Amb25132099 [1,1,0,0,0,0|1,0,0]=3 2236 B9R0.6 C[C@H](CCO)[C@H](N)C(O)=O Amb25111969 [1,1,0,0,0,0|1,0,0]=3 2237 B9R0.6 C[C@H](CCO)[C@H](O)C(O)=O Amb25122108 [1,1,0,0,0,0|2,0,0]=4 2238 B9R0.6 C[C@H](CSC)[C@@H](N)C(O)=O Amb24642749 [1,1,0,0,0,0|1,0,0]=3 2239 B9R0.6 C[C@H](CSC)[C@H](N)C(O)=O Amb25851133 [1,1,0,0,0,0|1,0,0]=3 2240 B9R0.6 C[C@H]([C@@H](O)CCC)C(C)=O Amb25145582 [1,1,0,0,0,0|2,0,0]=4 2241 B9R0.6 C[C@H]([C@@H](O)CCC)C(O)=O Amb25789993 [1,1,0,0,0,0|1,0,0]=3 2242 B9R0.6 C[C@H]([C@H](O)CCC)C(C)=O Amb25128812 [1,1,0,0,0,0|2,0,0]=4 2243 B9R0.6 NC(C(S)CCO)C(O)=O Amb24724703 [1,1,0,0,0,0|1,0,0]=3 2244 B9R0.6 N[C@@H](C(S)CCO)C(O)=O Amb25320812 [1,1,0,0,0,0|1,0,0]=3 2245 B9R0.6 OCCC(O)C(O)C(O)=O Amb24482452 [1,1,0,0,0,0|2,0,0]=4 2246 B9R0.7 CC(=C)CCC(C)C(O)=O Amb25809141 [1,1,0,0,0,0|1,0,1]=4 2247 B9R0.7 CC(=C)CC[C@@H](C)C(O)=O Amb25685103 [1,1,0,0,0,0|1,0,1]=4 2248 B9R0.7 CC(=C)CC[C@@H](N)C(O)=O Amb25775219 [1,1,0,0,0,0|0,0,1]=3 2249 B9R0.7 CC(=O)C(N)CCC(N)=O Amb25231237 [1,1,0,0,0,0|1,0,1]=4 2250 B9R0.7 CC(=O)CCC(C)C(O)=O Amb18644099 [1,1,0,0,0,0|1,0,1]=4 2251 B9R0.7 CC(=O)CCC(N)C(O)=O Amb20669473 [1,1,0,0,0,0|0,0,1]=3 2252 B9R0.7 CC(=O)CCC(N)C(O)=O Amb22157242 [1,1,0,0,0,0|0,0,1]=3 2253 B9R0.7 CC(=O)CC[C@@H](N)C(O)=O Amb19130479 [1,1,0,0,0,0|0,0,1]=3 2254 B9R0.7 CC(=O)CC[C@H](N)C(O)=O Amb25147501 [1,1,0,0,0,0|0,0,1]=3 2255 B9R0.7 CC(=O)NC[C@H](N)C(O)=O Amb25772091 [1,1,0,0,0,0|1,0,1]=4 2256 B9R0.7 CC(=O)OCC(C(=O)O)N Amb17593668 [1,1,0,0,0,0|1,0,1]=4 2257 B9R0.7 CC(=O)OC[C@@H](N)C(O)=O Amb22756697 [1,1,0,0,0,0|1,0,1]=4 2258 B9R0.7 CC(=O)SCC(N)C(O)=O Amb22490452 [1,1,0,0,0,0|1,0,1]=4 2259 B9R0.7 CC(=O)SC[C@@H](C(=O)O)N Amb16185419 [1,1,0,0,0,0|1,0,1]=4 2260 B9R0.7 CC(=O)[C@@H](N)CCC(N)=O Amb25142080 [1,1,0,0,0,0|1,0,1]=4 2261 B9R0.7 CC(C)=CC[C@H](N)C(O)=O Amb25836895 [1,1,0,0,0,0|0,0,2]=4 2262 B9R0.7 CC(C)CCC(Br)C(C)=O Amb25828882 [1,1,0,0,0,0|2,0,0]=4 2263 B9R0.7 CC(C)CCC(Br)C(O)=O Amb18131059 [1,1,0,0,0,0|1,0,0]=3 2264 B9R0.7 CC(C)CCC(C)C(C)=O Amb24392384 [1,1,0,0,0,0|2,0,0]=4 2265 B9R0.7 CC(C)CCC(C)C(O)=O Amb19033547 [1,1,0,0,0,0|1,0,0]=3 2266 B9R0.7 CC(C)CCC(Cl)C(=O)Cl Amb25225638 [1,1,0,0,0,0|2,0,0]=4 2267 B9R0.7 CC(C)CCC(Cl)C(N)=O Amb25362428 [1,1,0,0,0,0|2,0,0]=4 2268 B9R0.7 CC(C)CCC(F)C(C)=O Amb24383731 [1,1,0,0,0,0|2,0,0]=4 2269 B9R0.7 CC(C)CCC(N)C(C)=C Amb25765968 [1,1,0,0,0,0|2,0,0]=4 2270 B9R0.7 CC(C)CCC(N)C(C)=O Amb18831542 [1,1,0,0,0,0|1,0,0]=3 2271 B9R0.7 CC(C)CCC(N)C(C)O Amb18124763 [1,1,0,0,0,0|1,0,1]=4 2272 B9R0.7 CC(C)CCC(N)C(O)=O Amb19269152 [1,1,0,0,0,0|0,0,0]=2 2273 B9R0.7 CC(C)CCC(O)C(C)=O Amb24502166 [1,1,0,0,0,0|2,0,0]=4 2274 B9R0.7 CC(C)CCC(O)C(N)=O Amb25210125 [1,1,0,0,0,0|2,0,0]=4 2275 B9R0.7 CC(C)CC[C@@H](N)C(=O)Cl Amb25086091 [1,1,0,0,0,0|1,0,0]=3 2276 B9R0.7 CC(C)CC[C@@H](N)C(O)=O Amb19133196 [1,1,0,0,0,0|0,0,0]=2 2277 B9R0.7 CC(C)CC[C@@H](N)C(O)=O Amb22899130 [1,1,0,0,0,0|0,0,0]=2 2278 B9R0.7 CC(C)CC[C@H](Cl)C(=O)Cl Amb24544198 [1,1,0,0,0,0|2,0,0]=4 2279 B9R0.7 CC(C)CC[C@H](F)C(C)=O Amb25050234 [1,1,0,0,0,0|2,0,0]=4 2280 B9R0.7 CC(C)CC[C@H](O)C(C)=O Amb25059211 [1,1,0,0,0,0|2,0,0]=4 2281 B9R0.7 CC(C)CN[C@H](C)C(O)=O Amb25300819 [1,1,0,0,0,0|2,0,0]=4 2282 B9R0.7 CC(C)NCC(N)C(O)=O Amb25790256 [1,1,0,0,0,0|1,0,0]=3 2283 B9R0.7 CC(C)NC[C@H](N)C(O)=O Amb24682685 [1,1,0,0,0,0|1,0,0]=3 2284 B9R0.7 CC(C)NC[C@H](O)C(O)=O Amb24479668 [1,1,0,0,0,0|2,0,0]=4 2285 B9R0.7 CC(C)OCC(N)C(N)=O Amb25104507 [1,1,0,0,0,0|2,0,0]=4 2286 B9R0.7 CC(C)OCC(O)C(O)=O Amb24583914 [1,1,0,0,0,0|2,0,0]=4 2287 B9R0.7 CC(C)OC[C@@H](N)C(N)=O Amb25267850 [1,1,0,0,0,0|2,0,0]=4 2288 B9R0.7 CC(C)OC[C@@H](N)C(O)=O Amb24479342 [1,1,0,0,0,0|1,0,0]=3 2289 B9R0.7 CC(C)OC[C@H](O)C(O)=O Amb24480796 [1,1,0,0,0,0|2,0,0]=4 2290 B9R0.7 CC(C)SCC(C)C(O)=O Amb18303880 [1,1,0,0,0,0|2,0,0]=4 2291 B9R0.7 CC(C)SCC(N)C(N)=O Amb18788147 [1,1,0,0,0,0|2,0,0]=4 2292 B9R0.7 CC(C)SCC(O)C(O)=O Amb24728812 [1,1,0,0,0,0|2,0,0]=4 2293 B9R0.7 CC(C)SC[C@@H](N)C(O)=O Amb18792510 [1,1,0,0,0,0|1,0,0]=3 2294 B9R0.7 CC(C)SC[C@H](N)C(O)=O Amb25087870 [1,1,0,0,0,0|1,0,0]=3 2295 B9R0.7 CC(C)SC[C@H](O)C(O)=O Amb25362660 [1,1,0,0,0,0|2,0,0]=4 2296 B9R0.7 CC(CCC(C)Br)C(O)=O Amb24452260 [1,1,0,0,0,0|1,0,0]=3 2297 B9R0.7 CC(Cl)=CCC(N)C(O)=O Amb25326840 [1,1,0,0,0,0|0,0,2]=4 2298 B9R0.7 CC(Cl)=CC[C@H](N)C(O)=O Amb24518555 [1,1,0,0,0,0|0,0,2]=4 2299 B9R0.7 CC(Cl)CCC(N)C(O)=O Amb24692699 [1,1,0,0,0,0|0,0,0]=2 2300 B9R0.7 CC(Cl)CC[C@H](N)C(O)=O Amb24692939 [1,1,0,0,0,0|0,0,0]=2 2301 B9R0.7 CC(F)=CCC(N)C(O)=O Amb24354283 [1,1,0,0,0,0|0,0,2]=4 2302 B9R0.7 CC(NCC(C)N)C(O)=O Amb24599775 [1,1,0,0,0,0|2,0,0]=4 2303 B9R0.7 CC(O)CCC(=C)C(O)=O Amb24375911 [1,1,0,0,0,0|1,0,1]=4 2304 B9R0.7 CC(O)CCC(C)C(O)=O Amb25848509 [1,1,0,0,0,0|1,0,0]=3 2305 B9R0.7 CC(O)CCC(F)C(C)=O Amb25093785 [1,1,0,0,0,0|2,0,0]=4 2306 B9R0.7 CC(O)CNC(C)C(O)=O Amb18523859 [1,1,0,0,0,0|2,0,0]=4 2307 B9R0.7 CC(O)CN[C@@H](C)C(O)=O Amb25129862 [1,1,0,0,0,0|2,0,0]=4 2308 B9R0.7 CC(O)COC(C)C(O)=O Amb25146942 [1,1,0,0,0,0|2,0,0]=4 2309 B9R0.7 CC(O)CSC(C)C(O)=O Amb18303285 [1,1,0,0,0,0|2,0,0]=4 2310 B9R0.7 CC(O)NC[C@H](N)C(O)=O Amb24575047 [1,1,0,0,0,0|1,0,0]=3 2311 B9R0.7 CC(OCC(C)F)C(O)=O Amb25350495 [1,1,0,0,0,0|2,0,0]=4 2312 B9R0.7 CC(SCC(C)N)C(O)=O Amb25224815 [1,1,0,0,0,0|2,0,0]=4 2313 B9R0.7 CN(C)CCC(N)C(N)=O Amb19036813 [1,1,0,0,0,0|2,0,0]=4 2314 B9R0.7 CN(C)CC[C@H](N)C(O)=O Amb25108550 [1,1,0,0,0,0|1,0,0]=3 2315 B9R0.7 CP(=O)OCC(N)C(O)=O Amb24724745 [1,1,0,0,0,0|2,0,0]=4 2316 B9R0.7 CP(=O)OC[C@H](N)C(O)=O Amb25362185 [1,1,0,0,0,0|2,0,0]=4 2317 B9R0.7 CP(O)CCC(N)C(O)=O Amb25295427 [1,1,0,0,0,0|1,0,0]=3 2318 B9R0.7 CS(=N)CCC(N)C(O)=O Amb25243030 [1,1,0,0,0,0|1,0,0]=3 2319 B9R0.7 CS(=N)CC[C@H](N)C(O)=O Amb25100927 [1,1,0,0,0,0|1,0,0]=3 2320 B9R0.7 CS(=O)CC[C@@H](N)C(O)=O Amb19133021 [1,1,0,0,0,0|1,0,0]=3 2321 B9R0.7 CS(=O)NC[C@H](N)C(O)=O Amb25798536 [1,1,0,0,0,0|2,0,0]=4 2322 B9R0.7 CS(C)CCC(N)C(O)=O Amb25695887 [1,1,0,0,0,0|1,0,0]=3 2323 B9R0.7 CS(C)CC[C@H](N)C(O)=O Amb24440849 [1,1,0,0,0,0|1,0,0]=3 2324 B9R0.7 C[C@H](N)CC[C@@H](N)C(O)=O Amb25199121 [1,1,0,0,0,0|0,0,0]=2 2325 B9R0.7 C[C@H](O)CC[C@@H](C)C(O)=O Amb25378744 [1,1,0,0,0,0|1,0,0]=3 2326 B9R0.7 C[S+](C)CC[C@@H](N)C(O)=O Amb22800534 [1,1,0,0,0,0|1,0,0]=3 2327 B9R0.7 C[S+](C)CC[C@@H](N)C(O)=O Amb22800551 [1,1,0,0,0,0|1,0,0]=3 2328 B9R0.7 C\C(\Cl)=C\CC(N)C(O)=O Amb24692752 [1,1,0,0,0,0|0,0,2]=4 2329 B9R0.7 C\C(\Cl)=C\C[C@H](N)C(O)=O Amb24629700 [1,1,0,0,0,0|0,0,2]=4 2330 B9R0.7 NC(=N)NCC(N)C(O)=O Amb22169574 [1,1,0,0,0,0|1,0,1]=4 2331 B9R0.7 NC(=N)NC[C@@H](C(=O)O)N Amb16232025 [1,1,0,0,0,0|1,0,1]=4 2332 B9R0.7 NC(=O)CCC(F)C(O)=O Amb24745286 [1,1,0,0,0,0|1,0,1]=4 2333 B9R0.7 NC(=O)CCC(O)C(O)=O Amb25275311 [1,1,0,0,0,0|1,0,1]=4 2334 B9R0.7 NC(=O)CC[13C@H](N)[13C](O)=O Amb22338972 [1,1,0,0,0,0|0,0,1]=3 2335 B9R0.7 NC(=O)CC[C@@H](N)C(N)=O Amb22748708 [1,1,0,0,0,0|1,0,1]=4 2336 B9R0.7 NC(=O)CC[C@H](Br)C(O)=O Amb25223377 [1,1,0,0,0,0|1,0,1]=4 2337 B9R0.7 NC(=O)CC[C@H](N)C(N)=O Amb24426852 [1,1,0,0,0,0|1,0,1]=4 2338 B9R0.7 NC(=O)NC[C@H](C(=O)O)N Amb10068479 [1,1,0,0,0,0|1,0,1]=4 2339 B9R0.7 NC(=O)SC[C@H](C(=O)O)N Amb10072293 [1,1,0,0,0,0|1,0,1]=4 2340 B9R0.7 NC(=O)SC[C@H](N)C(O)=O Amb22735296 [1,1,0,0,0,0|1,0,1]=4 2341 B9R0.7 NC(CCB(O)O)C(O)=O Amb22497480 [1,1,0,0,0,0|2,0,0]=4 2342 B9R0.7 NC(CCC(=O)Br)C(O)=O Amb25224344 [1,1,0,0,0,0|1,0,1]=4 2343 B9R0.7 NC(CCC(O)=O)C(O)=O Amb22350008 [1,1,0,0,0,0|1,0,1]=4 2344 B9R0.7 NC(CCC(O)=O)C(O)=O Amb22350165 [1,1,0,0,0,0|1,0,1]=4 2345 B9R0.7 NC(CCC(O)=O)[13C](O)=O Amb22367384 [1,1,0,0,0,0|1,0,1]=4 2346 B9R0.7 NC(CCC(O)=S)C(O)=O Amb25039924 [1,1,0,0,0,0|1,0,1]=4 2347 B9R0.7 NC(CCP(O)=O)C(O)=O Amb25276313 [1,1,0,0,0,0|2,0,0]=4 2348 B9R0.7 NC(CCS(O)=O)C(O)=O Amb22349645 [1,1,0,0,0,0|2,0,0]=4 2349 B9R0.7 NC(CC[13C](O)=O)C(O)=O Amb22366853 [1,1,0,0,0,0|1,0,1]=4 2350 B9R0.7 N[13C](=O)CC[C@@H](C(=O)O)N Amb17614783 [1,1,0,0,0,0|0,0,1]=3 2351 B9R0.7 N[13C](=O)[13CH2][13CH2][13C@H](N)[13C](O)=O Amb22367371 [1,1,0,0,0,0|0,0,1]=3 2352 B9R0.7 N[C@@H](CCC(=O)Br)C(O)=O Amb25123825 [1,1,0,0,0,0|1,0,1]=4 2353 B9R0.7 N[C@@H](CCC(=O)Cl)C(O)=O Amb25065344 [1,1,0,0,0,0|1,0,1]=4 2354 B9R0.7 N[C@@H](CCC(O)=O)[13C](O)=O Amb22353662 [1,1,0,0,0,0|1,0,1]=4 2355 B9R0.7 N[C@@H](CCC(O)=S)C(O)=O Amb24480492 [1,1,0,0,0,0|1,0,1]=4 2356 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22338524 [1,1,0,0,0,0|1,0,1]=4 2357 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22350063 [1,1,0,0,0,0|1,0,1]=4 2358 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22800016 [1,1,0,0,0,0|1,0,1]=4 2359 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22801488 [1,1,0,0,0,0|1,0,1]=4 2360 B9R0.7 N[C@@H](CCP(O)=O)C(O)=O Amb22904307 [1,1,0,0,0,0|2,0,0]=4 2361 B9R0.7 N[C@@H](CC[N+]([O-])=O)C(O)=O Amb25227987 [1,1,0,0,0,0|2,0,0]=4 2362 B9R0.7 N[C@@H](CSC(F)F)C(O)=O Amb18180315 [1,1,0,0,0,0|2,0,0]=4 2363 B9R0.7 N[C@@H]([13CH2]CC(O)=O)C(O)=O Amb22338711 [1,1,0,0,0,0|1,0,1]=4 2364 B9R0.7 N[C@H](C(=O)O)CCC(C)C Amb16183866 [1,1,0,0,0,0|0,0,0]=2 2365 B9R0.7 N[C@H](C(=O)O)CC[S+](C)C Amb10601599 [1,1,0,0,0,0|1,0,0]=3 2366 B9R0.7 N[C@H](CCS(O)=O)C(O)=O Amb24099404 [1,1,0,0,0,0|2,0,0]=4 2367 B9R0.7 OC(=O)CCC(C(=O)O)N Amb1778181 [1,1,0,0,0,0|1,0,1]=4 2368 B9R0.7 [15NH2]C(=O)CC[C@@H](C(=O)O)N Amb17614782 [1,1,0,0,0,0|0,0,1]=3 2369 B9R0.7 [15NH2]C(=O)CC[C@H]([15NH2])C(O)=O Amb22338766 [1,1,0,0,0,0|0,0,1]=3 2370 B9R0.7 [15NH2]C(CCC(O)=O)C(O)=O Amb22336520 [1,1,0,0,0,0|1,0,1]=4 2371 B9R0.7 [15NH2][13C@@H]([13CH2][13CH2][13C](O)=O)[13C](O)=O Amb22353585 [1,1,0,0,0,0|1,0,1]=4 2372 B9R0.7 [15NH2][13C](=O)[13CH2][13CH2][13C@H]([15NH2])[13C](O)=O Amb22353586 [1,1,0,0,0,0|0,0,1]=3 2373 B9R0.13 C=CC(SCCN)C(O)=O Amb24481158 [1,1,0,0,0,0|2,0,0]=4 2374 B9R0.13 CCC(CCCBr)C(O)=O Amb18131058 [1,1,0,0,0,0|2,0,0]=4 2375 B9R0.13 CCC(CCCCl)C(O)=O Amb24480523 [1,1,0,0,0,0|2,0,0]=4 2376 B9R0.13 CCC(CCCF)C(O)=O Amb25104466 [1,1,0,0,0,0|2,0,0]=4 2377 B9R0.13 CCC(CCCN)C(O)=O Amb25703115 [1,1,0,0,0,0|1,0,0]=3 2378 B9R0.13 CCC(CCOC)C(O)=O Amb25289946 [1,1,0,0,0,0|2,0,0]=4 2379 B9R0.13 CCC(CCSC)C(O)=O Amb24373794 [1,1,0,0,0,0|2,0,0]=4 2380 B9R0.13 CCC(CSCC)C(O)=O Amb24482439 [1,1,0,0,0,0|2,0,0]=4 2381 B9R0.13 CCC(OCCN)C(O)=O Amb18111197 [1,1,0,0,0,0|2,0,0]=4 2382 B9R0.13 CCC(SCCN)C(O)=O Amb18788222 [1,1,0,0,0,0|2,0,0]=4 2383 B9R0.13 CCCCC(=CBr)C(O)=O Amb25025162 [1,1,0,0,0,0|1,0,1]=4 2384 B9R0.13 CCCCC(C#C)C(O)=O Amb25122141 [1,1,0,0,0,0|1,0,0]=3 2385 B9R0.13 CCCCC(C#N)C(C)=O Amb24647883 [1,1,0,0,0,0|1,0,1]=4 2386 B9R0.13 CCCCC(C(=O)[O-])CC Amb10807417 [1,1,0,0,0,0|1,0,1]=4 2387 B9R0.13 CCCCC(C=C)C(C)=O Amb24353218 [1,1,0,0,0,0|2,0,0]=4 2388 B9R0.13 CCCCC(C=O)C(C)=O Amb25293767 [1,1,0,0,0,0|2,0,0]=4 2389 B9R0.13 CCCCC(C=O)C(O)=O Amb25132913 [1,1,0,0,0,0|1,0,0]=3 2390 B9R0.13 CCCCC(CC)C(C)=O Amb25049588 [1,1,0,0,0,0|2,0,0]=4 2391 B9R0.13 CCCCC(CC)C(O)=O Amb22232366 [1,1,0,0,0,0|1,0,0]=3 2392 B9R0.13 CCCCC(CC)C(O)=O Amb22334224 [1,1,0,0,0,0|1,0,0]=3 2393 B9R0.13 CCCCC(CC)C(O)=O Amb22337839 [1,1,0,0,0,0|1,0,0]=3 2394 B9R0.13 CCCCC(CC)C(O)=O Amb22351159 [1,1,0,0,0,0|1,0,0]=3 2395 B9R0.13 CCCCC(CC)C(O)=O Amb22351729 [1,1,0,0,0,0|1,0,0]=3 2396 B9R0.13 CCCCC(CC)C(O)=O Amb22351933 [1,1,0,0,0,0|1,0,0]=3 2397 B9R0.13 CCCCC(CC)C(O)=O Amb22363218 [1,1,0,0,0,0|1,0,0]=3 2398 B9R0.13 CCCCC(CC)C([O-])=O Amb22043361 [1,1,0,0,0,0|1,0,1]=4 2399 B9R0.13 CCCCC(CC)C([O-])=O Amb22045502 [1,1,0,0,0,0|1,0,1]=4 2400 B9R0.13 CCCCC(CC)C([O-])=O Amb22045517 [1,1,0,0,0,0|1,0,1]=4 2401 B9R0.13 CCCCC(CC)C([O-])=O Amb22045537 [1,1,0,0,0,0|1,0,1]=4 2402 B9R0.13 CCCCC(CC)C([O-])=O Amb22045545 [1,1,0,0,0,0|1,0,1]=4 2403 B9R0.13 CCCCC(CC)C([O-])=O Amb22045678 [1,1,0,0,0,0|1,0,1]=4 2404 B9R0.13 CCCCC(CC)C([O-])=O Amb22045702 [1,1,0,0,0,0|1,0,1]=4 2405 B9R0.13 CCCCC(CC)C([O-])=O Amb22045706 [1,1,0,0,0,0|1,0,1]=4 2406 B9R0.13 CCCCC(CC)C([O-])=O Amb22045755 [1,1,0,0,0,0|1,0,1]=4 2407 B9R0.13 CCCCC(CC)C([O-])=O Amb22045778 [1,1,0,0,0,0|1,0,1]=4 2408 B9R0.13 CCCCC(CC)C([O-])=O Amb22045868 [1,1,0,0,0,0|1,0,1]=4 2409 B9R0.13 CCCCC(CC)C([O-])=O Amb22052434 [1,1,0,0,0,0|1,0,1]=4 2410 B9R0.13 CCCCC(CC)C([O-])=O Amb22053628 [1,1,0,0,0,0|1,0,1]=4 2411 B9R0.13 CCCCC(CC)C([O-])=O Amb22053638 [1,1,0,0,0,0|1,0,1]=4 2412 B9R0.13 CCCCC(CC)C([O-])=O Amb22053677 [1,1,0,0,0,0|1,0,1]=4 2413 B9R0.13 CCCCC(CC)C([O-])=O Amb22053733 [1,1,0,0,0,0|1,0,1]=4 2414 B9R0.13 CCCCC(CC)C([O-])=O Amb22053863 [1,1,0,0,0,0|1,0,1]=4 2415 B9R0.13 CCCCC(CC)C([O-])=O Amb22054110 [1,1,0,0,0,0|1,0,1]=4 2416 B9R0.13 CCCCC(CC)C([O-])=O Amb22054112 [1,1,0,0,0,0|1,0,1]=4 2417 B9R0.13 CCCCC(CC)C([O-])=O Amb22054129 [1,1,0,0,0,0|1,0,1]=4 2418 B9R0.13 CCCCC(CC)C([O-])=O Amb22054137 [1,1,0,0,0,0|1,0,1]=4 2419 B9R0.13 CCCCC(CC)C([O-])=O Amb22054141 [1,1,0,0,0,0|1,0,1]=4 2420 B9R0.13 CCCCC(CC)C([O-])=O Amb22055551 [1,1,0,0,0,0|1,0,1]=4 2421 B9R0.13 CCCCC(CC)C([O-])=O Amb22234920 [1,1,0,0,0,0|1,0,1]=4 2422 B9R0.13 CCCCC(CC)C([O-])=O Amb22338477 [1,1,0,0,0,0|1,0,1]=4 2423 B9R0.13 CCCCC(CC)C([O-])=O Amb22730062 [1,1,0,0,0,0|1,0,1]=4 2424 B9R0.13 CCCCC(CC)C([O-])=O Amb22730373 [1,1,0,0,0,0|1,0,1]=4 2425 B9R0.13 CCCCC(CC)C([O-])=O Amb22730960 [1,1,0,0,0,0|1,0,1]=4 2426 B9R0.13 CCCCC(CC)C([O-])=O Amb22732748 [1,1,0,0,0,0|1,0,1]=4 2427 B9R0.13 CCCCC(CC)C([O-])=O Amb22732981 [1,1,0,0,0,0|1,0,1]=4 2428 B9R0.13 CCCCC(CO)C(C)=O Amb22234725 [1,1,0,0,0,0|2,0,0]=4 2429 B9R0.13 CCCCC(NC)C(N)=O Amb24116641 [1,1,0,0,0,0|1,0,0]=3 2430 B9R0.13 CCCCC(NC)C(O)=O Amb24116642 [1,1,0,0,0,0|0,0,0]=2 2431 B9R0.13 CCCCC(NN)C(O)=O Amb18644274 [1,1,0,0,0,0|0,0,0]=2 2432 B9R0.13 CCCCC(ON)C(O)=O Amb25140283 [1,1,0,0,0,0|0,0,0]=2 2433 B9R0.13 CCCCC(SC)C(N)=O Amb25801007 [1,1,0,0,0,0|2,0,0]=4 2434 B9R0.13 CCCCC(SC)C(O)=O Amb24478447 [1,1,0,0,0,0|1,0,0]=3 2435 B9R0.13 CCCC[C@@H](C(=O)O)CO Amb16232529 [1,1,0,0,0,0|1,0,0]=3 2436 B9R0.13 CCCC[C@@H](CC)C(N)=O Amb24600233 [1,1,0,0,0,0|2,0,0]=4 2437 B9R0.13 CCCC[C@@H](CO)C(O)=O Amb22745320 [1,1,0,0,0,0|1,0,0]=3 2438 B9R0.13 CCCC[C@@H](NC)C(O)=O Amb22799980 [1,1,0,0,0,0|0,0,0]=2 2439 B9R0.13 CCCC[C@@H](NN)C(O)=O Amb25076236 [1,1,0,0,0,0|0,0,0]=2 2440 B9R0.13 CCCC[C@H](CC)C(C)=O Amb24478140 [1,1,0,0,0,0|2,0,0]=4 2441 B9R0.13 CCCC[C@H](CC)C(O)=O Amb24671282 [1,1,0,0,0,0|1,0,0]=3 2442 B9R0.13 CCCC[C@H](CN)C(O)=O Amb25307811 [1,1,0,0,0,0|0,0,0]=2 2443 B9R0.13 CCCC[C@H](NCl)C(O)=O Amb24482437 [1,1,0,0,0,0|0,0,0]=2 2444 B9R0.13 CCCC\C(=C/Br)\C(O)=O Amb24757714 [1,1,0,0,0,0|1,0,1]=4 2445 B9R0.13 CCCNC(CO)C(O)=O Amb18637569 [1,1,0,0,0,0|2,0,0]=4 2446 B9R0.13 CCCN[C@@H](CO)C(O)=O Amb24351588 [1,1,0,0,0,0|2,0,0]=4 2447 B9R0.13 CCCOC(CN)C(O)=O Amb25827128 [1,1,0,0,0,0|1,0,0]=3 2448 B9R0.13 CCONC(CN)C(O)=O Amb24481161 [1,1,0,0,0,0|2,0,0]=4 2449 B9R0.13 CCSCC(NC)C(N)=O Amb18788145 [1,1,0,0,0,0|2,0,0]=4 2450 B9R0.13 CCSCC(NC)C(O)=O Amb18788225 [1,1,0,0,0,0|1,0,0]=3 2451 B9R0.13 CNC(CCCN)C(O)=O Amb18644280 [1,1,0,0,0,0|0,0,0]=2 2452 B9R0.13 CNC(CCOC)C(N)=O Amb24476849 [1,1,0,0,0,0|2,0,0]=4 2453 B9R0.13 CNC(CCOC)C(O)=O Amb24405197 [1,1,0,0,0,0|1,0,0]=3 2454 B9R0.13 CNC(CCSC)C(N)=O Amb18792442 [1,1,0,0,0,0|2,0,0]=4 2455 B9R0.13 CNC(CCSC)C(O)=O Amb18792506 [1,1,0,0,0,0|1,0,0]=3 2456 B9R0.13 CN[C@@H](CCCN)C(O)=O Amb24584680 [1,1,0,0,0,0|0,0,0]=2 2457 B9R0.13 COCCC(CN)C(O)=O Amb24697893 [1,1,0,0,0,0|1,0,0]=3 2458 B9R0.13 CSCCC(CN)C(O)=O Amb24618199 [1,1,0,0,0,0|1,0,0]=3 2459 B9R0.13 CSCCC(NO)C(N)=O Amb25240562 [1,1,0,0,0,0|2,0,0]=4 2460 B9R0.13 CSCCC(SC)C(O)=O Amb25111182 [1,1,0,0,0,0|2,0,0]=4 2461 B9R0.13 CSCC[C@H](NO)C(O)=O Amb25306086 [1,1,0,0,0,0|1,0,0]=3 2462 B9R0.13 NCCCC(=NO)C(O)=O Amb24655637 [1,1,0,0,0,0|0,0,2]=4 2463 B9R0.13 NCCCC(C#N)C(O)=O Amb25147461 [1,1,0,0,0,0|0,0,1]=3 2464 B9R0.13 NCCCC(CN)C(O)=O Amb25072736 [1,1,0,0,0,0|0,0,0]=2 2465 B9R0.13 NCCCC(NCl)C(O)=O Amb24373822 [1,1,0,0,0,0|0,0,0]=2 2466 B9R0.13 NCCCC(NN)C(O)=O Amb18644331 [1,1,0,0,0,0|0,0,0]=2 2467 B9R0.13 NCCCC(NN)C(O)=O Amb22229924 [1,1,0,0,0,0|0,0,0]=2 2468 B9R0.13 NCCC[C@@H](NN)C(O)=O Amb22801170 [1,1,0,0,0,0|0,0,0]=2 2469 B9R0.13 NCCNC(CS)C(O)=O Amb24482466 [1,1,0,0,0,0|2,0,0]=4 2470 B9R0.13 NCCN[C@H](CS)C(O)=O Amb24334738 [1,1,0,0,0,0|2,0,0]=4 2471 B9R0.42 C=C(CC(N)CN)C(O)=O Amb24502423 [1,1,0,0,0,0|1,0,1]=4 2472 B9R0.42 CC(CC(=O)CN)C(O)=O Amb25758299 [1,1,0,0,0,0|1,0,1]=4 2473 B9R0.42 CC(CC(Br)C(O)=O)CN Amb24478240 [1,1,0,0,0,0|1,0,0]=3 2474 B9R0.42 CC(CC(F)C(O)=O)CN Amb25265347 [1,1,0,0,0,0|1,0,0]=3 2475 B9R0.42 CC(CC(F)C(O)=O)OC Amb25298262 [1,1,0,0,0,0|2,0,0]=4 2476 B9R0.42 CC(CC(N)C(C)=O)CC Amb25747386 [1,1,0,0,0,0|1,0,0]=3 2477 B9R0.42 CC(CC(N)C(N)=O)OC Amb25349298 [1,1,0,0,0,0|2,0,0]=4 2478 B9R0.42 CC(CC(N)C(O)=O)C#C Amb25067277 [1,1,0,0,0,0|0,0,2]=4 2479 B9R0.42 CC(CC(N)C(O)=O)C#N Amb25262927 [1,1,0,0,0,0|0,0,2]=4 2480 B9R0.42 CC(CC(N)C(O)=O)C=C Amb25778211 [1,1,0,0,0,0|0,0,2]=4 2481 B9R0.42 CC(CC(N)C(O)=O)CC Amb18313985 [1,1,0,0,0,0|0,0,0]=2 2482 B9R0.42 CC(CC(N)C(O)=O)CC Amb20667726 [1,1,0,0,0,0|0,0,0]=2 2483 B9R0.42 CC(CC(N)C(O)=O)CCl Amb24480574 [1,1,0,0,0,0|1,0,0]=3 2484 B9R0.42 CC(CC(N)C(O)=O)CO Amb25147300 [1,1,0,0,0,0|1,0,0]=3 2485 B9R0.42 CC(CC(N)C(O)=O)NC Amb24711878 [1,1,0,0,0,0|1,0,0]=3 2486 B9R0.42 CC(CC(N)C(O)=O)OC Amb25147752 [1,1,0,0,0,0|1,0,0]=3 2487 B9R0.42 CC(CC(N)C(O)=O)SC Amb24365891 [1,1,0,0,0,0|1,0,0]=3 2488 B9R0.42 CC(CC(O)C(O)=O)CC Amb25849308 [1,1,0,0,0,0|1,0,0]=3 2489 B9R0.42 CC(CC(O)CN)C(O)=O Amb25375725 [1,1,0,0,0,0|1,0,0]=3 2490 B9R0.42 CC(CC(S)C(O)=O)CC Amb18798152 [1,1,0,0,0,0|1,0,0]=3 2491 B9R0.42 CC(CC(S)C(O)=O)OC Amb24641528 [1,1,0,0,0,0|2,0,0]=4 2492 B9R0.42 CC(CC)OC(F)C(O)=O Amb25043871 [1,1,0,0,0,0|2,0,0]=4 2493 B9R0.42 CC(CN)CC(C)C(O)=O Amb24717285 [1,1,0,0,0,0|1,0,0]=3 2494 B9R0.42 CC(C[C@@H](N)C(O)=O)CC Amb25127143 [1,1,0,0,0,0|0,0,0]=2 2495 B9R0.42 CC(C[C@@H](N)C(O)=O)OC Amb24412403 [1,1,0,0,0,0|1,0,0]=3 2496 B9R0.42 CC(C[C@@H](N)C(O)=O)SC Amb24692660 [1,1,0,0,0,0|1,0,0]=3 2497 B9R0.42 CC(C[C@H](N)C(O)=O)C#C Amb25214668 [1,1,0,0,0,0|0,0,2]=4 2498 B9R0.42 CC(C[C@H](N)C(O)=O)CCl Amb24479195 [1,1,0,0,0,0|1,0,0]=3 2499 B9R0.42 CC(OC(C)CN)C(O)=O Amb18110542 [1,1,0,0,0,0|2,0,0]=4 2500 B9R0.42 CC(SC(C)CN)C(O)=O Amb25096975 [1,1,0,0,0,0|2,0,0]=4 2501 B9R0.42 CCC(=C)CC(C)C(O)=O Amb25342029 [1,1,0,0,0,0|1,0,1]=4 2502 B9R0.42 CCC(=C)CC(N)C(N)=O Amb24429018 [1,1,0,0,0,0|1,0,1]=4 2503 B9R0.42 CCC(=C)CC(O)C(O)=O Amb25200851 [1,1,0,0,0,0|1,0,1]=4 2504 B9R0.42 CCC(=C)C[C@H](C)C(O)=O Amb24384990 [1,1,0,0,0,0|1,0,1]=4 2505 B9R0.42 CCC(=C)C[C@H](N)C(O)=O Amb25694434 [1,1,0,0,0,0|0,0,1]=3 2506 B9R0.42 CCC(=O)CC(N)C(N)=O Amb25129863 [1,1,0,0,0,0|1,0,1]=4 2507 B9R0.42 CCC(=O)CC(N)C(O)=O Amb22546324 [1,1,0,0,0,0|0,0,1]=3 2508 B9R0.42 CCC(=O)CC(N)C(O)=O Amb24479073 [1,1,0,0,0,0|0,0,1]=3 2509 B9R0.42 CCC(=O)C[C@@H](C)C(O)=O Amb24680887 [1,1,0,0,0,0|1,0,1]=4 2510 B9R0.42 CCC(=O)C[C@H](N)C(O)=O Amb24479266 [1,1,0,0,0,0|0,0,1]=3 2511 B9R0.42 CCC(C)CC(C)C(C)=O Amb25056188 [1,1,0,0,0,0|2,0,0]=4 2512 B9R0.42 CCC(C)CC(C)C(O)=O Amb22228338 [1,1,0,0,0,0|1,0,0]=3 2513 B9R0.42 CCC(C)N[C@@H](C)C(O)=O Amb25691180 [1,1,0,0,0,0|2,0,0]=4 2514 B9R0.42 CCC(C)N[C@H](C)C(O)=O Amb24375136 [1,1,0,0,0,0|2,0,0]=4 2515 B9R0.42 CCC(C)OC(C)C(O)=O Amb25357779 [1,1,0,0,0,0|2,0,0]=4 2516 B9R0.42 CCC(Cl)CC(N)C(O)=O Amb24374416 [1,1,0,0,0,0|0,0,0]=2 2517 B9R0.42 CCC(O)CC(N)C(O)=O Amb24117068 [1,1,0,0,0,0|0,0,0]=2 2518 B9R0.42 CCC(O)C[C@H](N)C(O)=O Amb24759913 [1,1,0,0,0,0|0,0,0]=2 2519 B9R0.42 CCN(C)CC(Cl)C(O)=O Amb25713950 [1,1,0,0,0,0|2,0,0]=4 2520 B9R0.42 CCN(C)CC(O)C(O)=O Amb25367420 [1,1,0,0,0,0|2,0,0]=4 2521 B9R0.42 CCN(O)CC(O)C(O)=O Amb24699297 [1,1,0,0,0,0|2,0,0]=4 2522 B9R0.42 CCS(=N)CC(N)C(O)=O Amb25046702 [1,1,0,0,0,0|1,0,0]=3 2523 B9R0.42 CCS(=N)C[C@H](N)C(O)=O Amb24502175 [1,1,0,0,0,0|1,0,0]=3 2524 B9R0.42 CCS(=O)CC(C)C(O)=O Amb19012076 [1,1,0,0,0,0|2,0,0]=4 2525 B9R0.42 CC[C@@H](C)C[C@H](C)C(O)=O Amb24426532 [1,1,0,0,0,0|1,0,0]=3 2526 B9R0.42 CC[C@@H](F)C[C@H](N)C(O)=O Amb25147291 [1,1,0,0,0,0|0,0,0]=2 2527 B9R0.42 CC[C@H](C)CC(=C)C(O)=O Amb25367282 [1,1,0,0,0,0|1,0,1]=4 2528 B9R0.42 CC[C@H](C)CC(C)C(C)=O Amb25821401 [1,1,0,0,0,0|2,0,0]=4 2529 B9R0.42 CC[C@H](C)C[C@@H](C)C(O)=O Amb24480420 [1,1,0,0,0,0|1,0,0]=3 2530 B9R0.42 CNC(=O)C[C@@H](N)C(O)=O Amb20240891 [1,1,0,0,0,0|1,0,1]=4 2531 B9R0.42 CNC(=O)C[C@H](N)C(O)=O Amb20242140 [1,1,0,0,0,0|1,0,1]=4 2532 B9R0.42 CNC(C)CC(C)C(O)=O Amb25291515 [1,1,0,0,0,0|2,0,0]=4 2533 B9R0.42 COC(=O)CC(N)C(O)=O Amb22489498 [1,1,0,0,0,0|1,0,1]=4 2534 B9R0.42 COC(=O)C[C@@H](C(=O)O)N Amb13884879 [1,1,0,0,0,0|1,0,1]=4 2535 B9R0.42 COC(=O)C[C@@H](N)C(O)=O Amb22745861 [1,1,0,0,0,0|1,0,1]=4 2536 B9R0.42 CO[C@@H](C)C[C@H](C)C(O)=O Amb24691586 [1,1,0,0,0,0|2,0,0]=4 2537 B9R0.42 C[C@@H](C[C@@H](N)C(O)=O)CC Amb25844637 [1,1,0,0,0,0|0,0,0]=2 2538 B9R0.42 C[C@@H](C[C@H](N)C(O)=O)C=C Amb25727679 [1,1,0,0,0,0|0,0,2]=4 2539 B9R0.42 C[C@@H](C[C@H](N)C(O)=O)CC Amb24619367 [1,1,0,0,0,0|0,0,0]=2 2540 B9R0.42 C[C@@H](C[C@H](N)C(O)=O)CF Amb25147611 [1,1,0,0,0,0|1,0,0]=3 2541 B9R0.42 C[C@@H](C[C@H](O)CN)C(O)=O Amb24447195 [1,1,0,0,0,0|1,0,0]=3 2542 B9R0.42 C[C@@H](NC(C)CN)C(O)=O Amb25291159 [1,1,0,0,0,0|2,0,0]=4 2543 B9R0.42 C[C@H](C[C@@H](N)C(O)=O)CC Amb25738618 [1,1,0,0,0,0|0,0,0]=2 2544 B9R0.42 C[C@H](C[C@H](C)CO)C(O)=O Amb24480419 [1,1,0,0,0,0|2,0,0]=4 2545 B9R0.42 C[C@H](C[C@H](N)C(O)=O)C#N Amb24529159 [1,1,0,0,0,0|0,0,2]=4 2546 B9R0.42 C[C@H](C[C@H](N)C(O)=O)C=C Amb24561660 [1,1,0,0,0,0|0,0,2]=4 2547 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CC Amb25662528 [1,1,0,0,0,0|0,0,0]=2 2548 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CF Amb25378691 [1,1,0,0,0,0|1,0,0]=3 2549 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CO Amb25378739 [1,1,0,0,0,0|1,0,0]=3 2550 B9R0.42 C[C@H](C[C@H](N)C(O)=O)SC Amb25848560 [1,1,0,0,0,0|1,0,0]=3 2551 B9R0.42 C[C@H](C[C@H](O)C(O)=O)CC Amb24446982 [1,1,0,0,0,0|1,0,0]=3 2552 B9R0.42 C\C(\CC(N)C(O)=O)=C/C Amb24587021 [1,1,0,0,0,0|0,0,2]=4 2553 B9R0.42 C\C(\C[C@H](N)C(O)=O)=C\C Amb24746992 [1,1,0,0,0,0|0,0,2]=4 2554 B9R0.42 NC(CC(=O)CBr)C(O)=O Amb24477386 [1,1,0,0,0,0|1,0,1]=4 2555 B9R0.42 NC(CC(=O)CCl)C(O)=O Amb24061070 [1,1,0,0,0,0|1,0,1]=4 2556 B9R0.42 NC(CC(=O)CO)C(O)=O Amb18644310 [1,1,0,0,0,0|1,0,1]=4 2557 B9R0.42 NC(CC(F)CN)C(O)=O Amb24709973 [1,1,0,0,0,0|0,0,0]=2 2558 B9R0.42 NC(CC(O)CCl)C(O)=O Amb20179638 [1,1,0,0,0,0|1,0,0]=3 2559 B9R0.42 NC(CC(O)CO)C(O)=O Amb18644388 [1,1,0,0,0,0|1,0,0]=3 2560 B9R0.42 NC(CC(O)CO)C(O)=O Amb24117285 [1,1,0,0,0,0|1,0,0]=3 2561 B9R0.42 NCC(=O)CC(F)C(O)=O Amb25367166 [1,1,0,0,0,0|1,0,1]=4 2562 B9R0.42 NCC(=O)CC(N)C(O)=O Amb24462002 [1,1,0,0,0,0|0,0,1]=3 2563 B9R0.42 NCC(=O)C[C@H](N)C(O)=O Amb25757838 [1,1,0,0,0,0|0,0,1]=3 2564 B9R0.42 NC[C@H](O)C[C@H](O)C(O)=O Amb24383534 [1,1,0,0,0,0|1,0,0]=3 2565 B9R0.42 NNC(=O)C[C@H](N)C(O)=O Amb24680907 [1,1,0,0,0,0|1,0,1]=4 2566 B9R0.42 N[C@@H](CC(=O)CBr)C(O)=O Amb24477399 [1,1,0,0,0,0|1,0,1]=4 2567 B9R0.42 N[C@@H](CC(F)CO)C(O)=O Amb24079182 [1,1,0,0,0,0|1,0,0]=3 2568 B9R0.42 N[C@@H](CC(O)CN)C(O)=O Amb24455060 [1,1,0,0,0,0|0,0,0]=2 2569 B9R0.42 N[C@@H](C[C@@H](O)C=O)C(O)=O Amb25367252 [1,1,0,0,0,0|1,0,1]=4 2570 B9R0.42 N[C@@H](C[C@@H](O)CN)C(O)=O Amb25320209 [1,1,0,0,0,0|0,0,0]=2 2571 B9R0.42 N[C@@H](C[C@@H](O)CO)C(O)=O Amb24680903 [1,1,0,0,0,0|1,0,0]=3 2572 B9R0.42 N[C@@H](C[C@H](O)CCl)C(O)=O Amb25265266 [1,1,0,0,0,0|1,0,0]=3 2573 B9R0.42 N[C@@H](C[C@H](O)CN)C(O)=O Amb24446199 [1,1,0,0,0,0|0,0,0]=2 2574 B9R0.42 N[C@H](C[C@@H](O)CN)C(O)=O Amb24480730 [1,1,0,0,0,0|0,0,0]=2 2575 B9R0.42 N[C@H](C[C@H](O)CN)C(O)=O Amb25147418 [1,1,0,0,0,0|0,0,0]=2 2576 B9R0.42 OCC(O)CC(O)C(O)=O Amb18644410 [1,1,0,0,0,0|2,0,0]=4 2577 B9R0.42 OC[C@@H](O)C[C@@H](O)C(O)=O Amb25227512 [1,1,0,0,0,0|2,0,0]=4 2578 B9R0.42 OC[C@@H](O)C[C@H](O)C(O)=O Amb25336564 [1,1,0,0,0,0|2,0,0]=4 2579 B9R0.42 OC[C@H](O)C[C@@H](O)C(O)=O Amb25774509 [1,1,0,0,0,0|2,0,0]=4 2580 B9R0.51 CC(C(=O)O)(CCCC)O Amb17593657 [1,1,0,0,0,0|1,0,0]=3 2581 B9R0.51 CC(C)(CCCBr)C(O)=O Amb18131057 [1,1,0,0,0,0|2,0,0]=4 2582 B9R0.51 CC(C)(CCCS)C(O)=O Amb25699465 [1,1,0,0,0,0|2,0,0]=4 2583 B9R0.51 CC(C)(NCCN)C(O)=O Amb19015473 [1,1,0,0,0,0|2,0,0]=4 2584 B9R0.51 CC(C)(OCCN)C(O)=O Amb18110232 [1,1,0,0,0,0|2,0,0]=4 2585 B9R0.51 CC(N)(CCC=C)C(O)=O Amb24524526 [1,1,0,0,0,0|0,0,2]=4 2586 B9R0.51 CC(N)(CCCN)C(N)=O Amb24583159 [1,1,0,0,0,0|1,0,0]=3 2587 B9R0.51 CC(N)(CCCN)C(O)=O Amb18644277 [1,1,0,0,0,0|0,0,0]=2 2588 B9R0.51 CC(N)(CCCO)C(N)=O Amb24353259 [1,1,0,0,0,0|2,0,0]=4 2589 B9R0.51 CC(N)(CCCO)C(O)=O Amb24061058 [1,1,0,0,0,0|1,0,0]=3 2590 B9R0.51 CC(N)(\C=C\CN)C(O)=O Amb24669995 [1,1,0,0,0,0|0,0,2]=4 2591 B9R0.51 CC(O)(CCCN)C(O)=O Amb25380779 [1,1,0,0,0,0|1,0,0]=3 2592 B9R0.51 CCCCC(C)(C)C(=O)Cl Amb24705541 [1,1,0,0,0,0|2,0,0]=4 2593 B9R0.51 CCCCC(C)(C)C(C)=O Amb25302438 [1,1,0,0,0,0|2,0,0]=4 2594 B9R0.51 CCCCC(C)(C)C(N)=O Amb25798396 [1,1,0,0,0,0|2,0,0]=4 2595 B9R0.51 CCCCC(C)(Cl)C(O)=O Amb24373145 [1,1,0,0,0,0|1,0,0]=3 2596 B9R0.51 CCCCC(C)(F)C(O)=O Amb24444856 [1,1,0,0,0,0|1,0,0]=3 2597 B9R0.51 CCCCC(C)(N)C(N)=O Amb25321316 [1,1,0,0,0,0|1,0,0]=3 2598 B9R0.51 CCCCC(F)(F)C(O)=O Amb19929267 [1,1,0,0,0,0|1,0,0]=3 2599 B9R0.51 CCCCC(F)(F)C([O-])=O Amb22008194 [1,1,0,0,0,0|1,0,1]=4 2600 B9R0.51 CCCC[C@@](C)(F)C(O)=O Amb24622375 [1,1,0,0,0,0|1,0,0]=3 2601 B9R0.51 CCCC[C@@](C)(N)C(O)=O Amb19929613 [1,1,0,0,0,0|0,0,0]=2 2602 B9R0.51 CCCOC(C)(C)C(O)=O Amb18305285 [1,1,0,0,0,0|2,0,0]=4 2603 B9R0.51 CCCOC(C)(O)C(O)=O Amb25341784 [1,1,0,0,0,0|2,0,0]=4 2604 B9R0.51 CCCSC(C(=O)O)(C)C Amb17501481 [1,1,0,0,0,0|2,0,0]=4 2605 B9R0.51 CCNCC(C)(C)C(O)=O Amb25232529 [1,1,0,0,0,0|2,0,0]=4 2606 B9R0.51 CCSCC(C)(N)C(N)=O Amb18788144 [1,1,0,0,0,0|2,0,0]=4 2607 B9R0.51 CCSCC(C)(N)C(O)=O Amb18788224 [1,1,0,0,0,0|1,0,0]=3 2608 B9R0.51 CCSCC(C)(O)C(O)=O Amb18646119 [1,1,0,0,0,0|2,0,0]=4 2609 B9R0.51 CCSC[C@](C)(N)C(O)=O Amb24390760 [1,1,0,0,0,0|1,0,0]=3 2610 B9R0.51 COCCC(C)(C)C(O)=O Amb19029437 [1,1,0,0,0,0|2,0,0]=4 2611 B9R0.51 COCCC(C)(N)C(N)=O Amb24478104 [1,1,0,0,0,0|2,0,0]=4 2612 B9R0.51 COCCC(C)(N)C(O)=O Amb23580585 [1,1,0,0,0,0|1,0,0]=3 2613 B9R0.51 COCCC(C)(O)C(O)=O Amb23454643 [1,1,0,0,0,0|2,0,0]=4 2614 B9R0.51 COCC[C@@](C)(N)C(O)=O Amb24664972 [1,1,0,0,0,0|1,0,0]=3 2615 B9R0.51 CSCCC(C(=O)O)(C)C Amb10844081 [1,1,0,0,0,0|2,0,0]=4 2616 B9R0.51 CSCCC(C)(N)C(N)=O Amb18788148 [1,1,0,0,0,0|2,0,0]=4 2617 B9R0.51 CSCC[C@@](C)(N)C(O)=O Amb24482190 [1,1,0,0,0,0|1,0,0]=3 2618 B9R0.51 C[C@](N)(CCC=C)C(O)=O Amb24478852 [1,1,0,0,0,0|0,0,2]=4 2619 B9R0.51 C[C@](N)(CCCN)C(O)=O Amb24480786 [1,1,0,0,0,0|0,0,0]=2 2620 B9R0.51 C\C=C\C[C@@](C)(N)C(O)=O Amb25147509 [1,1,0,0,0,0|0,0,2]=4 2621 B9R0.51 NC(N)(CCCO)C(O)=O Amb25300624 [1,1,0,0,0,0|1,0,0]=3 2622 B9R0.51 NCCCC(Br)(Br)C(O)=O Amb25120084 [1,1,0,0,0,0|1,0,0]=3 2623 B9R0.51 NCCCC(C(=O)O)(Cl)Cl Amb17594797 [1,1,0,0,0,0|1,0,0]=3 2624 B9R0.51 NCCSC(C(=O)O)(C)C Amb17500467 [1,1,0,0,0,0|2,0,0]=4 2625 B9R0.51 NCCSC(F)(F)C(O)=O Amb25708043 [1,1,0,0,0,0|2,0,0]=4 2626 B9R0.51 OC(=O)C(Cl)(Cl)CCCCl Amb25075193 [1,1,0,0,0,0|2,0,0]=4 2627 B9R0.51 OCCCC(F)(F)C(O)=O Amb24652882 [1,1,0,0,0,0|2,0,0]=4 2628 B9R0.51 [2H]C(N)(CCSC)C(O)=O Amb22367539 [1,1,0,0,0,0|1,0,0]=3 2629 B9R0.51 [2H]C([2H])(CCCC)C(O)=O Amb22338412 [1,1,0,0,0,0|1,0,0]=3 2630 B11R0.2 CCCCCCC(CC(=O)O)N Amb2229636 [0,1,0,0,0,1|1,0,0]=3 2631 B11R0.2 CCCCCCC(O)CC(O)=O Amb18803982 [0,1,0,0,0,1|2,0,0]=4 2632 B11R0.107 CCC(C)CCC(C)CC(O)=O Amb22229103 [0,1,0,0,0,1|2,0,0]=4 2633 B11R0.154 CCCCCC(O)CC(=O)OC Amb21928835 [0,1,0,0,0,1|2,0,0]=4 2634 B11R0.324 CCCCCC(C)(C)CC(O)=O Amb22229020 [0,1,0,0,0,1|2,0,0]=4 2635 B11R0.324 NCCCCS(=O)(=O)CC(=O)O Amb17501019 [0,1,0,0,0,1|2,0,0]=4 2636 B11R0.33 CC(CC(C)N)CC(C)C(O)=O Amb22364544 [0,2,0,0,0,0|1,0,0]=3 2637 B11R0.125 NCCCCSC(C(=O)O)(C)C Amb17500971 [0,2,0,0,0,0|1,0,0]=3 2638 B11R0.125 [2H]C([2H])(CCCCCC)C(O)=O Amb21928955 [0,2,0,0,0,0|2,0,0]=4 2639 B11R0.329 CCCCCC(C)(CC)C(O)=O Amb18803025 [0,2,0,0,0,0|2,0,0]=4 2640 B11R0.29 CC(=N)NCCC[C@@H](N)C(O)=O Amb19132784 [0,2,0,0,0,0|0,0,2]=4 2641 B11R0.29 NC(=N)NCCCC(C(=O)O)N Amb1151252 [0,2,0,0,0,0|0,0,1]=3 2642 B11R0.29 NC(=N)NCCCC(N)C(O)=O Amb22349947 [0,2,0,0,0,0|0,0,1]=3 2643 B11R0.29 NC(=N)NCCCC(O)C(O)=O Amb22730085 [0,2,0,0,0,0|1,0,1]=4 2644 B11R0.29 NC(=N)NCCC[C@@H](C(=O)N)N Amb16232536 [0,2,0,0,0,0|1,0,1]=4 2645 B11R0.29 NC(=N)NCCC[C@@H](N)C(O)=O Amb22745064 [0,2,0,0,0,0|0,0,1]=3 2646 B11R0.29 NC(=N)NCCC[C@@H](N)C(O)=O Amb22745189 [0,2,0,0,0,0|0,0,1]=3 2647 B11R0.29 NC(=N)NCCC[C@@H](N)C(O)=O Amb22745210 [0,2,0,0,0,0|0,0,1]=3 2648 B11R0.29 NC(=N)NCCC[C@@H](N)C(O)=O Amb22745478 [0,2,0,0,0,0|0,0,1]=3 2649 B11R0.29 NC(=N)NCCC[C@@H](N)C(O)=O Amb22745921 [0,2,0,0,0,0|0,0,1]=3 2650 B11R0.29 NC(=N)NCCC[C@@H](N)C(O)=O Amb22748687 [0,2,0,0,0,0|0,0,1]=3 2651 B11R0.29 NC(=N)NCCC[C@@H](N)C(O)=O Amb22801409 [0,2,0,0,0,0|0,0,1]=3 2652 B11R0.29 NC(=N)NOCCC(N)C(O)=O Amb22261558 [0,2,0,0,0,0|1,0,1]=4 2653 B11R0.29 NC(=N)NOCC[C@@H](C(=O)O)N Amb10843206 [0,2,0,0,0,0|1,0,1]=4 2654 B11R0.29 NC(=N)NOCC[C@H](N)C(O)=O Amb22338123 [0,2,0,0,0,0|1,0,1]=4 2655 B11R0.29 NC(=O)NCCCC(N)C([O-])=O Amb22330608 [0,2,0,0,0,0|0,0,2]=4 2656 B11R0.29 NC(=O)NCCC[C@@H](N)C(O)=O Amb22744872 [0,2,0,0,0,0|0,0,1]=3 2657 B11R0.29 NC(=O)NCCC[C@H](N)C(=O)S Amb19930603 [0,2,0,0,0,0|0,1,1]=4 2658 B11R0.29 NC(=O)NCCC[C@H](N)C(O)=O Amb22169596 [0,2,0,0,0,0|0,0,1]=3 2659 B11R0.29 NC(=O)[C@@H](N)CCCNC(N)=N Amb22899566 [0,2,0,0,0,0|1,0,1]=4 2660 B11R0.29 NC(=S)NCCCC(N)C(O)=O Amb22470953 [0,2,0,0,0,0|0,0,1]=3 2661 B11R0.29 NC(=S)NCCC[C@@H](N)C(O)=O Amb22799910 [0,2,0,0,0,0|0,0,1]=3 2662 B11R0.29 NC(CSCCC(O)=O)C(O)=O Amb22734793 [0,2,0,0,0,0|1,0,1]=4 2663 B11R0.29 NC(N)=NCCCC(N)C(O)=O Amb19866551 [0,2,0,0,0,0|0,0,1]=3 2664 B11R0.29 N[13C](=N)N[13CH2][13CH2][13CH2][13C@H](N)[13C](O)=O Amb22337496 [0,2,0,0,0,0|0,0,1]=3 2665 B11R0.29 N[C@@H](CCCCB(O)O)C(O)=O Amb22747786 [0,2,0,0,0,0|1,0,0]=3 2666 B11R0.29 N[C@@H](CCCCC(O)=O)C(O)=O Amb22746360 [0,2,0,0,0,0|1,0,0]=3 2667 B11R0.29 N[C@@H](CCCNC(N)=N)C(O)=O Amb17942890 [0,2,0,0,0,0|0,0,1]=3 2668 B11R0.29 N[C@@H](CCCNC(N)=N)C(O)=O Amb17942891 [0,2,0,0,0,0|0,0,1]=3 2669 B11R0.29 OC(=O)CCCCC(C(=O)O)C Amb10844066 [0,2,0,0,0,0|2,0,0]=4 2670 B11R0.29 OC(=O)CCSC[C@@H](C(=O)O)N Amb17610546 [0,2,0,0,0,0|1,0,1]=4 2671 B11R0.29 [15NH2]C(=[15NH])[15NH]CCC[C@H]([15NH2])C(O)=O Amb22353583 [0,2,0,0,0,0|0,0,1]=3 2672 B11R0.42 C=CCCCCC[C@@H](N)C(O)=O Amb22745701 [0,2,0,0,0,0|1,0,0]=3 2673 B11R0.42 CCCCCCCC(Br)C(O)=O Amb21520353 [0,2,0,0,0,0|2,0,0]=4 2674 B11R0.42 CCCCCCCC(C(=O)O)N Amb2229635 [0,2,0,0,0,0|1,0,0]=3 2675 B11R0.42 CCCCCCCC(C)C(O)=O Amb18794410 [0,2,0,0,0,0|2,0,0]=4 2676 B11R0.42 CCCCCCCC(O)C(O)=O Amb18790307 [0,2,0,0,0,0|2,0,0]=4 2677 B11R0.42 CCCCCCC[C@@H](N)C(O)=O Amb22747720 [0,2,0,0,0,0|1,0,0]=3 2678 B11R0.42 CCCCCSC[C@H](N)C(O)=O Amb22451173 [0,2,0,0,0,0|1,0,0]=3 2679 B11R0.42 CCCCSCC[C@H](C(=O)O)N Amb17610162 [0,2,0,0,0,0|1,0,0]=3 2680 B11R0.42 CCNCCCCC(C(=O)O)N Amb17614099 [0,2,0,0,0,0|0,0,0]=2 2681 B11R0.42 CCOCCNCC(C(=O)O)C Amb13952381 [0,2,0,0,0,0|2,0,0]=4 2682 B11R0.42 CCOCCSC[C@@H](N)C(O)=O Amb19132222 [0,2,0,0,0,0|1,0,0]=3 2683 B11R0.42 C[C@@H](OCCCCC=C)C(O)=O Amb22225166 [0,2,0,0,0,0|2,0,0]=4 2684 B11R0.42 NC(CCCCNC=O)C(O)=O Amb22362874 [0,2,0,0,0,0|0,0,0]=2 2685 B11R0.42 NCCCCCNC(=O)C(O)=O Amb24068947 [0,2,0,0,0,0|1,0,1]=4 2686 B11R0.42 N[C@@H](CCCCNC=O)C(O)=O Amb22799599 [0,2,0,0,0,0|0,0,0]=2 2687 B11R0.76 CCCCCCC(CC)C(O)=O Amb18794406 [0,2,0,0,0,0|2,0,0]=4 2688 B11R0.76 CCCCCCC(O[NH3+])C(O)=O Amb22434188 [0,2,0,0,0,0|1,0,1]=4 2689 B11R0.109 COC(=O)CCC[C@@H](C(=O)O)N Amb13884888 [0,2,0,0,0,0|1,0,1]=4 2690 B11R0.109 COC(=O)CCC[C@@H](N)C(O)=O Amb23437884 [0,2,0,0,0,0|1,0,1]=4 2691 B11R0.109 ONC(=N)NCC[C@@H](C(=O)O)N Amb17615646 [0,2,0,0,0,0|1,0,1]=4 2692 B11R0.141 CCNC(=O)CC[C@@H](N)C(O)=O Amb19134042 [0,2,0,0,0,0|1,0,1]=4 2693 B11R0.141 CCOC(=O)CC[C@@H](N)C(O)=O Amb22745269 [0,2,0,0,0,0|1,0,1]=4 2694 B11R0.142 CCCCCCC(Br)C(=O)OC Amb22002102 [0,2,0,0,0,0|2,0,0]=4 2695 B11R0.142 CCCCCCC(O)C(=O)OC Amb18808375 [0,2,0,0,0,0|2,0,0]=4 2696 B11R0.218 NCCCS(=O)(=O)C(C(=O)O)C Amb17500781 [0,2,0,0,0,0|2,0,0]=4 2697 B11R0.150 NC(C(=O)O)CCC(C(=O)O)N Amb10602546 [0,2,0,0,0,0|1,0,1]=4 2698 B11R0.150 NC(C(=O)O)CCC(C(=O)O)N Amb17594468 [0,2,0,0,0,0|1,0,1]=4 2699 B11R0.150 N[C@@H](CC[C@H](O)C(F)F)C(O)=O Amb19148323 [0,2,0,0,0,0|1,0,0]=3 2700 B11R0.150 N[C@H](C(=O)O)CC[C@H](C(=O)O)N Amb10603182 [0,2,0,0,0,0|1,0,1]=4 2701 B11R0.302 CCC(C)(C)SC[C@@H](N)C(O)=O Amb22750563 [0,2,0,0,0,0|2,0,0]=4 2702 B11R0.155 CCCCCC(Br)C(=O)OCC Amb22500132 [0,2,0,0,0,0|2,0,0]=4 2703 B11R0.155 CCNC(=O)C(N)CCCCN Amb23443537 [0,2,0,0,0,0|1,0,0]=3 2704 B11R0.155 CCOC(=O)C(Br)CCCCCl Amb24066456 [0,2,0,0,0,0|2,0,0]=4 2705 B11R0.78 CCCC(CCCCC)C(O)=O Amb18794407 [0,2,0,0,0,0|2,0,0]=4 2706 B11R0.78 CCCCC[C@@H](CC#C)C(O)=O Amb22746635 [0,2,0,0,0,0|2,0,0]=4 2707 B11R0.78 CCSCCC(NC=O)C(O)=O Amb24325309 [0,2,0,0,0,0|2,0,0]=4 2708 B11R0.153 CC(C)C(CCCCC)C(O)=O Amb18794409 [0,2,0,0,0,0|2,0,0]=4 2709 B11R0.318 NC(CCCP(O)(O)=O)C(O)=O Amb22352627 [0,2,0,0,0,0|2,0,0]=4 2710 B11R0.318 N[C@H](CCCC(F)(F)F)C(O)=O Amb19889293 [0,2,0,0,0,0|1,0,0]=3 2711 B11R0.318 OC(=O)C(CCCP(=O)(O)O)N Amb17619388 [0,2,0,0,0,0|2,0,0]=4 2712 B11R0.318 [2H]C([2H])([2H])SCCC(N)C(O)=O Amb22336924 [0,2,0,0,0,0|2,0,0]=4 2713 B11R0.318 [2H]C([2H])([2H])SCC[C@@H](N)C(O)=O Amb19133020 [0,2,0,0,0,0|2,0,0]=4 2714 B11R0.318 [2H]C([2H])([2H])SCC[C@H](N)[13C](O)=O Amb22354058 [0,2,0,0,0,0|2,0,0]=4 2715 B11R0.318 [2H][13C]([2H])([2H])SCCC(N)C(O)=O Amb22336376 [0,2,0,0,0,0|2,0,0]=4 2716 B9R1.1 NC1CCC(CC1)CN Amb22491653 [1,0,0,1,0,0|1,0,1]=4 2717 B9R1.1 NC1CCC(CC1)CN Amb22491656 [1,0,0,1,0,0|1,0,1]=4 2718 B9R1.1 NC1CCC(CO)OC1 Amb25260412 [1,0,0,1,0,0|1,0,1]=4 2719 B9R1.1 NCC1CCC(CC1)N Amb16233730 [1,0,0,1,0,0|1,0,1]=4 2720 B9R1.1 N[C@@H]1CC[C@H](CO)C=C1 Amb24443345 [1,0,0,1,0,0|2,0,0]=4 2721 B9R1.1 N[C@H]1CC[C@@H](CO)C=C1 Amb24649717 [1,0,0,1,0,0|2,0,0]=4 2722 B9R1.1 N[C@H]1CC[C@H](CC1)CN Amb24405174 [1,0,0,1,0,0|1,0,1]=4 2723 B9R1.2 C=C[C@H]1CCC[C@H](N)C1 Amb25272193 [1,0,0,1,0,0|2,0,0]=4 2724 B9R1.2 CC1CC(CCC1)C=O Amb22059519 [1,0,0,1,0,0|2,0,0]=4 2725 B9R1.2 CC1CCCC(CO)N1 Amb20090381 [1,0,0,1,0,0|1,0,1]=4 2726 B9R1.2 C[C@@H]1CCC[C@@H](CO)N1 Amb24585706 [1,0,0,1,0,0|1,0,1]=4 2727 B9R1.2 C[C@@H]1CCC[C@H](CO)N1 Amb24647659 [1,0,0,1,0,0|1,0,1]=4 2728 B9R1.2 C[C@H]1CC(CCC1)C=O Amb24648931 [1,0,0,1,0,0|2,0,0]=4 2729 B9R1.2 C[C@H]1CCC[C@@H](CO)N1 Amb25174876 [1,0,0,1,0,0|1,0,1]=4 2730 B9R1.2 NC1CC(CO)CCC1 Amb24426645 [1,0,0,1,0,0|1,0,1]=4 2731 B9R1.2 NC1CN(CCC1)C=O Amb25684164 [1,0,0,1,0,0|2,0,0]=4 2732 B9R1.2 N[C@@H]1C[C@H](CO)CCC1 Amb23385323 [1,0,0,1,0,0|1,0,1]=4 2733 B9R1.2 O=CC1CCCC(F)C1 Amb24541768 [1,0,0,1,0,0|2,0,0]=4 2734 B9R1.2 OC1CC(CCC1)C=O Amb24456710 [1,0,0,1,0,0|2,0,0]=4 2735 B9R1.2 OC1CCCC(C=O)O1 Amb25063184 [1,0,0,1,0,0|2,0,0]=4 2736 B9R1.3 CC1CCCC(Br)C1=O Amb25250808 [1,0,0,1,0,0|2,0,0]=4 2737 B9R1.3 CC1CCCC(C1=O)Cl Amb17593667 [1,0,0,1,0,0|2,0,0]=4 2738 B9R1.3 CC1CCCC(F)C1=O Amb24400707 [1,0,0,1,0,0|2,0,0]=4 2739 B9R1.3 CN1CCCC(N)C1=O Amb18832622 [1,0,0,1,0,0|2,0,0]=4 2740 B9R1.3 CN1CCCC(N)C1=O Amb23440176 [1,0,0,1,0,0|2,0,0]=4 2741 B9R1.3 CN1CCC[C@@H](N)C1=O Amb22745485 [1,0,0,1,0,0|2,0,0]=4 2742 B9R1.3 CN1CCC[C@@H](N)C1=O Amb25709654 [1,0,0,1,0,0|2,0,0]=4 2743 B9R1.3 C[C@@H]1CCC[C@@H](Br)C1=O Amb24582835 [1,0,0,1,0,0|2,0,0]=4 2744 B9R1.3 C[C@@H]1CCC[C@@H](C)C1=O Amb25358874 [1,0,0,1,0,0|2,0,0]=4 2745 B9R1.3 C[C@@H]1[C@H](N)CCC[C@@H]1N Amb25377989 [1,0,0,1,0,0|1,0,1]=4 2746 B9R1.3 C[C@H]1CCC[C@@H](Cl)C1=O Amb25374610 [1,0,0,1,0,0|2,0,0]=4 2747 B9R1.3 C[C@H]1CCC[C@H](Cl)C1=O Amb25257959 [1,0,0,1,0,0|2,0,0]=4 2748 B9R1.3 NC1C(N)CCCC1N Amb24356533 [1,0,0,1,0,0|1,0,1]=4 2749 B9R1.3 NC1CCCC(N)C1O Amb25046672 [1,0,0,1,0,0|0,0,1]=3 2750 B9R1.3 NC1CCCC(O)C1O Amb25800086 [1,0,0,1,0,0|1,0,1]=4 2751 B9R1.3 NC1CCCN(O)C1=O Amb25062670 [1,0,0,1,0,0|2,0,0]=4 2752 B9R1.3 N[C@@H]1CCC[C@@H](O)[C@@H]1O Amb24698018 [1,0,0,1,0,0|1,0,1]=4 2753 B9R1.3 N[C@@H]1CCC[C@@H](O)[C@H]1O Amb22899068 [1,0,0,1,0,0|1,0,1]=4 2754 B9R1.3 N[C@@H]1CCC[C@@H](O)[C@H]1O Amb24117833 [1,0,0,1,0,0|1,0,1]=4 2755 B9R1.3 N[C@@H]1[C@@H](N)CCC[C@H]1N Amb25305090 [1,0,0,1,0,0|1,0,1]=4 2756 B9R1.3 N[C@H]1CCC[C@@H](N)[C@@H]1O Amb25128067 [1,0,0,1,0,0|0,0,1]=3 2757 B9R1.3 O=C1C(Cl)CCCC1Br Amb25119185 [1,0,0,1,0,0|2,0,0]=4 2758 B9R1.3 O=C1C(Cl)CCCC1Cl Amb24480185 [1,0,0,1,0,0|2,0,0]=4 2759 B9R1.3 O=C1C(F)CCCC1Br Amb25276368 [1,0,0,1,0,0|2,0,0]=4 2760 B9R1.3 O=C1C(F)CCCC1F Amb24529058 [1,0,0,1,0,0|2,0,0]=4 2761 B9R1.3 O=C1[C@H](Cl)CCC[C@H]1Cl Amb24617866 [1,0,0,1,0,0|2,0,0]=4 2762 B9R1.3 O=C1[C@H](F)CCC[C@@H]1Cl Amb25241339 [1,0,0,1,0,0|2,0,0]=4 2763 B9R1.3 O=C1[C@H](F)CCC[C@H]1Br Amb25258017 [1,0,0,1,0,0|2,0,0]=4 2764 B9R1.3 O[C@@H]1CCC[C@H](O)C1=O Amb24752475 [1,0,0,1,0,0|2,0,0]=4 2765 B9R1.5 CC1CCCCNC1=N Amb24376734 [1,0,0,1,0,0|2,0,0]=4 2766 B9R1.5 CC1CSCCNC1=O Amb22642303 [1,0,0,1,0,0|2,0,0]=4 2767 B9R1.5 CC1NCCCNC1=O Amb22496434 [1,0,0,1,0,0|2,0,0]=4 2768 B9R1.5 CC1OCCCNC1=O Amb22886655 [1,0,0,1,0,0|2,0,0]=4 2769 B9R1.5 CC1SCCCNC1=O Amb24451182 [1,0,0,1,0,0|2,0,0]=4 2770 B9R1.5 CN1CCCCNC1=O Amb24477807 [1,0,0,1,0,0|2,0,0]=4 2771 B9R1.5 C[C@@H]1CCCCCC1=O Amb25032177 [1,0,0,1,0,0|2,0,0]=4 2772 B9R1.5 C[C@@H]1NCCCNC1=O Amb25733316 [1,0,0,1,0,0|2,0,0]=4 2773 B9R1.5 C[C@H]1CCCCCC1=O Amb24475484 [1,0,0,1,0,0|2,0,0]=4 2774 B9R1.5 C[C@H]1NCCCNC1=O Amb25146171 [1,0,0,1,0,0|2,0,0]=4 2775 B9R1.5 NC1CCCCCC1=O Amb18276126 [1,0,0,1,0,0|1,0,0]=3 2776 B9R1.5 NC1CCCCNC1=O Amb19958477 [1,0,0,1,0,0|0,0,0]=2 2777 B9R1.5 NC1CNCCNC1=O Amb24476665 [1,0,0,1,0,0|1,0,0]=3 2778 B9R1.5 NC1COCCNC1=O Amb24409830 [1,0,0,1,0,0|1,0,0]=3 2779 B9R1.5 NC1CSCCNC1=O Amb25336468 [1,0,0,1,0,0|1,0,0]=3 2780 B9R1.5 NN1CCCCCC1=O Amb22494978 [1,0,0,1,0,0|2,0,0]=4 2781 B9R1.5 NN1CCCCCC1=O Amb22495331 [1,0,0,1,0,0|2,0,0]=4 2782 B9R1.5 N[C@@H]1CCCCC[C@@H]1O Amb1994010 [1,0,0,1,0,0|1,0,1]=4 2783 B9R1.5 N[C@@H]1CCCCC[C@H]1O Amb1994009 [1,0,0,1,0,0|1,0,1]=4 2784 B9R1.5 N[C@@H]1CCCCNC1=O Amb20670688 [1,0,0,1,0,0|0,0,0]=2 2785 B9R1.5 N[C@@H]1CSCCNC1=O Amb19374458 [1,0,0,1,0,0|1,0,0]=3 2786 B9R1.5 N[C@H]1CCCCC[C@H]1O Amb22270235 [1,0,0,1,0,0|1,0,1]=4 2787 B9R1.5 N[C@H]1CCCCNC1=O Amb19929579 [1,0,0,1,0,0|0,0,0]=2 2788 B9R1.5 O=C1CCCCCC1Br Amb18325296 [1,0,0,1,0,0|2,0,0]=4 2789 B9R1.5 O=C1CCCCCC1F Amb21965071 [1,0,0,1,0,0|2,0,0]=4 2790 B9R1.5 O=C1CCCCC[C@H]1F Amb25318902 [1,0,0,1,0,0|2,0,0]=4 2791 B9R1.5 O=C1CCCCNC1=O Amb24056373 [1,0,0,1,0,0|1,0,1]=4 2792 B9R1.5 O=C1NCCCC[C@H]1N Amb10608775 [1,0,0,1,0,0|0,0,0]=2 2793 B9R1.5 O=C1NCCSC[C@@H]1N Amb10067826 [1,0,0,1,0,0|1,0,0]=3 2794 B9R1.5 O=C1OCCCCC1Br Amb24725884 [1,0,0,1,0,0|2,0,0]=4 2795 B9R1.5 OC1CCCCCC1=O Amb25284997 [1,0,0,1,0,0|2,0,0]=4 2796 B9R1.7 NC1CC(CCO)C=C1 Amb24561674 [1,0,0,1,0,0|2,0,0]=4 2797 B9R1.7 N[C@@H]1C[C@H](CCO)C=C1 Amb24745788 [1,0,0,1,0,0|2,0,0]=4 2798 B9R1.11 C=CC(F)C1CCCN1 Amb25358328 [1,0,0,1,0,0|2,0,0]=4 2799 B9R1.11 C=CC(N)C1CCCC1 Amb25798511 [1,0,0,1,0,0|2,0,0]=4 2800 B9R1.11 C=CC(N)C1CCCO1 Amb24476089 [1,0,0,1,0,0|2,0,0]=4 2801 B9R1.11 C=CC(O)C1CCCN1 Amb18642529 [1,0,0,1,0,0|2,0,0]=4 2802 B9R1.11 C=C[C@@H](O)[C@@H]1CCCN1 Amb24584983 [1,0,0,1,0,0|2,0,0]=4 2803 B9R1.11 CC(C=C)C1CCCN1 Amb24754018 [1,0,0,1,0,0|2,0,0]=4 2804 B9R1.11 CC(C=O)C1CCCC1 Amb20668888 [1,0,0,1,0,0|2,0,0]=4 2805 B9R1.11 CC(C=O)C1CCCO1 Amb18642610 [1,0,0,1,0,0|2,0,0]=4 2806 B9R1.11 C[C@H](C=C)[C@@H]1CCCN1 Amb24068265 [1,0,0,1,0,0|2,0,0]=4 2807 B9R1.11 C[C@H](CO)[C@@H]1CCCN1 Amb24713470 [1,0,0,1,0,0|1,0,1]=4 2808 B9R1.11 NC(=NO)C1CCCN1 Amb24749080 [1,0,0,1,0,0|1,0,1]=4 2809 B9R1.11 NC(CO)C1CCCC1 Amb18958311 [1,0,0,1,0,0|1,0,1]=4 2810 B9R1.11 NC(CO)C1CCCO1 Amb24480307 [1,0,0,1,0,0|1,0,1]=4 2811 B9R1.11 N[C@@H](CO)C1CCCC1 Amb25757877 [1,0,0,1,0,0|1,0,1]=4 2812 B9R1.11 N[C@@H](CO)[C@@H]1CCCO1 Amb25360168 [1,0,0,1,0,0|1,0,1]=4 2813 B9R1.11 N[C@H](CO)C1CCCC1 Amb25324301 [1,0,0,1,0,0|1,0,1]=4 2814 B9R1.11 N[C@H](CO)[C@@H]1CCCO1 Amb24515629 [1,0,0,1,0,0|1,0,1]=4 2815 B9R1.11 O=C[C@@H](Br)C1CCCC1 Amb24387988 [1,0,0,1,0,0|2,0,0]=4 2816 B9R1.11 OC(C=O)C1CCCC1 Amb25731162 [1,0,0,1,0,0|2,0,0]=4 2817 B9R1.11 OC(C=O)C1CCCN1 Amb25682582 [1,0,0,1,0,0|1,0,0]=3 2818 B9R1.11 OC(CO)C1CCCN1 Amb24652702 [1,0,0,1,0,0|1,0,1]=4 2819 B9R1.17 NCCCCC1COC1 Amb25178448 [1,0,0,1,0,0|1,0,1]=4 2820 B9R1.20 CCCC[C@@H]1O[C@H]1C=O Amb24562977 [1,0,0,1,0,0|2,0,0]=4 2821 B9R1.20 O=CC1CC1CCCBr Amb25311248 [1,0,0,1,0,0|2,0,0]=4 2822 B9R1.20 O=CC1OC1CCCBr Amb24480119 [1,0,0,1,0,0|2,0,0]=4 2823 B9R1.20 O=C[C@@H]1C[C@H]1CCCBr Amb24519366 [1,0,0,1,0,0|2,0,0]=4 2824 B9R1.20 O=C[C@H]1O[C@@H]1CCCBr Amb25274101 [1,0,0,1,0,0|2,0,0]=4 2825 B9R1.21 C=CC1CCC(CO)N1 Amb25246074 [1,0,0,1,0,0|2,0,0]=4 2826 B9R1.21 CCC1CC(CC1)C=O Amb25312233 [1,0,0,1,0,0|2,0,0]=4 2827 B9R1.21 CCC1CCC(C=O)O1 Amb25790138 [1,0,0,1,0,0|2,0,0]=4 2828 B9R1.21 CCC1CCC(CO)N1 Amb24404906 [1,0,0,1,0,0|1,0,1]=4 2829 B9R1.21 CC[C@@H]1CC[C@H](C=C)N1 Amb25354876 [1,0,0,1,0,0|2,0,0]=4 2830 B9R1.21 CC[C@H]1CC[C@@H](CO)N1 Amb24591178 [1,0,0,1,0,0|1,0,1]=4 2831 B9R1.21 NCC1CN(CC1)C=O Amb18908291 [1,0,0,1,0,0|2,0,0]=4 2832 B9R1.21 NC[C@H]1CC[C@@H](CO)O1 Amb25367672 [1,0,0,1,0,0|1,0,1]=4 2833 B9R1.21 NC[C@H]1CC[C@H](CO)O1 Amb24746153 [1,0,0,1,0,0|1,0,1]=4 2834 B9R1.21 OCC1CCC(C=O)O1 Amb18642773 [1,0,0,1,0,0|2,0,0]=4 2835 B9R1.21 OCC1CCC(CF)N1 Amb24417543 [1,0,0,1,0,0|1,0,1]=4 2836 B9R1.21 OCC1CCC(CO)N1 Amb22728597 [1,0,0,1,0,0|1,0,1]=4 2837 B9R1.21 OC[C@@H]1CCC(C=O)O1 Amb25773392 [1,0,0,1,0,0|2,0,0]=4 2838 B9R1.21 OC[C@@H]1CC[C@@H](C=O)O1 Amb24628915 [1,0,0,1,0,0|2,0,0]=4 2839 B9R1.21 OC[C@@H]1CC[C@@H](CO)N1 Amb24375528 [1,0,0,1,0,0|1,0,1]=4 2840 B9R1.21 OC[C@@H]1CC[C@H](CO)N1 Amb24117031 [1,0,0,1,0,0|1,0,1]=4 2841 B9R1.21 OC[C@H]1CC[C@H](CO)N1 Amb24539840 [1,0,0,1,0,0|1,0,1]=4 2842 B9R1.49 N[C@H]1CCC[C@@H](O)C=C1 Amb24745229 [1,0,0,1,0,0|2,0,0]=4 2843 B9R1.50 NC1CCCCCC=C1 Amb22410845 [1,0,0,1,0,0|2,0,0]=4 2844 B9R1.58 NCCC1CC(CO)C1 Amb25222647 [1,0,0,1,0,0|1,0,1]=4 2845 B9R1.79 CN(CC1CCN1)C=O Amb25178791 [1,0,0,1,0,0|2,0,0]=4 2846 B9R1.79 NC(CC1CCC1)CO Amb24601442 [1,0,0,1,0,0|1,0,1]=4 2847 B9R1.80 NC(CO)CCC1CC1 Amb24715971 [1,0,0,1,0,0|1,0,1]=4 2848 B9R1.80 O=CC(Br)CCC1CC1 Amb24480149 [1,0,0,1,0,0|2,0,0]=4 2849 B9R1.80 OC(CCC1CC1)C=O Amb25846669 [1,0,0,1,0,0|2,0,0]=4 2850 B9R1.88 C=C[C@@H](N)[C@@H]1C[C@@H]1CO Amb25179503 [1,0,0,1,0,0|2,0,0]=4 2851 B9R1.88 C=C[C@@H](N)[C@@H]1C[C@H]1CO Amb25179502 [1,0,0,1,0,0|2,0,0]=4 2852 B9R1.88 C=C[C@@H](N)[C@H]1C[C@H]1CO Amb25322694 [1,0,0,1,0,0|2,0,0]=4 2853 B9R1.88 C=C[C@H](N)[C@@H]1C[C@@H]1CO Amb24623411 [1,0,0,1,0,0|2,0,0]=4 2854 B9R1.88 C=C[C@H](N)[C@H]1C[C@@H]1CO Amb24675829 [1,0,0,1,0,0|2,0,0]=4 2855 B9R1.88 CCC1CC1C(N)C=C Amb25294163 [1,0,0,1,0,0|2,0,0]=4 2856 B9R1.89 O=CC1CCCCCN1 Amb24461226 [1,0,0,1,0,0|1,0,0]=3 2857 B9R1.89 OCC1CNCCCC1 Amb19149352 [1,0,0,1,0,0|1,0,1]=4 2858 B9R1.89 OC[C@@H]1CCCCCN1 Amb24117101 [1,0,0,1,0,0|1,0,1]=4 2859 B9R1.89 OC[C@@H]1CNCCCC1 Amb24407589 [1,0,0,1,0,0|1,0,1]=4 2860 B9R1.118 C=CC1(N)CCCCC1 Amb18642344 [1,0,0,1,0,0|2,0,0]=4 2861 B9R1.118 CC1(CCCCO1)C=O Amb24627620 [1,0,0,1,0,0|2,0,0]=4 2862 B9R1.118 CC1(CO)CCCCN1 Amb19516855 [1,0,0,1,0,0|1,0,1]=4 2863 B9R1.118 CC1(CO)CCCCN1 Amb22587374 [1,0,0,1,0,0|1,0,1]=4 2864 B9R1.118 C[C@]1(CO)CCCCN1 Amb24417675 [1,0,0,1,0,0|1,0,1]=4 2865 B9R1.118 NC1(CCCCC1)C=O Amb25848234 [1,0,0,1,0,0|1,0,0]=3 2866 B9R1.118 O=CC1(Br)CCCCC1 Amb17594982 [1,0,0,1,0,0|2,0,0]=4 2867 B9R1.118 O=CC1(C)CCCCC1 Amb10070781 [1,0,0,1,0,0|2,0,0]=4 2868 B9R1.118 O=CC1(Cl)CCCCC1 Amb17593665 [1,0,0,1,0,0|2,0,0]=4 2869 B9R1.118 O=CC1(S)CCCCC1 Amb18124700 [1,0,0,1,0,0|2,0,0]=4 2870 B9R1.118 OC1(CCCCC1)C=O Amb18642629 [1,0,0,1,0,0|2,0,0]=4 2871 B9R1.118 OCC1(N)CCCCC1 Amb10608249 [1,0,0,1,0,0|1,0,1]=4 2872 B9R1.132 CCN1CCC(N)C1=O Amb18945418 [1,0,0,1,0,0|2,0,0]=4 2873 B9R1.135 CCCN1CC(N)C1=O Amb24356214 [1,0,0,1,0,0|2,0,0]=4 2874 B9R1.135 NC1CN(CCF)C1=O Amb24644466 [1,0,0,1,0,0|2,0,0]=4 2875 B9R1.202 CC1(CO)CCCC1N Amb19337610 [1,0,0,1,0,0|1,0,1]=4 2876 B9R1.202 CC1CCCC1(N)CO Amb25792492 [1,0,0,1,0,0|1,0,1]=4 2877 B9R1.202 C[C@H]1CCC[C@@]1(C)C=O Amb24640291 [1,0,0,1,0,0|2,0,0]=4 2878 B9R1.6 CC(=C)C1CCCCN1 Amb23536631 [1,0,0,1,0,0|2,0,0]=4 2879 B9R1.6 CC(=O)C1CCCCN1 Amb21962174 [1,0,0,1,0,0|1,0,0]=3 2880 B9R1.6 CC(=O)C1CCCCO1 Amb23585662 [1,0,0,1,0,0|2,0,0]=4 2881 B9R1.6 CC(=O)C1CCCCS1 Amb23568664 [1,0,0,1,0,0|2,0,0]=4 2882 B9R1.6 CC(=O)C1COCCN1 Amb24761214 [1,0,0,1,0,0|2,0,0]=4 2883 B9R1.6 CC(=O)C1CSCCN1 Amb25305093 [1,0,0,1,0,0|2,0,0]=4 2884 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb25072730 [1,0,0,1,0,0|1,0,0]=3 2885 B9R1.6 CC(O)C1CCCCN1 Amb18642713 [1,0,0,1,0,0|1,0,1]=4 2886 B9R1.6 C[C@H](O)[C@@H]1CCCCN1 Amb25260768 [1,0,0,1,0,0|1,0,1]=4 2887 B9R1.6 NC(=N)C1CCCCN1 Amb24659758 [1,0,0,1,0,0|2,0,0]=4 2888 B9R1.6 NC(=O)C1CCCCN1 Amb2370929 [1,0,0,1,0,0|1,0,0]=3 2889 B9R1.6 NC(=O)C1CCSCN1 Amb25264861 [1,0,0,1,0,0|2,0,0]=4 2890 B9R1.6 NC(=O)C1CNCCN1 Amb1158016 [1,0,0,1,0,0|2,0,0]=4 2891 B9R1.6 NC(=O)C1COCCN1 Amb22059486 [1,0,0,1,0,0|2,0,0]=4 2892 B9R1.6 NC(=O)[C@@H]1CCCCN1 Amb25315367 [1,0,0,1,0,0|1,0,0]=3 2893 B9R1.6 NC(=O)[C@@H]1CNCCN1 Amb24183728 [1,0,0,1,0,0|2,0,0]=4 2894 B9R1.6 NC(=O)[C@@H]1COCCN1 Amb24712516 [1,0,0,1,0,0|2,0,0]=4 2895 B9R1.6 NC(=S)C1CCCCN1 Amb19148045 [1,0,0,1,0,0|1,1,0]=4 2896 B9R1.6 O=C(Cl)C1CCCCN1 Amb24061326 [1,0,0,1,0,0|1,0,0]=3 2897 B9R1.6 O=C(Cl)C1COCCN1 Amb24738488 [1,0,0,1,0,0|2,0,0]=4 2898 B9R1.6 O=C(Cl)[C@@H]1CCCCN1 Amb24548250 [1,0,0,1,0,0|1,0,0]=3 2899 B9R1.6 O=C(Cl)[C@H]1CCCCN1 Amb24560223 [1,0,0,1,0,0|1,0,0]=3 2900 B9R1.6 O=C(Cl)[C@H]1CCCCO1 Amb24478586 [1,0,0,1,0,0|2,0,0]=4 2901 B9R1.6 OC(=O)C1=CCCCN1 Amb23585365 [1,0,0,1,0,0|0,0,2]=4 2902 B9R1.6 OC(=O)C1C=CCCN1 Amb25145978 [1,0,0,1,0,0|0,0,2]=4 2903 B9R1.6 OC(=O)C1CCC=CN1 Amb24640071 [1,0,0,1,0,0|0,0,2]=4 2904 B9R1.6 OC(=O)C1CCCC=C1 Amb18642396 [1,0,0,1,0,0|1,0,1]=4 2905 B9R1.6 OC(=O)C1CCCC=N1 Amb24346763 [1,0,0,1,0,0|0,0,2]=4 2906 B9R1.6 OC(=O)C1CCCCS1 Amb18202314 [1,0,0,1,0,0|1,0,0]=3 2907 B9R1.6 OC(=O)C1CCCNC1 Amb1151304 [1,0,0,1,0,0|2,0,0]=4 2908 B9R1.6 OC(=O)C1CCCNO1 Amb24672392 [1,0,0,1,0,0|2,0,0]=4 2909 B9R1.6 OC(=O)C1CCCOC1 Amb1102367 [1,0,0,1,0,0|2,0,0]=4 2910 B9R1.6 OC(=O)C1CCCSS1 Amb24480090 [1,0,0,1,0,0|2,0,0]=4 2911 B9R1.6 OC(=O)C1CCSCN1 Amb1102215 [1,0,0,1,0,0|1,0,0]=3 2912 B9R1.6 OC(=O)C1CCSCN1 Amb22284134 [1,0,0,1,0,0|1,0,0]=3 2913 B9R1.6 OC(=O)C1CNCCN1 Amb22490901 [1,0,0,1,0,0|1,0,0]=3 2914 B9R1.6 OC(=O)C1CNCCN1 Amb22490977 [1,0,0,1,0,0|1,0,0]=3 2915 B9R1.6 OC(=O)C1CNCCO1 Amb16232076 [1,0,0,1,0,0|2,0,0]=4 2916 B9R1.6 OC(=O)C1COCCN1 Amb10607157 [1,0,0,1,0,0|1,0,0]=3 2917 B9R1.6 OC(=O)C1CSCCC1 Amb18202321 [1,0,0,1,0,0|2,0,0]=4 2918 B9R1.6 OC(=O)C1CSCCN1 Amb19888398 [1,0,0,1,0,0|1,0,0]=3 2919 B9R1.6 OC(=O)C1CSCCO1 Amb25241709 [1,0,0,1,0,0|2,0,0]=4 2920 B9R1.6 OC(=O)C1CSCCS1 Amb20622962 [1,0,0,1,0,0|2,0,0]=4 2921 B9R1.6 OC(=O)C1NCCCS1 Amb22899084 [1,0,0,1,0,0|1,0,0]=3 2922 B9R1.6 OC(=O)C1OCCCO1 Amb24715581 [1,0,0,1,0,0|2,0,0]=4 2923 B9R1.6 OC(=O)C1SCCCS1 Amb22167283 [1,0,0,1,0,0|2,0,0]=4 2924 B9R1.6 OC(=O)C=1CCCCN1 Amb24597785 [1,0,0,1,0,0|0,0,2]=4 2925 B9R1.6 OC(=O)C=1NCCCN1 Amb25379456 [1,0,0,1,0,0|1,0,1]=4 2926 B9R1.6 OC(=O)N1CCCCC1 Amb20242677 [1,0,0,1,0,0|2,0,0]=4 2927 B9R1.6 OC(=O)[C@@H]1CCC=CN1 Amb19888332 [1,0,0,1,0,0|0,0,2]=4 2928 B9R1.6 OC(=O)[C@@H]1CCCC=N1 Amb25349486 [1,0,0,1,0,0|0,0,2]=4 2929 B9R1.6 OC(=O)[C@@H]1CCCCO1 Amb22746821 [1,0,0,1,0,0|1,0,0]=3 2930 B9R1.6 OC(=O)[C@@H]1CCCNC1 Amb16232354 [1,0,0,1,0,0|2,0,0]=4 2931 B9R1.6 OC(=O)[C@@H]1CCCNN1 Amb22747164 [1,0,0,1,0,0|1,0,0]=3 2932 B9R1.6 OC(=O)[C@@H]1CCSCN1 Amb24465168 [1,0,0,1,0,0|1,0,0]=3 2933 B9R1.6 OC(=O)[C@@H]1CNCCN1 Amb22748956 [1,0,0,1,0,0|1,0,0]=3 2934 B9R1.6 OC(=O)[C@@H]1CNCCO1 Amb22737231 [1,0,0,1,0,0|2,0,0]=4 2935 B9R1.6 OC(=O)[C@@H]1COCCC1 Amb24118033 [1,0,0,1,0,0|2,0,0]=4 2936 B9R1.6 OC(=O)[C@@H]1COCCN1 Amb10576585 [1,0,0,1,0,0|1,0,0]=3 2937 B9R1.6 OC(=O)[C@@H]1COCCO1 Amb23438856 [1,0,0,1,0,0|2,0,0]=4 2938 B9R1.6 OC(=O)[C@@H]1CSCCN1 Amb22386830 [1,0,0,1,0,0|1,0,0]=3 2939 B9R1.6 OC(=O)[C@H]1CC=CCN1 Amb25757299 [1,0,0,1,0,0|0,0,2]=4 2940 B9R1.6 OC(=O)[C@H]1CCSCN1 Amb25773953 [1,0,0,1,0,0|1,0,0]=3 2941 B9R1.6 OC(=O)[C@H]1CNCCN1 Amb20241207 [1,0,0,1,0,0|1,0,0]=3 2942 B9R1.6 OC(=O)[C@H]1CNCCO1 Amb10067023 [1,0,0,1,0,0|2,0,0]=4 2943 B9R1.6 OC(=O)[C@H]1CNCCO1 Amb22737232 [1,0,0,1,0,0|2,0,0]=4 2944 B9R1.6 OC(=O)[C@H]1COCCN1 Amb16232575 [1,0,0,1,0,0|1,0,0]=3 2945 B9R1.6 OP(=O)C1CCCCC1 Amb25327219 [1,0,0,1,0,0|2,0,0]=4 2946 B9R1.6 OS(=O)C1CCCCC1 Amb24603074 [1,0,0,1,0,0|2,0,0]=4 2947 B9R1.6 O[13C](=O)C1CCCCN1 Amb22363349 [1,0,0,1,0,0|0,0,0]=2 2948 B9R1.9 CCCCC1CC(=O)O1 Amb25202242 [1,0,0,1,0,0|1,0,0]=3 2949 B9R1.13 CC(=C)CC1CCCN1 Amb25162820 [1,0,0,1,0,0|2,0,0]=4 2950 B9R1.13 CC(=O)CC1CCCN1 Amb24064067 [1,0,0,1,0,0|1,0,0]=3 2951 B9R1.13 CC(=O)CC1CCCO1 Amb13952621 [1,0,0,1,0,0|2,0,0]=4 2952 B9R1.13 CC(=O)C[C@@H]1CCCN1 Amb24709255 [1,0,0,1,0,0|1,0,0]=3 2953 B9R1.13 CC(=O)C[C@H]1CCCO1 Amb24752778 [1,0,0,1,0,0|2,0,0]=4 2954 B9R1.13 CC(=O)N[C@@H]1CCCN1 Amb25848370 [1,0,0,1,0,0|2,0,0]=4 2955 B9R1.13 CC(O)CC1CCCN1 Amb22059496 [1,0,0,1,0,0|1,0,1]=4 2956 B9R1.13 CC(O)C[C@@H]1CCCN1 Amb25027963 [1,0,0,1,0,0|1,0,1]=4 2957 B9R1.13 CS(=O)CC1CCCN1 Amb25772181 [1,0,0,1,0,0|2,0,0]=4 2958 B9R1.13 NC(=O)CC1CCCN1 Amb18282785 [1,0,0,1,0,0|1,0,0]=3 2959 B9R1.13 NC(=O)CC1NCCS1 Amb25308974 [1,0,0,1,0,0|2,0,0]=4 2960 B9R1.13 NC(=O)C[C@@H]1CCCN1 Amb24583408 [1,0,0,1,0,0|1,0,0]=3 2961 B9R1.13 OB(O)C[C@@H]1CCCN1 Amb24670511 [1,0,0,1,0,0|1,0,1]=4 2962 B9R1.13 OC(=O)CC1CCCC1 Amb16192937 [1,0,0,1,0,0|1,0,0]=3 2963 B9R1.13 OC(=O)CC1CCCN1 Amb20668514 [1,0,0,1,0,0|0,0,0]=2 2964 B9R1.13 OC(=O)CC1CCCO1 Amb1088908 [1,0,0,1,0,0|1,0,0]=3 2965 B9R1.13 OC(=O)CC1CCCS1 Amb18644290 [1,0,0,1,0,0|1,0,0]=3 2966 B9R1.13 OC(=O)CC1CCNO1 Amb25261098 [1,0,0,1,0,0|2,0,0]=4 2967 B9R1.13 OC(=O)CC1CSCC1 Amb18202318 [1,0,0,1,0,0|2,0,0]=4 2968 B9R1.13 OC(=O)CC1NCCS1 Amb18644340 [1,0,0,1,0,0|1,0,0]=3 2969 B9R1.13 OC(=O)CC1OCCO1 Amb22740193 [1,0,0,1,0,0|2,0,0]=4 2970 B9R1.13 OC(=O)CC1SCCS1 Amb25361118 [1,0,0,1,0,0|2,0,0]=4 2971 B9R1.13 OC(=O)CC=1CCCC1 Amb18642404 [1,0,0,1,0,0|1,0,1]=4 2972 B9R1.13 OC(=O)C[C@@H]1CCCN1 Amb13891876 [1,0,0,1,0,0|0,0,0]=2 2973 B9R1.13 OC(=O)C[C@@H]1CCCO1 Amb24271115 [1,0,0,1,0,0|1,0,0]=3 2974 B9R1.13 OC(=O)C[C@@H]1COCC1 Amb23401495 [1,0,0,1,0,0|2,0,0]=4 2975 B9R1.13 OC(=O)C[C@H]1CCC=C1 Amb25378723 [1,0,0,1,0,0|1,0,1]=4 2976 B9R1.13 OC(=O)C[C@H]1CCCN1 Amb16184011 [1,0,0,1,0,0|0,0,0]=2 2977 B9R1.13 OC(=O)C[C@H]1CCCO1 Amb24271109 [1,0,0,1,0,0|1,0,0]=3 2978 B9R1.13 OC(=O)C[C@H]1CNCC1 Amb10067024 [1,0,0,1,0,0|2,0,0]=4 2979 B9R1.24 C[C@]1(O)CCC[C@H]1CN Amb24563033 [1,0,0,1,0,0|1,0,1]=4 2980 B9R1.24 NCC1CCCS1(=O)=O Amb17063302 [1,0,0,1,0,0|1,0,1]=4 2981 B9R1.40 CC1(O)CCCCC1N Amb25709525 [1,0,0,1,0,0|1,0,1]=4 2982 B9R1.40 C[C@@]1(O)CCCC[C@H]1N Amb24382560 [1,0,0,1,0,0|1,0,1]=4 2983 B9R1.40 C[C@]1(O)CCCC[C@@H]1N Amb25293517 [1,0,0,1,0,0|1,0,1]=4 2984 B9R1.40 NC1CCCCC1(N)O Amb25111965 [1,0,0,1,0,0|1,0,1]=4 2985 B9R1.40 NC1CCCOP1(O)=O Amb24664426 [1,0,0,1,0,0|2,0,0]=4 2986 B9R1.41 C=C1CCCC1C(O)=O Amb18642417 [1,0,0,1,0,0|1,0,1]=4 2987 B9R1.41 CC(=O)C1CCCC1Br Amb24710867 [1,0,0,1,0,0|2,0,0]=4 2988 B9R1.41 CC(=O)C1CCCC1Cl Amb24063968 [1,0,0,1,0,0|2,0,0]=4 2989 B9R1.41 CC(=O)C1CCCC1O Amb25086736 [1,0,0,1,0,0|2,0,0]=4 2990 B9R1.41 CC(=O)[C@H]1CCC[C@@H]1O Amb24512739 [1,0,0,1,0,0|2,0,0]=4 2991 B9R1.41 CC1CCCC1C(=O)C Amb17593321 [1,0,0,1,0,0|2,0,0]=4 2992 B9R1.41 CC1CCCC1C(N)=O Amb24680775 [1,0,0,1,0,0|2,0,0]=4 2993 B9R1.41 CC1CCNC1C(O)=O Amb22496299 [1,0,0,1,0,0|2,0,0]=4 2994 B9R1.41 CC1CCN[C@@H]1C(O)=O Amb25786199 [1,0,0,1,0,0|2,0,0]=4 2995 B9R1.41 CC1CCOC1C(O)=O Amb20668280 [1,0,0,1,0,0|2,0,0]=4 2996 B9R1.41 CC1COCC1C(O)=O Amb25326733 [1,0,0,1,0,0|2,0,0]=4 2997 B9R1.41 CC1NCCC1C(O)=O Amb18118138 [1,0,0,1,0,0|2,0,0]=4 2998 B9R1.41 CC1OCCC1C(O)=O Amb22059743 [1,0,0,1,0,0|2,0,0]=4 2999 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb17935722 [1,0,0,1,0,0|2,0,0]=4 3000 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb18559228 [1,0,0,1,0,0|2,0,0]=4 3001 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb22748316 [1,0,0,1,0,0|2,0,0]=4 3002 B9R1.41 CN1CCC[C@H]1C(=O)O Amb10604041 [1,0,0,1,0,0|2,0,0]=4 3003 B9R1.41 CN1CCC[C@H]1C(O)=O Amb22587172 [1,0,0,1,0,0|2,0,0]=4 3004 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [1,0,0,1,0,0|1,0,0]=3 3005 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [1,0,0,1,0,0|1,0,0]=3 3006 B9R1.41 C[C@@H]1CCC[C@H]1C(C)=O Amb24692616 [1,0,0,1,0,0|2,0,0]=4 3007 B9R1.41 C[C@@H]1CCC[C@H]1C(N)=O Amb24598612 [1,0,0,1,0,0|2,0,0]=4 3008 B9R1.41 C[C@@H]1CCN[C@H]1C(O)=O Amb22747259 [1,0,0,1,0,0|2,0,0]=4 3009 B9R1.41 C[C@@H]1CCO[C@@H]1C(O)=O Amb25251332 [1,0,0,1,0,0|2,0,0]=4 3010 B9R1.41 C[C@@H]1COC[C@@H]1C(O)=O Amb24649146 [1,0,0,1,0,0|2,0,0]=4 3011 B9R1.41 C[C@@H]1NCC[C@H]1C(O)=O Amb18832568 [1,0,0,1,0,0|2,0,0]=4 3012 B9R1.41 C[C@@H]1OCC[C@@H]1C(O)=O Amb22886528 [1,0,0,1,0,0|2,0,0]=4 3013 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [1,0,0,1,0,0|1,0,0]=3 3014 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [1,0,0,1,0,0|1,0,0]=3 3015 B9R1.41 C[C@H]1CCN[C@H]1C(O)=O Amb24715733 [1,0,0,1,0,0|2,0,0]=4 3016 B9R1.41 C[C@H]1CNCC1C(O)=O Amb24546979 [1,0,0,1,0,0|2,0,0]=4 3017 B9R1.41 C[C@H]1NCC[C@@H]1C(O)=O Amb24539923 [1,0,0,1,0,0|2,0,0]=4 3018 B9R1.41 C[C@H]1OCC[C@H]1C(O)=O Amb25253338 [1,0,0,1,0,0|2,0,0]=4 3019 B9R1.41 C[S+]1CCCC1C(O)=O Amb24634112 [1,0,0,1,0,0|2,0,0]=4 3020 B9R1.41 NC(=O)C1CCCC1O Amb25310986 [1,0,0,1,0,0|2,0,0]=4 3021 B9R1.41 NC(=O)C1CCCN1N Amb25703126 [1,0,0,1,0,0|2,0,0]=4 3022 B9R1.41 NC(=O)[C@@H]1CCC[C@H]1O Amb24120348 [1,0,0,1,0,0|2,0,0]=4 3023 B9R1.41 NC(=O)[C@H]1CCC[C@@H]1O Amb24514485 [1,0,0,1,0,0|2,0,0]=4 3024 B9R1.41 NC1C=CCC1C(O)=O Amb22353819 [1,0,0,1,0,0|0,0,2]=4 3025 B9R1.41 NC1C=CCC1C(O)=O Amb25723511 [1,0,0,1,0,0|0,0,2]=4 3026 B9R1.41 NC1CCCC1C(N)=O Amb19148786 [1,0,0,1,0,0|1,0,0]=3 3027 B9R1.41 NC1CCCC1C(N)=S Amb25688172 [1,0,0,1,0,0|1,1,0]=4 3028 B9R1.41 NC1CCN[C@@H]1C(O)=O Amb25032243 [1,0,0,1,0,0|1,0,0]=3 3029 B9R1.41 NC1CCSC1C(O)=O Amb25314364 [1,0,0,1,0,0|1,0,0]=3 3030 B9R1.41 NC1COCC1C(N)=O Amb25129487 [1,0,0,1,0,0|2,0,0]=4 3031 B9R1.41 NC1COCC1C(O)=O Amb24709230 [1,0,0,1,0,0|1,0,0]=3 3032 B9R1.41 NC1CSCC1C(O)=O Amb24457278 [1,0,0,1,0,0|1,0,0]=3 3033 B9R1.41 NC1OCCC1C(O)=O Amb24441640 [1,0,0,1,0,0|1,0,0]=3 3034 B9R1.41 NC=1CCCC1C(O)=O Amb20240586 [1,0,0,1,0,0|0,0,2]=4 3035 B9R1.41 NN1CCCC1C(O)=O Amb18642792 [1,0,0,1,0,0|1,0,0]=3 3036 B9R1.41 NN1CCC[C@@H]1C(=O)O Amb10069459 [1,0,0,1,0,0|1,0,0]=3 3037 B9R1.41 N[C@@H]1C=CC[C@@H]1C(O)=O Amb25213056 [1,0,0,1,0,0|0,0,2]=4 3038 B9R1.41 N[C@@H]1CCC[C@H]1C(N)=O Amb25269871 [1,0,0,1,0,0|1,0,0]=3 3039 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=O Amb20241297 [1,0,0,1,0,0|0,0,0]=2 3040 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=O Amb22224830 [1,0,0,1,0,0|0,0,0]=2 3041 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=[ClH] Amb24627931 [1,0,0,1,0,0|1,0,0]=3 3042 B9R1.41 N[C@@H]1CCN[C@@H]1C(O)=O Amb19929517 [1,0,0,1,0,0|1,0,0]=3 3043 B9R1.41 N[C@@H]1CCS[C@H]1C(O)=O Amb24061395 [1,0,0,1,0,0|1,0,0]=3 3044 B9R1.41 N[C@@H]1CNC[C@@H]1C(O)=O Amb25685466 [1,0,0,1,0,0|1,0,0]=3 3045 B9R1.41 N[C@@H]1COC[C@@H]1C(O)=O Amb24078777 [1,0,0,1,0,0|1,0,0]=3 3046 B9R1.41 N[C@@H]1CSC[C@@H]1C(O)=O Amb25685470 [1,0,0,1,0,0|1,0,0]=3 3047 B9R1.41 N[C@@H]1OCC[C@@H]1C(O)=O Amb24581227 [1,0,0,1,0,0|1,0,0]=3 3048 B9R1.41 N[C@H]1CCC[C@@H]1C(O)=O Amb20241298 [1,0,0,1,0,0|0,0,0]=2 3049 B9R1.41 N[C@H]1CCC[C@@H]1C(O)=O Amb22224860 [1,0,0,1,0,0|0,0,0]=2 3050 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993719 [1,0,0,1,0,0|0,0,0]=2 3051 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993764 [1,0,0,1,0,0|0,0,0]=2 3052 B9R1.41 N[C@H]1CCS[C@H]1C(O)=O Amb24061394 [1,0,0,1,0,0|1,0,0]=3 3053 B9R1.41 N[C@H]1CNC[C@H]1C(O)=O Amb24628081 [1,0,0,1,0,0|1,0,0]=3 3054 B9R1.41 N[C@H]1COC[C@@H]1C(O)=O Amb24605467 [1,0,0,1,0,0|1,0,0]=3 3055 B9R1.41 N[C@H]1COC[C@H]1C(O)=O Amb24763623 [1,0,0,1,0,0|1,0,0]=3 3056 B9R1.41 OC(=O)C1CCCC1=O Amb18642571 [1,0,0,1,0,0|1,0,1]=4 3057 B9R1.41 OC(=O)C1CCCC1=S Amb25273371 [1,0,0,1,0,0|1,0,1]=4 3058 B9R1.41 OC(=O)C1CCCC1Br Amb24480063 [1,0,0,1,0,0|1,0,0]=3 3059 B9R1.41 OC(=O)C1CCCC1S Amb18280971 [1,0,0,1,0,0|1,0,0]=3 3060 B9R1.41 OC(=O)C1CCCN1Cl Amb25291925 [1,0,0,1,0,0|2,0,0]=4 3061 B9R1.41 OC(=O)C1NCCC1Br Amb24694082 [1,0,0,1,0,0|2,0,0]=4 3062 B9R1.41 OC(=O)C1NCCC1Cl Amb25080543 [1,0,0,1,0,0|2,0,0]=4 3063 B9R1.41 OC(=O)C1NCCC1F Amb25772909 [1,0,0,1,0,0|2,0,0]=4 3064 B9R1.41 OC(=O)C1NCCC1S Amb24556940 [1,0,0,1,0,0|2,0,0]=4 3065 B9R1.41 OC(=O)C1OCCC1Cl Amb25124121 [1,0,0,1,0,0|2,0,0]=4 3066 B9R1.41 OC(=O)[C@@H]1CCCN1Br Amb24480123 [1,0,0,1,0,0|2,0,0]=4 3067 B9R1.41 OC(=O)[C@H]1CCCN1F Amb24534439 [1,0,0,1,0,0|2,0,0]=4 3068 B9R1.41 OC(=O)[C@H]1CCC[C@@H]1Br Amb25251282 [1,0,0,1,0,0|1,0,0]=3 3069 B9R1.41 OC(=O)[C@H]1CCC[C@H]1Br Amb24693868 [1,0,0,1,0,0|1,0,0]=3 3070 B9R1.41 OC(=O)[C@H]1NCCC1F Amb25312348 [1,0,0,1,0,0|2,0,0]=4 3071 B9R1.41 OC(=O)[C@H]1NCC[C@@H]1S Amb24548407 [1,0,0,1,0,0|2,0,0]=4 3072 B9R1.41 OC1CCCC1C(=O)Cl Amb24524192 [1,0,0,1,0,0|2,0,0]=4 3073 B9R1.41 OC1CCCC1C(O)=O Amb19148040 [1,0,0,1,0,0|1,0,0]=3 3074 B9R1.41 OC1CCNC1C(O)=O Amb22387784 [1,0,0,1,0,0|2,0,0]=4 3075 B9R1.41 OC1CCN[C@@H]1C(=O)O Amb10604192 [1,0,0,1,0,0|2,0,0]=4 3076 B9R1.41 OC1CCN[C@H]1C(O)=O Amb24359065 [1,0,0,1,0,0|2,0,0]=4 3077 B9R1.41 OC1CCSC1C(O)=O Amb24061424 [1,0,0,1,0,0|2,0,0]=4 3078 B9R1.41 OC1CNCC1C(O)=O Amb22886381 [1,0,0,1,0,0|2,0,0]=4 3079 B9R1.41 OC1CSCC1C(O)=O Amb18831363 [1,0,0,1,0,0|2,0,0]=4 3080 B9R1.41 O[C@@H]1CCC[C@@H]1C(O)=O Amb22747315 [1,0,0,1,0,0|1,0,0]=3 3081 B9R1.41 O[C@@H]1CCC[C@H]1C(O)=O Amb24120349 [1,0,0,1,0,0|1,0,0]=3 3082 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb22746928 [1,0,0,1,0,0|2,0,0]=4 3083 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb23439285 [1,0,0,1,0,0|2,0,0]=4 3084 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb24183503 [1,0,0,1,0,0|2,0,0]=4 3085 B9R1.41 O[C@@H]1CCN[C@H]1C(O)=O Amb22746713 [1,0,0,1,0,0|2,0,0]=4 3086 B9R1.41 O[C@@H]1CCN[C@H]1C(O)=O Amb24183557 [1,0,0,1,0,0|2,0,0]=4 3087 B9R1.41 O[C@@H]1CNC[C@H]1C(O)=O Amb24120417 [1,0,0,1,0,0|2,0,0]=4 3088 B9R1.41 O[C@H]1CCC[C@H]1C(=O)O Amb10844853 [1,0,0,1,0,0|1,0,0]=3 3089 B9R1.41 O[C@H]1CCN[C@@H]1C(O)=O Amb24055327 [1,0,0,1,0,0|2,0,0]=4 3090 B9R1.41 O[C@H]1CCN[C@H]1C(O)=O Amb22230426 [1,0,0,1,0,0|2,0,0]=4 3091 B9R1.41 O[C@H]1CNC[C@H]1C(O)=O Amb22274552 [1,0,0,1,0,0|2,0,0]=4 3092 B9R1.46 CC1CC1NCC(O)=O Amb18993215 [1,0,0,1,0,0|2,0,0]=4 3093 B9R1.46 C[C@@H]1C[C@@H]1CCC(C)=O Amb25834668 [1,0,0,1,0,0|2,0,0]=4 3094 B9R1.46 C[C@@H]1C[C@H]1CCC(C)=O Amb25163844 [1,0,0,1,0,0|2,0,0]=4 3095 B9R1.48 CC1CCCCC(=O)C1 Amb17593325 [1,0,0,1,0,0|2,0,0]=4 3096 B9R1.48 CC1CCCCC(=O)N1 Amb22434912 [1,0,0,1,0,0|2,0,0]=4 3097 B9R1.48 CC=1CCCCC(N)N1 Amb24548235 [1,0,0,1,0,0|2,0,0]=4 3098 B9R1.48 C[C@@H]1CC(=O)CCCC1 Amb25044345 [1,0,0,1,0,0|2,0,0]=4 3099 B9R1.48 NC1CC(=O)NCCC1 Amb22229644 [1,0,0,1,0,0|2,0,0]=4 3100 B9R1.48 NC1CC(=O)NCCC1 Amb22276469 [1,0,0,1,0,0|2,0,0]=4 3101 B9R1.48 NC1CC(O)CCCC1 Amb24374638 [1,0,0,1,0,0|1,0,1]=4 3102 B9R1.48 NC1CCCCC(=O)N1 Amb22492650 [1,0,0,1,0,0|1,0,0]=3 3103 B9R1.48 NC=1CCCCC(=O)C1 Amb25146097 [1,0,0,1,0,0|1,0,1]=4 3104 B9R1.48 N[C@@H]1CC(=O)NCCC1 Amb24442197 [1,0,0,1,0,0|2,0,0]=4 3105 B9R1.48 O=C1CC(Br)CCCC1 Amb25685402 [1,0,0,1,0,0|2,0,0]=4 3106 B9R1.48 O=C1CC(Cl)CCCC1 Amb25061378 [1,0,0,1,0,0|2,0,0]=4 3107 B9R1.48 O=C1CCCCC(Cl)N1 Amb25843742 [1,0,0,1,0,0|2,0,0]=4 3108 B9R1.48 OC1CCCCC(=O)N1 Amb24477685 [1,0,0,1,0,0|2,0,0]=4 3109 B9R1.48 O[C@@H]1CCCCC(=O)O1 Amb25296333 [1,0,0,1,0,0|1,0,0]=3 3110 B9R1.48 O[C@H]1CCCCC(=O)O1 Amb24529319 [1,0,0,1,0,0|1,0,0]=3 3111 B9R1.59 CCCC1CC1C(N)=O Amb24473639 [1,0,0,1,0,0|2,0,0]=4 3112 B9R1.59 CCCC1CC1C(O)=O Amb19001459 [1,0,0,1,0,0|1,0,0]=3 3113 B9R1.59 CCCC1OC1C(O)=O Amb24561183 [1,0,0,1,0,0|2,0,0]=4 3114 B9R1.59 CCC[C@@H]1C[C@H]1C(O)=O Amb25368727 [1,0,0,1,0,0|1,0,0]=3 3115 B9R1.59 CNC[C@@H]1C[C@H]1C(O)=O Amb24744378 [1,0,0,1,0,0|2,0,0]=4 3116 B9R1.59 OC(=O)[C@@H]1C[C@H]1CCBr Amb24519204 [1,0,0,1,0,0|1,0,0]=3 3117 B9R1.67 CC(=O)C[C@@H]1CC[C@@H]1F Amb24440447 [1,0,0,1,0,0|2,0,0]=4 3118 B9R1.67 CC(=O)C[C@H]1CC[C@H]1F Amb25246392 [1,0,0,1,0,0|2,0,0]=4 3119 B9R1.67 CC(=O)OC1CCC1N Amb25064702 [1,0,0,1,0,0|2,0,0]=4 3120 B9R1.67 CC1CCC1CC(O)=O Amb24466547 [1,0,0,1,0,0|1,0,0]=3 3121 B9R1.67 N[C@H]1CC[C@@H]1CC(O)=O Amb24700074 [1,0,0,1,0,0|0,0,0]=2 3122 B9R1.84 CC(=O)CCC1CCC1 Amb24534447 [1,0,0,1,0,0|2,0,0]=4 3123 B9R1.84 OC(=O)CCN1CCC1 Amb22292346 [1,0,0,1,0,0|2,0,0]=4 3124 B9R1.84 OC(=O)CNC1CCC1 Amb18982434 [1,0,0,1,0,0|2,0,0]=4 3125 B9R1.84 OC(=O)COC1CCC1 Amb18295877 [1,0,0,1,0,0|2,0,0]=4 3126 B9R1.84 OC(=O)CSC1CCC1 Amb24439698 [1,0,0,1,0,0|2,0,0]=4 3127 B9R1.85 CC(=O)CCCC1CC1 Amb25303589 [1,0,0,1,0,0|2,0,0]=4 3128 B9R1.85 OC(=O)CCCC1CC1 Amb18832629 [1,0,0,1,0,0|1,0,0]=3 3129 B9R1.85 OC(=O)CCC[C@H]1CO1 Amb24427275 [1,0,0,1,0,0|1,0,0]=3 3130 B9R1.85 OC(=O)CCNC1CC1 Amb1106410 [1,0,0,1,0,0|2,0,0]=4 3131 B9R1.85 OC(=O)CCSC1CC1 Amb25221891 [1,0,0,1,0,0|2,0,0]=4 3132 B9R1.86 OC(=O)CC1CC1CBr Amb25269489 [1,0,0,1,0,0|1,0,0]=3 3133 B9R1.96 CCC1CCC1C(O)=O Amb25727014 [1,0,0,1,0,0|1,0,0]=3 3134 B9R1.96 CCN1CCC1C(O)=O Amb22011877 [1,0,0,1,0,0|2,0,0]=4 3135 B9R1.96 CCN1CC[C@@H]1C(O)=O Amb24634744 [1,0,0,1,0,0|2,0,0]=4 3136 B9R1.96 CCN1CC[C@H]1C(O)=O Amb25347394 [1,0,0,1,0,0|2,0,0]=4 3137 B9R1.96 CNC1CCC1C(O)=O Amb25340658 [1,0,0,1,0,0|2,0,0]=4 3138 B9R1.96 CSC1CCC1C(O)=O Amb25118114 [1,0,0,1,0,0|2,0,0]=4 3139 B9R1.96 NCC1CCC1C(O)=O Amb25269589 [1,0,0,1,0,0|0,0,0]=2 3140 B9R1.96 NC[C@H]1CC[C@H]1C(O)=O Amb24579352 [1,0,0,1,0,0|0,0,0]=2 3141 B9R1.96 OC(=O)C1CCC1C=O Amb25302625 [1,0,0,1,0,0|1,0,1]=4 3142 B9R1.96 OC(=O)C1CCC1CF Amb20667674 [1,0,0,1,0,0|1,0,0]=3 3143 B9R1.96 OCC1CCC1C(O)=O Amb24340315 [1,0,0,1,0,0|1,0,0]=3 3144 B9R1.96 OCC1CCN1C(O)=O Amb22756926 [1,0,0,1,0,0|2,0,0]=4 3145 B9R1.96 ONC1CCC1C(O)=O Amb24471809 [1,0,0,1,0,0|2,0,0]=4 3146 B9R1.96 [O-]C(=O)[C@H]1CC[C@H]1CO Amb25176734 [1,0,0,1,0,0|1,0,1]=4 3147 B9R1.23 CC1CC(CC)NC1=O Amb20623299 [1,0,0,1,0,0|2,0,0]=4 3148 B9R1.23 CC1CC(CCl)OC1=O Amb25090247 [1,0,0,1,0,0|2,0,0]=4 3149 B9R1.23 CC1CC(CN)OC1=O Amb24480327 [1,0,0,1,0,0|1,0,0]=3 3150 B9R1.23 CC1CC(CO)OC1=O Amb24371209 [1,0,0,1,0,0|2,0,0]=4 3151 B9R1.23 CCC1CC(Br)C(=O)O1 Amb25839843 [1,0,0,1,0,0|1,0,0]=3 3152 B9R1.23 CCC1CC(O)C(=O)N1 Amb24426760 [1,0,0,1,0,0|2,0,0]=4 3153 B9R1.23 CC[C@@H]1C[C@H](N)C(=O)O1 Amb25163624 [1,0,0,1,0,0|0,0,0]=2 3154 B9R1.23 CC[C@@H]1OC(=O)[C@H](F)S1 Amb25054175 [1,0,0,1,0,0|2,0,0]=4 3155 B9R1.23 CC[C@H]1OC(=O)[C@@H](F)S1 Amb24514953 [1,0,0,1,0,0|2,0,0]=4 3156 B9R1.23 CN1CC(OC1=O)CN Amb17506100 [1,0,0,1,0,0|2,0,0]=4 3157 B9R1.23 CN1C[C@H](CN)OC1=O Amb25723152 [1,0,0,1,0,0|2,0,0]=4 3158 B9R1.23 C[C@@H]1C[C@@H](CBr)OC1=O Amb25323016 [1,0,0,1,0,0|2,0,0]=4 3159 B9R1.23 C[C@@H]1C[C@@H](CO)OC1=O Amb24612854 [1,0,0,1,0,0|2,0,0]=4 3160 B9R1.23 C[C@@H]1C[C@H](CO)OC1=O Amb24672472 [1,0,0,1,0,0|2,0,0]=4 3161 B9R1.23 C[C@H]1CC(CO)OC1=O Amb25078626 [1,0,0,1,0,0|2,0,0]=4 3162 B9R1.23 C[C@H]1C[C@@H](CBr)OC1=O Amb24597367 [1,0,0,1,0,0|2,0,0]=4 3163 B9R1.23 C[C@H]1C[C@@H](CN)OC1=O Amb25326754 [1,0,0,1,0,0|1,0,0]=3 3164 B9R1.23 ClCC1CC(Cl)C(=O)O1 Amb17940400 [1,0,0,1,0,0|2,0,0]=4 3165 B9R1.23 NC1CC(CF)NC1=O Amb25716850 [1,0,0,1,0,0|2,0,0]=4 3166 B9R1.23 NC1CC(CO)NC1=O Amb25124342 [1,0,0,1,0,0|2,0,0]=4 3167 B9R1.23 NC1CC(CO)OC1=O Amb18642829 [1,0,0,1,0,0|1,0,0]=3 3168 B9R1.23 NCC1CC(Br)C(=O)O1 Amb25272231 [1,0,0,1,0,0|1,0,0]=3 3169 B9R1.23 N[C@@H]1C[C@@H](CO)NC1=O Amb24645846 [1,0,0,1,0,0|2,0,0]=4 3170 B9R1.23 N[C@@H]1C[C@@H](CO)OC1=O Amb25327262 [1,0,0,1,0,0|1,0,0]=3 3171 B9R1.23 N[C@H]1CC(CO)OC1=O Amb25771995 [1,0,0,1,0,0|1,0,0]=3 3172 B9R1.23 N[C@H]1C[C@@H](CO)NC1=O Amb24561327 [1,0,0,1,0,0|2,0,0]=4 3173 B9R1.23 N[C@H]1C[C@H](CO)OC1=O Amb24567157 [1,0,0,1,0,0|1,0,0]=3 3174 B9R1.23 O=C1OC(CBr)CC1Cl Amb24654717 [1,0,0,1,0,0|2,0,0]=4 3175 B9R1.23 O=C1OC(CI)CC1F Amb24412098 [1,0,0,1,0,0|2,0,0]=4 3176 B9R1.23 O=C1O[C@H](C[C@@H]1Cl)CCl Amb24580694 [1,0,0,1,0,0|2,0,0]=4 3177 B9R1.23 O=C1O[C@H](C[C@H]1Cl)CCl Amb24515094 [1,0,0,1,0,0|2,0,0]=4 3178 B9R1.23 O[C@@H]1C[C@H](CCl)OC1=O Amb25213067 [1,0,0,1,0,0|2,0,0]=4 3179 B9R1.23 O[C@@H]1C[C@H](CO)OC1=O Amb25324131 [1,0,0,1,0,0|2,0,0]=4 3180 B9R1.35 CC1CC(CC1)C(N)=O Amb24763749 [1,0,0,1,0,0|2,0,0]=4 3181 B9R1.35 CC1CC(CC1)C(O)=O Amb18642624 [1,0,0,1,0,0|1,0,0]=3 3182 B9R1.35 CC1CC(CN1)C(O)=O Amb18832566 [1,0,0,1,0,0|2,0,0]=4 3183 B9R1.35 CC1CCC(=C1)C(O)=O Amb18642397 [1,0,0,1,0,0|1,0,1]=4 3184 B9R1.35 CC1CCC(C1)C(C)=O Amb25077503 [1,0,0,1,0,0|2,0,0]=4 3185 B9R1.35 CC1CCC(N1)C(N)=O Amb18642667 [1,0,0,1,0,0|1,0,0]=3 3186 B9R1.35 CC1CCC(N1)C(O)=O Amb18832572 [1,0,0,1,0,0|0,0,0]=2 3187 B9R1.35 CC1CCC(O1)C(=O)O Amb17593370 [1,0,0,1,0,0|1,0,0]=3 3188 B9R1.35 CC1CCC(O1)C(C)=O Amb24580538 [1,0,0,1,0,0|2,0,0]=4 3189 B9R1.35 CC1CCC(S1)C(O)=O Amb25719281 [1,0,0,1,0,0|1,0,0]=3 3190 B9R1.35 CC1CCC([NH2+]1)C(O)=O Amb22372047 [1,0,0,1,0,0|0,0,1]=3 3191 B9R1.35 CC1CC[C@@H](N1)C(O)=O Amb22748252 [1,0,0,1,0,0|0,0,0]=2 3192 B9R1.35 CC1CC[C@H](N1)C(N)=O Amb24696154 [1,0,0,1,0,0|1,0,0]=3 3193 B9R1.35 CC1CNC(O1)C(O)=O Amb25737834 [1,0,0,1,0,0|2,0,0]=4 3194 B9R1.35 CC1CSC(S1)C(O)=O Amb24608602 [1,0,0,1,0,0|2,0,0]=4 3195 B9R1.35 CC1N[C@@H](CS1)C(=O)O Amb16203706 [1,0,0,1,0,0|1,0,0]=3 3196 B9R1.35 CC=1CCC(N1)C(O)=O Amb23438203 [1,0,0,1,0,0|0,0,2]=4 3197 B9R1.35 CC=1CCC([NH+]1)C(O)=O Amb22372048 [1,0,0,1,0,0|0,0,2]=4 3198 B9R1.35 CC=1NC(CN1)C(O)=O Amb24599993 [1,0,0,1,0,0|1,0,1]=4 3199 B9R1.35 CN1CCC(N1)C(O)=O Amb25854311 [1,0,0,1,0,0|1,0,0]=3 3200 B9R1.35 CN1C[C@@H](CC1)C(O)=O Amb22746030 [1,0,0,1,0,0|2,0,0]=4 3201 B9R1.35 CN1C[C@@H](CC1)C(O)=O Amb22756448 [1,0,0,1,0,0|2,0,0]=4 3202 B9R1.35 C[C@@H]1CC[C@@H](C1)C(=O)O Amb10843961 [1,0,0,1,0,0|1,0,0]=3 3203 B9R1.35 C[C@@H]1CC[C@@H](N1)C(N)=O Amb24572556 [1,0,0,1,0,0|1,0,0]=3 3204 B9R1.35 C[C@@H]1CC[C@@H](N1)C(O)=O Amb24399449 [1,0,0,1,0,0|0,0,0]=2 3205 B9R1.35 C[C@@H]1CC[C@@H](O1)C(O)=O Amb22886534 [1,0,0,1,0,0|1,0,0]=3 3206 B9R1.35 C[C@@H]1C[C@@H](NC1)C(O)=O Amb19887682 [1,0,0,1,0,0|2,0,0]=4 3207 B9R1.35 C[C@@H]1C[C@@H](NC1)C(O)=O Amb23439040 [1,0,0,1,0,0|2,0,0]=4 3208 B9R1.35 C[C@@H]1C[C@H](NC1)C(O)=O Amb22008683 [1,0,0,1,0,0|2,0,0]=4 3209 B9R1.35 C[C@@H]1C[C@H](NC1)C(O)=O Amb22752452 [1,0,0,1,0,0|2,0,0]=4 3210 B9R1.35 C[C@@H]1N[C@H](CS1)C(O)=O Amb25294278 [1,0,0,1,0,0|1,0,0]=3 3211 B9R1.35 C[C@H]1CC[C@@H](N1)C(O)=O Amb25260830 [1,0,0,1,0,0|0,0,0]=2 3212 B9R1.35 C[C@H]1CC[C@H](C1)C(=O)O Amb10843955 [1,0,0,1,0,0|1,0,0]=3 3213 B9R1.35 C[C@H]1CC[C@H](N1)C(O)=O Amb24598417 [1,0,0,1,0,0|0,0,0]=2 3214 B9R1.35 C[C@H]1CC[C@H](O1)C(O)=O Amb24651587 [1,0,0,1,0,0|1,0,0]=3 3215 B9R1.35 C[C@H]1C[C@@H](CC1)C(N)=O Amb24612116 [1,0,0,1,0,0|2,0,0]=4 3216 B9R1.35 C[C@H]1C[C@@H](NC1)C(O)=O Amb24752952 [1,0,0,1,0,0|2,0,0]=4 3217 B9R1.35 C[C@H]1C[C@H](CN1)C(O)=O Amb24715999 [1,0,0,1,0,0|2,0,0]=4 3218 B9R1.35 C[C@H]1C[C@H](NC1)C(O)=O Amb19888348 [1,0,0,1,0,0|2,0,0]=4 3219 B9R1.35 C[C@H]1N[C@@H](CS1)C(O)=O Amb25347352 [1,0,0,1,0,0|1,0,0]=3 3220 B9R1.35 C[C@H]1O[C@H](CS1)C(O)=O Amb24625718 [1,0,0,1,0,0|2,0,0]=4 3221 B9R1.35 N=C1CCC(N1)C(O)=O Amb18642592 [1,0,0,1,0,0|0,0,2]=4 3222 B9R1.35 NC1CC(NC1)C(=O)O Amb10608922 [1,0,0,1,0,0|2,0,0]=4 3223 B9R1.35 NC1CC(OC1)C(O)=O Amb18642828 [1,0,0,1,0,0|2,0,0]=4 3224 B9R1.35 NC1CC(SC1)C(O)=O Amb18831415 [1,0,0,1,0,0|2,0,0]=4 3225 B9R1.35 NC1CCC(=C1)C(O)=O Amb18642496 [1,0,0,1,0,0|1,0,1]=4 3226 B9R1.35 NC1CCC(C1)C(=O)O Amb10066880 [1,0,0,1,0,0|1,0,0]=3 3227 B9R1.35 NC1CCC(C1)C(N)=O Amb25104222 [1,0,0,1,0,0|2,0,0]=4 3228 B9R1.35 NC1NC(CS1)C(O)=O Amb25703132 [1,0,0,1,0,0|1,0,0]=3 3229 B9R1.35 NC=1CC[C@H](N1)C(O)=O Amb25346757 [1,0,0,1,0,0|0,0,2]=4 3230 B9R1.35 N[C@@H]1CC(CC1)C(O)=O Amb25700807 [1,0,0,1,0,0|1,0,0]=3 3231 B9R1.35 N[C@@H]1CC[C@@H](C1)C(N)=O Amb25321319 [1,0,0,1,0,0|2,0,0]=4 3232 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O Amb10066881 [1,0,0,1,0,0|1,0,0]=3 3233 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O Amb10070446 [1,0,0,1,0,0|2,0,0]=4 3234 B9R1.35 N[C@@H]1C[C@@H](CC1)C(O)=O Amb22746692 [1,0,0,1,0,0|1,0,0]=3 3235 B9R1.35 N[C@@H]1C[C@@H](NC1)C(O)=O Amb22008702 [1,0,0,1,0,0|2,0,0]=4 3236 B9R1.35 N[C@@H]1C[C@@H](OC1)C(O)=O Amb24548389 [1,0,0,1,0,0|2,0,0]=4 3237 B9R1.35 N[C@@H]1C[C@H](CC1)C(O)=O Amb22756038 [1,0,0,1,0,0|1,0,0]=3 3238 B9R1.35 N[C@@H]1C[C@H](NC1)C(=O)O Amb10603131 [1,0,0,1,0,0|2,0,0]=4 3239 B9R1.35 N[C@@H]1C[C@H](NC1)C(O)=O Amb22224945 [1,0,0,1,0,0|2,0,0]=4 3240 B9R1.35 N[C@@H]1C[C@H](OC1)C(O)=O Amb24117069 [1,0,0,1,0,0|2,0,0]=4 3241 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O Amb10066883 [1,0,0,1,0,0|1,0,0]=3 3242 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O Amb10070445 [1,0,0,1,0,0|2,0,0]=4 3243 B9R1.35 N[C@H]1C[C@@H](NC1)C(O)=O Amb19515889 [1,0,0,1,0,0|2,0,0]=4 3244 B9R1.35 N[C@H]1C[C@@H](OC1)C(O)=O Amb25691536 [1,0,0,1,0,0|2,0,0]=4 3245 B9R1.35 N[C@H]1C[C@H](NC1)C(=O)O Amb10603136 [1,0,0,1,0,0|2,0,0]=4 3246 B9R1.35 N[C@H]1C[C@H](NC1)C(O)=O Amb22386834 [1,0,0,1,0,0|2,0,0]=4 3247 B9R1.35 N[C@H]1C[C@H](OC1)C(O)=O Amb25799075 [1,0,0,1,0,0|2,0,0]=4 3248 B9R1.35 O=C1CC[C@H](N1)C(=O)O Amb1995036 [1,0,0,1,0,0|1,0,1]=4 3249 B9R1.35 OC(=O)C1CCC(=O)N1 Amb22282321 [1,0,0,1,0,0|1,0,1]=4 3250 B9R1.35 OC(=O)C1CCC(=S)N1 Amb24477679 [1,0,0,1,0,0|1,0,1]=4 3251 B9R1.35 OC(=O)C1CCC(F)C1 Amb22886545 [1,0,0,1,0,0|2,0,0]=4 3252 B9R1.35 OC(=O)C1CCC(F)N1 Amb24423850 [1,0,0,1,0,0|1,0,0]=3 3253 B9R1.35 OC(=O)C1CCC(I)C1 Amb23456141 [1,0,0,1,0,0|2,0,0]=4 3254 B9R1.35 OC(=O)[C@@H]1CCC(=O)N1 Amb24099403 [1,0,0,1,0,0|1,0,1]=4 3255 B9R1.35 OC(=O)[C@@H]1CCC(F)N1 Amb25032254 [1,0,0,1,0,0|1,0,0]=3 3256 B9R1.35 OC1CCC(C1)C(O)=O Amb21963572 [1,0,0,1,0,0|2,0,0]=4 3257 B9R1.35 OC1NC(CS1)C(O)=O Amb25759113 [1,0,0,1,0,0|2,0,0]=4 3258 B9R1.35 O[C@@H]1CC[C@@H](C1)C(O)=O Amb22746073 [1,0,0,1,0,0|2,0,0]=4 3259 B9R1.35 O[C@@H]1CC[C@H](C1)C(O)=O Amb22746558 [1,0,0,1,0,0|2,0,0]=4 3260 B9R1.35 O[C@@H]1CC[C@H](N1)C(O)=O Amb24515622 [1,0,0,1,0,0|1,0,0]=3 3261 B9R1.45 C=C1CC1C(N)C(O)=O Amb24117258 [1,0,0,1,0,0|0,0,2]=4 3262 B9R1.45 CC(C1CC1C)C(C)=O Amb24529060 [1,0,0,1,0,0|2,0,0]=4 3263 B9R1.45 CC(C1CC1C)C(O)=O Amb25708709 [1,0,0,1,0,0|1,0,0]=3 3264 B9R1.45 CC1CC1C(=O)C(O)=O Amb24760671 [1,0,0,1,0,0|1,0,1]=4 3265 B9R1.45 CC1CC1C(N)C(C)=C Amb24478683 [1,0,0,1,0,0|2,0,0]=4 3266 B9R1.45 NC([C@H]1C[C@@H]1N)C(O)=O Amb25245366 [1,0,0,1,0,0|0,0,0]=2 3267 B9R1.69 C=C1CC[C@@H](N)C(=O)O1 Amb24426847 [1,0,0,1,0,0|0,0,2]=4 3268 B9R1.69 CC1CC(=O)C(C)CC1 Amb22228357 [1,0,0,1,0,0|2,0,0]=4 3269 B9R1.69 CC1CC(=O)C(N)CC1 Amb25291675 [1,0,0,1,0,0|1,0,0]=3 3270 B9R1.69 CC1CCC(=O)C(=O)O1 Amb24621712 [1,0,0,1,0,0|1,0,1]=4 3271 B9R1.69 CC1CCC(C)NC1=O Amb25692572 [1,0,0,1,0,0|2,0,0]=4 3272 B9R1.69 CC1CCC(Cl)C(O)=C1 Amb25288245 [1,0,0,1,0,0|2,0,0]=4 3273 B9R1.69 CC1CCC(N)C(=O)O1 Amb24563967 [1,0,0,1,0,0|0,0,0]=2 3274 B9R1.69 CC1CCC(O)C(=O)N1 Amb24427022 [1,0,0,1,0,0|2,0,0]=4 3275 B9R1.69 CC1CCC(O)OC1=O Amb25306421 [1,0,0,1,0,0|2,0,0]=4 3276 B9R1.69 C[C@@H]1CC(=O)[C@@H](Br)CC1 Amb23592295 [1,0,0,1,0,0|2,0,0]=4 3277 B9R1.69 C[C@@H]1CC(=O)[C@@H](C)CC1 Amb24619935 [1,0,0,1,0,0|2,0,0]=4 3278 B9R1.69 C[C@@H]1CC(=O)[C@H](Cl)CC1 Amb24694008 [1,0,0,1,0,0|2,0,0]=4 3279 B9R1.69 C[C@@H]1CC[C@@H](N)[C@H](C)O1 Amb24514973 [1,0,0,1,0,0|1,0,1]=4 3280 B9R1.69 C[C@@H]1CC[C@@H](O)C(=O)N1 Amb25175096 [1,0,0,1,0,0|2,0,0]=4 3281 B9R1.69 C[C@H]1CC(=O)C(Br)CC1 Amb25774507 [1,0,0,1,0,0|2,0,0]=4 3282 B9R1.69 C[C@H]1CC(=O)C(F)CC1 Amb24690818 [1,0,0,1,0,0|2,0,0]=4 3283 B9R1.69 C[C@H]1CC(=O)[C@H](Br)CC1 Amb25366783 [1,0,0,1,0,0|2,0,0]=4 3284 B9R1.69 C[C@H]1CCC(N)C(=O)N1 Amb25378397 [1,0,0,1,0,0|1,0,0]=3 3285 B9R1.69 N[C@H]1CCC(=O)OC1=O Amb24680533 [1,0,0,1,0,0|1,0,1]=4 3286 B9R1.93 C#CC1CC1(N)C(O)=O Amb23456002 [1,0,0,1,0,0|0,0,2]=4 3287 B9R1.93 C=C[C@@H]1C[C@]1(N)C(O)=O Amb22744970 [1,0,0,1,0,0|0,0,2]=4 3288 B9R1.93 C=C[C@H]1C[C@]1(N)C(O)=O Amb25105090 [1,0,0,1,0,0|0,0,2]=4 3289 B9R1.93 CC1(CC1CN)C(O)=O Amb24550226 [1,0,0,1,0,0|1,0,0]=3 3290 B9R1.93 CC1(CC1CO)C(O)=O Amb24559345 [1,0,0,1,0,0|2,0,0]=4 3291 B9R1.93 CCC1CC1(C)C(C)=O Amb24443160 [1,0,0,1,0,0|2,0,0]=4 3292 B9R1.93 CCC1CC1(N)C(O)=O Amb24655862 [1,0,0,1,0,0|0,0,0]=2 3293 B9R1.93 CCC1OC1(C)C(O)=O Amb25843946 [1,0,0,1,0,0|2,0,0]=4 3294 B9R1.93 CC[C@@H]1CC1(N)C(O)=O Amb25104706 [1,0,0,1,0,0|0,0,0]=2 3295 B9R1.93 CC[C@@H]1C[C@@]1(C)C(C)=O Amb24564910 [1,0,0,1,0,0|2,0,0]=4 3296 B9R1.93 CC[C@@H]1C[C@@]1(N)C(O)=O Amb23452849 [1,0,0,1,0,0|0,0,0]=2 3297 B9R1.93 CC[C@@H]1C[C@@]1(O)C(O)=O Amb25377855 [1,0,0,1,0,0|1,0,0]=3 3298 B9R1.93 CC[C@@H]1C[C@]1(N)C(O)=O Amb23452884 [1,0,0,1,0,0|0,0,0]=2 3299 B9R1.93 C[C@]1(C[C@@H]1CN)C(O)=O Amb25339704 [1,0,0,1,0,0|1,0,0]=3 3300 B9R1.93 NC1(CC1C=C)C(=O)O Amb10068409 [1,0,0,1,0,0|0,0,2]=4 3301 B9R1.93 NC1(CC1CO)C(O)=O Amb25828351 [1,0,0,1,0,0|1,0,0]=3 3302 B9R1.93 NC[C@@H]1C[C@@]1(N)C(O)=O Amb24763621 [1,0,0,1,0,0|0,0,0]=2 3303 B9R1.93 N[C@@]1(C[C@H]1CO)C(O)=O Amb25101898 [1,0,0,1,0,0|1,0,0]=3 3304 B9R1.93 N[C@]1(C[C@@H]1CO)C(O)=O Amb24581240 [1,0,0,1,0,0|1,0,0]=3 3305 B9R1.93 OC(=O)C1(Cl)CC1CCl Amb24404084 [1,0,0,1,0,0|2,0,0]=4 3306 B9R1.95 CCC1CC(=C1)C(O)=O Amb25238748 [1,0,0,1,0,0|1,0,1]=4 3307 B9R1.95 CCC1CC(C1)C(=O)Cl Amb25791521 [1,0,0,1,0,0|2,0,0]=4 3308 B9R1.95 CCC1CC(C1)C(C)=O Amb25046444 [1,0,0,1,0,0|2,0,0]=4 3309 B9R1.95 CCC1CC(C1)C(N)=O Amb25690385 [1,0,0,1,0,0|2,0,0]=4 3310 B9R1.95 CCC1CC(C1)C(O)=O Amb23456004 [1,0,0,1,0,0|1,0,0]=3 3311 B9R1.95 CCN1CC(C1)C(O)=O Amb24117130 [1,0,0,1,0,0|2,0,0]=4 3312 B9R1.95 CC[C@@H]1C[C@@H](C1)C(O)=O Amb25129624 [1,0,0,1,0,0|1,0,0]=3 3313 B9R1.95 CNC1CC(C1)C(O)=O Amb20622656 [1,0,0,1,0,0|2,0,0]=4 3314 B9R1.95 CO[C@@H]1C[C@@H](C1)C(O)=O Amb23440276 [1,0,0,1,0,0|2,0,0]=4 3315 B9R1.95 CO[C@@H]1C[C@H](C1)C(O)=O Amb23440277 [1,0,0,1,0,0|2,0,0]=4 3316 B9R1.95 OC(=O)C1CC(CBr)C1 Amb19958667 [1,0,0,1,0,0|2,0,0]=4 3317 B9R1.95 OC(=O)[C@H]1C[C@@H](CBr)C1 Amb25116147 [1,0,0,1,0,0|2,0,0]=4 3318 B9R1.95 OCC1CC(C1)C(O)=O Amb22002175 [1,0,0,1,0,0|2,0,0]=4 3319 B9R1.95 OC[C@@H]1C[C@@H](N1)C(O)=O Amb24556421 [1,0,0,1,0,0|1,0,0]=3 3320 B9R1.110 CC(=C)C(N)C1CCC1 Amb25726126 [1,0,0,1,0,0|2,0,0]=4 3321 B9R1.110 CC(=O)C(N)C1CCC1 Amb25062195 [1,0,0,1,0,0|1,0,0]=3 3322 B9R1.110 CC(C(=O)O)C1CCC1 Amb17087517 [1,0,0,1,0,0|1,0,0]=3 3323 B9R1.110 CC(C(O)=O)N1CCC1 Amb24178905 [1,0,0,1,0,0|2,0,0]=4 3324 B9R1.110 CC(C1CSC1)C(O)=O Amb25200790 [1,0,0,1,0,0|2,0,0]=4 3325 B9R1.110 C[C@@H](C1CCC1)C(O)=O Amb22748271 [1,0,0,1,0,0|1,0,0]=3 3326 B9R1.110 C[C@@H](O)[C@@H](N)C1CCC1 Amb24514875 [1,0,0,1,0,0|1,0,1]=4 3327 B9R1.110 C[C@H](C1CCC1)C(O)=O Amb24360449 [1,0,0,1,0,0|1,0,0]=3 3328 B9R1.110 C[C@H](O)[C@H](N)C1CCC1 Amb25245251 [1,0,0,1,0,0|1,0,1]=4 3329 B9R1.110 NC(C1CCC1)C(O)=O Amb19149365 [1,0,0,1,0,0|0,0,0]=2 3330 B9R1.110 NC(C1CCC1)C(O)=O Amb21858491 [1,0,0,1,0,0|0,0,0]=2 3331 B9R1.110 NC(C1CCC1)P(O)=O Amb25721258 [1,0,0,1,0,0|1,0,0]=3 3332 B9R1.110 NC(C1CCO1)C(N)=O Amb25364480 [1,0,0,1,0,0|2,0,0]=4 3333 B9R1.110 NC(C1COC1)C(O)=O Amb22405987 [1,0,0,1,0,0|1,0,0]=3 3334 B9R1.110 NC(C1CSC1)C(N)=O Amb25287406 [1,0,0,1,0,0|2,0,0]=4 3335 B9R1.110 N[C@@H](C1CCC1)C(N)=O Amb24476623 [1,0,0,1,0,0|1,0,0]=3 3336 B9R1.110 N[C@@H](C1COC1)C(O)=O Amb22737551 [1,0,0,1,0,0|1,0,0]=3 3337 B9R1.110 N[C@H](C(O)=O)C=1CCC1 Amb25680165 [1,0,0,1,0,0|0,0,2]=4 3338 B9R1.110 N[C@H](C1COC1)C(O)=O Amb22737550 [1,0,0,1,0,0|1,0,0]=3 3339 B9R1.110 O=C(Cl)C(Br)C1CCC1 Amb24598080 [1,0,0,1,0,0|2,0,0]=4 3340 B9R1.110 O=C(Cl)C(Cl)C1CCC1 Amb25362548 [1,0,0,1,0,0|2,0,0]=4 3341 B9R1.110 OC(=O)C(=O)C1CCC1 Amb19958875 [1,0,0,1,0,0|1,0,1]=4 3342 B9R1.110 OC(=O)C(F)C1CNC1 Amb25110697 [1,0,0,1,0,0|2,0,0]=4 3343 B9R1.110 OC(C1CCC1)C(O)=O Amb24426901 [1,0,0,1,0,0|1,0,0]=3 3344 B9R1.110 OC(C1CNC1)C(O)=O Amb24339989 [1,0,0,1,0,0|2,0,0]=4 3345 B9R1.110 OC(C1CSC1)C(O)=O Amb24759238 [1,0,0,1,0,0|2,0,0]=4 3346 B9R1.112 C=C(CC1CC1)C(O)=O Amb24700361 [1,0,0,1,0,0|1,0,1]=4 3347 B9R1.112 CC(CC1CC1)C(C)=O Amb25188950 [1,0,0,1,0,0|2,0,0]=4 3348 B9R1.112 CC(SC1CC1)C(O)=O Amb25337757 [1,0,0,1,0,0|2,0,0]=4 3349 B9R1.112 C[C@@H](NC1CC1)C(O)=O Amb24398132 [1,0,0,1,0,0|2,0,0]=4 3350 B9R1.112 NC(CC1CC1)C(N)=O Amb25767604 [1,0,0,1,0,0|1,0,0]=3 3351 B9R1.112 NC(CC1CC1)C(O)=O Amb23399727 [1,0,0,1,0,0|0,0,0]=2 3352 B9R1.112 NC(CC1CO1)C(O)=O Amb25800055 [1,0,0,1,0,0|1,0,0]=3 3353 B9R1.112 N[C@@H](CC1CC1)C(N)=O Amb25317927 [1,0,0,1,0,0|1,0,0]=3 3354 B9R1.112 N[C@@H](CC1CC1)C(O)=O Amb24329024 [1,0,0,1,0,0|0,0,0]=2 3355 B9R1.112 N[C@@H](CC1CO1)C(O)=O Amb25709170 [1,0,0,1,0,0|1,0,0]=3 3356 B9R1.112 N[C@H](CC1CC1)C(N)=O Amb24410138 [1,0,0,1,0,0|1,0,0]=3 3357 B9R1.112 OC(=O)C(=O)CC1CC1 Amb18988329 [1,0,0,1,0,0|1,0,1]=4 3358 B9R1.112 OC(=O)C(S)CC1CC1 Amb18296302 [1,0,0,1,0,0|1,0,0]=3 3359 B9R1.112 OC(=O)[C@H](Br)CC1CC1 Amb24480301 [1,0,0,1,0,0|1,0,0]=3 3360 B9R1.112 OC(CC1CC1)C(O)=O Amb25082516 [1,0,0,1,0,0|1,0,0]=3 3361 B9R1.112 O[C@@H](CC1CC1)C(O)=O Amb23401512 [1,0,0,1,0,0|1,0,0]=3 3362 B9R1.159 CC1CCC1(N)C(N)=O Amb24391671 [1,0,0,1,0,0|1,0,0]=3 3363 B9R1.159 CC1CCC1(N)C(O)=O Amb23456072 [1,0,0,1,0,0|0,0,0]=2 3364 B9R1.159 C[C@@H]1CC[C@]1(N)C(O)=O Amb24586126 [1,0,0,1,0,0|0,0,0]=2 3365 B9R1.159 C[C@H]1CC[C@@]1(C)C(O)=O Amb24575030 [1,0,0,1,0,0|1,0,0]=3 3366 B9R1.159 NC1(CCC1F)C(O)=O Amb25223441 [1,0,0,1,0,0|1,0,0]=3 3367 B9R1.159 N[C@@H]1CC[C@]1(N)C(O)=O Amb25233319 [1,0,0,1,0,0|0,0,0]=2 3368 B9R1.159 N[C@@]1(CC[C@H]1O)C(O)=O Amb25313173 [1,0,0,1,0,0|1,0,0]=3 3369 B9R1.159 OC1CCC1(O)C(O)=O Amb24477886 [1,0,0,1,0,0|2,0,0]=4 3370 B9R1.163 CC(=O)C1(C)CCCC1 Amb17593318 [1,0,0,1,0,0|2,0,0]=4 3371 B9R1.163 CC(=O)C1(C)CCCN1 Amb25789427 [1,0,0,1,0,0|2,0,0]=4 3372 B9R1.163 CC(=O)C1(N)CCCC1 Amb1091405 [1,0,0,1,0,0|1,0,0]=3 3373 B9R1.163 CC(=O)C1(N)CCCC1 Amb22283948 [1,0,0,1,0,0|1,0,0]=3 3374 B9R1.163 CC(=O)C1(N)COCC1 Amb24427660 [1,0,0,1,0,0|2,0,0]=4 3375 B9R1.163 CC(=O)C1(O)CCCC1 Amb17593345 [1,0,0,1,0,0|2,0,0]=4 3376 B9R1.163 CC(O)C1(N)CCCC1 Amb18832559 [1,0,0,1,0,0|1,0,1]=4 3377 B9R1.163 CC1(CCCC1)C(=O)Cl Amb24476587 [1,0,0,1,0,0|2,0,0]=4 3378 B9R1.163 CC1(CCCN1)C(N)=O Amb20061427 [1,0,0,1,0,0|2,0,0]=4 3379 B9R1.163 CC1(CCCN1)C(N)=O Amb21960323 [1,0,0,1,0,0|2,0,0]=4 3380 B9R1.163 CC1(CCCN1)C(O)=O Amb22587331 [1,0,0,1,0,0|1,0,0]=3 3381 B9R1.163 CC1(CCCS1)C(O)=O Amb20623191 [1,0,0,1,0,0|2,0,0]=4 3382 B9R1.163 CC1(CNCC1)C(O)=O Amb20634439 [1,0,0,1,0,0|2,0,0]=4 3383 B9R1.163 CC1(COCC1)C(O)=O Amb18280535 [1,0,0,1,0,0|2,0,0]=4 3384 B9R1.163 C[C@@]1(CCCN1)C(N)=O Amb25146194 [1,0,0,1,0,0|2,0,0]=4 3385 B9R1.163 C[C@@]1(CCCN1)C(O)=O Amb22406107 [1,0,0,1,0,0|1,0,0]=3 3386 B9R1.163 C[C@@]1(CCCO1)C(O)=O Amb24117235 [1,0,0,1,0,0|2,0,0]=4 3387 B9R1.163 C[C@]1(CCCN1)C(N)=O Amb24410858 [1,0,0,1,0,0|2,0,0]=4 3388 B9R1.163 C[C@]1(CCCN1)C(O)=O Amb22405952 [1,0,0,1,0,0|1,0,0]=3 3389 B9R1.163 C[C@]1(CNCC1)C(O)=O Amb24346794 [1,0,0,1,0,0|2,0,0]=4 3390 B9R1.163 NC(=N)C1(N)CCCC1 Amb25260496 [1,0,0,1,0,0|2,0,0]=4 3391 B9R1.163 NC(=O)C1(N)CCCC1 Amb19265774 [1,0,0,1,0,0|1,0,0]=3 3392 B9R1.163 NC(=O)C1(N)COCC1 Amb25835775 [1,0,0,1,0,0|2,0,0]=4 3393 B9R1.163 NC(=O)C1(N)CSCC1 Amb18279185 [1,0,0,1,0,0|2,0,0]=4 3394 B9R1.163 NC(=O)C1(O)CCCC1 Amb24116816 [1,0,0,1,0,0|2,0,0]=4 3395 B9R1.163 NC(=S)C1(N)CCCC1 Amb19374908 [1,0,0,1,0,0|1,1,0]=4 3396 B9R1.163 NC1(CCCC1)P(O)=O Amb24561449 [1,0,0,1,0,0|1,0,0]=3 3397 B9R1.163 NC1(CNCC1)C(O)=O Amb22490624 [1,0,0,1,0,0|1,0,0]=3 3398 B9R1.163 NC1(COCC1)C(O)=O Amb22274600 [1,0,0,1,0,0|1,0,0]=3 3399 B9R1.163 NC1(CSCC1)C(O)=O Amb22274058 [1,0,0,1,0,0|1,0,0]=3 3400 B9R1.163 N[C@@]1(COCC1)C(O)=O Amb20241211 [1,0,0,1,0,0|1,0,0]=3 3401 B9R1.163 N[C@]1(COCC1)C(O)=O Amb20241209 [1,0,0,1,0,0|1,0,0]=3 3402 B9R1.163 N[C@]1(CSCC1)C(O)=O Amb24476636 [1,0,0,1,0,0|1,0,0]=3 3403 B9R1.163 O=C(Cl)C1(Cl)CCCC1 Amb25106802 [1,0,0,1,0,0|2,0,0]=4 3404 B9R1.163 OC(=O)C1(Br)CCCC1 Amb17595053 [1,0,0,1,0,0|1,0,0]=3 3405 B9R1.163 OC(=O)C1(C)CCCN1 Amb15701407 [1,0,0,1,0,0|1,0,0]=3 3406 B9R1.163 OC(=O)C1(C)CCCO1 Amb1088877 [1,0,0,1,0,0|2,0,0]=4 3407 B9R1.163 OC(=O)C1(F)CNCC1 Amb24120613 [1,0,0,1,0,0|2,0,0]=4 3408 B9R1.163 OC(=O)C1(F)COCC1 Amb24420228 [1,0,0,1,0,0|2,0,0]=4 3409 B9R1.163 OC(=O)C1(F)CSCC1 Amb24541152 [1,0,0,1,0,0|2,0,0]=4 3410 B9R1.163 OC(=O)C1(N)CCCC1 Amb1838882 [1,0,0,1,0,0|0,0,0]=2 3411 B9R1.163 OC(=O)C1(N)COCC1 Amb16232669 [1,0,0,1,0,0|1,0,0]=3 3412 B9R1.163 OC(=O)C1(O)CCCC1 Amb1159211 [1,0,0,1,0,0|1,0,0]=3 3413 B9R1.163 OC(=O)C1(O)CNCC1 Amb22500918 [1,0,0,1,0,0|2,0,0]=4 3414 B9R1.163 OC(=O)C1(O)CNCC1 Amb22899772 [1,0,0,1,0,0|2,0,0]=4 3415 B9R1.163 OC(=O)C1(O)CSCC1 Amb18944714 [1,0,0,1,0,0|2,0,0]=4 3416 B9R1.163 OC(=O)[C@@]1(F)CCCN1 Amb22748241 [1,0,0,1,0,0|1,0,0]=3 3417 B9R1.163 OC(=O)[C@]1(C)CCCN1 Amb10603262 [1,0,0,1,0,0|1,0,0]=3 3418 B9R1.163 OC(=O)[C@]1(O)COCC1 Amb24389865 [1,0,0,1,0,0|2,0,0]=4 3419 B9R1.163 [2H]C1(CCCN1)C(O)=O Amb22367354 [1,0,0,1,0,0|1,0,0]=3 3420 B9R1.163 [NH3+]C1(C[NH2+]CC1)C(O)=O Amb22583868 [1,0,0,1,0,0|1,0,1]=4 3421 B11R1.27 CCCCC[C@@H]1COC(=O)N1 Amb24765069 [0,0,0,1,0,1|2,0,0]=4 3422 B11R1.34 C[C@@H]1C[C@H](CCO)OC(=O)C1 Amb24605031 [0,0,0,1,0,1|2,0,0]=4 3423 B11R1.34 OC1CC(CCCl)OC(=O)C1 Amb25758663 [0,0,0,1,0,1|2,0,0]=4 3424 B11R1.43 CCC1CC(CC1)CC(O)=O Amb25715115 [0,0,0,1,0,1|2,0,0]=4 3425 B11R1.43 NCC1CC(CC1)NC(N)=O Amb25309847 [0,0,0,1,0,1|2,0,0]=4 3426 B11R1.43 NCC1CCC(CC(O)=O)O1 Amb18199868 [0,0,0,1,0,1|1,0,0]=3 3427 B11R1.43 NCC1CCC(CC(O)=O)S1 Amb18197103 [0,0,0,1,0,1|1,0,0]=3 3428 B11R1.43 NCC1CN(CC(O)=O)CC1 Amb18296148 [0,0,0,1,0,1|2,0,0]=4 3429 B11R1.43 OCC1CC(CC1)CC(O)=O Amb25054034 [0,0,0,1,0,1|2,0,0]=4 3430 B11R1.77 CC(C1CCCC1)CC(=O)O Amb17506860 [0,0,0,1,0,1|2,0,0]=4 3431 B11R1.77 CC(CC(O)=O)C1CCCN1 Amb23536753 [0,0,0,1,0,1|1,0,0]=3 3432 B11R1.77 CC(CC(O)=O)N1CCCN1 Amb25202799 [0,0,0,1,0,1|2,0,0]=4 3433 B11R1.77 NC(CC(N)=O)C1CCCC1 Amb18296015 [0,0,0,1,0,1|2,0,0]=4 3434 B11R1.77 N[C@@H](CC(O)=O)C1CCCC1 Amb22748847 [0,0,0,1,0,1|1,0,0]=3 3435 B11R1.77 N[C@@H](CC(O)=O)C1CCCC1 Amb24670269 [0,0,0,1,0,1|1,0,0]=3 3436 B11R1.77 N[C@H](CC(N)=O)C1CCCO1 Amb24528295 [0,0,0,1,0,1|2,0,0]=4 3437 B11R1.77 OC(CC(O)=O)C1CCCC1 Amb18990583 [0,0,0,1,0,1|2,0,0]=4 3438 B11R1.88 CC1OCCC1(N)CC(O)=O Amb24735357 [0,0,0,1,0,1|2,0,0]=4 3439 B11R1.107 NC1CC(=O)NCCCCC1 Amb25732360 [0,0,0,1,0,1|2,0,0]=4 3440 B11R1.120 CCCC1CC(CC(O)=O)C1 Amb25384948 [0,0,0,1,0,1|2,0,0]=4 3441 B11R1.128 COCC1CC1(N)CC(O)=O Amb25386043 [0,0,0,1,0,1|2,0,0]=4 3442 B11R1.143 CC1CCCCCC1C(O)=O Amb25361762 [0,0,0,1,0,1|2,0,0]=4 3443 B11R1.143 NC1CCCCCC1C(N)=O Amb20668797 [0,0,0,1,0,1|2,0,0]=4 3444 B11R1.143 NC1CCCCCC1C(N)=O Amb22059737 [0,0,0,1,0,1|2,0,0]=4 3445 B11R1.143 NC=1CCCCCC1C(O)=O Amb24620224 [0,0,0,1,0,1|1,0,1]=4 3446 B11R1.143 OC(=O)C1CCCCCC1S Amb18949212 [0,0,0,1,0,1|2,0,0]=4 3447 B11R1.143 OC(=O)[C@@H]1CCCCC[C@@H]1N Amb1993850 [0,0,0,1,0,1|1,0,0]=3 3448 B11R1.143 OC(=O)[C@@H]1CCCCC[C@@H]1N Amb1994003 [0,0,0,1,0,1|1,0,0]=3 3449 B11R1.143 OC(=O)[C@H]1CCCCC[C@H]1N Amb1993851 [0,0,0,1,0,1|1,0,0]=3 3450 B11R1.143 OC(=O)[C@H]1CCCCC[C@H]1N Amb1994004 [0,0,0,1,0,1|1,0,0]=3 3451 B11R1.143 OC1CCCCCC1C(O)=O Amb18280963 [0,0,0,1,0,1|2,0,0]=4 3452 B11R1.156 CC1CCCC(N)C1C(N)=O Amb18182135 [0,0,0,1,0,1|2,0,0]=4 3453 B11R1.156 C[C@@H]1CCC[C@@H](C)C1C(O)=O Amb25202408 [0,0,0,1,0,1|2,0,0]=4 3454 B11R1.156 C[C@@H]1CCC[C@H](N)[C@@H]1C(O)=O Amb24612184 [0,0,0,1,0,1|1,0,0]=3 3455 B11R1.156 C[C@H]1CCC[C@@H](C)[C@@H]1C(O)=O Amb24711507 [0,0,0,1,0,1|2,0,0]=4 3456 B11R1.156 N[C@H]1CCC[C@H](O)[C@@H]1C(O)=O Amb24710152 [0,0,0,1,0,1|1,0,0]=3 3457 B11R1.157 CC(=O)CC1CCCC(N)C1 Amb24685265 [0,0,0,1,0,1|2,0,0]=4 3458 B11R1.157 CC(=O)N[C@@H]1CCC[C@H](N)C1 Amb25243054 [0,0,0,1,0,1|2,0,0]=4 3459 B11R1.157 CC1CCCC(CC(C)=O)N1 Amb25100933 [0,0,0,1,0,1|2,0,0]=4 3460 B11R1.157 CC1CCCC(CC(O)=O)O1 Amb18126127 [0,0,0,1,0,1|2,0,0]=4 3461 B11R1.157 C[C@@H]1CCC[C@@H](CC(O)=O)O1 Amb24609908 [0,0,0,1,0,1|2,0,0]=4 3462 B11R1.157 C[C@H]1CC(CC(O)=O)CCC1 Amb24677826 [0,0,0,1,0,1|2,0,0]=4 3463 B11R1.157 C[C@H]1CCC[C@@H](CC(C)=O)N1 Amb25179321 [0,0,0,1,0,1|2,0,0]=4 3464 B11R1.157 C[C@H]1CCC[C@@H](CC(O)=O)N1 Amb24669005 [0,0,0,1,0,1|1,0,0]=3 3465 B11R1.157 C[C@H]1CCC[C@@H](CC(O)=O)O1 Amb25201003 [0,0,0,1,0,1|2,0,0]=4 3466 B11R1.157 C[C@H]1C[C@@H](CC(O)=O)CCC1 Amb25179080 [0,0,0,1,0,1|2,0,0]=4 3467 B11R1.157 NC1CC(CC(O)=O)CCC1 Amb18644926 [0,0,0,1,0,1|1,0,0]=3 3468 B11R1.157 NC1CCCC(C1)CC(N)=O Amb18964224 [0,0,0,1,0,1|2,0,0]=4 3469 B11R1.157 NC1CCCC(C1)OC(N)=O Amb24724510 [0,0,0,1,0,1|2,0,0]=4 3470 B11R1.157 NC1CN(CC(O)=O)CCC1 Amb18955426 [0,0,0,1,0,1|2,0,0]=4 3471 B11R1.157 NC1C\C(\CCC1)=C\C(O)=O Amb24740593 [0,0,0,1,0,1|1,0,1]=4 3472 B11R1.157 N[C@H]1C[C@H](CC(O)=O)CCC1 Amb24627101 [0,0,0,1,0,1|1,0,0]=3 3473 B11R1.157 OC(=O)CC1CCCC(=O)N1 Amb18200018 [0,0,0,1,0,1|1,0,1]=4 3474 B11R1.157 OC(=O)CC1CCCC(Cl)C1 Amb18648013 [0,0,0,1,0,1|2,0,0]=4 3475 B11R1.157 OC(=O)CC1CCCC(F)C1 Amb24651233 [0,0,0,1,0,1|2,0,0]=4 3476 B11R1.157 OC1CCCC(C1)CC(O)=O Amb18645020 [0,0,0,1,0,1|2,0,0]=4 3477 B11R1.157 O[C@@H]1CCC[C@H](C1)CC(O)=O Amb25257413 [0,0,0,1,0,1|2,0,0]=4 3478 B11R1.157 O[C@H]1CCC[C@H](C1)CC(O)=O Amb24552923 [0,0,0,1,0,1|2,0,0]=4 3479 B11R1.230 CC1CC(=O)OC1CCCC Amb15692528 [0,0,0,1,0,1|2,0,0]=4 3480 B11R1.230 CC1NC(=O)OC1CCCO Amb24378115 [0,0,0,1,0,1|2,0,0]=4 3481 B11R1.230 CCCCC1OC(=O)N=C1N Amb24693411 [0,0,0,1,0,1|1,0,1]=4 3482 B11R1.230 CCCC[C@H]1OC(=O)C[C@@H]1O Amb25369404 [0,0,0,1,0,1|2,0,0]=4 3483 B11R1.230 C[C@@H]1CC(=O)OC1CCCO Amb25236083 [0,0,0,1,0,1|2,0,0]=4 3484 B11R1.230 C[C@@H]1CC(=O)O[C@H]1CCCC Amb24674272 [0,0,0,1,0,1|2,0,0]=4 3485 B11R1.230 C[C@H]1NC(=O)O[C@@H]1CCCO Amb25213083 [0,0,0,1,0,1|2,0,0]=4 3486 B11R1.230 N[C@@H]1CC(=O)O[C@H]1CCCBr Amb25175789 [0,0,0,1,0,1|1,0,0]=3 3487 B11R1.471 CC1CCC(CC)C1C(O)=O Amb25779324 [0,0,0,1,0,1|2,0,0]=4 3488 B11R1.471 CCC1CCC(N)C1C(O)=O Amb25222054 [0,0,0,1,0,1|1,0,0]=3 3489 B11R1.471 CN1CC[C@@H](CN)[C@@H]1C(O)=O Amb18199895 [0,0,0,1,0,1|2,0,0]=4 3490 B11R1.484 CC(CC1CCC1)CC(O)=O Amb25382090 [0,0,0,1,0,1|2,0,0]=4 3491 B11R1.484 CC(CC1CCN1)NC(N)=O Amb24665978 [0,0,0,1,0,1|2,0,0]=4 3492 B11R1.484 NC(CC1CCC1)CC(O)=O Amb25383680 [0,0,0,1,0,1|1,0,0]=3 3493 B11R1.742 CC(=O)CC1CCCCCN1 Amb23585599 [0,0,0,1,0,1|2,0,0]=4 3494 B11R1.742 CC(=O)NC1CNCCCC1 Amb25727717 [0,0,0,1,0,1|2,0,0]=4 3495 B11R1.742 NC(=O)CC1CCCCCN1 Amb25209448 [0,0,0,1,0,1|2,0,0]=4 3496 B11R1.742 OC(=O)CC1CCCCCN1 Amb18199972 [0,0,0,1,0,1|1,0,0]=3 3497 B11R1.742 OC(=O)CC1CNCCCC1 Amb18199974 [0,0,0,1,0,1|1,0,0]=3 3498 B11R1.742 OC(=O)CC1CNCCCO1 Amb25236359 [0,0,0,1,0,1|2,0,0]=4 3499 B11R1.742 OC(=O)C[C@H]1CCCCC=C1 Amb25798948 [0,0,0,1,0,1|2,0,0]=4 3500 B11R1.928 CC(=O)CC1(C)CCCCN1 Amb25844058 [0,0,0,1,0,1|2,0,0]=4 3501 B11R1.928 CC(=O)CC1(N)CCCCC1 Amb24488108 [0,0,0,1,0,1|2,0,0]=4 3502 B11R1.928 NC(=O)CC1(N)CCCCC1 Amb25151318 [0,0,0,1,0,1|2,0,0]=4 3503 B11R1.928 NC1(CC(=O)Cl)CCCCC1 Amb24376036 [0,0,0,1,0,1|2,0,0]=4 3504 B11R1.928 NC1(CC(O)=O)CCNCC1 Amb25085887 [0,0,0,1,0,1|2,0,0]=4 3505 B11R1.928 NC1(CNCCC1)CC(O)=O Amb24486933 [0,0,0,1,0,1|2,0,0]=4 3506 B11R1.928 OC(=O)CC1(C)CCCCC1 Amb17194149 [0,0,0,1,0,1|2,0,0]=4 3507 B11R1.928 OC(=O)CC1(N)CCCCC1 Amb10602480 [0,0,0,1,0,1|1,0,0]=3 3508 B11R1.928 OC(=O)CC1(N)CCOCC1 Amb19135893 [0,0,0,1,0,1|2,0,0]=4 3509 B11R1.928 OC(=O)CC1(N)CCSCC1 Amb19135848 [0,0,0,1,0,1|2,0,0]=4 3510 B11R1.155 N[C@@H]1CC(CCC1)S(O)(=O)=O Amb25374093 [0,1,0,1,0,0|2,0,0]=4 3511 B11R1.35 CC(C(=O)O)CC1CCCC1 Amb10844013 [0,1,0,1,0,0|2,0,0]=4 3512 B11R1.35 CC(C(=O)O)CC1OCCO1 Amb17334489 [0,1,0,1,0,0|2,0,0]=4 3513 B11R1.35 CC(CC1CCCO1)C(O)=O Amb18994653 [0,1,0,1,0,0|2,0,0]=4 3514 B11R1.35 CC(CC1CCOC1)C(O)=O Amb25315971 [0,1,0,1,0,0|2,0,0]=4 3515 B11R1.35 CC(CN1CCCC1)C(O)=O Amb22587263 [0,1,0,1,0,0|2,0,0]=4 3516 B11R1.35 CC(CN1CCCN1)C(N)=O Amb24630128 [0,1,0,1,0,0|2,0,0]=4 3517 B11R1.35 CC(OC1CCNC1)C(O)=O Amb25148231 [0,1,0,1,0,0|2,0,0]=4 3518 B11R1.35 C[C@@H](NC1CCCC1)C(O)=O Amb25151812 [0,1,0,1,0,0|2,0,0]=4 3519 B11R1.35 C[C@@H](NC1CNCC1)C(O)=O Amb25829116 [0,1,0,1,0,0|2,0,0]=4 3520 B11R1.35 C[C@@H](OC1CCCC1)C(O)=O Amb24385410 [0,1,0,1,0,0|2,0,0]=4 3521 B11R1.35 C[C@H](NC1CCCC1)C(O)=O Amb17772284 [0,1,0,1,0,0|2,0,0]=4 3522 B11R1.35 C[C@H](OC1CCCC1)C(O)=O Amb25841911 [0,1,0,1,0,0|2,0,0]=4 3523 B11R1.35 NC(CC1CCCO1)C(N)=O Amb25052480 [0,1,0,1,0,0|2,0,0]=4 3524 B11R1.35 NC(CC1CCNC1)C(O)=O Amb22002696 [0,1,0,1,0,0|0,0,0]=2 3525 B11R1.35 NC(CC1CCOC1)C(O)=O Amb18979090 [0,1,0,1,0,0|1,0,0]=3 3526 B11R1.35 NC(CC1COCC1)C(N)=O Amb24487738 [0,1,0,1,0,0|2,0,0]=4 3527 B11R1.35 NC(CN1CCCC1)C(N)=O Amb18984331 [0,1,0,1,0,0|2,0,0]=4 3528 B11R1.35 NC(CN1CCCC1)C(O)=O Amb18293486 [0,1,0,1,0,0|1,0,0]=3 3529 B11R1.35 NC(C[C@@H]1CCCO1)C(O)=O Amb24639753 [0,1,0,1,0,0|1,0,0]=3 3530 B11R1.35 NC(C[C@@H]1CCCS1)C(O)=O Amb25255808 [0,1,0,1,0,0|1,0,0]=3 3531 B11R1.35 N[C@@H](CC1CCCN1)C(O)=O Amb25124150 [0,1,0,1,0,0|0,0,0]=2 3532 B11R1.35 N[C@@H](CC1CCCO1)C(O)=O Amb24373217 [0,1,0,1,0,0|1,0,0]=3 3533 B11R1.35 N[C@@H](CC1CCNC1)C(O)=O Amb22228974 [0,1,0,1,0,0|0,0,0]=2 3534 B11R1.35 N[C@@H](CC1CCOC1)C(O)=O Amb18797502 [0,1,0,1,0,0|1,0,0]=3 3535 B11R1.35 N[C@@H](CN1CCCC1)C(O)=O Amb25304318 [0,1,0,1,0,0|1,0,0]=3 3536 B11R1.35 N[C@H](CC1CCNC1)C(O)=O Amb22228965 [0,1,0,1,0,0|0,0,0]=2 3537 B11R1.35 OC(=O)C(CC1=CCCC1)C Amb10844012 [0,1,0,1,0,0|2,0,0]=4 3538 B11R1.35 OC(=O)C(Cl)CN1CCCC1 Amb24741355 [0,1,0,1,0,0|2,0,0]=4 3539 B11R1.35 OC(=O)C(F)CC1CCCC1 Amb25706351 [0,1,0,1,0,0|2,0,0]=4 3540 B11R1.35 OC(=O)C(F)CC1CCOC1 Amb25712274 [0,1,0,1,0,0|2,0,0]=4 3541 B11R1.35 OC(=O)C(F)OC1CCCC1 Amb25045342 [0,1,0,1,0,0|2,0,0]=4 3542 B11R1.35 OC(=O)C(F)SC1CCCC1 Amb25828149 [0,1,0,1,0,0|2,0,0]=4 3543 B11R1.35 OC(=O)C(S)CC1CCCC1 Amb18296291 [0,1,0,1,0,0|2,0,0]=4 3544 B11R1.35 OC(=O)C(S)CC1CCCO1 Amb24370196 [0,1,0,1,0,0|2,0,0]=4 3545 B11R1.35 OC(=O)C(S)CC1CCOC1 Amb18296306 [0,1,0,1,0,0|2,0,0]=4 3546 B11R1.35 OC(CC1COCC1)C(O)=O Amb24643044 [0,1,0,1,0,0|2,0,0]=4 3547 B11R1.35 OC(CN1CCCC1)C(O)=O Amb24437853 [0,1,0,1,0,0|2,0,0]=4 3548 B11R1.35 O[C@@H](CC1CCCC1)C(O)=O Amb25700901 [0,1,0,1,0,0|2,0,0]=4 3549 B11R1.48 CC1CC(CC1CC)C(O)=O Amb24534431 [0,1,0,1,0,0|2,0,0]=4 3550 B11R1.48 CC1CC(NC1CC)C(O)=O Amb18200003 [0,1,0,1,0,0|1,0,0]=3 3551 B11R1.48 CC1CC(OC1CC)C(O)=O Amb24400033 [0,1,0,1,0,0|2,0,0]=4 3552 B11R1.48 NC[C@@H]1O[C@@H](C[C@H]1O)C(O)=O Amb17933205 [0,1,0,1,0,0|1,0,0]=3 3553 B11R1.48 NC[C@@H]1O[C@H](C[C@H]1O)C(O)=O Amb17933206 [0,1,0,1,0,0|1,0,0]=3 3554 B11R1.48 NC[C@H]1O[C@@H](C[C@@H]1O)C(=O)O Amb10066960 [0,1,0,1,0,0|1,0,0]=3 3555 B11R1.48 NC[C@H]1O[C@H](C[C@@H]1O)C(=O)O Amb10066959 [0,1,0,1,0,0|1,0,0]=3 3556 B11R1.48 OC1CC(NC1CO)C(O)=O Amb24356688 [0,1,0,1,0,0|1,0,0]=3 3557 B11R1.48 O[C@H]1C[C@@H](N[C@H]1CO)C(O)=O Amb25176112 [0,1,0,1,0,0|1,0,0]=3 3558 B11R1.48 O[C@H]1C[C@H](N[C@H]1CO)C(O)=O Amb25273969 [0,1,0,1,0,0|1,0,0]=3 3559 B11R1.74 CC1CC(=O)CC(N1)C(O)=O Amb18200027 [0,1,0,1,0,0|1,0,1]=4 3560 B11R1.74 CC1CC(N)CC(C1)C(N)=O Amb24486747 [0,1,0,1,0,0|2,0,0]=4 3561 B11R1.74 CC1CC(NC(C)C1)C(O)=O Amb24588101 [0,1,0,1,0,0|1,0,0]=3 3562 B11R1.74 CC1CC(O)CC(C1)C(O)=O Amb24740731 [0,1,0,1,0,0|2,0,0]=4 3563 B11R1.74 CC1CC(OC(C)C1)C(O)=O Amb18830486 [0,1,0,1,0,0|2,0,0]=4 3564 B11R1.74 CC1CS(=O)CC(N1)C(O)=O Amb22304712 [0,1,0,1,0,0|2,0,0]=4 3565 B11R1.74 C[C@@H]1C[C@@H](C[C@H](C)C1)C(O)=O Amb24487888 [0,1,0,1,0,0|2,0,0]=4 3566 B11R1.74 C[C@H]1CS(=O)C[C@@H](N1)C(O)=O Amb24565788 [0,1,0,1,0,0|2,0,0]=4 3567 B11R1.74 NC1CC(NC(=O)C1)C(O)=O Amb18199921 [0,1,0,1,0,0|1,0,1]=4 3568 B11R1.74 OC(=O)C1CC(F)CC(F)C1 Amb25854232 [0,1,0,1,0,0|2,0,0]=4 3569 B11R1.74 OC(=O)[C@@H]1C[C@H](O)CC(=O)N1 Amb24693924 [0,1,0,1,0,0|1,0,1]=4 3570 B11R1.89 CC(C1CCCC1=C)C(O)=O Amb25201582 [0,1,0,1,0,0|2,0,0]=4 3571 B11R1.89 CC(C1CCCC1=O)C(O)=O Amb18125958 [0,1,0,1,0,0|2,0,0]=4 3572 B11R1.89 CC(C1CCCN1C)C(O)=O Amb18199971 [0,1,0,1,0,0|1,0,0]=3 3573 B11R1.89 CC(C1CCSC1C)C(O)=O Amb25200711 [0,1,0,1,0,0|2,0,0]=4 3574 B11R1.89 CC([C@@H]1CCC[C@H]1O)C(O)=O Amb25208062 [0,1,0,1,0,0|2,0,0]=4 3575 B11R1.89 CC1CCCC1C(C)C(O)=O Amb24645562 [0,1,0,1,0,0|2,0,0]=4 3576 B11R1.89 CC1CCCC1C(F)C(O)=O Amb25823406 [0,1,0,1,0,0|2,0,0]=4 3577 B11R1.89 CC1CCCC1C(O)C(O)=O Amb25217460 [0,1,0,1,0,0|2,0,0]=4 3578 B11R1.89 CC1CCCN1C(C)C(O)=O Amb18284138 [0,1,0,1,0,0|2,0,0]=4 3579 B11R1.89 CC1CSCC1C(C)C(O)=O Amb25352801 [0,1,0,1,0,0|2,0,0]=4 3580 B11R1.89 CC1CSCC1C(F)C(O)=O Amb24549162 [0,1,0,1,0,0|2,0,0]=4 3581 B11R1.89 CC1OCCC1C(F)C(O)=O Amb24576700 [0,1,0,1,0,0|2,0,0]=4 3582 B11R1.89 CC1SCCC1C(F)C(O)=O Amb25229704 [0,1,0,1,0,0|2,0,0]=4 3583 B11R1.89 CN1CCCC1C(N)C(O)=O Amb25683390 [0,1,0,1,0,0|0,0,0]=2 3584 B11R1.89 CN1CCN=C1C(N)C(O)=O Amb18200006 [0,1,0,1,0,0|1,0,1]=4 3585 B11R1.89 NC(C1CC=CC1O)C(O)=O Amb24729644 [0,1,0,1,0,0|1,0,1]=4 3586 B11R1.89 NC(C1CCCC1=O)C(O)=O Amb24595573 [0,1,0,1,0,0|1,0,0]=3 3587 B11R1.89 NC(C1CCCC1O)C(O)=O Amb24484702 [0,1,0,1,0,0|1,0,0]=3 3588 B11R1.89 N[C@@H]([C@@H]1CC=C[C@@H]1O)C(O)=O Amb25232620 [0,1,0,1,0,0|1,0,1]=4 3589 B11R1.89 N[C@@H]([C@@H]1CC=C[C@H]1O)C(O)=O Amb25201053 [0,1,0,1,0,0|1,0,1]=4 3590 B11R1.89 N[C@@H]([C@H]1CCC[C@H]1O)C(O)=O Amb25294355 [0,1,0,1,0,0|1,0,0]=3 3591 B11R1.89 N[C@H](C1CCCC1O)C(O)=O Amb24355871 [0,1,0,1,0,0|1,0,0]=3 3592 B11R1.89 OC(=O)C(O)C1CCCC1=O Amb25321958 [0,1,0,1,0,0|2,0,0]=4 3593 B11R1.124 C#CCC1CCC(N1)C(O)=O Amb24470439 [0,1,0,1,0,0|1,0,0]=3 3594 B11R1.124 C=CCC1CNC(C1)C(O)=O Amb25027902 [0,1,0,1,0,0|1,0,1]=4 3595 B11R1.124 C=CC[C@@H]1CN[C@H](C1)C(O)=O Amb22752941 [0,1,0,1,0,0|1,0,1]=4 3596 B11R1.124 C=CC[C@@H]1CN[C@H](C1)C(O)=O Amb22752975 [0,1,0,1,0,0|1,0,1]=4 3597 B11R1.124 C=CC[C@H]1CC[C@H](N1)C(O)=O Amb24512707 [0,1,0,1,0,0|1,0,0]=3 3598 B11R1.124 CCCC1CC(CC1)C(O)=O Amb24650608 [0,1,0,1,0,0|2,0,0]=4 3599 B11R1.124 CCCC1CC(CN1)C(C)=O Amb18644757 [0,1,0,1,0,0|2,0,0]=4 3600 B11R1.124 CCCC1CC(NC1)C(O)=O Amb18126070 [0,1,0,1,0,0|1,0,0]=3 3601 B11R1.124 CCCC1CCC(N1)C(O)=O Amb24423990 [0,1,0,1,0,0|1,0,0]=3 3602 B11R1.124 CCCC1C[C@H](NC1)C(O)=O Amb24487717 [0,1,0,1,0,0|1,0,0]=3 3603 B11R1.124 CCCC1N[C@@H](CS1)C(O)=O Amb18180517 [0,1,0,1,0,0|1,0,0]=3 3604 B11R1.124 CCCC1N[C@H](CS1)C(O)=O Amb25685699 [0,1,0,1,0,0|1,0,0]=3 3605 B11R1.124 CCCN1CC(CC1)C(O)=O Amb18302805 [0,1,0,1,0,0|2,0,0]=4 3606 B11R1.124 CCC[C@H]1CC[C@@H](N1)C(O)=O Amb25338321 [0,1,0,1,0,0|1,0,0]=3 3607 B11R1.124 CCC[C@H]1C[C@H](NC1)C(O)=O Amb24692815 [0,1,0,1,0,0|1,0,0]=3 3608 B11R1.124 CCC[C@H]1N[C@@H](CS1)C(O)=O Amb25176275 [0,1,0,1,0,0|1,0,0]=3 3609 B11R1.124 CCNC1CC(CC1)C(O)=O Amb23454120 [0,1,0,1,0,0|2,0,0]=4 3610 B11R1.124 CCO[C@@H]1CN[C@@H](C1)C(O)=O Amb24558205 [0,1,0,1,0,0|2,0,0]=4 3611 B11R1.124 CCO[C@@H]1CN[C@H](C1)C(O)=O Amb24627143 [0,1,0,1,0,0|2,0,0]=4 3612 B11R1.124 CNCC1CCC(O1)C(O)=O Amb25140444 [0,1,0,1,0,0|1,0,0]=3 3613 B11R1.124 COCC1CC(CC1)C(O)=O Amb25780193 [0,1,0,1,0,0|2,0,0]=4 3614 B11R1.124 COCC1CCC(N1)C(O)=O Amb24441382 [0,1,0,1,0,0|1,0,0]=3 3615 B11R1.124 COCC1CCC(O1)C(O)=O Amb18988012 [0,1,0,1,0,0|2,0,0]=4 3616 B11R1.124 COCC1NC(CS1)C(O)=O Amb25338580 [0,1,0,1,0,0|2,0,0]=4 3617 B11R1.124 COCC1N[C@@H](CS1)C(O)=O Amb24435602 [0,1,0,1,0,0|2,0,0]=4 3618 B11R1.124 COC[C@@H]1CC[C@H](N1)C(O)=O Amb24547011 [0,1,0,1,0,0|1,0,0]=3 3619 B11R1.124 COC[C@H]1CC[C@H](N1)C(O)=O Amb25369771 [0,1,0,1,0,0|1,0,0]=3 3620 B11R1.124 CSCC1CCC(O1)C(O)=O Amb18296201 [0,1,0,1,0,0|2,0,0]=4 3621 B11R1.124 N#CCC1CNC(C1)C(O)=O Amb18125706 [0,1,0,1,0,0|0,0,2]=4 3622 B11R1.124 N#CC[C@H]1CN[C@@H](C1)C(O)=O Amb25179025 [0,1,0,1,0,0|0,0,2]=4 3623 B11R1.124 NCCC1CC(CC1)C(N)=O Amb25194989 [0,1,0,1,0,0|2,0,0]=4 3624 B11R1.124 NCCN1CC(CC1)C(O)=O Amb25697896 [0,1,0,1,0,0|1,0,0]=3 3625 B11R1.124 OC(=O)C1CCC(CCF)C1 Amb24742558 [0,1,0,1,0,0|2,0,0]=4 3626 B11R1.124 OCCN1CC(CC1)C(O)=O Amb18302792 [0,1,0,1,0,0|2,0,0]=4 3627 B11R1.153 CC(CN1CC(N)C1)C(O)=O Amb24688645 [0,1,0,1,0,0|2,0,0]=4 3628 B11R1.153 CC(OC1CC(N)C1)C(O)=O Amb24443565 [0,1,0,1,0,0|2,0,0]=4 3629 B11R1.153 C[C@@H](NC1CC(N)C1)C(O)=O Amb25150356 [0,1,0,1,0,0|2,0,0]=4 3630 B11R1.153 C[C@H](NC1CC(N)C1)C(O)=O Amb25829120 [0,1,0,1,0,0|2,0,0]=4 3631 B11R1.192 CCCC1CCC(=O)C(N)C1 Amb18956644 [0,1,0,1,0,0|2,0,0]=4 3632 B11R1.192 CN1CC(CCN)OCC1=O Amb25742323 [0,1,0,1,0,0|2,0,0]=4 3633 B11R1.192 CNCC1CCC(N)C(O)O1 Amb25806020 [0,1,0,1,0,0|0,0,2]=4 3634 B11R1.277 N[C@@H]1C[C@H](O)[C@@H](CN)OC1O Amb24612081 [0,1,0,1,0,0|0,0,2]=4 3635 B11R1.277 OC[C@H]1OC(=O)[C@@H](O)C[C@@H]1O Amb25317485 [0,1,0,1,0,0|2,0,0]=4 3636 B11R1.490 CC1CC(C)C(O)(C1)C(O)=O Amb24693751 [0,1,0,1,0,0|2,0,0]=4 3637 B11R1.490 CC1OC(C)CC1(N)C(O)=O Amb25342752 [0,1,0,1,0,0|2,0,0]=4 3638 B11R1.497 CC1CCCC[C@H](N1)C(O)=O Amb25119161 [0,1,0,1,0,0|1,0,0]=3 3639 B11R1.497 CN1CC(CNCC1)C(O)=O Amb24554014 [0,1,0,1,0,0|2,0,0]=4 3640 B11R1.497 CN1CC(NCCC1)C(O)=O Amb25314145 [0,1,0,1,0,0|2,0,0]=4 3641 B11R1.497 N=C1NC(CCCN1)C(O)=O Amb25321896 [0,1,0,1,0,0|0,0,2]=4 3642 B11R1.497 NC1CC(COCC1)C(O)=O Amb24707410 [0,1,0,1,0,0|1,0,0]=3 3643 B11R1.497 NC1CCCCC(C1)C(N)=O Amb24651296 [0,1,0,1,0,0|2,0,0]=4 3644 B11R1.497 O=C1CCCCC(C1)C(=O)O Amb10603800 [0,1,0,1,0,0|2,0,0]=4 3645 B11R1.497 OC(=O)C1CCCCC(=O)N1 Amb19515429 [0,1,0,1,0,0|1,0,0]=3 3646 B11R1.497 OC(=O)C1COCCC(=O)N1 Amb24417172 [0,1,0,1,0,0|1,0,1]=4 3647 B11R1.497 OC(=O)C1CSCCC(=O)N1 Amb21937059 [0,1,0,1,0,0|1,0,1]=4 3648 B11R1.497 OC(=O)[C@@H]1CCCNC(=O)N1 Amb24692630 [0,1,0,1,0,0|1,0,1]=4 3649 B11R1.497 OC(=O)[C@@H]1CSCCC(=O)N1 Amb24469319 [0,1,0,1,0,0|1,0,1]=4 3650 B11R1.560 C[C@H]1COCC[C@H](N)C(=O)N1 Amb24754137 [0,1,0,1,0,0|2,0,0]=4 3651 B11R1.667 CC1(CC(=O)CCN1)C(O)=O Amb24615760 [0,1,0,1,0,0|1,0,1]=4 3652 B11R1.667 CC1(CC(Cl)CCC1)C(O)=O Amb18127807 [0,1,0,1,0,0|2,0,0]=4 3653 B11R1.667 CC1(CC(N)CCC1)C(O)=O Amb24511317 [0,1,0,1,0,0|1,0,0]=3 3654 B11R1.667 CC1(CC(O)CCC1)C(O)=O Amb24356065 [0,1,0,1,0,0|2,0,0]=4 3655 B11R1.667 CC1(CCCC(=O)N1)C(O)=O Amb23590303 [0,1,0,1,0,0|1,0,1]=4 3656 B11R1.667 CC1CC(N)(CCC1)C(C)=O Amb25369024 [0,1,0,1,0,0|2,0,0]=4 3657 B11R1.667 CC1CC(N)(CCC1)C(N)=O Amb18279186 [0,1,0,1,0,0|2,0,0]=4 3658 B11R1.667 CC1CC(O)(CCC1)C(O)=O Amb18278640 [0,1,0,1,0,0|2,0,0]=4 3659 B11R1.667 CC1CCCC(C)(O1)C(O)=O Amb18645016 [0,1,0,1,0,0|2,0,0]=4 3660 B11R1.667 CC1CCCC(N1)(N)C(=O)O Amb13886110 [0,1,0,1,0,0|0,0,0]=2 3661 B11R1.667 CC1C[C@](C)(CCC1)C(O)=O Amb24373142 [0,1,0,1,0,0|2,0,0]=4 3662 B11R1.667 C[C@@H]1C[C@@](C)(CCC1)C(O)=O Amb24571744 [0,1,0,1,0,0|2,0,0]=4 3663 B11R1.667 C[C@@H]1C[C@](N)(CCC1)C(O)=O Amb24609910 [0,1,0,1,0,0|1,0,0]=3 3664 B11R1.667 C[C@@]1(C[C@@H](O)CCC1)C(O)=O Amb24540831 [0,1,0,1,0,0|2,0,0]=4 3665 B11R1.667 C[C@@]1(C[C@H](Cl)CCC1)C(O)=O Amb25232600 [0,1,0,1,0,0|2,0,0]=4 3666 B11R1.667 C[C@H]1C[C@@](O)(CCC1)C(O)=O Amb24595362 [0,1,0,1,0,0|2,0,0]=4 3667 B11R1.667 NC1(CC(=O)CCC1)C(O)=O Amb23560233 [0,1,0,1,0,0|1,0,1]=4 3668 B11R1.667 NC1CC(O)(CCC1)C(N)=O Amb25178273 [0,1,0,1,0,0|2,0,0]=4 3669 B11R1.667 NC1CNCC(N)(C1)C(O)=O Amb24359121 [0,1,0,1,0,0|1,0,0]=3 3670 B11R1.667 N[C@@]1(C[C@@H](O)CCC1)C(O)=O Amb25264396 [0,1,0,1,0,0|1,0,0]=3 3671 B11R1.667 N[C@@]1(C[C@H](O)CCC1)C(O)=O Amb25377812 [0,1,0,1,0,0|1,0,0]=3 3672 B11R1.667 N[C@]1(C[C@H](O)CCC1)C(O)=O Amb25288503 [0,1,0,1,0,0|1,0,0]=3 3673 B11R1.718 CC(CC(O)C1CC1)C(O)=O Amb18182337 [0,1,0,1,0,0|2,0,0]=4 3674 B11R1.718 CN(CC(N)C(O)=O)C1CC1 Amb18799931 [0,1,0,1,0,0|2,0,0]=4 3675 B11R1.784 CCCC1(O)CC(C1)C(O)=O Amb25049923 [0,1,0,1,0,0|2,0,0]=4 3676 B11R1.1112 CC1(CC(N)C(O)=O)CCC1 Amb25689379 [0,1,0,1,0,0|1,0,0]=3 3677 B11R1.1112 CC1(CC(O)C(O)=O)CCC1 Amb24600197 [0,1,0,1,0,0|2,0,0]=4 3678 B11R1.1112 CC1(C[C@@H](N)C(O)=O)CCC1 Amb25127513 [0,1,0,1,0,0|1,0,0]=3 3679 B11R1.1257 CC1(CN(CCN)C1)C(O)=O Amb24568524 [0,1,0,1,0,0|2,0,0]=4 3680 B11R1.1257 NCCC1CC(N)(C1)C(O)=O Amb24364754 [0,1,0,1,0,0|0,0,0]=2 3681 B11R1.56 CC1(C)CCC(CO)OC1=O Amb25317327 [0,1,0,1,0,0|2,0,0]=4 3682 B11R1.56 CC1(C)CC[C@@H](CO)OC1=O Amb24619187 [0,1,0,1,0,0|2,0,0]=4 3683 B11R1.173 CC(=O)C(C)(O)C1CCCN1 Amb25828307 [0,1,0,1,0,0|2,0,0]=4 3684 B11R1.173 CC(C)(C1CCCC1)C(O)=O Amb22059619 [0,1,0,1,0,0|2,0,0]=4 3685 B11R1.173 CC(C)(C1NCCS1)C(O)=O Amb18127466 [0,1,0,1,0,0|2,0,0]=4 3686 B11R1.173 CC(N)(C1CCC=C1)C(O)=O Amb25259272 [0,1,0,1,0,0|1,0,1]=4 3687 B11R1.173 CC(N)(C1CCCC1)C(N)=O Amb18286681 [0,1,0,1,0,0|2,0,0]=4 3688 B11R1.173 CC(N)(C1CCCO1)C(N)=O Amb25328258 [0,1,0,1,0,0|2,0,0]=4 3689 B11R1.173 CC(O)(C1CCCC1)C(O)=O Amb18199915 [0,1,0,1,0,0|2,0,0]=4 3690 B11R1.173 C[C@](N)(C1CCCC1)C(O)=O Amb24485793 [0,1,0,1,0,0|1,0,0]=3 3691 B11R1.173 OC(=O)C(F)(F)C1CCCC1 Amb19929279 [0,1,0,1,0,0|2,0,0]=4 3692 B11R1.173 OC(=O)C(F)(F)C1CCCN1 Amb25190085 [0,1,0,1,0,0|1,0,0]=3 3693 B11R1.173 OC(=O)C(F)(F)C1CCCO1 Amb23591028 [0,1,0,1,0,0|2,0,0]=4 3694 B11R1.715 C[C@](N)(CC1CCC1)C(O)=O Amb24635740 [0,1,0,1,0,0|1,0,0]=3 3695 B11R1.716 CC(C)(CCC1CC1)C(O)=O Amb22500077 [0,1,0,1,0,0|2,0,0]=4 3696 B11R1.737 CC(=O)C1(N)CCCCCC1 Amb18200345 [0,1,0,1,0,0|2,0,0]=4 3697 B11R1.737 CC1(CCCCC=C1)C(O)=O Amb25310941 [0,1,0,1,0,0|2,0,0]=4 3698 B11R1.737 CC1(CCCCCC1)C(O)=O Amb25152741 [0,1,0,1,0,0|2,0,0]=4 3699 B11R1.737 NC(=O)C1(O)CNCCCC1 Amb24488222 [0,1,0,1,0,0|2,0,0]=4 3700 B11R1.737 OC(=O)C1(Br)CCCCCC1 Amb24603087 [0,1,0,1,0,0|2,0,0]=4 3701 B11R1.737 OC(=O)C1(F)CCCCCC1 Amb25151314 [0,1,0,1,0,0|2,0,0]=4 3702 B11R1.737 OC(=O)C1(N)CCCCCC1 Amb1841034 [0,1,0,1,0,0|1,0,0]=3 3703 B11R1.737 OC(=O)C1(O)CCCOCC1 Amb25841968 [0,1,0,1,0,0|2,0,0]=4 3704 B11R1.1229 CCC1CC(C)(CC1)C(O)=O Amb25696378 [0,1,0,1,0,0|2,0,0]=4 3705 B11R1.1229 CCC1CC(N)(CC1)C(O)=O Amb25060576 [0,1,0,1,0,0|1,0,0]=3 3706 B11R1.1229 CC[C@@H]1C[C@@](N)(CN1)C(O)=O Amb24621892 [0,1,0,1,0,0|2,0,0]=4 3707 B11R1.1229 COC1CC(N)(CC1)C(O)=O Amb25678284 [0,1,0,1,0,0|2,0,0]=4 3708 B11R1.1229 CS[C@@H]1C[C@@](N)(CC1)C(O)=O Amb24607274 [0,1,0,1,0,0|2,0,0]=4 3709 B11R1.1229 N[C@]1(CO[C@H](C1)CO)C(O)=O Amb25216968 [0,1,0,1,0,0|2,0,0]=4 3710 B11R1.36 CC(=O)C(N)C1CCCCC1 Amb24655803 [0,1,0,1,0,0|2,0,0]=4 3711 B11R1.36 CC(C(=O)O)C1CCNCC1 Amb10607938 [0,1,0,1,0,0|2,0,0]=4 3712 B11R1.36 CC(C(=O)O)C1CCNCC1 Amb13949185 [0,1,0,1,0,0|2,0,0]=4 3713 B11R1.36 CC(C(O)=O)C=1CCCCC1 Amb18125728 [0,1,0,1,0,0|2,0,0]=4 3714 B11R1.36 CC(C1CCCC=C1)C(O)=O Amb18125733 [0,1,0,1,0,0|2,0,0]=4 3715 B11R1.36 CC(C1CCCCN1)C(O)=O Amb18830609 [0,1,0,1,0,0|1,0,0]=3 3716 B11R1.36 CC(C1CCCNC1)C(N)=O Amb24708292 [0,1,0,1,0,0|2,0,0]=4 3717 B11R1.36 CC(C1CCCNC1)C(O)=O Amb18199993 [0,1,0,1,0,0|1,0,0]=3 3718 B11R1.36 CC(C1CCCOC1)C(O)=O Amb18830485 [0,1,0,1,0,0|2,0,0]=4 3719 B11R1.36 CC(C1CCCSC1)C(O)=O Amb18197517 [0,1,0,1,0,0|2,0,0]=4 3720 B11R1.36 CC(C1CCOCC1)C(O)=O Amb18199913 [0,1,0,1,0,0|2,0,0]=4 3721 B11R1.36 CC(C1CCSCC1)C(O)=O Amb18197516 [0,1,0,1,0,0|2,0,0]=4 3722 B11R1.36 CC(C1COCCN1)C(O)=O Amb18199869 [0,1,0,1,0,0|1,0,0]=3 3723 B11R1.36 CC(C1CSCCN1)C(O)=O Amb18197104 [0,1,0,1,0,0|1,0,0]=3 3724 B11R1.36 C[C@@H](C(=O)O)C1CCCCC1 Amb10844024 [0,1,0,1,0,0|2,0,0]=4 3725 B11R1.36 C[C@@H](C(O)=O)N1CCCCC1 Amb24360124 [0,1,0,1,0,0|2,0,0]=4 3726 B11R1.36 C[C@H](C(=O)O)C1CCCCC1 Amb10844035 [0,1,0,1,0,0|2,0,0]=4 3727 B11R1.36 NC(=O)C(O)C1CCCNC1 Amb19148580 [0,1,0,1,0,0|2,0,0]=4 3728 B11R1.36 NC(C(O)=O)C=1CCCCC1 Amb18125858 [0,1,0,1,0,0|1,0,0]=3 3729 B11R1.36 NC(C(O)=O)C=1CCOCC1 Amb25749003 [0,1,0,1,0,0|1,0,1]=4 3730 B11R1.36 NC(C(O)=O)C=1CCSCC1 Amb25693586 [0,1,0,1,0,0|1,0,1]=4 3731 B11R1.36 NC(C(O)=O)N1CCNCC1 Amb24501423 [0,1,0,1,0,0|2,0,0]=4 3732 B11R1.36 NC(C1CCCC=C1)C(N)=O Amb24389817 [0,1,0,1,0,0|2,0,0]=4 3733 B11R1.36 NC(C1CCCCC1)C(N)=O Amb23580620 [0,1,0,1,0,0|2,0,0]=4 3734 B11R1.36 NC(C1CCCCN1)C(N)=O Amb25268320 [0,1,0,1,0,0|1,0,0]=3 3735 B11R1.36 NC(C1CCCCN1)C(O)=O Amb23401448 [0,1,0,1,0,0|0,0,0]=2 3736 B11R1.36 NC(C1CCCCO1)C(N)=O Amb25195318 [0,1,0,1,0,0|2,0,0]=4 3737 B11R1.36 NC(C1CCCOC1)C(O)=O Amb22011581 [0,1,0,1,0,0|1,0,0]=3 3738 B11R1.36 NC(C1CCCSC1)C(O)=O Amb18197110 [0,1,0,1,0,0|1,0,0]=3 3739 B11R1.36 NC(C1CCNCC1)C(O)=O Amb18199899 [0,1,0,1,0,0|1,0,0]=3 3740 B11R1.36 NC(C1CCNCC1)C(O)=O Amb24081007 [0,1,0,1,0,0|1,0,0]=3 3741 B11R1.36 NC(C1CCOCC1)C(N)=O Amb18961315 [0,1,0,1,0,0|2,0,0]=4 3742 B11R1.36 NC(C1CCOCC1)C(O)=O Amb21858398 [0,1,0,1,0,0|1,0,0]=3 3743 B11R1.36 NC(C1CNCCC1)C(N)=O Amb25139636 [0,1,0,1,0,0|1,0,0]=3 3744 B11R1.36 NC(C1COCCC1)C(N)=O Amb25169231 [0,1,0,1,0,0|2,0,0]=4 3745 B11R1.36 N[C@@H](C(=O)O)C1CCOCC1 Amb16232103 [0,1,0,1,0,0|1,0,0]=3 3746 B11R1.36 N[C@@H](C1CCCC=C1)C(O)=O Amb25339911 [0,1,0,1,0,0|1,0,0]=3 3747 B11R1.36 N[C@@H](C1CCCCC1)C(N)=O Amb25100938 [0,1,0,1,0,0|2,0,0]=4 3748 B11R1.36 N[C@@H](C1CCCCC1)C(O)=O Amb20240588 [0,1,0,1,0,0|1,0,0]=3 3749 B11R1.36 N[C@@H](C1CCCOC1)C(O)=O Amb25847027 [0,1,0,1,0,0|1,0,0]=3 3750 B11R1.36 N[C@@H](C1CCOCC1)C(O)=O Amb23399650 [0,1,0,1,0,0|1,0,0]=3 3751 B11R1.36 N[C@@H](C1SCCCS1)C(O)=O Amb25739107 [0,1,0,1,0,0|1,0,0]=3 3752 B11R1.36 N[C@@H]([C@@H]1CCCCN1)C(O)=O Amb24519512 [0,1,0,1,0,0|0,0,0]=2 3753 B11R1.36 N[C@@H]([C@H]1CCCC=C1)C(O)=O Amb25227486 [0,1,0,1,0,0|1,0,0]=3 3754 B11R1.36 N[C@H](C(=O)O)C1CCOCC1 Amb10603259 [0,1,0,1,0,0|1,0,0]=3 3755 B11R1.36 N[C@H](C(O)=O)C=1CCCCC1 Amb25699117 [0,1,0,1,0,0|1,0,0]=3 3756 B11R1.36 N[C@H](C1CCCCC1)C(N)=O Amb25102437 [0,1,0,1,0,0|2,0,0]=4 3757 B11R1.36 N[C@H](C1CCCCC1)C(O)=O Amb20242426 [0,1,0,1,0,0|1,0,0]=3 3758 B11R1.36 N[C@H](C1CCCOC1)C(O)=O Amb25144455 [0,1,0,1,0,0|1,0,0]=3 3759 B11R1.36 N[C@H](C1CCNCC1)C(O)=O Amb25111066 [0,1,0,1,0,0|1,0,0]=3 3760 B11R1.36 N[C@H](C1SCCCS1)C(O)=O Amb24350633 [0,1,0,1,0,0|1,0,0]=3 3761 B11R1.36 OC(=O)C(C1=CCCCC1)O Amb17593900 [0,1,0,1,0,0|2,0,0]=4 3762 B11R1.36 OC(=O)C(C1CCCNC1)N Amb13885812 [0,1,0,1,0,0|0,0,0]=2 3763 B11R1.36 OC(=O)C(Cl)C1CCCCC1 Amb18127804 [0,1,0,1,0,0|2,0,0]=4 3764 B11R1.36 OC(=O)C(F)C1CCCCN1 Amb25801124 [0,1,0,1,0,0|1,0,0]=3 3765 B11R1.36 OC(=O)C(F)C1CCCNC1 Amb24733862 [0,1,0,1,0,0|1,0,0]=3 3766 B11R1.36 OC(=O)C(F)C1CCNCC1 Amb24409024 [0,1,0,1,0,0|2,0,0]=4 3767 B11R1.36 OC(=O)C(F)C1CCOCC1 Amb25071850 [0,1,0,1,0,0|2,0,0]=4 3768 B11R1.36 OC(C1CCCC=C1)C(O)=O Amb18125970 [0,1,0,1,0,0|2,0,0]=4 3769 B11R1.36 OC(C1CCNCC1)C(O)=O Amb18830397 [0,1,0,1,0,0|2,0,0]=4 3770 B11R1.36 OC(C1CCOCC1)C(O)=O Amb18285838 [0,1,0,1,0,0|2,0,0]=4 3771 B11R1.36 OC(C1CCSCC1)C(O)=O Amb25125158 [0,1,0,1,0,0|2,0,0]=4 3772 B11R1.36 OC(C1CNCCC1)C(O)=O Amb18830396 [0,1,0,1,0,0|1,0,0]=3 3773 B11R1.36 OC(C1COCCC1)C(O)=O Amb25169232 [0,1,0,1,0,0|2,0,0]=4 3774 B11R1.36 OC(C1CSCCC1)C(O)=O Amb24557625 [0,1,0,1,0,0|2,0,0]=4 3775 B11R1.36 O[C@@H](C1CCOCC1)C(O)=O Amb25148298 [0,1,0,1,0,0|2,0,0]=4 3776 B11R1.36 O[C@H](C1CCCCC1)C(O)=O Amb22361246 [0,1,0,1,0,0|2,0,0]=4 3777 B11R1.85 N[C@@H]1CCCCCCNC1=O Amb24558722 [0,1,0,1,0,0|2,0,0]=4 3778 B11R1.104 CC(CNC1CC1C)C(O)=O Amb18182214 [0,1,0,1,0,0|2,0,0]=4 3779 B11R1.104 CC1CC1NCC(N)C(O)=O Amb25383188 [0,1,0,1,0,0|1,0,0]=3 3780 B11R1.142 CC(CC1CCN1C)C(O)=O Amb24679463 [0,1,0,1,0,0|1,0,0]=3 3781 B11R1.142 CC1CCC1NC(C)C(O)=O Amb25283466 [0,1,0,1,0,0|2,0,0]=4 3782 B11R1.142 CC1CCC1N[C@@H](C)C(O)=O Amb24735541 [0,1,0,1,0,0|2,0,0]=4 3783 B11R1.142 CC1CCN1CC(O)C(O)=O Amb25089736 [0,1,0,1,0,0|2,0,0]=4 3784 B11R1.211 CCCCC1CC(C1)C(O)=O Amb23537588 [0,1,0,1,0,0|2,0,0]=4 3785 B11R1.211 CCCCN1CC(C1)C(O)=O Amb24763101 [0,1,0,1,0,0|2,0,0]=4 3786 B11R1.211 CCCNC1CC(C1)C(O)=O Amb20622658 [0,1,0,1,0,0|2,0,0]=4 3787 B11R1.211 CCCOC1CC(C1)C(O)=O Amb23448760 [0,1,0,1,0,0|2,0,0]=4 3788 B11R1.211 COCCC1CC(C1)C(O)=O Amb23537799 [0,1,0,1,0,0|2,0,0]=4 3789 B11R1.211 NCCCN1CC(C1)C(N)=O Amb24767080 [0,1,0,1,0,0|2,0,0]=4 3790 B11R1.211 NCCCN1CC(C1)C(O)=O Amb24763104 [0,1,0,1,0,0|1,0,0]=3 3791 B11R1.211 OC(=O)C1CC(C1)OCCF Amb23449204 [0,1,0,1,0,0|2,0,0]=4 3792 B11R1.211 OCCCN1CC(C1)C(O)=O Amb24763102 [0,1,0,1,0,0|2,0,0]=4 3793 B11R1.231 CCCC[C@@H]1C[C@@H](Cl)C(=O)O1 Amb25262544 [0,1,0,1,0,0|2,0,0]=4 3794 B11R1.231 CCCC[C@@H]1C[C@H](Cl)C(=O)O1 Amb24557198 [0,1,0,1,0,0|2,0,0]=4 3795 B11R1.231 CCCC[C@@H]1C[C@H](N)C(=O)O1 Amb25263992 [0,1,0,1,0,0|1,0,0]=3 3796 B11R1.231 CCCC[C@H]1C[C@H](N)C(=O)O1 Amb25179026 [0,1,0,1,0,0|1,0,0]=3 3797 B11R1.231 CNCCC1CN(C)C(=O)O1 Amb25279452 [0,1,0,1,0,0|2,0,0]=4 3798 B11R1.231 O=C1OC(CC1Cl)CCCCl Amb25362131 [0,1,0,1,0,0|2,0,0]=4 3799 B11R1.231 OC1CC(CCCO)OC1=O Amb24520564 [0,1,0,1,0,0|2,0,0]=4 3800 B11R1.266 CCC1CC(CCC1)C(O)=O Amb24486034 [0,1,0,1,0,0|2,0,0]=4 3801 B11R1.266 CCC1CC(CCN1)C(O)=O Amb18199986 [0,1,0,1,0,0|2,0,0]=4 3802 B11R1.266 CCC1CC(CCO1)C(O)=O Amb25679263 [0,1,0,1,0,0|2,0,0]=4 3803 B11R1.266 CCC1CC(NCC1)C(O)=O Amb18830613 [0,1,0,1,0,0|2,0,0]=4 3804 B11R1.266 CCC1CCCC(N1)C(O)=O Amb25110486 [0,1,0,1,0,0|1,0,0]=3 3805 B11R1.266 CCC1CCNC(N1)C(O)=O Amb24484693 [0,1,0,1,0,0|1,0,0]=3 3806 B11R1.266 CCC1CSCC(N1)C(O)=O Amb18647913 [0,1,0,1,0,0|1,0,0]=3 3807 B11R1.266 CCC1NC(CCS1)C(O)=O Amb18950378 [0,1,0,1,0,0|1,0,0]=3 3808 B11R1.266 CCN1CCCC(C1)C(=O)O Amb10609659 [0,1,0,1,0,0|2,0,0]=4 3809 B11R1.266 CCN1C[C@@H](CCC1)C(O)=O Amb25856837 [0,1,0,1,0,0|2,0,0]=4 3810 B11R1.266 CC[C@@H]1C[C@@H](CCC1)C(O)=O Amb25179101 [0,1,0,1,0,0|2,0,0]=4 3811 B11R1.266 CC[C@H]1CCN[C@H](N1)C(O)=O Amb25179308 [0,1,0,1,0,0|1,0,0]=3 3812 B11R1.266 CNC1CC(CCC1)C(C)=O Amb25802837 [0,1,0,1,0,0|2,0,0]=4 3813 B11R1.266 CNC1CC(CCC1)C(N)=O Amb24574233 [0,1,0,1,0,0|2,0,0]=4 3814 B11R1.266 CNC1CC(CCC1)C(O)=O Amb18288393 [0,1,0,1,0,0|1,0,0]=3 3815 B11R1.266 CO[C@H]1C[C@@H](CCC1)C(O)=O Amb24739740 [0,1,0,1,0,0|2,0,0]=4 3816 B11R1.266 N#CC1CC(CCC1)C(O)=O Amb18201139 [0,1,0,1,0,0|1,0,1]=4 3817 B11R1.266 N#CC1CCCC(N1)C(O)=O Amb24538286 [0,1,0,1,0,0|0,0,1]=3 3818 B11R1.266 N#CC1CNCC(N1)C(O)=O Amb24390401 [0,1,0,1,0,0|0,0,2]=4 3819 B11R1.266 N#CC1COCC(N1)C(O)=O Amb24419754 [0,1,0,1,0,0|0,0,2]=4 3820 B11R1.266 N#CC1COC[C@@H](N1)C(O)=O Amb18200250 [0,1,0,1,0,0|0,0,2]=4 3821 B11R1.266 NCC1CC(CCC1)C(N)=O Amb18287381 [0,1,0,1,0,0|2,0,0]=4 3822 B11R1.266 NCC1CC(CCC1)C(O)=O Amb25684748 [0,1,0,1,0,0|1,0,0]=3 3823 B11R1.266 NCC=1NCCC(N1)C(O)=O Amb24099646 [0,1,0,1,0,0|0,0,2]=4 3824 B11R1.266 N\N=C\1/CCCC(C1)C(O)=O Amb23453137 [0,1,0,1,0,0|1,0,1]=4 3825 B11R1.266 OC(=O)C1CC(CCC1)C=O Amb25849368 [0,1,0,1,0,0|2,0,0]=4 3826 B11R1.266 OCC1CC(CCC1)C(O)=O Amb24488127 [0,1,0,1,0,0|2,0,0]=4 3827 B11R1.266 OC[C@@H]1CCC[C@@H](N1)C(O)=O Amb25348501 [0,1,0,1,0,0|1,0,0]=3 3828 B11R1.266 OC[C@@H]1C[C@@H](CCC1)C(O)=O Amb24596686 [0,1,0,1,0,0|2,0,0]=4 3829 B11R1.266 ONC1CC(CCC1)C(O)=O Amb24488171 [0,1,0,1,0,0|1,0,0]=3 3830 B11R1.332 CC(CCC1CCC1)C(O)=O Amb24765911 [0,1,0,1,0,0|2,0,0]=4 3831 B11R1.332 CC(CNC1CCC1)C(O)=O Amb18310630 [0,1,0,1,0,0|2,0,0]=4 3832 B11R1.332 CC(NCC1CCC1)C(O)=O Amb18182199 [0,1,0,1,0,0|2,0,0]=4 3833 B11R1.332 CC(OCC1CCC1)C(O)=O Amb24762012 [0,1,0,1,0,0|2,0,0]=4 3834 B11R1.332 C[C@@H](NCC1CCC1)C(O)=O Amb25383670 [0,1,0,1,0,0|2,0,0]=4 3835 B11R1.332 C[C@H](NCC1CCC1)C(O)=O Amb25383664 [0,1,0,1,0,0|2,0,0]=4 3836 B11R1.332 NC(CCC1CCC1)C(N)=O Amb24765839 [0,1,0,1,0,0|2,0,0]=4 3837 B11R1.332 NC(CCC1CCC1)C(O)=O Amb24765840 [0,1,0,1,0,0|1,0,0]=3 3838 B11R1.332 NC(CCN1CCC1)C(N)=O Amb25385541 [0,1,0,1,0,0|2,0,0]=4 3839 B11R1.332 NC(COC1CCC1)C(N)=O Amb18179817 [0,1,0,1,0,0|2,0,0]=4 3840 B11R1.332 NC(COC1CCC1)C(O)=O Amb18792070 [0,1,0,1,0,0|1,0,0]=3 3841 B11R1.332 N[C@@H](CCC1CCC1)C(O)=O Amb24765842 [0,1,0,1,0,0|1,0,0]=3 3842 B11R1.332 N[C@H](CCC1CCC1)C(O)=O Amb24765843 [0,1,0,1,0,0|1,0,0]=3 3843 B11R1.332 OC(=O)C(Cl)COC1CCC1 Amb25381770 [0,1,0,1,0,0|2,0,0]=4 3844 B11R1.332 OC(CCC1CCC1)C(O)=O Amb24765884 [0,1,0,1,0,0|2,0,0]=4 3845 B11R1.421 CC1(CCCC1CCl)C(O)=O Amb25311251 [0,1,0,1,0,0|2,0,0]=4 3846 B11R1.421 CC[C@@H]1CCC[C@@]1(N)C(O)=O Amb25227403 [0,1,0,1,0,0|1,0,0]=3 3847 B11R1.421 CC[C@@H]1CCC[C@]1(N)C(O)=O Amb25295379 [0,1,0,1,0,0|1,0,0]=3 3848 B11R1.421 CC[C@H]1CCC[C@@]1(N)C(O)=O Amb24557381 [0,1,0,1,0,0|1,0,0]=3 3849 B11R1.421 CC[C@H]1CCC[C@]1(N)C(N)=O Amb24565110 [0,1,0,1,0,0|2,0,0]=4 3850 B11R1.421 CC[C@H]1CCC[C@]1(N)C(O)=O Amb24571144 [0,1,0,1,0,0|1,0,0]=3 3851 B11R1.421 CC[C@H]1CCN[C@]1(C)C(O)=O Amb25294337 [0,1,0,1,0,0|2,0,0]=4 3852 B11R1.421 CO[C@H]1CCC[C@@]1(N)C(N)=O Amb25179010 [0,1,0,1,0,0|2,0,0]=4 3853 B11R1.421 CO[C@H]1CCC[C@]1(N)C(N)=O Amb25179009 [0,1,0,1,0,0|2,0,0]=4 3854 B11R1.421 OC(=O)C1(Cl)CCCC1CCl Amb18130208 [0,1,0,1,0,0|2,0,0]=4 3855 B11R1.520 CC1(CCCCC1=C)C(O)=O Amb18125734 [0,1,0,1,0,0|2,0,0]=4 3856 B11R1.520 CC1(CCCCC1=O)C(O)=O Amb24487822 [0,1,0,1,0,0|2,0,0]=4 3857 B11R1.520 CC1(CCCCC1N)C(N)=O Amb25296991 [0,1,0,1,0,0|2,0,0]=4 3858 B11R1.520 CC1(CCCCC1N)C(O)=O Amb25759350 [0,1,0,1,0,0|1,0,0]=3 3859 B11R1.520 CC1(CCCCC1O)C(O)=O Amb24487804 [0,1,0,1,0,0|2,0,0]=4 3860 B11R1.520 CC1(CCNCC1O)C(O)=O Amb25275659 [0,1,0,1,0,0|2,0,0]=4 3861 B11R1.520 CC1(CCOCC1N)C(O)=O Amb24507422 [0,1,0,1,0,0|1,0,0]=3 3862 B11R1.520 CC1(CCSCC1F)C(O)=O Amb25349744 [0,1,0,1,0,0|2,0,0]=4 3863 B11R1.520 CC1(CNCCC1O)C(O)=O Amb25178371 [0,1,0,1,0,0|2,0,0]=4 3864 B11R1.520 CC1(COCCC1O)C(O)=O Amb24596145 [0,1,0,1,0,0|2,0,0]=4 3865 B11R1.520 CC1CCCCC1(C)C(O)=O Amb24635732 [0,1,0,1,0,0|2,0,0]=4 3866 B11R1.520 CC1CCCCC1(N)C(N)=O Amb18278298 [0,1,0,1,0,0|2,0,0]=4 3867 B11R1.520 CC1CCCCC1(O)C(O)=O Amb18278639 [0,1,0,1,0,0|2,0,0]=4 3868 B11R1.520 CC1CNCCC1(N)C(N)=O Amb25065612 [0,1,0,1,0,0|2,0,0]=4 3869 B11R1.520 CC1CNCCC1(O)C(O)=O Amb24703497 [0,1,0,1,0,0|2,0,0]=4 3870 B11R1.520 CC1COCCC1(O)C(O)=O Amb25152245 [0,1,0,1,0,0|2,0,0]=4 3871 B11R1.520 CC1NCCCC1(N)C(N)=O Amb24550032 [0,1,0,1,0,0|2,0,0]=4 3872 B11R1.520 CC1SCCCC1(N)C(N)=O Amb25204386 [0,1,0,1,0,0|2,0,0]=4 3873 B11R1.520 CC1SCCCC1(O)C(O)=O Amb24389616 [0,1,0,1,0,0|2,0,0]=4 3874 B11R1.520 CN1CCCCC1(C)C(O)=O Amb24691634 [0,1,0,1,0,0|1,0,0]=3 3875 B11R1.520 C[C@@H]1CCCC[C@@]1(N)C(N)=O Amb25224333 [0,1,0,1,0,0|2,0,0]=4 3876 B11R1.520 C[C@@H]1CCCC[C@]1(N)C(O)=O Amb25263952 [0,1,0,1,0,0|1,0,0]=3 3877 B11R1.520 C[C@@H]1CCCC[C@]1(O)C(O)=O Amb25361084 [0,1,0,1,0,0|2,0,0]=4 3878 B11R1.520 C[C@H]1CCCC[C@@]1(N)C(O)=O Amb24607337 [0,1,0,1,0,0|1,0,0]=3 3879 B11R1.520 C[C@H]1CCCC[C@]1(C)C(O)=O Amb24735955 [0,1,0,1,0,0|2,0,0]=4 3880 B11R1.520 NC1(CCCCC1O)C(O)=O Amb24441540 [0,1,0,1,0,0|1,0,0]=3 3881 B11R1.520 NC1CCCCC1(N)C(O)=O Amb25348456 [0,1,0,1,0,0|0,0,0]=2 3882 B11R1.520 N[C@@H]1CCCC[C@]1(N)C(O)=O Amb24675453 [0,1,0,1,0,0|0,0,0]=2 3883 B11R1.520 N[C@@H]1CCCC[C@]1(O)C(O)=O Amb25363189 [0,1,0,1,0,0|1,0,0]=3 3884 B11R1.520 N[C@@]1(CCCC[C@@H]1O)C(O)=O Amb24602384 [0,1,0,1,0,0|1,0,0]=3 3885 B11R1.520 N[C@@]1(CCCC[C@H]1O)C(O)=O Amb24626559 [0,1,0,1,0,0|1,0,0]=3 3886 B11R1.520 N[C@]1(CCCCC1O)C(O)=O Amb25100900 [0,1,0,1,0,0|1,0,0]=3 3887 B11R1.520 N[C@]1(CCCC[C@H]1O)C(O)=O Amb24590185 [0,1,0,1,0,0|1,0,0]=3 3888 B11R1.520 OC(=O)C1(Cl)CCCCC1Cl Amb18652202 [0,1,0,1,0,0|2,0,0]=4 3889 B11R1.520 OC(=O)C1(F)CCNCC1F Amb24563623 [0,1,0,1,0,0|2,0,0]=4 3890 B11R1.520 OC(=O)C1(F)CCSCC1F Amb24663363 [0,1,0,1,0,0|2,0,0]=4 3891 B11R1.520 OC(=O)[C@@]1(O)CCCC[C@@H]1Cl Amb24587383 [0,1,0,1,0,0|2,0,0]=4 3892 B11R1.520 OC1CCCCC1(F)C(O)=O Amb24334791 [0,1,0,1,0,0|2,0,0]=4 3893 B11R1.520 OC1CCCCC1(O)C(O)=O Amb24348654 [0,1,0,1,0,0|2,0,0]=4 3894 B11R1.520 O[C@@H]1CCCC[C@@]1(F)C(O)=O Amb24366232 [0,1,0,1,0,0|2,0,0]=4 3895 B11R1.706 NC(=O)C1CCCCCCN1 Amb24433710 [0,1,0,1,0,0|2,0,0]=4 3896 B11R1.706 OC(=O)C1CC=CCCCC1 Amb25774993 [0,1,0,1,0,0|2,0,0]=4 3897 B11R1.706 OC(=O)C1CC=CCCCN1 Amb25779359 [0,1,0,1,0,0|1,0,1]=4 3898 B11R1.706 OC(=O)C1CCCCCCC1 Amb18278612 [0,1,0,1,0,0|2,0,0]=4 3899 B11R1.706 OC(=O)C1CCCCCNN1 Amb25827524 [0,1,0,1,0,0|0,0,0]=2 3900 B11R1.757 CCCCCC1NC(=O)C1O Amb24767006 [0,1,0,1,0,0|1,0,1]=4 3901 B11R1.757 C[C@H]1[C@H](CCCC=O)OC1=O Amb24764977 [0,1,0,1,0,0|2,0,0]=4 3902 B11R1.757 C[C@H]1[C@H](CCCCO)OC1=O Amb25383535 [0,1,0,1,0,0|2,0,0]=4 3903 B11R1.14 CC1CC(CO)OC(=O)C1O Amb25136203 [0,1,0,1,0,0|2,0,0]=4 3904 B11R1.14 CCC1CC(O)C(O)C(=O)O1 Amb24583700 [0,1,0,1,0,0|2,0,0]=4 3905 B11R1.14 CC[C@H]1C[C@H](O)[C@@H](O)C(=O)O1 Amb24632154 [0,1,0,1,0,0|2,0,0]=4 3906 B11R1.14 C[C@@H]1C[C@H](CO)OC(=O)[C@H]1O Amb24748522 [0,1,0,1,0,0|2,0,0]=4 3907 B11R1.14 OC[C@@H]1C[C@H](O)[C@H](O)C(=O)O1 Amb24515474 [0,1,0,1,0,0|2,0,0]=4 3908 B11R1.50 CC1CC(CO)OC1C(O)=O Amb24509126 [0,1,0,1,0,0|2,0,0]=4 3909 B11R1.50 CC1OC(CN)CC1C(O)=O Amb25349541 [0,1,0,1,0,0|2,0,0]=4 3910 B11R1.50 OC1CC(CO)OC1C(O)=O Amb25799063 [0,1,0,1,0,0|2,0,0]=4 3911 B11R1.50 O[C@@H]1C[C@@H](CO)O[C@H]1C(O)=O Amb24634250 [0,1,0,1,0,0|2,0,0]=4 3912 B11R1.149 CC([C@H](N)C(O)=O)C1CC1=C Amb24626612 [0,1,0,1,0,0|1,0,1]=4 3913 B11R1.167 CC1CC(C(N)CC1)C(O)=O Amb18200001 [0,1,0,1,0,0|2,0,0]=4 3914 B11R1.167 CC1CCC(=O)NC1C(O)=O Amb25053909 [0,1,0,1,0,0|1,0,1]=4 3915 B11R1.167 CC1CCC(Cl)CC1C(O)=O Amb25260877 [0,1,0,1,0,0|2,0,0]=4 3916 B11R1.167 CC1CCC(N)CC1C(N)=O Amb18797052 [0,1,0,1,0,0|2,0,0]=4 3917 B11R1.167 CC1CCC(O)C(C1)C(O)=O Amb25210516 [0,1,0,1,0,0|2,0,0]=4 3918 B11R1.167 CC1CCC(O)C(N1)C(O)=O Amb24395700 [0,1,0,1,0,0|1,0,0]=3 3919 B11R1.167 CC1CCC(O)CC1C(O)=O Amb24392245 [0,1,0,1,0,0|2,0,0]=4 3920 B11R1.167 CC1CC[C@@H](O)C[C@H]1C(O)=O Amb25233392 [0,1,0,1,0,0|2,0,0]=4 3921 B11R1.167 C[C@@H]1C[C@H]([C@H](C)CC1)C(O)=O Amb24595391 [0,1,0,1,0,0|2,0,0]=4 3922 B11R1.167 C[C@H]1C[C@H]([C@@H](C)CC1)C(O)=O Amb24511944 [0,1,0,1,0,0|2,0,0]=4 3923 B11R1.167 NC1CCC(O)CC1C(O)=O Amb25139597 [0,1,0,1,0,0|2,0,0]=4 3924 B11R1.167 OC(=O)[C@@H]1NC(=O)CC[C@@H]1O Amb25174915 [0,1,0,1,0,0|1,0,1]=4 3925 B11R1.167 OC(=O)[C@@H]1NC(=O)CC[C@H]1O Amb22754033 [0,1,0,1,0,0|1,0,1]=4 3926 B11R1.167 OC(=O)[C@H]1NC(=O)CC[C@@H]1O Amb25241968 [0,1,0,1,0,0|1,0,1]=4 3927 B11R1.167 OC(=O)[C@H]1NC(=O)CC[C@H]1O Amb25327757 [0,1,0,1,0,0|1,0,1]=4 3928 B11R1.167 OC1CC(C(O)CC1)C(O)=O Amb25809422 [0,1,0,1,0,0|2,0,0]=4 3929 B11R1.186 OCCC1OC(=O)C(O)C1O Amb25150511 [0,1,0,1,0,0|2,0,0]=4 3930 B11R1.204 CCCCC1CCC1C(O)=O Amb24762099 [0,1,0,1,0,0|2,0,0]=4 3931 B11R1.204 CCCCC1CNC1C(O)=O Amb25385838 [0,1,0,1,0,0|1,0,0]=3 3932 B11R1.212 CCCCC1COC(=O)C1O Amb25680553 [0,1,0,1,0,0|2,0,0]=4 3933 B11R1.212 CCCC[C@@H]1COC(=O)[C@H]1O Amb24733418 [0,1,0,1,0,0|2,0,0]=4 3934 B11R1.212 CCCC[C@H]1COC(=O)[C@@H]1O Amb24741786 [0,1,0,1,0,0|2,0,0]=4 3935 B11R1.314 CC(C(O)=O)N1CC(N)CC1 Amb18285032 [0,1,0,1,0,0|2,0,0]=4 3936 B11R1.314 CC(C(O)=O)N1C[C@H](N)CC1 Amb24677207 [0,1,0,1,0,0|2,0,0]=4 3937 B11R1.314 CC(C1CC(O)CC1)C(O)=O Amb24639274 [0,1,0,1,0,0|2,0,0]=4 3938 B11R1.314 CC(C1CCC(=O)N1)C(O)=O Amb24741902 [0,1,0,1,0,0|1,0,1]=4 3939 B11R1.314 CC1CC(CC1)C(O)C(O)=O Amb25149222 [0,1,0,1,0,0|2,0,0]=4 3940 B11R1.314 CC1CCC(O1)C(N)C(N)=O Amb25853156 [0,1,0,1,0,0|2,0,0]=4 3941 B11R1.314 CC1CCC(O1)C(N)C(O)=O Amb24390378 [0,1,0,1,0,0|1,0,0]=3 3942 B11R1.314 CN1CC(CC1)C(N)C(O)=O Amb18199896 [0,1,0,1,0,0|2,0,0]=4 3943 B11R1.314 C[C@@H]1CC[C@H](O1)C(C)C(O)=O Amb24601845 [0,1,0,1,0,0|2,0,0]=4 3944 B11R1.314 C[C@@H]1C[C@H](C=C1)[C@H](N)C(O)=O Amb24692774 [0,1,0,1,0,0|1,0,1]=4 3945 B11R1.314 NC(C1CC(O)CO1)C(O)=O Amb24436005 [0,1,0,1,0,0|1,0,0]=3 3946 B11R1.314 N[C@H](C1CCC(=O)C1)C(O)=O Amb25148224 [0,1,0,1,0,0|1,0,1]=4 3947 B11R1.314 N[C@H]([C@@H]1CCC(=O)O1)C(O)=O Amb24511954 [0,1,0,1,0,0|1,0,1]=4 3948 B11R1.314 O[C@H]1CN[C@@H](C1)[C@H](O)C(O)=O Amb24652516 [0,1,0,1,0,0|1,0,0]=3 3949 B11R1.321 COC1CC(C1)C(N)C(O)=O Amb24742556 [0,1,0,1,0,0|2,0,0]=4 3950 B11R1.503 CC(CC1CC1)C(C)C(O)=O Amb25382091 [0,1,0,1,0,0|2,0,0]=4 3951 B11R1.503 CC(CC1CC1)C(F)C(O)=O Amb25382092 [0,1,0,1,0,0|2,0,0]=4 3952 B11R1.503 CC(CC1CC1)C(O)C(O)=O Amb25382102 [0,1,0,1,0,0|2,0,0]=4 3953 B11R1.513 CC1CCC(C)C1(N)C(O)=O Amb24733899 [0,1,0,1,0,0|1,0,0]=3 3954 B11R1.513 CC1CCC(C)C1(O)C(O)=O Amb25248880 [0,1,0,1,0,0|2,0,0]=4 3955 B11R1.513 CC1CCC(N)C1(C)C(O)=O Amb20623942 [0,1,0,1,0,0|1,0,0]=3 3956 B11R1.558 O[C@H]1CCCCC[C@H](O)C1=O Amb24604821 [0,1,0,1,0,0|2,0,0]=4 3957 B11R1.1105 CC1(CCCS1)C(N)C(N)=O Amb25762364 [0,1,0,1,0,0|2,0,0]=4 3958 B11R1.1105 CC1(CCCS1)C(N)C(O)=O Amb25116883 [0,1,0,1,0,0|1,0,0]=3 3959 B11R1.1105 CC1(CCCS1)C(O)C(O)=O Amb24385370 [0,1,0,1,0,0|2,0,0]=4 3960 B11R1.1105 NC(C(O)=O)C1(F)CCCC1 Amb25299458 [0,1,0,1,0,0|1,0,0]=3 3961 B11R1.1105 NC(C(O)=O)C1(O)CCCC1 Amb24375423 [0,1,0,1,0,0|1,0,0]=3 3962 B11R1.1105 NC(C(O)=O)C1(S)CCCC1 Amb18127518 [0,1,0,1,0,0|1,0,0]=3 3963 B11R1.3 CCC1CCC(CC1)C(=O)O Amb2413128 [0,1,0,1,0,0|2,0,0]=4 3964 B11R1.3 CCC1CCC(CN1)C(N)=O Amb24628359 [0,1,0,1,0,0|2,0,0]=4 3965 B11R1.3 CCC1CCC(CN1)C(O)=O Amb25848341 [0,1,0,1,0,0|1,0,0]=3 3966 B11R1.3 CCC1CCC(NC1)C(O)=O Amb18126073 [0,1,0,1,0,0|1,0,0]=3 3967 B11R1.3 NCC1CCC(=CC1)C(=O)O Amb17608157 [0,1,0,1,0,0|1,0,1]=4 3968 B11R1.3 NCC1CCC(CC1)C(=O)Cl Amb24440899 [0,1,0,1,0,0|2,0,0]=4 3969 B11R1.3 NCC1CCC(CC1)C(N)=O Amb18287382 [0,1,0,1,0,0|2,0,0]=4 3970 B11R1.3 NCC1CCC(CC1)C(N)=O Amb20622451 [0,1,0,1,0,0|2,0,0]=4 3971 B11R1.3 NCC1CCC(OC1)C(O)=O Amb18126184 [0,1,0,1,0,0|1,0,0]=3 3972 B11R1.3 NCC1COC(CO1)C(O)=O Amb18126282 [0,1,0,1,0,0|2,0,0]=4 3973 B11R1.3 NC[C@@H]1CC[C@@H](CC1)C(=O)O Amb17620787 [0,1,0,1,0,0|1,0,0]=3 3974 B11R1.3 NC[C@@H]1CC[C@@H](CC1)C(N)=O Amb25337629 [0,1,0,1,0,0|2,0,0]=4 3975 B11R1.3 NC[C@@H]1CC[C@@H](CC1)C(O)=O Amb24095009 [0,1,0,1,0,0|1,0,0]=3 3976 B11R1.3 NC[C@@H]1OC[C@@H](CO1)C(O)=O Amb24711233 [0,1,0,1,0,0|2,0,0]=4 3977 B11R1.3 OC(=O)C1CCC(CF)NC1 Amb25209958 [0,1,0,1,0,0|1,0,0]=3 3978 B11R1.3 OC(=O)[C@@H]1CC[C@@H](CF)CC1 Amb25351015 [0,1,0,1,0,0|2,0,0]=4 3979 B11R1.3 OC[C@@H]1CC[C@H](CC1)C(O)=O Amb22750650 [0,1,0,1,0,0|2,0,0]=4 3980 B11R1.3 OC[C@H]1CC[C@H](CN1)C(O)=O Amb24105564 [0,1,0,1,0,0|1,0,0]=3 3981 B11R1.3 [15NH2][13CH2]C1CCC(CC1)[13C](=O)O Amb17620788 [0,1,0,1,0,0|1,0,0]=3 3982 B11R1.21 CC(C)C1CCC(C)C(=O)O1 Amb25149452 [0,1,0,1,0,0|2,0,0]=4 3983 B11R1.21 CC(N)C1CCC(N)C(O)O1 Amb25054674 [0,1,0,1,0,0|0,0,2]=4 3984 B11R1.21 CC1CC(CCC1N)C(O)=O Amb25262562 [0,1,0,1,0,0|2,0,0]=4 3985 B11R1.21 CC1CCC(CC1N)C(N)=O Amb18182132 [0,1,0,1,0,0|2,0,0]=4 3986 B11R1.21 CC1CCC(CC1N)C(O)=O Amb25065260 [0,1,0,1,0,0|1,0,0]=3 3987 B11R1.21 C[C@@H]1CC[C@H](CC1O)C(O)=O Amb24677766 [0,1,0,1,0,0|2,0,0]=4 3988 B11R1.21 C[C@@H]1CC[C@H](C[C@H]1O)C(O)=O Amb24692813 [0,1,0,1,0,0|2,0,0]=4 3989 B11R1.21 C[C@@H]1C[C@@H](CC[C@@H]1Cl)C(O)=O Amb24726368 [0,1,0,1,0,0|2,0,0]=4 3990 B11R1.21 C[C@H](N)[C@@H]1CC[C@@H](N)C(O)O1 Amb24670552 [0,1,0,1,0,0|0,0,2]=4 3991 B11R1.21 NC(=O)C1CCC(N)C(=O)N1 Amb24707747 [0,1,0,1,0,0|1,0,1]=4 3992 B11R1.21 N[C@H]1CC[C@H](NC1=O)C(O)=O Amb25274959 [0,1,0,1,0,0|1,0,1]=4 3993 B11R1.21 OC(=O)C1CC(F)C(F)CC1 Amb25294326 [0,1,0,1,0,0|2,0,0]=4 3994 B11R1.21 OC1CC(CCC1Cl)C(O)=O Amb24484624 [0,1,0,1,0,0|2,0,0]=4 3995 B11R1.21 OC1CC(CCC1O)C(O)=O Amb25701852 [0,1,0,1,0,0|2,0,0]=4 3996 B11R1.21 O[C@H]1C[C@@H](CC[C@@H]1Cl)C(O)=O Amb24519210 [0,1,0,1,0,0|2,0,0]=4 3997 B11R1.146 CC1C(CC1C)C(O)C(O)=O Amb25764141 [0,1,0,1,0,0|2,0,0]=4 3998 B11R1.146 CC1CC(C(F)C(O)=O)C1C Amb25066152 [0,1,0,1,0,0|2,0,0]=4 3999 B11R1.220 CC1(CCC(Cl)CC1)C(O)=O Amb18127808 [0,1,0,1,0,0|2,0,0]=4 4000 B11R1.220 CC1(CCC(F)CC1)C(O)=O Amb23456113 [0,1,0,1,0,0|2,0,0]=4 4001 B11R1.220 CC1(CCC(N)CC1)C(O)=O Amb23536219 [0,1,0,1,0,0|2,0,0]=4 4002 B11R1.220 CC1(CCC(O)CC1)C(O)=O Amb18126139 [0,1,0,1,0,0|2,0,0]=4 4003 B11R1.220 CC1CCC(C)(CC1)C(O)=O Amb25083864 [0,1,0,1,0,0|2,0,0]=4 4004 B11R1.220 CC1CCC(N)(CC1)C(N)=O Amb18279188 [0,1,0,1,0,0|2,0,0]=4 4005 B11R1.220 CC1CCC(O)(CC1)C(O)=O Amb18944702 [0,1,0,1,0,0|2,0,0]=4 4006 B11R1.220 CN1CCC(N)(CC1)C(O)=O Amb22899584 [0,1,0,1,0,0|2,0,0]=4 4007 B11R1.220 C[C@@]1(CC[C@@H](O)CC1)C(O)=O Amb25085529 [0,1,0,1,0,0|2,0,0]=4 4008 B11R1.220 C[C@]1(CC[C@@H](Cl)CC1)C(O)=O Amb25210850 [0,1,0,1,0,0|2,0,0]=4 4009 B11R1.220 C[C@]1(CC[C@@H](N)CC1)C(O)=O Amb25074620 [0,1,0,1,0,0|2,0,0]=4 4010 B11R1.220 NC1CCC(F)(CC1)C(O)=O Amb24105434 [0,1,0,1,0,0|2,0,0]=4 4011 B11R1.220 NC1CCC(O)(CC1)C(O)=O Amb24116860 [0,1,0,1,0,0|2,0,0]=4 4012 B11R1.220 N[C@]1(CC[C@@H](O)CC1)C(O)=O Amb25088436 [0,1,0,1,0,0|1,0,0]=3 4013 B11R1.220 O=C1CCC(CC1)(N)C(=O)O Amb16183881 [0,1,0,1,0,0|1,0,1]=4 4014 B11R1.220 OC(=O)C1(O)CCC(Cl)CC1 Amb25257426 [0,1,0,1,0,0|2,0,0]=4 4015 B11R1.220 O[C@@H]1CC[C@](O)(CC1)C(O)=O Amb24390390 [0,1,0,1,0,0|2,0,0]=4 4016 B11R1.226 CC1CC(OC1=O)C(N)CO Amb24745900 [0,1,0,1,0,0|2,0,0]=4 4017 B11R1.226 N[C@@H]1C[C@@H](OC1=O)[C@H](O)CO Amb25258424 [0,1,0,1,0,0|1,0,0]=3 4018 B11R1.226 N[C@H]1C[C@H](OC1=O)[C@H](O)CO Amb25227831 [0,1,0,1,0,0|1,0,0]=3 4019 B11R1.226 OC(CF)C1CC(O)C(=O)O1 Amb25317324 [0,1,0,1,0,0|2,0,0]=4 4020 B11R1.226 OC[C@H](O)[C@H]1C[C@H](O)C(=O)O1 Amb24576074 [0,1,0,1,0,0|2,0,0]=4 4021 B11R1.226 O[C@H](CO)[C@@H]1C[C@H](Cl)C(=O)O1 Amb24656133 [0,1,0,1,0,0|2,0,0]=4 4022 B11R1.417 CCC1(C)NC(CO1)C(O)=O Amb24566641 [0,1,0,1,0,0|2,0,0]=4 4023 B11R1.417 CCC1(C)N[C@@H](CS1)C(O)=O Amb25101530 [0,1,0,1,0,0|2,0,0]=4 4024 B11R1.417 CCC1(C)N[C@H](CS1)C(O)=O Amb24730400 [0,1,0,1,0,0|2,0,0]=4 4025 B11R1.417 C[C@]1(CC)N[C@@H](CS1)C(=O)O Amb16203705 [0,1,0,1,0,0|2,0,0]=4 4026 B11R1.417 OC(=O)C1CC(F)(CBr)CC1 Amb24502007 [0,1,0,1,0,0|2,0,0]=4 4027 B11R1.565 CC1CCCC(CC1)C(O)=O Amb24487583 [0,1,0,1,0,0|2,0,0]=4 4028 B11R1.565 NC1CCC(CCC1)C(N)=O Amb24759194 [0,1,0,1,0,0|2,0,0]=4 4029 B11R1.1270 CC1CCC(C)(C1O)C(O)=O Amb24420524 [0,1,0,1,0,0|2,0,0]=4 4030 B11R1.1270 CC1N(C)CCC1(N)C(O)=O Amb24615848 [0,1,0,1,0,0|2,0,0]=4 4031 B11R1.1270 OC1CCC(O)(C1Cl)C(O)=O Amb24484555 [0,1,0,1,0,0|2,0,0]=4 4032 B11R1.1270 O[C@@H]1CCC(O)([C@@H]1Cl)C(O)=O Amb24626658 [0,1,0,1,0,0|2,0,0]=4 4033 B11R1.23 CC1CC(CCC1)C(=O)NO Amb24386557 [0,1,0,1,0,0|2,0,0]=4 4034 B11R1.23 CC1CCCC(N1)C(=O)OC Amb18644928 [0,1,0,1,0,0|1,0,0]=3 4035 B11R1.23 CC1COCC(N1)C(=O)OC Amb23585369 [0,1,0,1,0,0|2,0,0]=4 4036 B11R1.23 CC1CSCC(N1)C(=O)OC Amb22304714 [0,1,0,1,0,0|2,0,0]=4 4037 B11R1.23 CCC(=O)C1CCCC(N)C1 Amb25188889 [0,1,0,1,0,0|2,0,0]=4 4038 B11R1.23 COC(=O)C1CC(N)CCN1 Amb13886365 [0,1,0,1,0,0|2,0,0]=4 4039 B11R1.23 COC(=O)C1CC(N)CCO1 Amb24638116 [0,1,0,1,0,0|2,0,0]=4 4040 B11R1.23 COC(=O)C1CCCC(=O)N1 Amb13886339 [0,1,0,1,0,0|1,0,1]=4 4041 B11R1.23 COC(=O)C1CCCC(Cl)C1 Amb24390370 [0,1,0,1,0,0|2,0,0]=4 4042 B11R1.23 COC(=O)C1CCCC(F)C1 Amb24439491 [0,1,0,1,0,0|2,0,0]=4 4043 B11R1.23 COC(=O)C1CCCC(N)C1 Amb18288448 [0,1,0,1,0,0|1,0,0]=3 4044 B11R1.23 COC(=O)C1CCCC(N)C1 Amb20668217 [0,1,0,1,0,0|1,0,0]=3 4045 B11R1.23 COC(=O)C1CCCC(O)C1 Amb19516181 [0,1,0,1,0,0|2,0,0]=4 4046 B11R1.23 COC(=O)C1CSCC(N)C1 Amb24581425 [0,1,0,1,0,0|2,0,0]=4 4047 B11R1.23 COC(=O)N1CCCC(C1)N Amb13951817 [0,1,0,1,0,0|2,0,0]=4 4048 B11R1.23 COC(=O)N1C[C@H](N)CCC1 Amb24597562 [0,1,0,1,0,0|2,0,0]=4 4049 B11R1.23 COC(=O)[C@@H]1CCCC(=O)N1 Amb25375349 [0,1,0,1,0,0|1,0,1]=4 4050 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](N)C1 Amb24563866 [0,1,0,1,0,0|1,0,0]=3 4051 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](O)C1 Amb22899456 [0,1,0,1,0,0|2,0,0]=4 4052 B11R1.23 COC(=O)[C@@H]1CCC[C@H](C1)N Amb10873181 [0,1,0,1,0,0|1,0,0]=3 4053 B11R1.23 COC(=O)[C@@H]1CCC[C@H](Cl)C1 Amb25328848 [0,1,0,1,0,0|2,0,0]=4 4054 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 Amb22747531 [0,1,0,1,0,0|1,0,0]=3 4055 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 Amb23438867 [0,1,0,1,0,0|1,0,0]=3 4056 B11R1.23 COC(=O)[C@H]1CCC[C@@H](Cl)C1 Amb24602426 [0,1,0,1,0,0|2,0,0]=4 4057 B11R1.23 COC(=O)[C@H]1CCC[C@@H](O)C1 Amb25198846 [0,1,0,1,0,0|2,0,0]=4 4058 B11R1.23 COC(=O)[C@H]1CCC[C@H](O)C1 Amb25225913 [0,1,0,1,0,0|2,0,0]=4 4059 B11R1.23 COC(=O)[C@H]1C[C@H](N)CCN1 Amb25174839 [0,1,0,1,0,0|2,0,0]=4 4060 B11R1.23 C[C@H]1CCC[C@H](N1)C(=O)NN Amb24606495 [0,1,0,1,0,0|2,0,0]=4 4061 B11R1.23 NC1CCCC(C1)C(=O)NN Amb25785522 [0,1,0,1,0,0|2,0,0]=4 4062 B11R1.23 NC1CN(CCC1)C(=O)CO Amb25857984 [0,1,0,1,0,0|2,0,0]=4 4063 B11R1.23 ONC(=O)C1CCCC(=O)N1 Amb25122407 [0,1,0,1,0,0|1,0,1]=4 4064 B11R1.31 CC(C1CCCC1)C(=O)NO Amb25357258 [0,1,0,1,0,0|2,0,0]=4 4065 B11R1.31 CC(C1CCCC1)C(=O)OC Amb24744320 [0,1,0,1,0,0|2,0,0]=4 4066 B11R1.31 CC(C1CCCN1)C(=O)OC Amb18126061 [0,1,0,1,0,0|1,0,0]=3 4067 B11R1.31 CNC(=O)C(N)C1CCCO1 Amb24498003 [0,1,0,1,0,0|2,0,0]=4 4068 B11R1.31 COC(=O)C(Cl)C1CCCC1 Amb18186039 [0,1,0,1,0,0|2,0,0]=4 4069 B11R1.31 COC(=O)C(N)C1CCC=C1 Amb18125865 [0,1,0,1,0,0|1,0,1]=4 4070 B11R1.31 COC(=O)C(N)C1CCCC1 Amb18294470 [0,1,0,1,0,0|1,0,0]=3 4071 B11R1.31 COC(=O)C(N)C1CCCO1 Amb24570094 [0,1,0,1,0,0|1,0,0]=3 4072 B11R1.31 COC(=O)C(N)C1COCC1 Amb18968187 [0,1,0,1,0,0|2,0,0]=4 4073 B11R1.31 COC(=O)C(N)C=1CCCC1 Amb24432753 [0,1,0,1,0,0|1,0,1]=4 4074 B11R1.31 COC(=O)C(O)C1CCCC1 Amb18183256 [0,1,0,1,0,0|2,0,0]=4 4075 B11R1.31 COC(=O)C(O)C1CCCO1 Amb25052508 [0,1,0,1,0,0|2,0,0]=4 4076 B11R1.31 COC(=O)[C@@H](N)C1CCC=C1 Amb25806094 [0,1,0,1,0,0|1,0,1]=4 4077 B11R1.31 COC(=O)[C@@H](N)C1CCCC1 Amb22226722 [0,1,0,1,0,0|1,0,0]=3 4078 B11R1.31 C[C@@H]([C@@H]1CCCN1)C(=O)OC Amb25179341 [0,1,0,1,0,0|1,0,0]=3 4079 B11R1.31 C[C@H]([C@@H]1CCCN1)C(=O)OC Amb24637597 [0,1,0,1,0,0|1,0,0]=3 4080 B11R1.31 NC(C1CCCO1)C(=O)NN Amb25833410 [0,1,0,1,0,0|2,0,0]=4 4081 B11R1.31 O[C@@H](C1CCCC1)C(=O)CO Amb24698871 [0,1,0,1,0,0|2,0,0]=4 4082 B11R1.44 C#CC(=O)C1CCC(CN)O1 Amb24351346 [0,1,0,1,0,0|2,0,0]=4 4083 B11R1.44 CCC1CCC(N1)C(=O)OC Amb23454511 [0,1,0,1,0,0|1,0,0]=3 4084 B11R1.44 CCC1NC(CS1)C(=O)OC Amb22261542 [0,1,0,1,0,0|2,0,0]=4 4085 B11R1.44 CCC1N[C@@H](CS1)C(=O)OC Amb24697573 [0,1,0,1,0,0|2,0,0]=4 4086 B11R1.44 CC[C@@H]1CC[C@H](N1)C(=O)OC Amb24595770 [0,1,0,1,0,0|1,0,0]=3 4087 B11R1.44 CC[C@@H]1N[C@@H](CS1)C(=O)OC Amb24666585 [0,1,0,1,0,0|2,0,0]=4 4088 B11R1.44 CC[C@H]1N[C@@H](CS1)C(=O)OC Amb25208944 [0,1,0,1,0,0|2,0,0]=4 4089 B11R1.44 COC(=O)C1CCC(CN)O1 Amb24474950 [0,1,0,1,0,0|1,0,0]=3 4090 B11R1.44 COC(=O)C1CCC(N1)OC Amb25087834 [0,1,0,1,0,0|2,0,0]=4 4091 B11R1.44 COC(=O)C1CCC(O1)CO Amb13951705 [0,1,0,1,0,0|2,0,0]=4 4092 B11R1.44 COC(=O)N1CC(CN)CC1 Amb18958263 [0,1,0,1,0,0|2,0,0]=4 4093 B11R1.44 COC(=O)[C@@H]1CC[C@H](C=C)N1 Amb24626456 [0,1,0,1,0,0|1,0,1]=4 4094 B11R1.44 COC(=O)[C@@H]1CC[C@H](CN)O1 Amb25231224 [0,1,0,1,0,0|1,0,0]=3 4095 B11R1.44 COC(=O)[C@@H]1CC[C@H](CO)O1 Amb25168854 [0,1,0,1,0,0|2,0,0]=4 4096 B11R1.44 NCC1CCC(O1)C(=O)NO Amb25333012 [0,1,0,1,0,0|1,0,0]=3 4097 B11R1.121 CCCC1CC(C1)C(=O)OC Amb23537589 [0,1,0,1,0,0|2,0,0]=4 4098 B11R1.121 COC(=O)N1CC(CCN)C1 Amb25385620 [0,1,0,1,0,0|2,0,0]=4 4099 B11R1.187 CCCC1CC(C=O)C(=O)O1 Amb25334827 [0,1,0,1,0,0|2,0,0]=4 4100 B11R1.187 CCN1CC(CCN)OC1=O Amb18199898 [0,1,0,1,0,0|2,0,0]=4 4101 B11R1.218 CCCCC1CC1C(=O)OC Amb24061167 [0,1,0,1,0,0|2,0,0]=4 4102 B11R1.274 COC(=O)[C@@]1(C)CC[C@@H]1CO Amb24520209 [0,1,0,1,0,0|2,0,0]=4 4103 B11R1.280 COC1OC(CN)CCC1N Amb24484601 [0,1,0,1,0,0|0,0,2]=4 4104 B11R1.280 COC1O[C@@H](CN)CC[C@H]1N Amb24682204 [0,1,0,1,0,0|0,0,2]=4 4105 B11R1.280 CO[C@@H]1O[C@H](CN)CC[C@@H]1N Amb25240557 [0,1,0,1,0,0|0,0,2]=4 4106 B11R1.280 CO[C@H]1O[C@H](CN)CCC1N Amb25364243 [0,1,0,1,0,0|0,0,2]=4 4107 B11R1.280 CO[C@H]1O[C@H](CN)CC[C@H]1N Amb24627129 [0,1,0,1,0,0|0,0,2]=4 4108 B11R1.293 COC(=O)C(N)CC1CCC1 Amb25380472 [0,1,0,1,0,0|1,0,0]=3 4109 B11R1.293 COC(=O)C(N)CN1CCC1 Amb25385454 [0,1,0,1,0,0|2,0,0]=4 4110 B11R1.293 COC(=O)[C@H](O)CC1CCC1 Amb25383753 [0,1,0,1,0,0|2,0,0]=4 4111 B11R1.852 C#CC(=O)C1CCCCCN1 Amb24584920 [0,1,0,1,0,0|2,0,0]=4 4112 B11R1.852 CNC(=O)C1CCCCCN1 Amb23585564 [0,1,0,1,0,0|2,0,0]=4 4113 B11R1.852 COC(=O)C1CCCCCC1 Amb18182101 [0,1,0,1,0,0|2,0,0]=4 4114 B11R1.852 COC(=O)C1CCCCCN1 Amb21963566 [0,1,0,1,0,0|1,0,0]=3 4115 B11R1.852 COC(=O)C1CCCCCN1 Amb21964454 [0,1,0,1,0,0|1,0,0]=3 4116 B11R1.852 COC(=O)C1CCNCCN1 Amb24446566 [0,1,0,1,0,0|2,0,0]=4 4117 B11R1.852 COC(=O)C1CCOCCN1 Amb24696937 [0,1,0,1,0,0|2,0,0]=4 4118 B11R1.852 COC(=O)C1CNCCCC1 Amb21963336 [0,1,0,1,0,0|1,0,0]=3 4119 B11R1.852 COC(=O)C1CNCCCC1 Amb22490910 [0,1,0,1,0,0|1,0,0]=3 4120 B11R1.852 COC(=O)C1CNCCCN1 Amb22406405 [0,1,0,1,0,0|2,0,0]=4 4121 B11R1.852 COC(=O)C1CNCCCO1 Amb17739811 [0,1,0,1,0,0|2,0,0]=4 4122 B11R1.852 COC(=O)C1CNCCNC1 Amb22227357 [0,1,0,1,0,0|2,0,0]=4 4123 B11R1.852 COC(=O)C1COCCCN1 Amb25683052 [0,1,0,1,0,0|2,0,0]=4 4124 B11R1.852 COC(=O)C1CSCCCN1 Amb25689511 [0,1,0,1,0,0|2,0,0]=4 4125 B11R1.852 COC(=O)[C@H]1CSCCCN1 Amb25064608 [0,1,0,1,0,0|2,0,0]=4 4126 B11R1.852 NNC(=O)C1CCCCCN1 Amb25101333 [0,1,0,1,0,0|2,0,0]=4 4127 B11R1.852 OC(C=O)C1CCCCCN1 Amb24350419 [0,1,0,1,0,0|1,0,1]=4 4128 B11R1.852 ONC(=O)C1CCCCCC1 Amb18182216 [0,1,0,1,0,0|2,0,0]=4 4129 B11R1.852 ONC(=O)C1CCCCCN1 Amb25151281 [0,1,0,1,0,0|1,0,0]=3 4130 B11R1.878 C#CC(=O)C1(N)CCCCC1 Amb24698347 [0,1,0,1,0,0|2,0,0]=4 4131 B11R1.878 CC1(CCCCN1)C(=O)C#C Amb24610432 [0,1,0,1,0,0|2,0,0]=4 4132 B11R1.878 CC1(CCCCN1)C(=O)C=C Amb24548157 [0,1,0,1,0,0|2,0,0]=4 4133 B11R1.878 CC1(CCCCN1)C(=O)NN Amb24486781 [0,1,0,1,0,0|2,0,0]=4 4134 B11R1.878 CC1(CCCCN1)C(=O)NO Amb24486780 [0,1,0,1,0,0|1,0,0]=3 4135 B11R1.878 CCC(=O)C1(C)CCCCN1 Amb25800558 [0,1,0,1,0,0|2,0,0]=4 4136 B11R1.878 CCC(=O)C1(N)CCCCC1 Amb18200346 [0,1,0,1,0,0|2,0,0]=4 4137 B11R1.878 CNC(=O)C1(N)CCCCC1 Amb10609167 [0,1,0,1,0,0|2,0,0]=4 4138 B11R1.878 COC(=O)C1(C)CCCCC1 Amb25808571 [0,1,0,1,0,0|2,0,0]=4 4139 B11R1.878 COC(=O)C1(C)CCCCN1 Amb18644927 [0,1,0,1,0,0|1,0,0]=3 4140 B11R1.878 COC(=O)C1(C)CCCCN1 Amb21960057 [0,1,0,1,0,0|1,0,0]=3 4141 B11R1.878 COC(=O)C1(C)CCCCO1 Amb10072963 [0,1,0,1,0,0|2,0,0]=4 4142 B11R1.878 COC(=O)C1(C)COCCN1 Amb22899735 [0,1,0,1,0,0|2,0,0]=4 4143 B11R1.878 COC(=O)C1(F)CCCCC1 Amb25189563 [0,1,0,1,0,0|2,0,0]=4 4144 B11R1.878 COC(=O)C1(N)CCNCC1 Amb18281934 [0,1,0,1,0,0|2,0,0]=4 4145 B11R1.878 COC(=O)C1(N)CCNCC1 Amb19373642 [0,1,0,1,0,0|2,0,0]=4 4146 B11R1.878 COC(=O)C1(N)CCOCC1 Amb22167156 [0,1,0,1,0,0|2,0,0]=4 4147 B11R1.878 COC(=O)C1(N)CCSCC1 Amb18953112 [0,1,0,1,0,0|2,0,0]=4 4148 B11R1.878 COC(=O)C1(N)COCCC1 Amb25340372 [0,1,0,1,0,0|2,0,0]=4 4149 B11R1.878 COC(=O)C1(N)CSCCC1 Amb18287675 [0,1,0,1,0,0|2,0,0]=4 4150 B11R1.878 COC(=O)C1(S)CCCCC1 Amb22499490 [0,1,0,1,0,0|2,0,0]=4 4151 B11R1.878 COC(=O)[C@@]1(C)CCCCN1 Amb22748861 [0,1,0,1,0,0|1,0,0]=3 4152 B11R1.878 COC(=O)[C@@]1(C)COCCN1 Amb23439327 [0,1,0,1,0,0|2,0,0]=4 4153 B11R1.878 COC(=O)[C@]1(C)CCCCN1 Amb25299311 [0,1,0,1,0,0|1,0,0]=3 4154 B11R1.878 NC(=NO)C1(N)CCCCC1 Amb25784235 [0,1,0,1,0,0|2,0,0]=4 4155 B11R1.878 NC1(CCOCC1)C(=O)NO Amb25718021 [0,1,0,1,0,0|2,0,0]=4 4156 B11R1.878 NNC(=O)C1(N)CCCCC1 Amb25254510 [0,1,0,1,0,0|2,0,0]=4 4157 B11R1.1470 CC1(CCCC1N)C(=O)C=C Amb25681906 [0,1,0,1,0,0|2,0,0]=4 4158 B11R1.1470 CC1(COCC1N)C(=O)NO Amb25776965 [0,1,0,1,0,0|2,0,0]=4 4159 B11R1.1470 CNC(=O)C1(C)CCCC1N Amb24452965 [0,1,0,1,0,0|2,0,0]=4 4160 B11R1.1470 COC(=O)C1(C)CCCC1N Amb25338939 [0,1,0,1,0,0|1,0,0]=3 4161 B11R1.1470 COC(=O)C1(C)CCCC1O Amb25098676 [0,1,0,1,0,0|2,0,0]=4 4162 B11R1.1470 COC(=O)C1(C)COCC1N Amb24467181 [0,1,0,1,0,0|2,0,0]=4 4163 B11R1.1470 COC(=O)C1(F)CCCC1N Amb24392609 [0,1,0,1,0,0|1,0,0]=3 4164 B11R1.1470 COC(=O)C1(F)CCCC1O Amb25177559 [0,1,0,1,0,0|2,0,0]=4 4165 B11R1.1470 COC(=O)C1(N)CNCC1C Amb25837462 [0,1,0,1,0,0|2,0,0]=4 4166 B11R1.1470 COC(=O)C1(N)CSCC1C Amb24453553 [0,1,0,1,0,0|2,0,0]=4 4167 B11R1.1470 COC(=O)C1(O)CCCC1N Amb24394721 [0,1,0,1,0,0|1,0,0]=3 4168 B11R1.1470 COC(=O)[C@@]1(C)CCC[C@@H]1O Amb24741879 [0,1,0,1,0,0|2,0,0]=4 4169 B11R1.1470 COC(=O)[C@@]1(O)CCC[C@H]1N Amb24610147 [0,1,0,1,0,0|1,0,0]=3 4170 B11R1.1470 COC(=O)[C@]1(C)CCC[C@H]1O Amb24618782 [0,1,0,1,0,0|2,0,0]=4 4171 B11R1.134 CCCC1CC1(CN)C(O)=O Amb25382121 [0,1,0,1,0,0|1,0,0]=3 4172 B11R1.159 CC1C(CCCC1N)C(N)=O Amb18182134 [0,1,0,1,0,0|2,0,0]=4 4173 B11R1.159 CC1C(CCCC1O)C(O)=O Amb25072619 [0,1,0,1,0,0|2,0,0]=4 4174 B11R1.159 CC1C(Cl)CCCC1C(O)=O Amb25780658 [0,1,0,1,0,0|2,0,0]=4 4175 B11R1.159 CC1CCCC(C(N)=O)N1C Amb25711564 [0,1,0,1,0,0|2,0,0]=4 4176 B11R1.159 CC1CCCC(C1C)C(O)=O Amb25189114 [0,1,0,1,0,0|2,0,0]=4 4177 B11R1.159 CC1CCCC(C1N)C(N)=O Amb18797051 [0,1,0,1,0,0|2,0,0]=4 4178 B11R1.159 CC1CCCC(C1O)C(O)=O Amb25216945 [0,1,0,1,0,0|2,0,0]=4 4179 B11R1.159 CC1COCC(C(O)=O)N1C Amb25260215 [0,1,0,1,0,0|2,0,0]=4 4180 B11R1.159 CC1[C@H](CCC[C@@H]1O)C(O)=O Amb24512159 [0,1,0,1,0,0|2,0,0]=4 4181 B11R1.159 CN1C(CCCC1=O)C(O)=O Amb18830654 [0,1,0,1,0,0|1,0,1]=4 4182 B11R1.159 C[C@H]1CCC[C@@H](C(N)=O)N1C Amb24512306 [0,1,0,1,0,0|2,0,0]=4 4183 B11R1.159 C[C@H]1[C@H](CCC[C@H]1O)C(O)=O Amb24634320 [0,1,0,1,0,0|2,0,0]=4 4184 B11R1.159 NC(=O)C1CCCC(N)C1=O Amb25132264 [0,1,0,1,0,0|2,0,0]=4 4185 B11R1.159 N[C@@H]1C(CCCC1O)C(O)=O Amb25693587 [0,1,0,1,0,0|1,0,0]=3 4186 B11R1.159 N[C@H]1CCC[C@@H]([C@@H]1O)C(O)=O Amb24557744 [0,1,0,1,0,0|1,0,0]=3 4187 B11R1.159 N[C@H]1[C@@H](CCC[C@@H]1O)C(O)=O Amb24607358 [0,1,0,1,0,0|1,0,0]=3 4188 B11R1.298 CCC(C1CCCC1)C(O)=O Amb18125995 [0,1,0,1,0,0|2,0,0]=4 4189 B11R1.298 CCC(C1CCCO1)C(O)=O Amb24650922 [0,1,0,1,0,0|2,0,0]=4 4190 B11R1.298 CNC(C1CCCC1)C(N)=O Amb18985418 [0,1,0,1,0,0|2,0,0]=4 4191 B11R1.298 CNC(C1CCCC1)C(O)=O Amb18985420 [0,1,0,1,0,0|1,0,0]=3 4192 B11R1.298 CNC(C1CCCO1)C(O)=O Amb24334829 [0,1,0,1,0,0|1,0,0]=3 4193 B11R1.298 COC(C1CCCC1)C(O)=O Amb25060695 [0,1,0,1,0,0|2,0,0]=4 4194 B11R1.298 N#CC(C1CCCC1)C(O)=O Amb24422965 [0,1,0,1,0,0|1,0,1]=4 4195 B11R1.298 NCC(C(O)=O)N1CCCC1 Amb25761853 [0,1,0,1,0,0|2,0,0]=4 4196 B11R1.298 NCC(C1CCCC1)C(N)=O Amb24518954 [0,1,0,1,0,0|2,0,0]=4 4197 B11R1.298 NCC(C1CCCC1)C(O)=O Amb18830612 [0,1,0,1,0,0|1,0,0]=3 4198 B11R1.298 NCC(C1CCCO1)C(N)=O Amb24656733 [0,1,0,1,0,0|2,0,0]=4 4199 B11R1.298 NC[C@H](C1CCCC1)C(O)=O Amb25062568 [0,1,0,1,0,0|1,0,0]=3 4200 B11R1.298 OC(=O)C(CS)C1CCCC1 Amb25203204 [0,1,0,1,0,0|2,0,0]=4 4201 B11R1.298 OCC(C1CCCC1)C(O)=O Amb23512886 [0,1,0,1,0,0|2,0,0]=4 4202 B11R1.473 CO[C@@H]1CC[C@H]([C@H]1N)C(O)=O Amb24693846 [0,1,0,1,0,0|2,0,0]=4 4203 B11R1.1016 NCC(CC1CCC1)C(N)=O Amb25384715 [0,1,0,1,0,0|2,0,0]=4 4204 B11R1.1016 NCC(CC1CCC1)C(O)=O Amb25384714 [0,1,0,1,0,0|1,0,0]=3 4205 B11R1.1016 NCC(CC1CNC1)C(O)=O Amb25385294 [0,1,0,1,0,0|2,0,0]=4 4206 B11R1.1016 NCC(CC1COC1)C(O)=O Amb25385299 [0,1,0,1,0,0|2,0,0]=4 4207 B11R1.1016 NCC(NC1CCC1)C(O)=O Amb24754579 [0,1,0,1,0,0|2,0,0]=4 4208 B11R1.1033 CC1CC1NC(CN)C(O)=O Amb24754577 [0,1,0,1,0,0|2,0,0]=4 4209 B11R1.1064 CC1CCCC1(CN)C(O)=O Amb24702744 [0,1,0,1,0,0|1,0,0]=3 4210 B11R1.1064 CC1CCCC1(CO)C(O)=O Amb24515890 [0,1,0,1,0,0|2,0,0]=4 4211 B11R1.1064 CNC1(CCCC1C)C(N)=O Amb25042411 [0,1,0,1,0,0|2,0,0]=4 4212 B11R1.1064 CNC1(CCCC1C)C(O)=O Amb24486631 [0,1,0,1,0,0|1,0,0]=3 4213 B11R1.1064 CNC1(CSCC1C)C(O)=O Amb24580617 [0,1,0,1,0,0|2,0,0]=4 4214 B11R1.1074 CC(=O)C1(CN)CCCCC1 Amb24445563 [0,1,0,1,0,0|2,0,0]=4 4215 B11R1.1074 CCC1(CCCCC1)C(=O)O Amb1016524 [0,1,0,1,0,0|2,0,0]=4 4216 B11R1.1074 CCC1(CCCCN1)C(=O)O Amb15701483 [0,1,0,1,0,0|1,0,0]=3 4217 B11R1.1074 CCC1(CCCCN1)C(O)=O Amb19892167 [0,1,0,1,0,0|1,0,0]=3 4218 B11R1.1074 CCC1(COCCN1)C(O)=O Amb25848403 [0,1,0,1,0,0|2,0,0]=4 4219 B11R1.1074 CC[C@]1(CCCCN1)C(O)=O Amb24614684 [0,1,0,1,0,0|1,0,0]=3 4220 B11R1.1074 CNC1(CCCCC1)C(C)=O Amb24406380 [0,1,0,1,0,0|2,0,0]=4 4221 B11R1.1074 CNC1(CCCCC1)C(N)=O Amb18950561 [0,1,0,1,0,0|2,0,0]=4 4222 B11R1.1074 CNC1(CCNCC1)C(O)=O Amb18951529 [0,1,0,1,0,0|2,0,0]=4 4223 B11R1.1074 CNC1(CCSCC1)C(O)=O Amb18282840 [0,1,0,1,0,0|2,0,0]=4 4224 B11R1.1074 CNC1(COCCC1)C(O)=O Amb24744543 [0,1,0,1,0,0|2,0,0]=4 4225 B11R1.1074 CNC1(CSCCC1)C(O)=O Amb18288252 [0,1,0,1,0,0|2,0,0]=4 4226 B11R1.1074 COC1(CCCCC1)C(O)=O Amb18953825 [0,1,0,1,0,0|2,0,0]=4 4227 B11R1.1074 CSC1(CCCCC1)C(O)=O Amb18953837 [0,1,0,1,0,0|2,0,0]=4 4228 B11R1.1074 NC(=O)C1(CCCCC1)NO Amb24635806 [0,1,0,1,0,0|2,0,0]=4 4229 B11R1.1074 NCC1(CCCCC1)C(N)=O Amb18283789 [0,1,0,1,0,0|2,0,0]=4 4230 B11R1.1074 NCC1(CCCCC1)C(O)=O Amb18959883 [0,1,0,1,0,0|1,0,0]=3 4231 B11R1.1074 NCC1(CCCCC1)C(O)=O Amb22371113 [0,1,0,1,0,0|1,0,0]=3 4232 B11R1.1074 NCC1(CCOCC1)C(O)=O Amb24077508 [0,1,0,1,0,0|2,0,0]=4 4233 B11R1.1074 NCC1(CCSCC1)C(O)=O Amb25837487 [0,1,0,1,0,0|2,0,0]=4 4234 B11R1.1074 NNC1(CCCCC1)C(O)=O Amb19515065 [0,1,0,1,0,0|1,0,0]=3 4235 B11R1.1074 OC(=O)C1(CCCCC1)NCl Amb24711508 [0,1,0,1,0,0|1,0,0]=3 4236 B11R1.1074 OC(=O)C1(CS)CCCCC1 Amb25053870 [0,1,0,1,0,0|2,0,0]=4 4237 B11R1.1074 OCC1(CCCCC1)C(=O)O Amb17400032 [0,1,0,1,0,0|2,0,0]=4 4238 B11R1.1074 OCC1(CCCCO1)C(O)=O Amb24356432 [0,1,0,1,0,0|2,0,0]=4 4239 B11R1.80 C[C@@H]1C[C@@H](CC(Cl)Cl)OC1=O Amb24651029 [0,1,0,1,0,0|2,0,0]=4 4240 B11R1.175 CC(C)C1CCC(N1)C(O)=O Amb18200002 [0,1,0,1,0,0|1,0,0]=3 4241 B11R1.175 CC(C)C1CCC(O1)C(O)=O Amb24392753 [0,1,0,1,0,0|2,0,0]=4 4242 B11R1.175 CC(C)C1N[C@@H](CS1)C(O)=O Amb18180516 [0,1,0,1,0,0|2,0,0]=4 4243 B11R1.175 CC(C)[C@@H]1CC[C@@H](N1)C(O)=O Amb24514876 [0,1,0,1,0,0|1,0,0]=3 4244 B11R1.175 CC(C)[C@H]1CC[C@H](N1)C(O)=O Amb25174843 [0,1,0,1,0,0|1,0,0]=3 4245 B11R1.175 NC(=O)C1CCC(C1)C(O)=O Amb18126050 [0,1,0,1,0,0|1,0,1]=4 4246 B11R1.175 NC(=O)C1CCC(N1)C(N)=O Amb24093510 [0,1,0,1,0,0|1,0,1]=4 4247 B11R1.175 NC(=O)C1CCC(O1)C(O)=O Amb25111716 [0,1,0,1,0,0|1,0,1]=4 4248 B11R1.175 NC(=O)C1CCC(S1)C(O)=O Amb25323095 [0,1,0,1,0,0|1,0,1]=4 4249 B11R1.175 NC(=O)[C@@H]1CC[C@@H](N1)C(O)=O Amb23560440 [0,1,0,1,0,0|0,0,1]=3 4250 B11R1.175 NC(=O)[C@@H]1CC[C@@H](O1)C(O)=O Amb24384443 [0,1,0,1,0,0|1,0,1]=4 4251 B11R1.175 NC(=O)[C@@H]1CC[C@@H](S1)C(O)=O Amb23560409 [0,1,0,1,0,0|1,0,1]=4 4252 B11R1.175 NC(=O)[C@@H]1CC[C@H](N1)C(O)=O Amb23560427 [0,1,0,1,0,0|0,0,1]=3 4253 B11R1.175 NC(=O)[C@@H]1CC[C@H](S1)C(O)=O Amb23560425 [0,1,0,1,0,0|1,0,1]=4 4254 B11R1.175 NC(=O)[C@H]1CC[C@H](N1)C(N)=O Amb25337594 [0,1,0,1,0,0|1,0,1]=4 4255 B11R1.175 NC(=O)[C@H]1CC[C@H](O1)C(O)=O Amb25143267 [0,1,0,1,0,0|1,0,1]=4 4256 B11R1.175 OC(=O)C1CCC(N1)C(F)F Amb19515716 [0,1,0,1,0,0|1,0,0]=3 4257 B11R1.175 OC(=O)[C@@H]1CC[C@H](N1)C(O)=O Amb25174831 [0,1,0,1,0,0|1,0,1]=4 4258 B11R1.175 OC(=O)[C@H]1CC[C@H](N1)C(O)=O Amb24538157 [0,1,0,1,0,0|1,0,1]=4 4259 B11R1.561 CC1(C)CCC[C@H](N)C(=O)N1 Amb24731373 [0,1,0,1,0,0|2,0,0]=4 4260 B11R1.704 NC(C1CC1C(O)=O)C(O)=O Amb24447417 [0,1,0,1,0,0|1,0,1]=4 4261 B11R1.704 NC(C1C[C@@H]1C(O)=O)C(O)=O Amb25689113 [0,1,0,1,0,0|1,0,1]=4 4262 B11R1.704 N[C@@H](C1CC1C(O)=O)C(O)=O Amb25794472 [0,1,0,1,0,0|1,0,1]=4 4263 B11R1.704 N[C@@H]([C@@H]1CC1C(O)=O)C(O)=O Amb24512148 [0,1,0,1,0,0|1,0,1]=4 4264 B11R1.704 N[C@@H]([C@@H]1C[C@@H]1C(O)=O)C(O)=O Amb22352678 [0,1,0,1,0,0|1,0,1]=4 4265 B11R1.704 N[C@@H]([C@@H]1C[C@H]1C(O)=O)C(O)=O Amb25210847 [0,1,0,1,0,0|1,0,1]=4 4266 B11R1.704 N[C@@H]([C@H]1CC1C(O)=O)C(O)=O Amb25273752 [0,1,0,1,0,0|1,0,1]=4 4267 B11R1.704 N[C@@H]([C@H]1C[C@@H]1C(O)=O)C(O)=O Amb19930360 [0,1,0,1,0,0|1,0,1]=4 4268 B11R1.704 N[C@@H]([C@H]1C[C@H]1C(O)=O)C(O)=O Amb22388556 [0,1,0,1,0,0|1,0,1]=4 4269 B11R1.704 N[C@H]([C@@H]1CC1C(O)=O)C(O)=O Amb25274088 [0,1,0,1,0,0|1,0,1]=4 4270 B11R1.704 N[C@H]([C@@H]1C[C@@H]1C(O)=O)C(O)=O Amb25274089 [0,1,0,1,0,0|1,0,1]=4 4271 B11R1.704 N[C@H]([C@@H]1C[C@H]1C(O)=O)C(O)=O Amb25242512 [0,1,0,1,0,0|1,0,1]=4 4272 B11R1.704 N[C@H]([C@H]1C[C@H]1C(O)=O)C(O)=O Amb24692814 [0,1,0,1,0,0|1,0,1]=4 4273 B11R1.711 CC(C)CC[C@@H]1O[C@H]1C(O)=O Amb25386408 [0,1,0,1,0,0|2,0,0]=4 4274 B11R1.723 CC(C)C1CCC1(N)C(O)=O Amb23456073 [0,1,0,1,0,0|1,0,0]=3 4275 B11R1.723 CC(C)[C@@H]1CC[C@@]1(N)C(O)=O Amb25349511 [0,1,0,1,0,0|1,0,0]=3 4276 B11R1.723 NC1(CCC1C(O)=O)C(O)=O Amb24381448 [0,1,0,1,0,0|1,0,1]=4 4277 B11R1.730 CC1(C)CC(CCC1)C(O)=O Amb22059548 [0,1,0,1,0,0|2,0,0]=4 4278 B11R1.730 CC1(C)CCCC(N1)C(O)=O Amb23589291 [0,1,0,1,0,0|1,0,0]=3 4279 B11R1.730 CC1(C)COCC(N1)C(O)=O Amb23585295 [0,1,0,1,0,0|2,0,0]=4 4280 B11R1.730 CC1(C)CSCC(N1)C(O)=O Amb25189224 [0,1,0,1,0,0|2,0,0]=4 4281 B11R1.730 CC1(C)C[C@H](CCC1)C(O)=O Amb24538171 [0,1,0,1,0,0|2,0,0]=4 4282 B11R1.730 CC1(C)NC(CCS1)C(O)=O Amb25683967 [0,1,0,1,0,0|2,0,0]=4 4283 B11R1.730 CC1(Cl)CC(CCC1)C(O)=O Amb18648012 [0,1,0,1,0,0|2,0,0]=4 4284 B11R1.730 CC1(N)CC(CCC1)C(O)=O Amb24594199 [0,1,0,1,0,0|1,0,0]=3 4285 B11R1.730 CC1(O)CC(CCC1)C(O)=O Amb18126140 [0,1,0,1,0,0|2,0,0]=4 4286 B11R1.730 OC(=O)C1CC(F)(F)CCC1 Amb22738663 [0,1,0,1,0,0|2,0,0]=4 4287 B11R1.730 OC(=O)[C@@H]1CCCS(=O)(=O)N1 Amb25080020 [0,1,0,1,0,0|2,0,0]=4 4288 B11R1.743 CC(C)CC1CC(C1)C(O)=O Amb23456005 [0,1,0,1,0,0|2,0,0]=4 4289 B11R1.927 NC(=O)CC1CC1(N)C(O)=O Amb25738018 [0,1,0,1,0,0|0,0,1]=3 4290 B11R1.927 N[C@@]1(C[C@@H]1CC(O)=O)C(O)=O Amb19148343 [0,1,0,1,0,0|1,0,1]=4 4291 B11R1.927 N[C@@]1(C[C@@H]1CC(O)=O)C(O)=O Amb25321870 [0,1,0,1,0,0|1,0,1]=4 4292 B11R1.927 N[C@]1(C[C@H]1CC(O)=O)C(O)=O Amb25179270 [0,1,0,1,0,0|1,0,1]=4 4293 B11R1.1107 CC(C1CCC1(C)C)C(O)=O Amb25129232 [0,1,0,1,0,0|2,0,0]=4 4294 B11R1.1386 CC1(C)CCCC1(C)C(O)=O Amb25806188 [0,1,0,1,0,0|2,0,0]=4 4295 B11R1.1386 CC1(C)CCC[C@@]1(C)C(O)=O Amb25210548 [0,1,0,1,0,0|2,0,0]=4 4296 B11R1.1386 CC1(C)CCC[C@]1(C)C(O)=O Amb25765820 [0,1,0,1,0,0|2,0,0]=4 4297 B11R1.1386 CC1(C)SCC[C@@]1(N)C(O)=O Amb25784007 [0,1,0,1,0,0|2,0,0]=4 4298 B11R1.1386 CC1(CCCC1(F)F)C(O)=O Amb25223204 [0,1,0,1,0,0|2,0,0]=4 4299 B11R1.1386 CC1(O)CCCC1(C)C(O)=O Amb18126142 [0,1,0,1,0,0|2,0,0]=4 4300 B11R1.1386 N[C@@]1(CCCC1(F)F)C(O)=O Amb24634327 [0,1,0,1,0,0|1,0,0]=3 4301 B11R2.8 CC1C2NCCC2NC1=O Amb24420002 [0,0,0,2,0,0|2,0,0]=4 4302 B11R2.8 NC1C2CCCC2OC1=O Amb25218538 [0,0,0,2,0,0|1,0,0]=3 4303 B11R2.8 NC1C2CCCN2CC1=O Amb25695430 [0,0,0,2,0,0|1,0,0]=3 4304 B11R2.8 NC1CC2CCCN2C1=O Amb25722600 [0,0,0,2,0,0|2,0,0]=4 4305 B11R2.8 N[C@H]1C(O)CN2CCCC21 Amb24470679 [0,0,0,2,0,0|1,0,1]=4 4306 B11R2.8 N[C@H]1C[C@@H]2CCCN2C1=O Amb24583806 [0,0,0,2,0,0|2,0,0]=4 4307 B11R2.8 N[C@H]1[C@H](O)CN2CCCC21 Amb25367299 [0,0,0,2,0,0|1,0,1]=4 4308 B11R2.54 NC1C2CCCCN2C1=O Amb25786075 [0,0,0,2,0,0|2,0,0]=4 4309 B11R2.54 NC1[C@H]2CCCCN2C1=O Amb25335357 [0,0,0,2,0,0|2,0,0]=4 4310 B11R2.474 O=C1CCCC2CCC1N2 Amb24674236 [0,0,0,2,0,0|2,0,0]=4 4311 B11R2.130 OC1C2CC(CC2)OC1=O Amb25333566 [0,0,0,2,0,0|2,0,0]=4 4312 B11R2.141 OC(=O)C1CC12CCCC2 Amb10607312 [0,0,0,2,0,0|2,0,0]=4 4313 B11R2.814 OC(=O)C1CC2CCCC21 Amb24524606 [0,0,0,2,0,0|2,0,0]=4 4314 B11R2.814 OC(=O)C1CC2CCOC21 Amb25695992 [0,0,0,2,0,0|2,0,0]=4 4315 B11R2.845 NC(=O)C1CC2CCC1N2 Amb25794704 [0,0,0,2,0,0|2,0,0]=4 4316 B11R2.845 NC(=O)C1NC2CC1CC2 Amb22372278 [0,0,0,2,0,0|2,0,0]=4 4317 B11R2.845 O=C(Cl)C1NC2CC1CC2 Amb25780178 [0,0,0,2,0,0|2,0,0]=4 4318 B11R2.845 OC(=O)C1CC2CCC1O2 Amb18202638 [0,0,0,2,0,0|2,0,0]=4 4319 B11R2.845 OC(=O)C1C[C@@H]2CC[C@H]1N2 Amb24517450 [0,0,0,2,0,0|1,0,0]=3 4320 B11R2.845 OC(=O)C1C[C@@H]2C[C@H]1CC2 Amb24598959 [0,0,0,2,0,0|2,0,0]=4 4321 B11R2.845 OC(=O)C1NC2CC1C=C2 Amb18832102 [0,0,0,2,0,0|1,0,1]=4 4322 B11R2.845 OC(=O)[C@@H]1CC2CC1CC2 Amb24745677 [0,0,0,2,0,0|2,0,0]=4 4323 B11R2.845 OC(=O)[C@@H]1CC2CCC1O2 Amb24480795 [0,0,0,2,0,0|2,0,0]=4 4324 B11R2.845 OC(=O)[C@@H]1C[C@@H]2CC[C@H]1N2 Amb23385246 [0,0,0,2,0,0|1,0,0]=3 4325 B11R2.845 OC(=O)[C@@H]1C[C@@H]2CC[C@H]1O2 Amb24120328 [0,0,0,2,0,0|2,0,0]=4 4326 B11R2.845 OC(=O)[C@@H]1C[C@@H]2C[C@@H]1CC2 Amb24599985 [0,0,0,2,0,0|2,0,0]=4 4327 B11R2.845 OC(=O)[C@@H]1C[C@@H]2C[C@H]1CC2 Amb24630346 [0,0,0,2,0,0|2,0,0]=4 4328 B11R2.845 OC(=O)[C@@H]1C[C@H]2CC1CC2 Amb24615765 [0,0,0,2,0,0|2,0,0]=4 4329 B11R2.845 OC(=O)[C@@H]1C[C@H]2CC[C@@H]1N2 Amb23385249 [0,0,0,2,0,0|1,0,0]=3 4330 B11R2.845 OC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2 Amb19334556 [0,0,0,2,0,0|2,0,0]=4 4331 B11R2.845 OC(=O)[C@@H]1C[C@H]2C[C@H]1CC2 Amb25175105 [0,0,0,2,0,0|2,0,0]=4 4332 B11R2.845 OC(=O)[C@@H]1NC2CC1C=C2 Amb25693328 [0,0,0,2,0,0|1,0,1]=4 4333 B11R2.845 OC(=O)[C@@H]1N[C@@H]2C[C@@H]1CC2 Amb22745380 [0,0,0,2,0,0|1,0,0]=3 4334 B11R2.845 OC(=O)[C@@H]1N[C@@H]2C[C@H]1CC2 Amb18180724 [0,0,0,2,0,0|1,0,0]=3 4335 B11R2.845 OC(=O)[C@@H]1N[C@@H]2C[C@H]1CC2 Amb22748360 [0,0,0,2,0,0|1,0,0]=3 4336 B11R2.845 OC(=O)[C@@H]1N[C@H]2C[C@@H]1CC2 Amb24560741 [0,0,0,2,0,0|1,0,0]=3 4337 B11R2.845 OC(=O)[C@H]1C[C@@H]2CC[C@H]1N2 Amb24056615 [0,0,0,2,0,0|1,0,0]=3 4338 B11R2.845 OC(=O)[C@H]1C[C@@H]2C[C@@H]1CC2 Amb24615645 [0,0,0,2,0,0|2,0,0]=4 4339 B11R2.845 OC(=O)[C@H]1C[C@@H]2C[C@H]1CC2 Amb24548859 [0,0,0,2,0,0|2,0,0]=4 4340 B11R2.845 OC(=O)[C@H]1C[C@H]2CC[C@@H]1O2 Amb24681023 [0,0,0,2,0,0|2,0,0]=4 4341 B11R2.845 OC(=O)[C@H]1C[C@H]2CC[C@H]1O2 Amb25230625 [0,0,0,2,0,0|2,0,0]=4 4342 B11R2.845 OC(=O)[C@H]1C[C@H]2C[C@H]1CC2 Amb25175104 [0,0,0,2,0,0|2,0,0]=4 4343 B11R2.845 OC(=O)[C@H]1N[C@@H]2CC[C@H]1C2 Amb17913041 [0,0,0,2,0,0|1,0,0]=3 4344 B11R2.845 OC(=O)[C@H]1N[C@H]2C[C@@H]1CC2 Amb2371885 [0,0,0,2,0,0|1,0,0]=3 4345 B11R2.1825 CC1(C2CCCC12)C(O)=O Amb24392221 [0,0,0,2,0,0|2,0,0]=4 4346 B11R2.1825 C[C@]1([C@@H]2CCC[C@H]12)C(O)=O Amb25847519 [0,0,0,2,0,0|2,0,0]=4 4347 B11R2.1825 OC(=O)C1(Cl)C2CCCC12 Amb25102485 [0,0,0,2,0,0|2,0,0]=4 4348 B11R2.1825 OC(=O)[C@@]1(Cl)[C@@H]2CCC[C@H]12 Amb24710099 [0,0,0,2,0,0|2,0,0]=4 4349 B11R2.1825 OC(=O)[C@]1(Cl)[C@@H]2CCC[C@H]12 Amb24482191 [0,0,0,2,0,0|2,0,0]=4 4350 B11R2.587 NC1C2C1CCC2C(O)=O Amb24716006 [0,0,0,2,0,0|1,0,0]=3 4351 B11R2.822 OC(=O)C1CSC2CCN12 Amb24711461 [0,0,0,2,0,0|2,0,0]=4 4352 B11R2.822 OC(=O)C1OCC2CCC21 Amb24523153 [0,0,0,2,0,0|2,0,0]=4 4353 B11R2.822 OC(=O)[C@@H]1OC[C@H]2CC[C@H]21 Amb25209300 [0,0,0,2,0,0|2,0,0]=4 4354 B11R2.842 OC(=O)C1CC2CCC2C1 Amb25256091 [0,0,0,2,0,0|2,0,0]=4 4355 B11R2.842 OC(=O)C1C[C@@H]2CC[C@@H]2C1 Amb24460735 [0,0,0,2,0,0|2,0,0]=4 4356 B11R2.842 OC(=O)[C@@H]1C[C@@H]2CC[C@@H]2C1 Amb24446426 [0,0,0,2,0,0|2,0,0]=4 4357 B11R2.842 OC(=O)[C@@H]1C[C@H]2CC[C@H]2C1 Amb24472881 [0,0,0,2,0,0|2,0,0]=4 4358 B11R2.1839 OC(=O)C12CCC(CC1)N2 Amb17719274 [0,0,0,2,0,0|1,0,0]=3 4359 B11R2.1839 OC(=O)C12CCC(CC1)O2 Amb23452647 [0,0,0,2,0,0|2,0,0]=4 4360 B11R2.1839 OC(=O)C12CCC(N1)CC2 Amb2372047 [0,0,0,2,0,0|1,0,0]=3 4361 B11R2.1839 OC(=O)[C@@]12CC[C@@H](C1)CN2 Amb2372049 [0,0,0,2,0,0|1,0,0]=3 4362 B11R2.1839 OC(=O)[C@@]12C[C@@H](CN1)CC2 Amb19148162 [0,0,0,2,0,0|1,0,0]=3 4363 B11R2.1839 OC(=O)[C@]12CC[C@H](C1)CN2 Amb2372048 [0,0,0,2,0,0|1,0,0]=3 4364 B11R2.1839 OC(=O)[C@]12CC[C@H](CC1)N2 Amb25146464 [0,0,0,2,0,0|1,0,0]=3 4365 B11R2.1839 OC(=O)[C@]12C[C@H](CC1)CC2 Amb24621865 [0,0,0,2,0,0|2,0,0]=4 4366 B11R2.440 NC1CC12CC(C2)C(O)=O Amb25856074 [0,0,0,2,0,0|1,0,0]=3 4367 B11R2.1826 OC(=O)C12CC(C1)CCC2 Amb25261064 [0,0,0,2,0,0|2,0,0]=4 4368 B11R2.1826 OC(=O)C12CC(C1)CCN2 Amb24479083 [0,0,0,2,0,0|1,0,0]=3 4369 B11R2.1867 OC(=O)C1CC2(C1)CCC2 Amb22406223 [0,0,0,2,0,0|2,0,0]=4 4370 B11R2.1867 OC(=O)C1CC2(C1)CCN2 Amb24580573 [0,0,0,2,0,0|1,0,0]=3 4371 B11R2.47 O=C1O[C@H]2CC[C@@H]1C[C@@H]2Cl Amb24558189 [0,0,0,2,0,0|2,0,0]=4 4372 B11R2.47 OC1CC2CCC1OC2=O Amb25128536 [0,0,0,2,0,0|2,0,0]=4 4373 B11R2.411 OC(=O)C12CC1CC(=O)N2 Amb24480704 [0,0,0,2,0,0|1,0,1]=4 4374 B11R2.530 OC1CCC2C1C2C(O)=O Amb25378714 [0,0,0,2,0,0|2,0,0]=4 4375 B11R2.839 OC(=O)C1CC2OC2CC1 Amb22274789 [0,0,0,2,0,0|2,0,0]=4 4376 B11R2.839 OC(=O)C1CC2OC2CC1 Amb24671302 [0,0,0,2,0,0|2,0,0]=4 4377 B11R2.839 OC(=O)C1CC2OC2CN1 Amb25849260 [0,0,0,2,0,0|2,0,0]=4 4378 B11R2.839 OC(=O)C1CCC2CC2N1 Amb25342650 [0,0,0,2,0,0|1,0,0]=3 4379 B11R2.839 OC(=O)[C@@H]1C[C@@H]2C[C@@H]2CC1 Amb25174795 [0,0,0,2,0,0|2,0,0]=4 4380 B11R2.839 OC(=O)[C@H]1C[C@@H]2OC2CC1 Amb24514915 [0,0,0,2,0,0|2,0,0]=4 4381 B11R2.839 OC(=O)[C@H]1C[C@@H]2O[C@@H]2CC1 Amb25366365 [0,0,0,2,0,0|2,0,0]=4 4382 B11R2.846 OC(=O)C1CC2CC(C1)C2 Amb25809306 [0,0,0,2,0,0|2,0,0]=4 4383 B11R2.1837 OC(=O)C1NCCC2CC21 Amb24758905 [0,0,0,2,0,0|1,0,0]=3 4384 B11R2.1837 OC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21 Amb24580476 [0,0,0,2,0,0|2,0,0]=4 4385 B11R2.119 NC12CC(CCC1)OC2=O Amb24653771 [0,0,0,2,0,0|1,0,0]=3 4386 B11R2.119 N[C@]12C[C@H](CCC1)OC2=O Amb25259203 [0,0,0,2,0,0|1,0,0]=3 4387 B11R2.119 O[C@@]12CCC[C@@H](CC1=O)N2 Amb25176057 [0,0,0,2,0,0|2,0,0]=4 4388 B11R2.355 OC1CC(OC1=O)C2CO2 Amb24437961 [0,0,0,2,0,0|2,0,0]=4 4389 B11R2.355 O[C@@H]1C[C@@H](OC1=O)[C@H]2CO2 Amb25271933 [0,0,0,2,0,0|2,0,0]=4 4390 B11R2.813 NC(=O)C12CC1CCCN2 Amb25195920 [0,0,0,2,0,0|2,0,0]=4 4391 B11R2.813 OC(=O)C12CC1CCCC2 Amb25709012 [0,0,0,2,0,0|2,0,0]=4 4392 B11R2.813 OC(=O)C12CC1CCCN2 Amb24112951 [0,0,0,2,0,0|1,0,0]=3 4393 B11R2.813 OC(=O)C12CNCCC1C2 Amb10610566 [0,0,0,2,0,0|1,0,0]=3 4394 B11R2.813 OC(=O)C12CNCCC1C2 Amb24426368 [0,0,0,2,0,0|1,0,0]=3 4395 B11R2.813 OC(=O)[C@]12C[C@H]1CCCN2 Amb24609781 [0,0,0,2,0,0|1,0,0]=3 4396 B11R2.951 OC[C@H]1C[C@@]12C[C@H]2C(O)=O Amb24612143 [0,0,0,2,0,0|2,0,0]=4 4397 B11R2.1024 O=C1OC(CCl)CC2OC12 Amb25212209 [0,0,0,2,0,0|2,0,0]=4 4398 B11R2.1836 OC(=O)C1CC1C2CCC2 Amb20622343 [0,0,0,2,0,0|2,0,0]=4 4399 B11R2.1852 CC(=O)C1[C@@H]2NCCC[C@H]12 Amb24741957 [0,0,0,2,0,0|2,0,0]=4 4400 B11R2.1852 OC(=O)C1C2C1CCCC2 Amb2235084 [0,0,0,2,0,0|2,0,0]=4 4401 B11R2.1852 OC(=O)C1C2NCCCC12 Amb18831774 [0,0,0,2,0,0|1,0,0]=3 4402 B11R2.1852 OC(=O)C1[C@@H]2NCCC[C@H]12 Amb25217768 [0,0,0,2,0,0|1,0,0]=3 4403 B11R2.1852 OC(=O)C1[C@@H]2[C@H]1CCCC2 Amb13777307 [0,0,0,2,0,0|2,0,0]=4 4404 B11R2.1852 OC(=O)[C@@H]1[C@H]2OCCC[C@@H]12 Amb25296387 [0,0,0,2,0,0|2,0,0]=4 4405 B11R2.849 NC(=O)C1(N)CCC2CC12 Amb25846368 [0,0,0,2,0,0|2,0,0]=4 4406 B11R2.849 NC1(CCC2CC12)C(O)=O Amb19148505 [0,0,0,2,0,0|1,0,0]=3 4407 B11R2.849 OC(=O)C1(O)CCC2CC12 Amb25314065 [0,0,0,2,0,0|2,0,0]=4 4408 B11R2.1230 NC(C1CC12CC2)C(O)=O Amb25131280 [0,0,0,2,0,0|1,0,0]=3 4409 B11R2.48 O=C1N[C@@H]2CNC[C@H]1CC2 Amb22757913 [0,0,0,2,0,0|2,0,0]=4 4410 B11R2.1850 NC1(CC2OC2C1)C(O)=O Amb25672225 [0,0,0,2,0,0|2,0,0]=4 4411 B11R2.820 NC1(CC2CC1C2)C(O)=O Amb25362310 [0,0,0,2,0,0|1,0,0]=3 4412 B11R2.820 OC(=O)C1(O)CC2CC1C2 Amb25241628 [0,0,0,2,0,0|2,0,0]=4 4413 B11R2.851 NC1(CC12CCC2)C(O)=O Amb25126310 [0,0,0,2,0,0|1,0,0]=3 4414 B11R2.851 NC1(CC12COC2)C(O)=O Amb25208300 [0,0,0,2,0,0|2,0,0]=4 4415 B11R2.851 OC(=O)C1(Cl)CC12CCC2 Amb24482206 [0,0,0,2,0,0|2,0,0]=4 4416 B11R2.819 OC(=O)C12CCC1CCN2 Amb24399669 [0,0,0,2,0,0|1,0,0]=3 4417 B11R2.819 OC(=O)C12CNCC1CC2 Amb25688250 [0,0,0,2,0,0|1,0,0]=3 4418 B11R0.46 CCCCCC(CCC(=O)O)C Amb10807482 [0,0,0,0,0,2|2,0,0]=4 4419 B11R0.46 CCCCCC(\C=C\C(=O)O)O Amb10549834 [0,0,0,0,0,2|2,0,0]=4