0 B9R0.7 C=C(NCC(O)=O)C(O)=O Amb24350752 [0,0,0,0,0,0|1,0,1]=2 1 B9R0.7 CC(=C)C(=O)OCC(O)=O Amb18644056 [0,0,0,0,0,0|4,0,0]=4 2 B9R0.7 CC(=C)CCC(C)C(O)=O Amb25809141 [0,0,0,0,0,0|2,0,2]=4 3 B9R0.7 CC(=C)CC[C@@H](C)C(O)=O Amb25685103 [0,0,0,0,0,0|2,0,2]=4 4 B9R0.7 CC(=C)COC(C)C(O)=O Amb24549744 [0,0,0,0,0,0|3,0,1]=4 5 B9R0.7 CC(=C)CO[C@@H](C)C(O)=O Amb24505175 [0,0,0,0,0,0|3,0,1]=4 6 B9R0.7 CC(=C)CO[C@H](C)C(O)=O Amb25772492 [0,0,0,0,0,0|3,0,1]=4 7 B9R0.7 CC(=N)C(=O)NCC(O)=O Amb25694426 [0,0,0,0,0,0|4,0,0]=4 8 B9R0.7 CC(=NN=C(C)N)C(O)=O Amb25216201 [0,0,0,0,0,0|4,0,0]=4 9 B9R0.7 CC(=NN=C(N)N)C(O)=O Amb24093604 [0,0,0,0,0,0|4,0,0]=4 10 B9R0.7 CC(=NNC(N)=O)C(O)=O Amb24516860 [0,0,0,0,0,0|3,0,0]=3 11 B9R0.7 CC(=N\N=C(\N)/S)C(O)=O Amb24558320 [0,0,0,0,0,0|3,1,0]=4 12 B9R0.7 CC(=O)C(=O)CCC(O)=O Amb24359327 [0,0,0,0,0,0|2,0,1]=3 13 B9R0.7 CC(=O)C(=O)NCC(C)=O Amb24376332 [0,0,0,0,0,0|4,0,0]=4 14 B9R0.7 CC(=O)C(=O)NCC(N)=O Amb25147496 [0,0,0,0,0,0|4,0,0]=4 15 B9R0.7 CC(=O)C(Br)CCC(O)=O Amb25733508 [0,0,0,0,0,0|2,0,2]=4 16 B9R0.7 CC(=O)C(C)=NNC(C)=O Amb24598972 [0,0,0,0,0,0|4,0,0]=4 17 B9R0.7 CC(=O)C(C)C=NC(N)=O Amb24695370 [0,0,0,0,0,0|3,0,1]=4 18 B9R0.7 CC(=O)C(C)CCC(N)=O Amb25843826 [0,0,0,0,0,0|2,0,2]=4 19 B9R0.7 CC(=O)C(C)SCC(C)=O Amb24482830 [0,0,0,0,0,0|3,0,1]=4 20 B9R0.7 CC(=O)C(C)\C=N\C(N)=O Amb25789488 [0,0,0,0,0,0|3,0,1]=4 21 B9R0.7 CC(=O)CCC(=C)C(C)=O Amb25303019 [0,0,0,0,0,0|2,0,2]=4 22 B9R0.7 CC(=O)CCC(=O)C(C)=O Amb25852390 [0,0,0,0,0,0|3,0,1]=4 23 B9R0.7 CC(=O)CCC(C)C(C)=O Amb25146789 [0,0,0,0,0,0|2,0,2]=4 24 B9R0.7 CC(=O)CCC(C)C(O)=O Amb18644099 [0,0,0,0,0,0|1,0,2]=3 25 B9R0.7 CC(=O)CCC(N)C(O)=O Amb20669473 [0,0,0,0,0,0|2,0,2]=4 26 B9R0.7 CC(=O)CCC(N)C(O)=O Amb22157242 [0,0,0,0,0,0|2,0,2]=4 27 B9R0.7 CC(=O)CCN(C)C(C)=O Amb24352049 [0,0,0,0,0,0|3,0,1]=4 28 B9R0.7 CC(=O)CC[C@@H](N)C(O)=O Amb19130479 [0,0,0,0,0,0|2,0,2]=4 29 B9R0.7 CC(=O)CC[C@H](C)C(C)=O Amb25692099 [0,0,0,0,0,0|2,0,2]=4 30 B9R0.7 CC(=O)CC[C@H](N)C(O)=O Amb25147501 [0,0,0,0,0,0|2,0,2]=4 31 B9R0.7 CC(=O)CNC(=O)C(O)=O Amb24480846 [0,0,0,0,0,0|3,0,0]=3 32 B9R0.7 CC(=O)CSC(C(=O)O)C Amb17501621 [0,0,0,0,0,0|2,0,1]=3 33 B9R0.7 CC(=O)N(C)CCC(N)=O Amb25688630 [0,0,0,0,0,0|3,0,1]=4 34 B9R0.7 CC(=O)NCC(C)C(O)=O Amb18300085 [0,0,0,0,0,0|2,0,2]=4 35 B9R0.7 CC(=O)NN=C(C)C(O)=O Amb25367709 [0,0,0,0,0,0|3,0,0]=3 36 B9R0.7 CC(=O)NNC(=O)C(O)=O Amb25185290 [0,0,0,0,0,0|4,0,0]=4 37 B9R0.7 CC(=O)NNC(C)C(O)=O Amb24679763 [0,0,0,0,0,0|3,0,1]=4 38 B9R0.7 CC(=O)NN[C@@H](C)C(O)=O Amb24068257 [0,0,0,0,0,0|3,0,1]=4 39 B9R0.7 CC(=O)OCC(=O)C(O)=O Amb24350556 [0,0,0,0,0,0|3,0,1]=4 40 B9R0.7 CC(=O)OC[C@@H](C)C(O)=O Amb25187888 [0,0,0,0,0,0|2,0,2]=4 41 B9R0.7 CC(=O)ON=C(Cl)C(O)=O Amb25702873 [0,0,0,0,0,0|4,0,0]=4 42 B9R0.7 CC(=O)ON[C@@H](C)C(O)=O Amb25096728 [0,0,0,0,0,0|3,0,1]=4 43 B9R0.7 CC(=O)O\N=C(/C)\C(O)=O Amb24579771 [0,0,0,0,0,0|3,0,0]=3 44 B9R0.7 CC(=O)O\N=C(/Cl)\C(O)=O Amb25258406 [0,0,0,0,0,0|4,0,0]=4 45 B9R0.7 CC(=O)SCC(=C)C(O)=O Amb24482306 [0,0,0,0,0,0|2,0,2]=4 46 B9R0.7 CC(=O)[C@@H](C)CCC(O)=O Amb25333003 [0,0,0,0,0,0|1,0,2]=3 47 B9R0.7 CC(=O)[C@@H](N)CCC(O)=O Amb24386065 [0,0,0,0,0,0|2,0,2]=4 48 B9R0.7 CC(=O)[C@H](C)CCC(O)=O Amb24671283 [0,0,0,0,0,0|1,0,2]=3 49 B9R0.7 CC(=O)\C(\C)=C/CC(C)=O Amb24589098 [0,0,0,0,0,0|2,0,0]=2 50 B9R0.7 CC(=O)\C(\C)=C\NC(N)=O Amb24428715 [0,0,0,0,0,0|3,0,0]=3 51 B9R0.7 CC(=O)\C(\C)=N/NC(N)=O Amb24723966 [0,0,0,0,0,0|4,0,0]=4 52 B9R0.7 CC(=O)\C=C\C(C)C(C)=O Amb25112484 [0,0,0,0,0,0|2,0,2]=4 53 B9R0.7 CC(=O)\C=C\N(C)C(C)=O Amb24584364 [0,0,0,0,0,0|3,0,1]=4 54 B9R0.7 CC(C#CC(O)=O)=C(Cl)Cl Amb25772816 [0,0,0,0,0,0|2,0,2]=4 55 B9R0.7 CC(C)=C(C)C=CC(O)=O Amb24514918 [0,0,0,0,0,0|2,0,1]=3 56 B9R0.7 CC(C)=C(C)CCC(O)=O Amb24505016 [0,0,0,0,0,0|2,0,1]=3 57 B9R0.7 CC(C)=C(C)OCC(C)=O Amb24478157 [0,0,0,0,0,0|4,0,0]=4 58 B9R0.7 CC(C)=C(C)SCC(C)=O Amb25093065 [0,0,0,0,0,0|4,0,0]=4 59 B9R0.7 CC(C)=C(C)\C=C\C(O)=O Amb18643593 [0,0,0,0,0,0|2,0,1]=3 60 B9R0.7 CC(C)=C=CC(C)C(O)=O Amb25063829 [0,0,0,0,0,0|2,0,2]=4 61 B9R0.7 CC(C)=C\C=C(/C)\C(C)=O Amb25116531 [0,0,0,0,0,0|3,0,1]=4 62 B9R0.7 CC(C)=C\C=C(/C)\C(O)=O Amb24701987 [0,0,0,0,0,0|2,0,1]=3 63 B9R0.7 CC(C)C\C=C(/F)\C(O)=O Amb18124770 [0,0,0,0,0,0|3,0,1]=4 64 B9R0.7 CC(CCC(O)=O)[N+]([O-])=O Amb25221792 [0,0,0,0,0,0|1,0,3]=4 65 B9R0.7 CC(CNC(N)=O)C(O)=O Amb18298054 [0,0,0,0,0,0|2,0,2]=4 66 B9R0.7 CC(N=CC(O)=O)C(O)=O Amb24446584 [0,0,0,0,0,0|1,0,2]=3 67 B9R0.7 CC(NCC(=C)Br)C(O)=O Amb18303282 [0,0,0,0,0,0|3,0,1]=4 68 B9R0.7 CC(O)C(=O)CCC(O)=O Amb25825263 [0,0,0,0,0,0|2,0,2]=4 69 B9R0.7 CC(O)C(=O)NCC(O)=O Amb24640434 [0,0,0,0,0,0|3,0,1]=4 70 B9R0.7 CC(O)C(C)OCC(O)=O Amb25185257 [0,0,0,0,0,0|2,0,2]=4 71 B9R0.7 CC(O)CCC(=C)C(O)=O Amb24375911 [0,0,0,0,0,0|1,0,3]=4 72 B9R0.7 CC(O)CCC(C)C(O)=O Amb25848509 [0,0,0,0,0,0|1,0,3]=4 73 B9R0.7 CC(O)CNC(C)C(O)=O Amb18523859 [0,0,0,0,0,0|2,0,2]=4 74 B9R0.7 CC(O)CN[C@@H](C)C(O)=O Amb25129862 [0,0,0,0,0,0|2,0,2]=4 75 B9R0.7 CC(O)COC(C)C(O)=O Amb25146942 [0,0,0,0,0,0|2,0,2]=4 76 B9R0.7 CC(O)CSC(C)C(O)=O Amb18303285 [0,0,0,0,0,0|2,0,2]=4 77 B9R0.7 CC(OCC(N)=O)C(N)=O Amb25727276 [0,0,0,0,0,0|3,0,1]=4 78 B9R0.7 CC(OCC(N)=O)C(O)=O Amb24660109 [0,0,0,0,0,0|2,0,1]=3 79 B9R0.7 CC(OCC(O)=O)C(O)=O Amb25292152 [0,0,0,0,0,0|1,0,1]=2 80 B9R0.7 CC(SCC(=C)Br)C(O)=O Amb19005210 [0,0,0,0,0,0|3,0,1]=4 81 B9R0.7 CC(\C=C\C(N)=O)C(O)=O Amb25174967 [0,0,0,0,0,0|1,0,2]=3 82 B9R0.7 CC(\C=C\C(O)=O)C(O)=O Amb24409525 [0,0,0,0,0,0|0,0,2]=2 83 B9R0.7 CN(CCC(O)=O)C(N)=O Amb18984979 [0,0,0,0,0,0|2,0,1]=3 84 B9R0.7 CN(CCC(O)=O)C([S-])=S Amb24486141 [0,0,0,0,0,0|1,2,1]=4 85 B9R0.7 CN(CCC(O)=O)[N+]([O-])=O Amb23481534 [0,0,0,0,0,0|2,0,2]=4 86 B9R0.7 CN(N=CC(O)=O)C(N)=O Amb25737345 [0,0,0,0,0,0|3,0,1]=4 87 B9R0.7 CN(O)C(=O)\C=C\C(O)=O Amb24617596 [0,0,0,0,0,0|3,0,1]=4 88 B9R0.7 CN(\C=C\C(O)=O)C(N)=O Amb25084386 [0,0,0,0,0,0|2,0,1]=3 89 B9R0.7 C[C@@H](CCC(O)=O)C(O)=O Amb22799543 [0,0,0,0,0,0|0,0,2]=2 90 B9R0.7 C[C@@H](CC[N+]([O-])=O)C(O)=O Amb24330210 [0,0,0,0,0,0|1,0,3]=4 91 B9R0.7 C[C@@H](NCC(=C)Br)C(O)=O Amb24441867 [0,0,0,0,0,0|3,0,1]=4 92 B9R0.7 C[C@@H](NCC(=C)Cl)C(O)=O Amb25085078 [0,0,0,0,0,0|3,0,1]=4 93 B9R0.7 C[C@@H](NCC(N)=O)C(O)=O Amb25849548 [0,0,0,0,0,0|2,0,1]=3 94 B9R0.7 C[C@@H](NCC(O)=O)C(O)=O Amb22748947 [0,0,0,0,0,0|1,0,1]=2 95 B9R0.7 C[C@@H](O)[C@H](C)SCC(O)=O Amb25774489 [0,0,0,0,0,0|2,0,2]=4 96 B9R0.7 C[C@@H](OCC(=C)Br)C(O)=O Amb25061755 [0,0,0,0,0,0|3,0,1]=4 97 B9R0.7 C[C@@H](OCC(=C)Cl)C(O)=O Amb25146946 [0,0,0,0,0,0|3,0,1]=4 98 B9R0.7 C[C@@H](SCC(O)=O)C(O)=O Amb24482305 [0,0,0,0,0,0|1,0,1]=2 99 B9R0.7 C[C@H](CCC(O)=O)C(O)=O Amb22225175 [0,0,0,0,0,0|0,0,2]=2 100 B9R0.7 C[C@H](NCC(=C)Cl)C(O)=O Amb25135747 [0,0,0,0,0,0|3,0,1]=4 101 B9R0.7 C[C@H](NCC(N)=O)C(O)=O Amb24753576 [0,0,0,0,0,0|2,0,1]=3 102 B9R0.7 C[C@H](NCC(O)=O)C(O)=O Amb25133540 [0,0,0,0,0,0|1,0,1]=2 103 B9R0.7 C[C@H](O)CC[C@@H](C)C(O)=O Amb25378744 [0,0,0,0,0,0|1,0,3]=4 104 B9R0.7 C[C@H](O)CNC(=O)C(O)=O Amb25853206 [0,0,0,0,0,0|3,0,1]=4 105 B9R0.7 C[C@H](O)[C@H](C)CCC(O)=O Amb25340448 [0,0,0,0,0,0|1,0,3]=4 106 B9R0.7 C[C@H](OCC(=C)Br)C(O)=O Amb24471685 [0,0,0,0,0,0|3,0,1]=4 107 B9R0.7 C[C@H](OCC(=C)Cl)C(O)=O Amb25146948 [0,0,0,0,0,0|3,0,1]=4 108 B9R0.7 C[C@H](OCC(O)=O)C(O)=O Amb24393806 [0,0,0,0,0,0|1,0,1]=2 109 B9R0.7 C\C(=C/CC(C)=O)\C(C)C Amb24725292 [0,0,0,0,0,0|3,0,1]=4 110 B9R0.7 C\C(=C/CC(C)C)\C(C)=O Amb24478340 [0,0,0,0,0,0|3,0,1]=4 111 B9R0.7 C\C(=C\CC(C)=O)\C(C)C Amb24408897 [0,0,0,0,0,0|3,0,1]=4 112 B9R0.7 C\C(=C\CC(C)O)\C(C)=C Amb25316913 [0,0,0,0,0,0|3,0,1]=4 113 B9R0.7 C\C(=C\CC(C)O)\C(O)=O Amb25368118 [0,0,0,0,0,0|1,0,1]=2 114 B9R0.7 C\C(=C\CN(C)O)\C(O)=O Amb24611958 [0,0,0,0,0,0|2,0,0]=2 115 B9R0.7 C\C(=C\NC(N)=N)\C(O)=O Amb24358460 [0,0,0,0,0,0|3,0,0]=3 116 B9R0.7 C\C(=N/NC(N)=O)\C(N)=O Amb24760259 [0,0,0,0,0,0|4,0,0]=4 117 B9R0.7 C\C(=N\CC(C)C)\C(O)=O Amb24068330 [0,0,0,0,0,0|3,0,1]=4 118 B9R0.7 C\C(=N\CC(C)O)\C(C)=O Amb25273034 [0,0,0,0,0,0|3,0,1]=4 119 B9R0.7 N=C(CCC(O)=O)C(O)=O Amb25064299 [0,0,0,0,0,0|1,0,1]=2 120 B9R0.7 NC(=O)C(=O)CCC(O)=O Amb25279394 [0,0,0,0,0,0|2,0,1]=3 121 B9R0.7 NC(=O)C(N)CCC(O)=O Amb18644256 [0,0,0,0,0,0|2,0,2]=4 122 B9R0.7 NC(=O)CCC(F)C(O)=O Amb24745286 [0,0,0,0,0,0|2,0,2]=4 123 B9R0.7 NC(=O)CCC(O)C(O)=O Amb25275311 [0,0,0,0,0,0|2,0,2]=4 124 B9R0.7 NC(=O)CC[13C@H](N)[13C](O)=O Amb22338972 [0,0,0,0,0,0|2,0,2]=4 125 B9R0.7 NC(=O)CC[C@H](Br)C(O)=O Amb25223377 [0,0,0,0,0,0|2,0,2]=4 126 B9R0.7 NC(=O)NC=C(F)C(O)=O Amb24065618 [0,0,0,0,0,0|3,0,0]=3 127 B9R0.7 NC(=O)NC[C@@H](C(=O)O)C Amb10844047 [0,0,0,0,0,0|2,0,2]=4 128 B9R0.7 NC(=O)N\C=C(/N)\C(O)=O Amb25113093 [0,0,0,0,0,0|3,0,0]=3 129 B9R0.7 NC(=O)N\C=C(\C(=O)O)/F Amb17614482 [0,0,0,0,0,0|3,0,0]=3 130 B9R0.7 NC(=O)N\C=C(\N)/C(O)=O Amb25174854 [0,0,0,0,0,0|3,0,0]=3 131 B9R0.7 NC(=O)[C@@H](N)CCC(O)=O Amb22745051 [0,0,0,0,0,0|2,0,2]=4 132 B9R0.7 NC(=O)[C@H](N)CCC(O)=O Amb24557281 [0,0,0,0,0,0|2,0,2]=4 133 B9R0.7 NC(=S)CSC(C(=O)O)C Amb17503393 [0,0,0,0,0,0|2,1,1]=4 134 B9R0.7 NC(=S)N\N=C(\C(=O)O)/C Amb2496281 [0,0,0,0,0,0|3,1,0]=4 135 B9R0.7 NC(CCC(=O)Br)C(O)=O Amb25224344 [0,0,0,0,0,0|2,0,2]=4 136 B9R0.7 NC(CCC(O)=O)C(=O)[Na] Amb24375221 [0,0,0,0,0,0|2,0,2]=4 137 B9R0.7 NC(CCC(O)=O)C(O)=O Amb22350008 [0,0,0,0,0,0|1,0,2]=3 138 B9R0.7 NC(CCC(O)=O)C(O)=O Amb22350165 [0,0,0,0,0,0|1,0,2]=3 139 B9R0.7 NC(CCC(O)=O)P(O)=O Amb24340498 [0,0,0,0,0,0|2,0,2]=4 140 B9R0.7 NC(CCC(O)=O)[13C](O)=O Amb22367384 [0,0,0,0,0,0|1,0,2]=3 141 B9R0.7 NC(CCC(O)=S)C(O)=O Amb25039924 [0,0,0,0,0,0|1,1,2]=4 142 B9R0.7 NC(CCP(O)=O)C(O)=O Amb25276313 [0,0,0,0,0,0|2,0,2]=4 143 B9R0.7 NC(CCS(O)=O)C(O)=O Amb22349645 [0,0,0,0,0,0|2,0,2]=4 144 B9R0.7 NC(CC[13C](O)=O)C(O)=O Amb22366853 [0,0,0,0,0,0|1,0,2]=3 145 B9R0.7 N[13C](=O)CC[C@@H](C(=O)O)N Amb17614783 [0,0,0,0,0,0|2,0,2]=4 146 B9R0.7 N[13C](=O)[13CH2][13CH2][13C@H](N)[13C](O)=O Amb22367371 [0,0,0,0,0,0|2,0,2]=4 147 B9R0.7 N[C@@H](CCC(=O)Br)C(O)=O Amb25123825 [0,0,0,0,0,0|2,0,2]=4 148 B9R0.7 N[C@@H](CCC(=O)Cl)C(O)=O Amb25065344 [0,0,0,0,0,0|2,0,2]=4 149 B9R0.7 N[C@@H](CCC(O)=O)C([O-])=O Amb22745619 [0,0,0,0,0,0|1,0,3]=4 150 B9R0.7 N[C@@H](CCC(O)=O)[13C](O)=O Amb22353662 [0,0,0,0,0,0|1,0,2]=3 151 B9R0.7 N[C@@H](CCC(O)=S)C(O)=O Amb24480492 [0,0,0,0,0,0|1,1,2]=4 152 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22338524 [0,0,0,0,0,0|1,0,3]=4 153 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22350063 [0,0,0,0,0,0|1,0,3]=4 154 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22800016 [0,0,0,0,0,0|1,0,3]=4 155 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22801488 [0,0,0,0,0,0|1,0,3]=4 156 B9R0.7 N[C@@H](CCP(O)=O)C(O)=O Amb22904307 [0,0,0,0,0,0|2,0,2]=4 157 B9R0.7 N[C@@H]([13CH2]CC(O)=O)C(O)=O Amb22338711 [0,0,0,0,0,0|1,0,2]=3 158 B9R0.7 N[C@H](CCS(O)=O)C(O)=O Amb24099404 [0,0,0,0,0,0|2,0,2]=4 159 B9R0.7 OC(=O)C(=S)NCC(O)=O Amb24423880 [0,0,0,0,0,0|2,0,0]=2 160 B9R0.7 OC(=O)C(Cl)SCC(O)=O Amb24390363 [0,0,0,0,0,0|2,0,1]=3 161 B9R0.7 OC(=O)C(O)SCC(O)=O Amb24524554 [0,0,0,0,0,0|2,0,1]=3 162 B9R0.7 OC(=O)C=C=C(C(=O)O)C Amb17593578 [0,0,0,0,0,0|0,0,2]=2 163 B9R0.7 OC(=O)CCC(=O)C(=O)O Amb1154117 [0,0,0,0,0,0|1,0,1]=2 164 B9R0.7 OC(=O)CCC(=O)C(=O)[O-] Amb10072616 [0,0,0,0,0,0|1,0,2]=3 165 B9R0.7 OC(=O)CCC(=O)C(O)=O Amb22349893 [0,0,0,0,0,0|1,0,1]=2 166 B9R0.7 OC(=O)CCC(=O)C(O)=O Amb22350267 [0,0,0,0,0,0|1,0,1]=2 167 B9R0.7 OC(=O)CCC(=O)C(O)=O Amb22746233 [0,0,0,0,0,0|1,0,1]=2 168 B9R0.7 OC(=O)CCC(=O)[13C](O)=O Amb22055609 [0,0,0,0,0,0|1,0,1]=2 169 B9R0.7 OC(=O)CCC(C(=O)O)Cl Amb17594149 [0,0,0,0,0,0|1,0,2]=3 170 B9R0.7 OC(=O)CCC(C(=O)O)N Amb1778181 [0,0,0,0,0,0|1,0,2]=3 171 B9R0.7 OC(=O)CCC(F)C(O)=O Amb25708515 [0,0,0,0,0,0|1,0,2]=3 172 B9R0.7 OC(=O)CCC(O)C(O)=O Amb18124864 [0,0,0,0,0,0|1,0,2]=3 173 B9R0.7 OC(=O)CC[C@@H](O)C(O)=O Amb22799690 [0,0,0,0,0,0|1,0,2]=3 174 B9R0.7 OC(=O)CNC(=O)C(=C)C Amb16232088 [0,0,0,0,0,0|4,0,0]=4 175 B9R0.7 OC(=O)CNC(=O)C(=O)C Amb17593639 [0,0,0,0,0,0|3,0,0]=3 176 B9R0.7 OC(=O)CNC(=O)C(=O)O Amb2447304 [0,0,0,0,0,0|2,0,0]=2 177 B9R0.7 OC(=O)CSC(C(=O)O)C Amb2431034 [0,0,0,0,0,0|1,0,1]=2 178 B9R0.7 OC(=O)\C(\Br)=C/CC(O)=O Amb25364176 [0,0,0,0,0,0|1,0,0]=1 179 B9R0.7 OC(=O)\C(\Cl)=C\C=C(Cl)Cl Amb24513601 [0,0,0,0,0,0|3,0,1]=4 180 B9R0.7 OC(=O)\C=C/C(O)C(O)=O Amb25757882 [0,0,0,0,0,0|1,0,2]=3 181 B9R0.7 OC(=O)\C=C\C(Cl)=C(Cl)Cl Amb24452138 [0,0,0,0,0,0|3,0,1]=4 182 B9R0.7 OC(=O)\C=C\C(F)=C(F)F Amb24620550 [0,0,0,0,0,0|3,0,1]=4 183 B9R0.7 [15NH2]C(=O)CC[C@@H](C(=O)O)N Amb17614782 [0,0,0,0,0,0|2,0,2]=4 184 B9R0.7 [15NH2]C(=O)CC[C@H]([15NH2])C(O)=O Amb22338766 [0,0,0,0,0,0|2,0,2]=4 185 B9R0.7 [15NH2]C(CCC(O)=O)C(O)=O Amb22336520 [0,0,0,0,0,0|1,0,2]=3 186 B9R0.7 [15NH2][13C@@H]([13CH2][13CH2][13C](O)=O)[13C](O)=O Amb22353585 [0,0,0,0,0,0|1,0,2]=3 187 B9R0.7 [15NH2][13C](=O)[13CH2][13CH2][13C@H]([15NH2])[13C](O)=O Amb22353586 [0,0,0,0,0,0|2,0,2]=4 188 B9R0.7 [O-]C(=O)C(=O)CCC(O)=O Amb22166891 [0,0,0,0,0,0|1,0,2]=3 189 B9R0.7 [O-]C(=O)CCC(=O)C(=O)[O-] Amb10072211 [0,0,0,0,0,0|1,0,3]=4 190 B9R0.7 [O-]C(=O)CCC(=O)C(O)=O Amb22231405 [0,0,0,0,0,0|1,0,2]=3 191 B9R0.7 [O-][N+](=O)CC[C@H](C(=O)O)C Amb13883662 [0,0,0,0,0,0|1,0,3]=4 192 B8R0.8 C=C(CCC=C)C(O)=O Amb18642395 [1,0,0,0,0,0|1,0,2]=4 193 B8R0.8 C=CCCC(=O)C(O)=O Amb25738669 [1,0,0,0,0,0|2,0,1]=4 194 B8R0.8 CC(=CCCF)C(O)=O Amb24359141 [1,0,0,0,0,0|1,0,1]=3 195 B8R0.8 CC(=CCCO)C(C)=C Amb25071397 [1,0,0,0,0,0|2,0,1]=4 196 B8R0.8 CC(=O)C(=O)\C=C\C=O Amb24557852 [1,0,0,0,0,0|2,0,1]=4 197 B8R0.8 CC(=O)C(C)=CCCO Amb24617765 [1,0,0,0,0,0|1,0,1]=3 198 B8R0.8 CC(=O)C(C)=NCCO Amb24625306 [1,0,0,0,0,0|2,0,1]=4 199 B8R0.8 CC(=O)\C(\C)=C\CCO Amb25735231 [1,0,0,0,0,0|1,0,1]=3 200 B8R0.8 CC(=O)\C(\C)=N/NC=O Amb24478105 [1,0,0,0,0,0|3,0,0]=4 201 B8R0.8 CC(=O)\C(\C)=N\NC=O Amb25747449 [1,0,0,0,0,0|3,0,0]=4 202 B8R0.8 CC(C)=C(C)CCC=O Amb24373951 [1,0,0,0,0,0|2,0,1]=4 203 B8R0.8 CC(C=CC=O)=C(Cl)Cl Amb25264855 [1,0,0,0,0,0|2,0,1]=4 204 B8R0.8 CC(CCC=C)C(O)=O Amb18642656 [1,0,0,0,0,0|1,0,2]=4 205 B8R0.8 CC(CCC=O)C(C)=O Amb18642650 [1,0,0,0,0,0|1,0,2]=4 206 B8R0.8 CC(CCC=O)C(O)=O Amb18642767 [1,0,0,0,0,0|0,0,2]=3 207 B8R0.8 CC(CNC=O)C(O)=O Amb18299693 [1,0,0,0,0,0|1,0,2]=4 208 B8R0.8 CC(OCC=O)C(C)=O Amb24340213 [1,0,0,0,0,0|2,0,1]=4 209 B8R0.8 CCC\C=C(\C(=O)C)/C Amb17593317 [1,0,0,0,0,0|2,0,1]=4 210 B8R0.8 CN(CCC=O)C(N)=O Amb25146044 [1,0,0,0,0,0|2,0,1]=4 211 B8R0.8 COC\C=C(\Br)/C(O)=O Amb24580462 [1,0,0,0,0,0|3,0,0]=4 212 B8R0.8 C[C@@H](NCC=C)C(O)=O Amb24481671 [1,0,0,0,0,0|2,0,1]=4 213 B8R0.8 C[C@H](CCC=C)C(O)=O Amb24337306 [1,0,0,0,0,0|1,0,2]=4 214 B8R0.8 C\C(=C/C=C/C)\C(O)=O Amb18642423 [1,0,0,0,0,0|1,0,1]=3 215 B8R0.8 C\C(=C/CC=C)\C(O)=O Amb18642394 [1,0,0,0,0,0|1,0,0]=2 216 B8R0.8 C\C(=C/CCC)\C(=O)O Amb10844998 [1,0,0,0,0,0|1,0,1]=3 217 B8R0.8 C\C(=C\C#CC)\C(O)=O Amb24655041 [1,0,0,0,0,0|1,0,2]=4 218 B8R0.8 C\C(=C\CC=C)\C(O)=O Amb25264925 [1,0,0,0,0,0|1,0,0]=2 219 B8R0.8 C\C(=C\CCC)\C(O)=O Amb25032199 [1,0,0,0,0,0|1,0,1]=3 220 B8R0.8 C\C(=C\OCC)\C(O)=O Amb25741753 [1,0,0,0,0,0|2,0,1]=4 221 B8R0.8 C\C(=N\CC=C)\C(C)=O Amb24340133 [1,0,0,0,0,0|3,0,0]=4 222 B8R0.8 C\C=C\C=C(Br)C(O)=O Amb25294936 [1,0,0,0,0,0|2,0,1]=4 223 B8R0.8 C\C=C\C=C(C)C(C)=O Amb25298494 [1,0,0,0,0,0|2,0,1]=4 224 B8R0.8 C\C=C\C=C(Cl)C(O)=O Amb25259369 [1,0,0,0,0,0|2,0,1]=4 225 B8R0.8 C\C=C\C=C(F)C(O)=O Amb24514833 [1,0,0,0,0,0|2,0,1]=4 226 B8R0.8 C\C=C\C=C(O)C(O)=O Amb24550203 [1,0,0,0,0,0|2,0,1]=4 227 B8R0.8 N=C(NCCO)C(O)=O Amb18124348 [1,0,0,0,0,0|2,0,1]=4 228 B8R0.8 NC(CCC=O)C(O)=O Amb24340141 [1,0,0,0,0,0|1,0,2]=4 229 B8R0.8 N[C@@H](CCC=O)C(O)=O Amb25378080 [1,0,0,0,0,0|1,0,2]=4 230 B8R0.8 N[C@H](CCC=O)C(O)=O Amb24477812 [1,0,0,0,0,0|1,0,2]=4 231 B8R0.8 OC(=O)C(=O)NCCO Amb24117944 [1,0,0,0,0,0|2,0,1]=4 232 B8R0.8 OC(=O)C(=O)\C=C\C=O Amb24392793 [1,0,0,0,0,0|1,0,1]=3 233 B8R0.8 OC(=O)\C(\Br)=C\C=N\O Amb25779954 [1,0,0,0,0,0|2,0,1]=4 234 B8R0.9 BOC(O)=CCC(O)=O Amb25179903 [1,0,0,0,0,0|3,0,0]=4 235 B8R0.9 C=C(CCC(O)=O)C=C Amb18642412 [1,0,0,0,0,0|1,0,2]=4 236 B8R0.9 C=CC(=O)CCC(O)=O Amb22055999 [1,0,0,0,0,0|2,0,1]=4 237 B8R0.9 CC(=CCC(O)=O)C#N Amb25175102 [1,0,0,0,0,0|1,0,1]=3 238 B8R0.9 CC(=CCl)OCC(C)=O Amb25233389 [1,0,0,0,0,0|3,0,0]=4 239 B8R0.9 CC(=CCl)\C=C\C(O)=O Amb24397298 [1,0,0,0,0,0|1,0,1]=3 240 B8R0.9 CC(=O)CCC(=C)C=O Amb24640352 [1,0,0,0,0,0|1,0,2]=4 241 B8R0.9 CC(=O)CCC(=O)C=O Amb25224384 [1,0,0,0,0,0|2,0,1]=4 242 B8R0.9 CC(=O)COC(=O)C=O Amb18642738 [1,0,0,0,0,0|3,0,0]=4 243 B8R0.9 CC(=O)C\C=C(/C)\C=C Amb25198446 [1,0,0,0,0,0|2,0,0]=3 244 B8R0.9 CC(=O)C\C=C(\C)/C=C Amb24686521 [1,0,0,0,0,0|2,0,0]=3 245 B8R0.9 CC(=O)N\C=C(\C)/C=O Amb18642508 [1,0,0,0,0,0|2,0,0]=3 246 B8R0.9 CC(=O)O\C=C(/Br)\C=O Amb25785618 [1,0,0,0,0,0|3,0,0]=4 247 B8R0.9 CC(=O)O\C=C(/C)\C=O Amb24426274 [1,0,0,0,0,0|2,0,0]=3 248 B8R0.9 CC(=O)O\C=C(/F)\C=O Amb25132702 [1,0,0,0,0,0|3,0,0]=4 249 B8R0.9 CC(=O)\C=C/C(=O)C=O Amb25756958 [1,0,0,0,0,0|2,0,1]=4 250 B8R0.9 CC(=O)\C=C/C(C)=S=O Amb25318848 [1,0,0,0,0,0|2,0,1]=4 251 B8R0.9 CC(=O)\C=C\C(=O)C=O Amb18642365 [1,0,0,0,0,0|2,0,1]=4 252 B8R0.9 CC(C)=C\C=C(\C)/C=O Amb18642240 [1,0,0,0,0,0|2,0,1]=4 253 B8R0.9 CC(C)C\C=C(/C)\C=O Amb25055531 [1,0,0,0,0,0|2,0,1]=4 254 B8R0.9 CC(C)C\C=C(\C)/C=O Amb24573481 [1,0,0,0,0,0|2,0,1]=4 255 B8R0.9 CC(C=C)NCC(O)=O Amb18310594 [1,0,0,0,0,0|2,0,1]=4 256 B8R0.9 CC(C=C)OCC(O)=O Amb18642764 [1,0,0,0,0,0|2,0,1]=4 257 B8R0.9 CC(C=C)SCC(O)=O Amb18311113 [1,0,0,0,0,0|2,0,1]=4 258 B8R0.9 CC(CCC(C)=O)=CCl Amb24581923 [1,0,0,0,0,0|2,0,1]=4 259 B8R0.9 CC(CCC(C)=O)=NO Amb24760824 [1,0,0,0,0,0|2,0,1]=4 260 B8R0.9 CC(CCC(C)=O)C=O Amb18642612 [1,0,0,0,0,0|1,0,2]=4 261 B8R0.9 CC(CCC(O)=O)=NN Amb24579336 [1,0,0,0,0,0|2,0,1]=4 262 B8R0.9 CC(CCC(O)=O)=NO Amb25138471 [1,0,0,0,0,0|1,0,1]=3 263 B8R0.9 CC(CCC(O)=O)C=C Amb18642631 [1,0,0,0,0,0|1,0,2]=4 264 B8R0.9 CC(CO)OCC(O)=O Amb25675017 [1,0,0,0,0,0|1,0,2]=4 265 B8R0.9 CC(CO)SCC(O)=O Amb18644427 [1,0,0,0,0,0|1,0,2]=4 266 B8R0.9 CC(O)C\C=C(/Br)\C=O Amb24388944 [1,0,0,0,0,0|2,0,1]=4 267 B8R0.9 CC(O)C\C=C(\C)/C=C Amb24686395 [1,0,0,0,0,0|2,0,1]=4 268 B8R0.9 CC(\C=C\C(C)=O)=NO Amb24513914 [1,0,0,0,0,0|2,0,1]=4 269 B8R0.9 CCC(C)=CCC(C)=O Amb24736154 [1,0,0,0,0,0|2,0,1]=4 270 B8R0.9 CCC(Cl)=CCC(O)=O Amb24580821 [1,0,0,0,0,0|2,0,1]=4 271 B8R0.9 CC\C(\C)=C/CC(C)=O Amb24333826 [1,0,0,0,0,0|2,0,1]=4 272 B8R0.9 CC\C(\C)=C\CC(C)=O Amb25773428 [1,0,0,0,0,0|2,0,1]=4 273 B8R0.9 CN(CCC(N)=O)C=O Amb25146008 [1,0,0,0,0,0|2,0,1]=4 274 B8R0.9 CN(CCC(O)=O)C=O Amb18984989 [1,0,0,0,0,0|1,0,1]=3 275 B8R0.9 CN(CCC(O)=O)N=O Amb22729196 [1,0,0,0,0,0|2,0,1]=4 276 B8R0.9 C[C@@H](CCC(C)=O)C=O Amb24441758 [1,0,0,0,0,0|1,0,2]=4 277 B8R0.9 C[C@@H](CCC(O)=O)C=C Amb25859365 [1,0,0,0,0,0|1,0,2]=4 278 B8R0.9 C\C(=C/CC(C)=O)\C#C Amb25767766 [1,0,0,0,0,0|2,0,1]=4 279 B8R0.9 C\C(=C/CC(C)=O)\C#N Amb25735739 [1,0,0,0,0,0|2,0,1]=4 280 B8R0.9 C\C(=C\Cl)\OCC(C)=O Amb25061238 [1,0,0,0,0,0|3,0,0]=4 281 B8R0.9 C\C(\C=C)=C/CC(O)=O Amb25305754 [1,0,0,0,0,0|1,0,0]=2 282 B8R0.9 C\C(\C=CC(N)=O)=N\O Amb24741748 [1,0,0,0,0,0|2,0,1]=4 283 B8R0.9 C\C(\C=CC(O)=O)=N\O Amb24640839 [1,0,0,0,0,0|1,0,1]=3 284 B8R0.9 C\C(\C=C\C(C)=O)=N/O Amb25243565 [1,0,0,0,0,0|2,0,1]=4 285 B8R0.9 C\C(\C=C\C(O)=O)=C/C Amb18642399 [1,0,0,0,0,0|1,0,1]=3 286 B8R0.9 C\C(\C=O)=C/C=C(Cl)Cl Amb24340215 [1,0,0,0,0,0|2,0,1]=4 287 B8R0.9 C\C(\C=O)=C\CC(C)=C Amb18642231 [1,0,0,0,0,0|2,0,0]=3 288 B8R0.9 C\C(\CC)=C/CC(O)=O Amb22011800 [1,0,0,0,0,0|1,0,1]=3 289 B8R0.9 C\C(\CCC(C)=O)=C/C Amb25768510 [1,0,0,0,0,0|2,0,1]=4 290 B8R0.9 C\C(\CCC(C)=O)=C\C Amb24610198 [1,0,0,0,0,0|2,0,1]=4 291 B8R0.9 C\C(\CCC(C)=O)=N/O Amb24422445 [1,0,0,0,0,0|2,0,1]=4 292 B8R0.9 C\C(\CCC(O)=O)=C\C Amb24681032 [1,0,0,0,0,0|1,0,1]=3 293 B8R0.9 C\C(\CCC(O)=O)=N\N Amb24382718 [1,0,0,0,0,0|2,0,1]=4 294 B8R0.9 C\C=C(/Br)\CCC(O)=O Amb25685237 [1,0,0,0,0,0|2,0,1]=4 295 B8R0.9 C\C=C(\Br)/CCC(O)=O Amb25210030 [1,0,0,0,0,0|2,0,1]=4 296 B8R0.9 C\C=C(\F)/CCC(O)=O Amb24670842 [1,0,0,0,0,0|2,0,1]=4 297 B8R0.9 NC(NCC(O)=O)=NO Amb24568694 [1,0,0,0,0,0|3,0,0]=4 298 B8R0.9 N[C@@H](CCC(O)=O)C=O Amb24347675 [1,0,0,0,0,0|1,0,2]=4 299 B8R0.9 O=NN(CCC(=O)O)C Amb17618592 [1,0,0,0,0,0|2,0,1]=4 300 B8R0.9 OC(=O)CCC(=O)C=O Amb18642737 [1,0,0,0,0,0|1,0,1]=3 301 B8R0.9 OC(=O)CCC(=O)CO Amb18642867 [1,0,0,0,0,0|1,0,2]=4 302 B8R0.9 OC(=O)CNC(=O)C=O Amb25328169 [1,0,0,0,0,0|2,0,0]=3 303 B8R0.9 OC(=O)CNC(=O)CO Amb18124375 [1,0,0,0,0,0|2,0,1]=4 304 B8R0.9 OC(=O)CNC(=O)NO Amb25228420 [1,0,0,0,0,0|3,0,0]=4 305 B8R0.9 OC(=O)\C=C\C(=O)CO Amb18642735 [1,0,0,0,0,0|1,0,2]=4 306 B8R0.9 OC(=O)\C=C\C(Cl)C=O Amb24382565 [1,0,0,0,0,0|1,0,2]=4 307 B8R0.9 OC(CCC(O)=O)=NO Amb24745795 [1,0,0,0,0,0|2,0,1]=4 308 B8R0.9 ONC(=O)/C=C\C(O)=O Amb17673396 [1,0,0,0,0,0|2,0,1]=4 309 B8R0.28 CC(=C)\C=C\CC(O)=O Amb18642409 [1,0,0,0,0,0|2,0,0]=3 310 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [1,0,0,0,0,0|1,0,2]=4 311 B8R0.28 CC(=O)CNCC(O)=O Amb24375747 [1,0,0,0,0,0|2,0,1]=4 312 B8R0.28 CC(=O)C\C=C/C(C)=C Amb25810284 [1,0,0,0,0,0|3,0,0]=4 313 B8R0.28 CC(=O)C\C=C\C(=O)O Amb16232091 [1,0,0,0,0,0|1,0,0]=2 314 B8R0.28 CC(=O)C\C=C\C(C)=C Amb24744667 [1,0,0,0,0,0|3,0,0]=4 315 B8R0.28 CC(=O)N\C=C\C(N)=O Amb24477760 [1,0,0,0,0,0|3,0,0]=4 316 B8R0.28 CC(=O)OCCC(O)=O Amb18642866 [1,0,0,0,0,0|2,0,1]=4 317 B8R0.28 CC(=O)\C=C/CC(C)=O Amb25072729 [1,0,0,0,0,0|2,0,0]=3 318 B8R0.28 CC(=O)\C=C/NC(C)=O Amb24072874 [1,0,0,0,0,0|3,0,0]=4 319 B8R0.28 CC(=O)\C=C\CC(C)=O Amb25238337 [1,0,0,0,0,0|2,0,0]=3 320 B8R0.28 CC(=O)\C=C\NC(C)=O Amb24072848 [1,0,0,0,0,0|3,0,0]=4 321 B8R0.28 CC(=O)\C=C\OC(C)=O Amb25225602 [1,0,0,0,0,0|3,0,0]=4 322 B8R0.28 CC(=O)\C=N/CC(O)=O Amb25347610 [1,0,0,0,0,0|2,0,0]=3 323 B8R0.28 CC(Br)=CCCC(O)=O Amb25200944 [1,0,0,0,0,0|2,0,1]=4 324 B8R0.28 CC(C)/C=C/CC(O)=O Amb17844074 [1,0,0,0,0,0|2,0,1]=4 325 B8R0.28 CC(C)=C\C=C\C(O)=O Amb18642414 [1,0,0,0,0,0|2,0,1]=4 326 B8R0.28 CC(O)C\C=C\C(O)=O Amb18642771 [1,0,0,0,0,0|1,0,1]=3 327 B8R0.28 CC(S)\C=C/CC(O)=O Amb18644289 [1,0,0,0,0,0|1,1,1]=4 328 B8R0.28 CC(S)\C=C\CC(O)=O Amb24514919 [1,0,0,0,0,0|1,1,1]=4 329 B8R0.28 CN(C\C=C\C(=O)O)C Amb15695416 [1,0,0,0,0,0|3,0,0]=4 330 B8R0.28 CS(=O)C\C=C\C(O)=O Amb24586059 [1,0,0,0,0,0|2,0,0]=3 331 B8R0.28 C[C@@H](O)C\C=C\C(O)=O Amb25250610 [1,0,0,0,0,0|1,0,1]=3 332 B8R0.28 NC(=N)S\C=C/C(O)=O Amb22733172 [1,0,0,0,0,0|3,0,0]=4 333 B8R0.28 NC(=O)CSCC(=O)O Amb1128074 [1,0,0,0,0,0|2,0,1]=4 334 B8R0.28 NC(=O)NN=CC(O)=O Amb24616453 [1,0,0,0,0,0|3,0,0]=4 335 B8R0.28 NC(=O)N\N=C\C(=O)O Amb10552378 [1,0,0,0,0,0|3,0,0]=4 336 B8R0.28 NC(=O)\C=C\CC(N)=O Amb24721870 [1,0,0,0,0,0|2,0,0]=3 337 B8R0.28 NC(=S)S\C=C\C(=O)O Amb10552410 [1,0,0,0,0,0|2,1,0]=4 338 B8R0.28 OC(=O)C#CCC(O)=O Amb25850643 [1,0,0,0,0,0|0,0,2]=3 339 B8R0.28 OC(=O)C=C=CC(=O)O Amb17593335 [1,0,0,0,0,0|0,0,2]=3 340 B8R0.28 OC(=O)CCC=C(C)C Amb10601609 [1,0,0,0,0,0|2,0,1]=4 341 B8R0.28 OC(=O)CCC=C(F)F Amb25224993 [1,0,0,0,0,0|2,0,1]=4 342 B8R0.28 OC(=O)CCCC(=O)Br Amb24480005 [1,0,0,0,0,0|1,0,2]=4 343 B8R0.28 OC(=O)CCCC(O)=O Amb22351480 [1,0,0,0,0,0|0,0,2]=3 344 B8R0.28 OC(=O)CCCC(O)=O Amb22351829 [1,0,0,0,0,0|0,0,2]=3 345 B8R0.28 OC(=O)CCCP(O)=O Amb24480161 [1,0,0,0,0,0|1,0,2]=4 346 B8R0.28 OC(=O)CCNC(=O)C Amb1104704 [1,0,0,0,0,0|2,0,1]=4 347 B8R0.28 OC(=O)CCSC(=O)C Amb17607685 [1,0,0,0,0,0|2,0,1]=4 348 B8R0.28 OC(=O)CNC=P(O)=O Amb24558051 [1,0,0,0,0,0|2,0,0]=3 349 B8R0.28 OC(=O)CNCP(O)=O Amb24557425 [1,0,0,0,0,0|2,0,1]=4 350 B8R0.28 OC(=O)COCC(=O)Cl Amb25372456 [1,0,0,0,0,0|2,0,1]=4 351 B8R0.28 OC(=O)CSC=C(Cl)Cl Amb24479937 [1,0,0,0,0,0|3,0,0]=4 352 B8R0.28 OC(=O)C\C=C\C(=O)O Amb1154189 [1,0,0,0,0,0|0,0,0]=1 353 B8R0.28 OC(=O)O[Sr]OC(O)=O Amb22353408 [1,0,0,0,0,0|3,0,0]=4 354 B8R0.28 OC(=O)\C=C\OP(O)=O Amb24560361 [1,0,0,0,0,0|2,0,0]=3 355 B8R0.28 OC(=S)COCC(O)=O Amb22262972 [1,0,0,0,0,0|1,1,1]=4 356 B8R0.28 O[13C](=O)CCC[13C](=O)O Amb17614793 [1,0,0,0,0,0|0,0,2]=3 357 B10R0.12 CC(CCC(O)=O)S(O)(=O)=O Amb25386031 [0,1,0,0,0,0|1,0,2]=4 358 B10R0.12 C\C(=C/CC(C)=O)\C(C)(C)O Amb25150343 [0,1,0,0,0,0|2,0,1]=4 359 B10R0.12 C\C(=C/CC(O)=O)\C(C)(C)C Amb25028118 [0,1,0,0,0,0|2,0,1]=4 360 B10R0.12 [O-]P(O)(=O)C(=O)NCC(O)=O Amb25268237 [0,1,0,0,0,0|3,0,0]=4 361 B10R0.13 CC(=O)C(=O)N(C)CC(O)=O Amb25384890 [0,1,0,0,0,0|3,0,0]=4 362 B10R0.13 CC(=O)C(C)=C(C)OC(C)=O Amb24063554 [0,1,0,0,0,0|3,0,0]=4 363 B10R0.13 CC(=O)C(C)C(C)CC(O)=O Amb18645031 [0,1,0,0,0,0|1,0,2]=4 364 B10R0.13 CC(=O)CC(C)C(C)C(O)=O Amb18126130 [0,1,0,0,0,0|1,0,2]=4 365 B10R0.13 CC(=O)N(C)C(=O)CC(O)=O Amb25383156 [0,1,0,0,0,0|2,0,0]=3 366 B10R0.13 CC(=O)N(C)C(C)CC(O)=O Amb18224393 [0,1,0,0,0,0|2,0,1]=4 367 B10R0.13 CC(=O)O\C(=C(\C(=O)C)/C)\C Amb17593898 [0,1,0,0,0,0|3,0,0]=4 368 B10R0.13 CC(C(N)=O)S(=O)CC(O)=O Amb18305129 [0,1,0,0,0,0|2,0,1]=4 369 B10R0.13 CC(C(O)=O)=C(C)CC(O)=O Amb25326749 [0,1,0,0,0,0|0,0,0]=1 370 B10R0.13 CC(C(O)=O)C(=O)NC(N)=O Amb24693937 [0,1,0,0,0,0|2,0,1]=4 371 B10R0.13 CC(C(O)=O)N(C)CC(O)=O Amb24751154 [0,1,0,0,0,0|1,0,1]=3 372 B10R0.13 CC(C(O)=O)S(=O)CC(N)=O Amb18304636 [0,1,0,0,0,0|2,0,1]=4 373 B10R0.13 CC(CC(O)=O)C(=O)C(O)=O Amb25386314 [0,1,0,0,0,0|1,0,1]=3 374 B10R0.13 CC(CC(O)=O)C(N)C(O)=O Amb23440872 [0,1,0,0,0,0|1,0,2]=4 375 B10R0.13 CC(CC(O)=O)N(C)C(N)=O Amb18830285 [0,1,0,0,0,0|2,0,1]=4 376 B10R0.13 CN(C(=O)CC(N)=O)C(N)=O Amb24764688 [0,1,0,0,0,0|3,0,0]=4 377 B10R0.13 C[C@@H](CC(O)=O)[C@@H](N)C(O)=O Amb19133152 [0,1,0,0,0,0|1,0,2]=4 378 B10R0.13 C[C@@H](CC(O)=O)[C@H](N)C(O)=O Amb19133150 [0,1,0,0,0,0|1,0,2]=4 379 B10R0.13 C[C@H](CC(O)=O)C(=O)C(O)=O Amb25385022 [0,1,0,0,0,0|1,0,1]=3 380 B10R0.13 C\C(\C(O)=O)=C(\C)/CC(O)=O Amb24373861 [0,1,0,0,0,0|0,0,0]=1 381 B10R0.13 C\C(\O)=C(/C)\C(=O)\C=C(\C)/O Amb25151485 [0,1,0,0,0,0|2,0,1]=4 382 B10R0.13 NC(=O)NC(=O)C(=O)C(O)=O Amb24358082 [0,1,0,0,0,0|3,0,0]=4 383 B10R0.13 NC(C(Cl)=CC(O)=O)C(O)=O Amb24374819 [0,1,0,0,0,0|1,0,2]=4 384 B10R0.13 NC(C(O)CC(O)=O)C(O)=O Amb25383245 [0,1,0,0,0,0|1,0,2]=4 385 B10R0.13 NC(CC(O)=O)C(N)C(O)=O Amb25386391 [0,1,0,0,0,0|1,0,2]=4 386 B10R0.13 NC(CC(O)=O)[C@H](N)C(O)=O Amb24764806 [0,1,0,0,0,0|1,0,2]=4 387 B10R0.13 N[C@@H](C(Cl)=CC(O)=O)C(O)=O Amb24758200 [0,1,0,0,0,0|1,0,2]=4 388 B10R0.13 N[C@@H](C(Cl)CC(O)=O)C(O)=O Amb24764556 [0,1,0,0,0,0|1,0,2]=4 389 B10R0.13 N[C@@H](C(O)CC(O)=O)C(O)=O Amb22746926 [0,1,0,0,0,0|1,0,2]=4 390 B10R0.13 N[C@@H]([C@@H](Cl)CC(O)=O)C(O)=O Amb25386256 [0,1,0,0,0,0|1,0,2]=4 391 B10R0.13 N[C@@H]([C@@H](F)CC(O)=O)C(O)=O Amb25386225 [0,1,0,0,0,0|1,0,2]=4 392 B10R0.13 N[C@@H]([C@H](F)CC(O)=O)C(O)=O Amb25386224 [0,1,0,0,0,0|1,0,2]=4 393 B10R0.13 N[C@H](C(F)CC(O)=O)C(O)=O Amb25383802 [0,1,0,0,0,0|1,0,2]=4 394 B10R0.13 N[C@H](\C(\Cl)=C\C(O)=O)C(O)=O Amb24688393 [0,1,0,0,0,0|1,0,2]=4 395 B10R0.13 OC(=O)C[C@@H]([C@H](C(=O)O)N)C Amb17617452 [0,1,0,0,0,0|1,0,2]=4 396 B10R0.13 OC(=O)C[C@H]([C@@H](C(=O)O)N)C Amb17617455 [0,1,0,0,0,0|1,0,2]=4 397 B10R0.13 OC(=O)[C@@H](O)[C@@H](O)CC(O)=O Amb25386187 [0,1,0,0,0,0|1,0,2]=4 398 B10R0.13 OC(=O)[C@@H](O)[C@H](O)CC(O)=O Amb25386186 [0,1,0,0,0,0|1,0,2]=4 399 B10R0.13 OC(CC(O)=O)C(Cl)C(O)=O Amb25386324 [0,1,0,0,0,0|1,0,2]=4 400 B10R0.43 CC(=O)C(C)(C)CCC(O)=O Amb18126156 [0,1,0,0,0,0|1,0,2]=4 401 B10R0.43 CC(=O)CCC(C)(C)C(O)=O Amb18645019 [0,1,0,0,0,0|1,0,2]=4 402 B10R0.43 CC(=O)CSC(C(=O)O)(C)C Amb17501494 [0,1,0,0,0,0|2,0,1]=4 403 B10R0.43 CC(C)(CCC(O)=O)C(N)=O Amb25382153 [0,1,0,0,0,0|1,0,2]=4 404 B10R0.43 CC(C)(NCC(N)=O)C(O)=O Amb18306733 [0,1,0,0,0,0|2,0,1]=4 405 B10R0.43 CC(C)(NCC(O)=O)C(N)=O Amb18306310 [0,1,0,0,0,0|2,0,1]=4 406 B10R0.43 CC(C)(OCC(O)=O)C(O)=O Amb25384885 [0,1,0,0,0,0|1,0,1]=3 407 B10R0.43 CC(C)(SCC(O)=O)C(N)=O Amb25381511 [0,1,0,0,0,0|2,0,1]=4 408 B10R0.43 CC(C)(\C=C\C(O)=O)C(O)=O Amb24487945 [0,1,0,0,0,0|0,0,2]=3 409 B10R0.43 CC(Cl)(CCC(O)=O)C(O)=O Amb25385218 [0,1,0,0,0,0|0,0,2]=3 410 B10R0.43 CC(N)(CCC(N)=O)C(O)=O Amb25385217 [0,1,0,0,0,0|1,0,2]=4 411 B10R0.43 CC(N)(CCC(O)=O)C(O)=O Amb22801426 [0,1,0,0,0,0|0,0,2]=3 412 B10R0.43 CC(N)(\C=C\C(N)=O)C(O)=O Amb24655969 [0,1,0,0,0,0|1,0,2]=4 413 B10R0.43 CC(O)(CCC(O)=O)C(O)=O Amb25384878 [0,1,0,0,0,0|0,0,2]=3 414 B10R0.43 C[C@@](O)(CCC(O)=O)C(O)=O Amb25386439 [0,1,0,0,0,0|0,0,2]=3 415 B10R0.43 NC(=O)CSC(C(=O)O)(C)C Amb17501450 [0,1,0,0,0,0|2,0,1]=4 416 B10R0.43 OC(=O)CCC(Cl)(Cl)C(O)=O Amb25384394 [0,1,0,0,0,0|1,0,2]=4 417 B10R0.43 OC(=O)CCC(F)(F)C(O)=O Amb22263070 [0,1,0,0,0,0|1,0,2]=4 418 B10R0.43 OC(=O)CSC(C(=O)O)(C)C Amb17501462 [0,1,0,0,0,0|1,0,1]=3 419 B10R0.57 CC(=C=CC(O)=O)C(=O)OC Amb24700645 [0,1,0,0,0,0|0,0,2]=3 420 B10R0.57 CC(=NO)C(=O)CCC(O)=O Amb25385214 [0,1,0,0,0,0|2,0,1]=4 421 B10R0.57 CC(=O)C\C=C(/C)\C(=O)OC Amb24765181 [0,1,0,0,0,0|1,0,0]=2 422 B10R0.57 CC(=O)\C=C\C(C)C(=O)OC Amb24765182 [0,1,0,0,0,0|1,0,2]=4 423 B10R0.57 CCC(=O)C(/C)=C/OC(C)=O Amb17778956 [0,1,0,0,0,0|3,0,0]=4 424 B10R0.57 CN(C(=O)CC)CCC(=O)O Amb17400039 [0,1,0,0,0,0|2,0,1]=4 425 B10R0.57 CN(CCC(O)=O)C(=O)C#C Amb18984978 [0,1,0,0,0,0|2,0,1]=4 426 B10R0.57 CNC(=O)N(C)CCC(O)=O Amb18977475 [0,1,0,0,0,0|2,0,1]=4 427 B10R0.57 COC(=O)C(/C)=C/OC(C)=O Amb17844071 [0,1,0,0,0,0|2,0,0]=3 428 B10R0.57 COC(=O)C(=O)NCC(N)=O Amb24757424 [0,1,0,0,0,0|3,0,0]=4 429 B10R0.57 COC(=O)C(=O)NCC(O)=O Amb25385135 [0,1,0,0,0,0|2,0,0]=3 430 B10R0.57 COC(=O)C(C)CCC(O)=O Amb22008198 [0,1,0,0,0,0|0,0,2]=3 431 B10R0.57 COC(=O)[C@@H](N)CCC(O)=O Amb22754032 [0,1,0,0,0,0|1,0,2]=4 432 B10R0.57 C\C(=C/CC(O)=O)\C(=O)OC Amb18126096 [0,1,0,0,0,0|0,0,0]=1 433 B10R0.57 C\C(=N/O)\C(=O)OCC(O)=O Amb25382146 [0,1,0,0,0,0|3,0,0]=4 434 B10R0.57 NC(C(=O)O[Na])CCC(=O)O Amb16224798 [0,1,0,0,0,0|1,0,2]=4 435 B10R0.57 NC(CCC(O)=O)C(=O)O[Na] Amb22730975 [0,1,0,0,0,0|1,0,2]=4 436 B10R0.57 NNC(=O)C(=O)NCC(O)=O Amb25337580 [0,1,0,0,0,0|3,0,0]=4 437 B10R0.57 OC(=O)CCC(=O)\C(\Cl)=N\O Amb25382148 [0,1,0,0,0,0|2,0,1]=4 438 B10R0.57 OC(=O)\C=C\C(O)=C(Cl)C=O Amb25258413 [0,1,0,0,0,0|2,0,1]=4 439 B10R0.57 OC(=O)\C=C\C(\O)=C(/Cl)\C=O Amb24635724 [0,1,0,0,0,0|2,0,1]=4 440 B10R0.57 OC(=O)\C=C\C(\O)=C(/O)\C=O Amb24383141 [0,1,0,0,0,0|1,0,1]=3 441 B10R0.57 O\C=C(/O)\C(=O)\C=C\C(O)=O Amb25205841 [0,1,0,0,0,0|1,0,2]=4 442 B10R0.82 CC(=C\C=C(\O)/C(O)=O)C=O Amb24563500 [0,1,0,0,0,0|2,0,1]=4 443 B10R0.82 CC(=NNC(=O)NC)C(O)=O Amb24666306 [0,1,0,0,0,0|3,0,0]=4 444 B10R0.82 CC(=NNC(=O)SC)C(O)=O Amb24512168 [0,1,0,0,0,0|2,1,0]=4 445 B10R0.82 CC(=O)C(=O)NCC(=O)OC Amb25385804 [0,1,0,0,0,0|3,0,0]=4 446 B10R0.82 CC(=O)C(=O)\C=C\C(=O)OC Amb24764989 [0,1,0,0,0,0|2,0,1]=4 447 B10R0.82 CC(=O)\C(\C)=C\CC(=O)OC Amb24766642 [0,1,0,0,0,0|1,0,0]=2 448 B10R0.82 CNC(=O)CCC(=O)C(O)=O Amb25385153 [0,1,0,0,0,0|2,0,1]=4 449 B10R0.82 CNC(=O)CN[C@@H](C)C(O)=O Amb25383665 [0,1,0,0,0,0|2,0,1]=4 450 B10R0.82 CNC(=O)CN[C@H](C)C(O)=O Amb25383671 [0,1,0,0,0,0|2,0,1]=4 451 B10R0.82 COC(=O)CC[C@@H](C(=O)O)[NH3+] Amb10574405 [0,1,0,0,0,0|1,0,2]=4 452 B10R0.82 COC(=O)CC[C@@H](C)C(O)=O Amb22801605 [0,1,0,0,0,0|0,0,2]=3 453 B10R0.82 COC(=O)CC[C@@H](N)C(O)=O Amb22746068 [0,1,0,0,0,0|1,0,2]=4 454 B10R0.82 COC(=O)CC[C@H](C(=O)O)N Amb16183875 [0,1,0,0,0,0|1,0,2]=4 455 B10R0.82 COC(=O)CC[C@H](N)C(O)=O Amb22336436 [0,1,0,0,0,0|1,0,2]=4 456 B10R0.82 COC(=O)NCC(C)C(O)=O Amb19027704 [0,1,0,0,0,0|1,0,2]=4 457 B10R0.82 COC(=O)\C=C\C(N)C(O)=O Amb25385682 [0,1,0,0,0,0|1,0,2]=4 458 B10R0.82 C\C(=C\CC(=O)OC)\C(O)=O Amb25385213 [0,1,0,0,0,0|0,0,0]=1 459 B10R0.82 C\C(=C\CC(C)CC)\C(O)=O Amb25386433 [0,1,0,0,0,0|2,0,1]=4 460 B10R0.82 C\C(=C\CC(O)CC)\C(O)=O Amb25383444 [0,1,0,0,0,0|1,0,1]=3 461 B10R0.82 C\C(=N/NC(=O)SC)\C(O)=O Amb24634257 [0,1,0,0,0,0|2,1,0]=4 462 B10R0.82 C\C(\C=O)=C\C=C(N)C(O)=O Amb25201599 [0,1,0,0,0,0|2,0,1]=4 463 B10R0.82 C\C(\C=O)=C\C=C(\N)/C(O)=O Amb25837304 [0,1,0,0,0,0|2,0,1]=4 464 B10R0.82 NC(CCC(=O)NO)C(O)=O Amb22350145 [0,1,0,0,0,0|1,0,2]=4 465 B10R0.82 OC(=O)C(=O)\C=C\C(=O)CCl Amb25384835 [0,1,0,0,0,0|2,0,1]=4 466 B10R0.82 OC(=O)\C(\O)=C\C=C(/Cl)\C=O Amb25188726 [0,1,0,0,0,0|2,0,1]=4 467 B10R0.82 OC(=O)\C(\O)=C\C=C(/O)\C=O Amb25060733 [0,1,0,0,0,0|1,0,1]=3 468 B10R0.82 OC(=O)\C(\O)=C\C=C(F)C=O Amb25246238 [0,1,0,0,0,0|2,0,1]=4 469 B10R0.84 CC(=O)OC\C(=C\C)\C(O)=O Amb24767106 [0,1,0,0,0,0|2,0,1]=4 470 B10R0.84 CC(=O)\C(\CCC(O)=O)=N/O Amb24765012 [0,1,0,0,0,0|2,0,1]=4 471 B10R0.84 CC(C)=C(CC)\C=C\C(O)=O Amb18644660 [0,1,0,0,0,0|2,0,1]=4 472 B10R0.84 CCC(=C=CC(O)=O)C(O)=O Amb25258018 [0,1,0,0,0,0|0,0,2]=3 473 B10R0.84 CCC(C(=O)O)CCC(=O)O Amb10552864 [0,1,0,0,0,0|0,0,2]=3 474 B10R0.84 CCC(C(=O)O)SCC(=O)N Amb17501319 [0,1,0,0,0,0|2,0,1]=4 475 B10R0.84 CCC(C(=O)O)SCC(=O)O Amb17501325 [0,1,0,0,0,0|1,0,1]=3 476 B10R0.84 CC\C(=C/CC(O)=O)\C(O)=O Amb18644984 [0,1,0,0,0,0|0,0,0]=1 477 B10R0.84 CNC(C(=O)O)CCC(=O)O Amb13884886 [0,1,0,0,0,0|0,0,2]=3 478 B10R0.84 CN[C@@H](C(=O)O)CCC(=O)O Amb10604040 [0,1,0,0,0,0|0,0,2]=3 479 B10R0.84 CN[C@@H](CCC(N)=O)C(O)=O Amb22270246 [0,1,0,0,0,0|1,0,2]=4 480 B10R0.84 CN[C@@H](CCC(O)=O)C(O)=O Amb24117978 [0,1,0,0,0,0|0,0,2]=3 481 B10R0.84 CN[C@H](C(=O)O)CCC(=O)O Amb13884885 [0,1,0,0,0,0|0,0,2]=3 482 B10R0.84 C\C=C(\CCC(O)=O)/C(O)=O Amb25386289 [0,1,0,0,0,0|0,0,1]=2 483 B10R0.84 NC(=O)NN=C(CS)C(O)=O Amb25772853 [0,1,0,0,0,0|3,0,0]=4 484 B10R0.84 OC(=O)C=C\C(=N\O)\C(O)=O Amb24693170 [0,1,0,0,0,0|1,0,1]=3 485 B10R0.84 OC(=O)CC\C(=N\O)\C(O)=O Amb22365968 [0,1,0,0,0,0|1,0,1]=3 486 B10R0.92 CC(=CNC(C)(O)O)C(O)=O Amb24519242 [0,1,0,0,0,0|1,0,2]=4 487 B10R0.92 CP(O)(=O)C\C=C(\O)/C(N)=O Amb25376895 [0,1,0,0,0,0|3,0,0]=4 488 B10R0.92 C\C(=C/NC(C)(O)O)\C(O)=O Amb25213796 [0,1,0,0,0,0|1,0,2]=4 489 B10R0.92 OC(=O)C(=O)CCP(O)(O)=O Amb25386301 [0,1,0,0,0,0|2,0,1]=4 490 B10R0.93 BrC(C(=O)O)CC(C(=O)O)Br Amb17621581 [0,1,0,0,0,0|1,0,2]=4 491 B10R0.93 C=C(CC(N)C(N)=O)C(O)=O Amb25382149 [0,1,0,0,0,0|1,0,2]=4 492 B10R0.93 C=C(CC(N)C(O)=O)C(O)=O Amb18126175 [0,1,0,0,0,0|0,0,2]=3 493 B10R0.93 C=C(C[C@H](N)C(O)=O)C(N)=O Amb25386182 [0,1,0,0,0,0|1,0,2]=4 494 B10R0.93 CC(=CC(=O)C(O)=O)C(O)=O Amb24634036 [0,1,0,0,0,0|0,0,1]=2 495 B10R0.93 CC(=O)C(N)CC(C)C(O)=O Amb24765255 [0,1,0,0,0,0|1,0,2]=4 496 B10R0.93 CC(=O)C(O)\C=C(/C)\C(O)=O Amb24433897 [0,1,0,0,0,0|1,0,0]=2 497 B10R0.93 CC(=O)C(O)\C=C(\C)/C(O)=O Amb24563377 [0,1,0,0,0,0|1,0,0]=2 498 B10R0.93 CC(=O)N(C)CC(C)C(O)=O Amb18984560 [0,1,0,0,0,0|2,0,1]=4 499 B10R0.93 CC(=O)[C@@H](N)C[C@@H](C)C(O)=O Amb25384326 [0,1,0,0,0,0|1,0,2]=4 500 B10R0.93 CC(C(=O)O)CC(=C)C(=O)O Amb10844068 [0,1,0,0,0,0|0,0,2]=3 501 B10R0.93 CC(C(=O)O)SC(C(=O)O)C Amb17501619 [0,1,0,0,0,0|1,0,1]=3 502 B10R0.93 CC(CC(C)C(O)=O)C(N)=O Amb25383441 [0,1,0,0,0,0|1,0,2]=4 503 B10R0.93 CC(CC(Cl)C(O)=O)C(O)=O Amb25386325 [0,1,0,0,0,0|0,0,2]=3 504 B10R0.93 CC(CC(N)C(O)=O)C(O)=O Amb23440871 [0,1,0,0,0,0|0,0,2]=3 505 B10R0.93 CC(CN(C)C(N)=O)C(O)=O Amb18292772 [0,1,0,0,0,0|2,0,1]=4 506 B10R0.93 CC(C[C@H](N)C(O)=O)=C(Cl)Cl Amb25329776 [0,1,0,0,0,0|2,0,1]=4 507 B10R0.93 CC(C[C@H](N)C(O)=O)C(N)=O Amb25386389 [0,1,0,0,0,0|1,0,2]=4 508 B10R0.93 CC(NC(=O)C(O)=O)C(O)=O Amb25108452 [0,1,0,0,0,0|2,0,0]=3 509 B10R0.93 CC(NC(C)C(O)=O)C(O)=O Amb18126275 [0,1,0,0,0,0|1,0,1]=3 510 B10R0.93 CC(O)C(O)\C=C(\O)/C(O)=O Amb25690308 [0,1,0,0,0,0|2,0,1]=4 511 B10R0.93 C[C@@H](C[C@@H](N)C(O)=O)C(O)=O Amb19133151 [0,1,0,0,0,0|0,0,2]=3 512 B10R0.93 C[C@@H](NC(=O)C(O)=O)C(O)=O Amb19893389 [0,1,0,0,0,0|2,0,0]=3 513 B10R0.93 C[C@@H](N[C@H](C)C(O)=O)C(O)=O Amb25384906 [0,1,0,0,0,0|1,0,1]=3 514 B10R0.93 C[C@@H](O[C@H](C)C(O)=O)C(O)=O Amb25386293 [0,1,0,0,0,0|1,0,1]=3 515 B10R0.93 C[C@H](NC(=O)C(O)=O)C(O)=O Amb19893397 [0,1,0,0,0,0|2,0,0]=3 516 B10R0.93 C[C@H](N[C@H](C)C(O)=O)C(N)=O Amb25384905 [0,1,0,0,0,0|2,0,1]=4 517 B10R0.93 C[C@H](N[C@H](C)C(O)=O)C(O)=O Amb25382979 [0,1,0,0,0,0|1,0,1]=3 518 B10R0.93 C[C@H](O[C@@H](C)C(O)=O)C(O)=O Amb25386287 [0,1,0,0,0,0|1,0,1]=3 519 B10R0.93 C[C@H](O[C@H](C)C(O)=O)C(O)=O Amb25386292 [0,1,0,0,0,0|1,0,1]=3 520 B10R0.93 C\C(=C/C(=O)C(O)=O)\C(C)=O Amb24721665 [0,1,0,0,0,0|1,0,1]=3 521 B10R0.93 C\C(=C/C(=O)C(O)=O)\C(O)=O Amb25091208 [0,1,0,0,0,0|0,0,1]=2 522 B10R0.93 C\C(=C/C(C)C(C)=O)\C(C)=C Amb24582463 [0,1,0,0,0,0|3,0,0]=4 523 B10R0.93 C\C(=C/C(C)C(O)=O)\C(O)=O Amb25138641 [0,1,0,0,0,0|0,0,0]=1 524 B10R0.93 C\C(=C\C(C)C(C)C)\C(O)=O Amb25849091 [0,1,0,0,0,0|2,0,1]=4 525 B10R0.93 C\C(=C\C(C)C(O)=O)\C(O)=O Amb23591115 [0,1,0,0,0,0|0,0,0]=1 526 B10R0.93 NC(CC(N)C(O)=O)C(O)=O Amb24117887 [0,1,0,0,0,0|1,0,2]=4 527 B10R0.93 N[C@@H](CC(F)C(O)=O)C(O)=O Amb22800491 [0,1,0,0,0,0|1,0,2]=4 528 B10R0.93 N[C@@H](C[C@@H](F)C(O)=O)C(O)=O Amb24055860 [0,1,0,0,0,0|1,0,2]=4 529 B10R0.93 N[C@@H](C[C@@H](N)C(O)=O)C(O)=O Amb22746048 [0,1,0,0,0,0|1,0,2]=4 530 B10R0.93 N[C@@H](C[C@H](N)C(O)=O)C(O)=O Amb22388564 [0,1,0,0,0,0|1,0,2]=4 531 B10R0.93 N[C@@H](C[C@H](N)C(O)=O)C(O)=O Amb22745417 [0,1,0,0,0,0|1,0,2]=4 532 B10R0.93 N[C@@H](C[C@H](O)C(O)=O)C(O)=O Amb22800665 [0,1,0,0,0,0|1,0,2]=4 533 B10R0.93 N[C@@H](C[C@H](O)C(O)=O)C(O)=O Amb24117514 [0,1,0,0,0,0|1,0,2]=4 534 B10R0.93 N[C@H](C[C@@H](N)C(O)=O)C(O)=O Amb22388558 [0,1,0,0,0,0|1,0,2]=4 535 B10R0.93 N[C@H](C[C@@H](O)C(O)=O)C(O)=O Amb25386295 [0,1,0,0,0,0|1,0,2]=4 536 B10R0.93 OC(=O)C(=O)CC(=O)C(O)=O Amb24754815 [0,1,0,0,0,0|1,0,2]=4 537 B10R0.93 OC(=O)C(Cl)CC(Cl)C(O)=O Amb25385940 [0,1,0,0,0,0|1,0,2]=4 538 B10R0.93 OC(=O)C(O)CC(O)C(O)=O Amb18645944 [0,1,0,0,0,0|1,0,2]=4 539 B10R0.93 OC(=O)C(S)CC(S)C(O)=O Amb25384913 [0,1,0,0,0,0|1,0,2]=4 540 B10R0.93 OC(=O)[C@@H](C[C@@H](C(=O)O)F)N Amb10839750 [0,1,0,0,0,0|1,0,2]=4 541 B10R0.93 OC(=O)[C@@H](C[C@@H](C(=O)O)N)C Amb10807462 [0,1,0,0,0,0|0,0,2]=3 542 B10R0.93 OC(=O)[C@H](C[C@@H](C(=O)O)F)N Amb10839751 [0,1,0,0,0,0|1,0,2]=4 543 B10R0.93 OC(=O)[C@H](C[C@@H](C(=O)O)N)C Amb17617454 [0,1,0,0,0,0|0,0,2]=3 544 B10R0.93 OC(=O)[C@H](O)C[C@@H](O)C(O)=O Amb25386296 [0,1,0,0,0,0|1,0,2]=4 545 B10R0.93 OC(=O)[C@H](S)C[C@@H](S)C(O)=O Amb25386192 [0,1,0,0,0,0|1,0,2]=4 546 B10R0.93 OC(C(=O)O)CC(=O)C(=O)O Amb17615458 [0,1,0,0,0,0|1,0,1]=3 547 B10R0.93 OC(SC(O)C(O)=O)C(O)=O Amb17772308 [0,1,0,0,0,0|2,0,1]=4 548 B10R0.93 O[C@H](CC(=O)C(O)=O)C(O)=O Amb25383809 [0,1,0,0,0,0|1,0,1]=3 549 B10R1.13 CC(=O)C1CCC(=O)OC1 Amb25092970 [0,0,0,1,0,0|1,0,2]=4 550 B10R1.13 CC1CC=C(CN1)C(O)=O Amb18831771 [0,0,0,1,0,0|2,0,1]=4 551 B10R1.13 CC1CCC(=CC1)C(O)=O Amb18124589 [0,0,0,1,0,0|2,0,1]=4 552 B10R1.13 CN1CCC(=CC1)C(=O)O Amb17593569 [0,0,0,1,0,0|3,0,0]=4 553 B10R1.13 C[C@@H]1CCC(=CC1)C(O)=O Amb24349868 [0,0,0,1,0,0|2,0,1]=4 554 B10R1.13 NC(=O)C=1C=CC(=O)OC1 Amb25147558 [0,0,0,1,0,0|1,0,2]=4 555 B10R1.13 NC(=O)C=1CNC(=O)NC1 Amb24063069 [0,0,0,1,0,0|3,0,0]=4 556 B10R1.13 NC1CCC(=CC1)C(O)=O Amb24101018 [0,0,0,1,0,0|2,0,1]=4 557 B10R1.13 O=C1C=CC(=CO1)C(=O)Cl Amb19895315 [0,0,0,1,0,0|1,0,2]=4 558 B10R1.13 O=C1CCC(=CC1)C(=O)C Amb17593496 [0,0,0,1,0,0|2,0,0]=3 559 B10R1.13 O=C1CCC(=CN1)C(=O)C Amb2386720 [0,0,0,1,0,0|3,0,0]=4 560 B10R1.13 OC(=O)C1=CCC(=O)N=N1 Amb22641446 [0,0,0,1,0,0|2,0,0]=3 561 B10R1.13 OC(=O)C1=CNC(=O)C=N1 Amb18278228 [0,0,0,1,0,0|3,0,0]=4 562 B10R1.13 OC(=O)C1=CNC(=O)N=C1 Amb18643480 [0,0,0,1,0,0|2,0,1]=4 563 B10R1.13 OC(=O)C1CCC(=O)CN1 Amb21960863 [0,0,0,1,0,0|2,0,1]=4 564 B10R1.13 OC(=O)C1CCC(=O)CO1 Amb23596936 [0,0,0,1,0,0|2,0,1]=4 565 B10R1.13 OC(=O)C1CCC(=O)CS1 Amb23596925 [0,0,0,1,0,0|2,0,1]=4 566 B10R1.13 OC(=O)C1CCC(=O)SC1 Amb24637279 [0,0,0,1,0,0|0,1,2]=4 567 B10R1.13 OC(=O)C1CNC(=O)CN1 Amb22235954 [0,0,0,1,0,0|2,0,1]=4 568 B10R1.13 OC(=O)C1CNC(=O)CN1 Amb22641428 [0,0,0,1,0,0|2,0,1]=4 569 B10R1.13 OC(=O)C=1C=CC(=O)NC1 Amb18028595 [0,0,0,1,0,0|1,0,2]=4 570 B10R1.13 OC(=O)C=1C=CC(=O)NN1 Amb18013052 [0,0,0,1,0,0|2,0,1]=4 571 B10R1.13 OC(=O)C=1C=CC(=O)NN1 Amb19894728 [0,0,0,1,0,0|2,0,1]=4 572 B10R1.13 OC(=O)C=1C=CC(=O)OC1 Amb19723416 [0,0,0,1,0,0|0,0,2]=3 573 B10R1.13 OC(=O)C=1C=CC(=O)OC1 Amb20661802 [0,0,0,1,0,0|0,0,2]=3 574 B10R1.13 OC(=O)C=1C=NC(=O)CN1 Amb24093763 [0,0,0,1,0,0|2,0,1]=4 575 B10R1.13 OC(=O)C=1CCC(=O)CC1 Amb24656398 [0,0,0,1,0,0|1,0,0]=2 576 B10R1.13 OC(=O)C=1CCC(=O)NC1 Amb22011873 [0,0,0,1,0,0|2,0,0]=3 577 B10R1.13 OC(=O)C=1CSC(=O)NC1 Amb25061302 [0,0,0,1,0,0|1,1,0]=3 578 B10R1.13 OC(=O)[C@@H]1CCC(=O)CN1 Amb24655763 [0,0,0,1,0,0|2,0,1]=4 579 B10R1.13 OC(=O)[C@@H]1CNC(=O)CN1 Amb22746776 [0,0,0,1,0,0|2,0,1]=4 580 B10R1.13 OC(=O)[C@@H]1CNC(=O)CN1 Amb22756547 [0,0,0,1,0,0|2,0,1]=4 581 B10R1.13 OC(=O)[C@H]1CNC(=O)CN1 Amb24423079 [0,0,0,1,0,0|2,0,1]=4 582 B10R1.13 OC(=O)c1ccc(O)cc1 Amb22338464 [0,0,0,1,0,0|1,0,2]=4 583 B10R1.13 OC(=O)c1ccc(O)nn1 Amb17755179 [0,0,0,1,0,0|2,0,1]=4 584 B10R1.13 OC(=O)c1ccc(O)nn1 Amb17935842 [0,0,0,1,0,0|2,0,1]=4 585 B10R1.13 OC1CCC(=CC1)C(=O)C Amb17593547 [0,0,0,1,0,0|2,0,1]=4 586 B10R1.13 O[13c]1[13cH][13cH][13c]([13cH][13cH]1)C(O)=O Amb22367403 [0,0,0,1,0,0|1,0,2]=4 587 B10R1.13 O[13c]1[13cH][13cH][13c]([13cH][13cH]1)[13C](O)=O Amb22367323 [0,0,0,1,0,0|1,0,2]=4 588 B10R1.13 Oc1ccc([p]c1)C(O)=O Amb25321003 [0,0,0,1,0,0|2,0,1]=4 589 B10R1.13 Oc1ccc(cc1)C(=O)O Amb2569657 [0,0,0,1,0,0|1,0,2]=4 590 B10R1.13 Oc1ccc(cc1)[13C](O)=O Amb22353368 [0,0,0,1,0,0|1,0,2]=4 591 B10R1.13 Oc1ccc(cn1)C(=O)O Amb1085852 [0,0,0,1,0,0|1,0,2]=4 592 B10R1.13 Oc1ccc(nc1)C(=O)O Amb2235994 [0,0,0,1,0,0|2,0,1]=4 593 B10R1.13 Oc1ncc(cn1)C(=O)O Amb10067812 [0,0,0,1,0,0|2,0,1]=4 594 B10R1.58 C=C1C[C@@H](CC1=O)C(O)=O Amb25789978 [0,0,0,1,0,0|1,0,2]=4 595 B10R1.58 C=C1C[C@@H](NC1=O)C(O)=O Amb25821844 [0,0,0,1,0,0|1,0,2]=4 596 B10R1.58 CC(=O)C1CC(C)C(=O)O1 Amb25146781 [0,0,0,1,0,0|1,0,2]=4 597 B10R1.58 CC1=CC(OC1C)C(O)=O Amb24392723 [0,0,0,1,0,0|1,0,1]=3 598 B10R1.58 CC1=CC(SC1C)C(O)=O Amb18645090 [0,0,0,1,0,0|1,1,1]=4 599 B10R1.58 CC1=C[C@H](OC1=O)[C@@H](C)Br Amb24519817 [0,0,0,1,0,0|2,0,1]=4 600 B10R1.58 CC1C=C(OC1=O)C(O)=O Amb24505308 [0,0,0,1,0,0|0,0,2]=3 601 B10R1.58 CC1CC(NC1=O)C(O)=O Amb24561629 [0,0,0,1,0,0|1,0,2]=4 602 B10R1.58 CC1CC(OC1=O)C(=O)Cl Amb25124855 [0,0,0,1,0,0|1,0,2]=4 603 B10R1.58 CC1C[C@H](NC1=O)C(O)=O Amb24425935 [0,0,0,1,0,0|1,0,2]=4 604 B10R1.58 CC1NC(CC1=O)C(O)=O Amb24681544 [0,0,0,1,0,0|2,0,1]=4 605 B10R1.58 CC1SC(CC1=O)C(O)=O Amb24061426 [0,0,0,1,0,0|2,0,1]=4 606 B10R1.58 CC=1CC(CC1C)C(O)=O Amb25692577 [0,0,0,1,0,0|2,0,1]=4 607 B10R1.58 CN1C=C(CC1=O)C(O)=O Amb25336640 [0,0,0,1,0,0|2,0,1]=4 608 B10R1.58 CN1C[C@@H](NC1=O)C(O)=O Amb23598492 [0,0,0,1,0,0|2,0,1]=4 609 B10R1.58 CN1C[C@H](OC1=O)C(O)=O Amb25696396 [0,0,0,1,0,0|1,0,1]=3 610 B10R1.58 CN1N=C(OC1=O)C(O)=O Amb24656249 [0,0,0,1,0,0|2,0,1]=4 611 B10R1.58 CN1NC(C=C1O)C(O)=O Amb25216375 [0,0,0,1,0,0|3,0,0]=4 612 B10R1.58 C[C@@H]1C[C@H](NC1=O)C(O)=O Amb25294315 [0,0,0,1,0,0|1,0,2]=4 613 B10R1.58 C[C@@H]1N[C@@H](CC1=O)C(O)=O Amb25176921 [0,0,0,1,0,0|2,0,1]=4 614 B10R1.58 Cc1[nH]c(cc1C)C(O)=O Amb18832101 [0,0,0,1,0,0|2,0,1]=4 615 B10R1.58 Cc1[s]c([n]c1O)C(O)=O Amb24061368 [0,0,0,1,0,0|2,0,1]=4 616 B10R1.58 Cc1cc([s]c1Br)C(O)=O Amb20622803 [0,0,0,1,0,0|1,1,1]=4 617 B10R1.58 Cc1cc([s]c1N)C(O)=O Amb18830630 [0,0,0,1,0,0|1,1,1]=4 618 B10R1.58 Cc1cc(oc1N)C(C)=O Amb18832099 [0,0,0,1,0,0|2,0,1]=4 619 B10R1.58 Cc1cc(oc1N)C(O)=O Amb18831791 [0,0,0,1,0,0|1,0,1]=3 620 B10R1.58 Cc1oc([n]c1C)C(O)=O Amb18202775 [0,0,0,1,0,0|2,0,1]=4 621 B10R1.58 Cc1oc(cc1Br)C(O)=O Amb23537903 [0,0,0,1,0,0|2,0,1]=4 622 B10R1.58 Cc1oc(cc1C)C(=O)Cl Amb25114728 [0,0,0,1,0,0|2,0,1]=4 623 B10R1.58 Cc1oc(cc1C)C(C)=O Amb22229922 [0,0,0,1,0,0|2,0,1]=4 624 B10R1.58 Cc1oc(cc1I)C(O)=O Amb24720128 [0,0,0,1,0,0|2,0,1]=4 625 B10R1.58 Cc1oc(cc1N)C(O)=O Amb18280933 [0,0,0,1,0,0|2,0,1]=4 626 B10R1.58 Cc1oc(cc1S)C(O)=O Amb24644674 [0,0,0,1,0,0|2,0,1]=4 627 B10R1.58 NC1CC(OC1=O)C(O)=O Amb25147458 [0,0,0,1,0,0|1,0,2]=4 628 B10R1.58 Nc1cc(oc1Br)C(O)=O Amb18280934 [0,0,0,1,0,0|2,0,1]=4 629 B10R1.58 OC(=O)C1CC(O)C(=O)O1 Amb18644233 [0,0,0,1,0,0|1,0,2]=4 630 B10R1.58 OC(=O)[C@@H]1C[C@@H](O)C(=O)O1 Amb24514914 [0,0,0,1,0,0|1,0,2]=4 631 B10R1.58 OC(=O)[C@@H]1C[C@H](O)C(=O)O1 Amb25230626 [0,0,0,1,0,0|1,0,2]=4 632 B10R1.58 OC(=O)c1cc(Br)c(Cl)o1 Amb18134782 [0,0,0,1,0,0|2,0,1]=4 633 B10R1.58 OC(=O)c1cc(S)c(Br)o1 Amb25716618 [0,0,0,1,0,0|2,0,1]=4 634 B10R1.58 OC(=O)c1sc(c(c1)C)C Amb1107632 [0,0,0,1,0,0|1,1,1]=4 635 B10R1.190 CC(NC1CC1=O)C(O)=O Amb25789148 [0,0,0,1,0,0|2,0,1]=4 636 B10R1.190 C\C(=C/C1OC1C)\C(N)=O Amb25789449 [0,0,0,1,0,0|2,0,1]=4 637 B10R1.349 CC(=O)C1CC(C1)C(O)=O Amb25113879 [0,0,0,1,0,0|1,0,2]=4 638 B10R1.349 CC(=O)N1CC(C1)C(O)=O Amb20061395 [0,0,0,1,0,0|2,0,1]=4 639 B10R1.349 CC(C)=C1CC(C1)C(O)=O Amb25770982 [0,0,0,1,0,0|2,0,1]=4 640 B10R1.349 NC(=O)C1CC(C1)C(O)=O Amb24698479 [0,0,0,1,0,0|1,0,2]=4 641 B10R1.349 NC(=O)[C@@H]1C[C@H](C1)C(O)=O Amb24394961 [0,0,0,1,0,0|1,0,2]=4 642 B10R1.349 NC(=O)[C@H]1C[C@H](C1)C(O)=O Amb24425563 [0,0,0,1,0,0|1,0,2]=4 643 B10R1.349 OC(=O)C1CC(C1)C(O)=O Amb19958786 [0,0,0,1,0,0|0,0,2]=3 644 B10R1.349 OC(=O)[C@@H]1C[C@H](C1)C(O)=O Amb19514892 [0,0,0,1,0,0|0,0,2]=3 645 B10R1.359 CC1(C)CC(=CC1)C(O)=O Amb18643597 [0,0,0,1,0,0|2,0,1]=4 646 B10R1.359 CP1(=O)CC(=CC1)C(O)=O Amb25708497 [0,0,0,1,0,0|2,0,0]=3 647 B10R1.360 CC(=O)C1(C)CC1C(O)=O Amb25771095 [0,0,0,1,0,0|1,0,2]=4 648 B10R1.360 C[C@]1(C[C@@H]1C(O)=O)C(O)=O Amb24598825 [0,0,0,1,0,0|0,0,2]=3 649 B10R1.360 C[C@]1(C[C@H]1C(O)=O)C(O)=O Amb25231202 [0,0,0,1,0,0|0,0,2]=3 650 B10R1.360 C[C@]1(O[C@@H]1C(O)=O)C(O)=O Amb25340526 [0,0,0,1,0,0|1,0,1]=3 651 B10R1.360 NC1(CC1C(O)=O)C(O)=O Amb25124900 [0,0,0,1,0,0|1,0,2]=4 652 B10R1.360 N[C@@]1(C[C@@H]1C(O)=O)C(O)=O Amb23452842 [0,0,0,1,0,0|1,0,2]=4 653 B10R1.360 N[C@@]1(C[C@H]1C(O)=O)C(O)=O Amb23452828 [0,0,0,1,0,0|1,0,2]=4 654 B10R1.360 N[C@]1(C[C@H]1C(O)=O)C(O)=O Amb24515142 [0,0,0,1,0,0|1,0,2]=4 655 B10R1.360 OC(=O)[C@@]1(Br)C[C@@H]1C(O)=O Amb24748251 [0,0,0,1,0,0|1,0,2]=4 656 B10R1.360 OC(=O)[C@@]1(Cl)C[C@H]1C(O)=O Amb25258365 [0,0,0,1,0,0|1,0,2]=4 657 B10R1.360 OC(=O)[C@]1(Cl)C[C@H]1C(O)=O Amb25179268 [0,0,0,1,0,0|1,0,2]=4 658 B10R1.368 OC(=O)CC1CC1C(O)=O Amb25111566 [0,0,0,1,0,0|0,0,2]=3 659 B10R1.368 OC(=O)CN1CC1C(O)=O Amb24078333 [0,0,0,1,0,0|1,0,1]=3 660 B10R1.368 OC(=O)CN1C[C@H]1C(O)=O Amb24078334 [0,0,0,1,0,0|1,0,1]=3 661 B10R1.368 OC(=O)[C@@H]/1C\C1=C\C(O)=O Amb25827923 [0,0,0,1,0,0|0,0,2]=3 662 B10R1.470 CC1(C=CC(=O)N1)C(O)=O Amb25063873 [0,0,0,1,0,0|1,0,2]=4 663 B10R1.470 CC1(CC(=O)CC1)C(O)=O Amb23454199 [0,0,0,1,0,0|1,0,2]=4 664 B10R1.470 CC1(CCC(=O)N1)C(O)=O Amb23515108 [0,0,0,1,0,0|1,0,2]=4 665 B10R1.470 CC1(CCC(=O)O1)C(N)=O Amb25842762 [0,0,0,1,0,0|1,0,2]=4 666 B10R1.470 CC1(OC(=O)CS1)C(O)=O Amb25322035 [0,0,0,1,0,0|1,0,1]=3 667 B10R1.470 C[C@]1(CC(=O)CC1)C(O)=O Amb25693811 [0,0,0,1,0,0|1,0,2]=4 668 B8R0.23 C=C(CC(=O)Cl)C(O)=O Amb25227983 [0,0,0,0,1,0|1,0,1]=3 669 B8R0.23 C=C(CC(N)=O)C(N)=O Amb25338425 [0,0,0,0,1,0|2,0,1]=4 670 B8R0.23 C=C(CC(N)=O)C(O)=O Amb24333452 [0,0,0,0,1,0|1,0,1]=3 671 B8R0.23 C=C(CC(O)=O)C(N)=O Amb22011744 [0,0,0,0,1,0|1,0,1]=3 672 B8R0.23 C=C(CC([O-])=O)C([O-])=O Amb22731973 [0,0,0,0,1,0|0,0,3]=4 673 B8R0.23 C=C(CC([O-])=O)C([O-])=O Amb22732122 [0,0,0,0,1,0|0,0,3]=4 674 B8R0.23 C=C(CC([O-])=O)C([O-])=O Amb22732709 [0,0,0,0,1,0|0,0,3]=4 675 B8R0.23 C=C(CC([O-])=O)C([O-])=O Amb22734239 [0,0,0,0,1,0|0,0,3]=4 676 B8R0.23 CC(=C)C(C)CC(O)=O Amb18642614 [0,0,0,0,1,0|2,0,1]=4 677 B8R0.23 CC(=C)CC(=C)C(O)=O Amb24669131 [0,0,0,0,1,0|2,0,1]=4 678 B8R0.23 CC(=C)CC(C)C(O)=O Amb24471924 [0,0,0,0,1,0|2,0,1]=4 679 B8R0.23 CC(=C)C[C@@H](C(=O)O)C Amb10843988 [0,0,0,0,1,0|2,0,1]=4 680 B8R0.23 CC(=C)C[C@@H](C)C(O)=O Amb24340253 [0,0,0,0,1,0|2,0,1]=4 681 B8R0.23 CC(=CC(=O)Cl)C(=O)Cl Amb24464565 [0,0,0,0,1,0|2,0,0]=3 682 B8R0.23 CC(=CC(N)=O)C(O)=O Amb24744881 [0,0,0,0,1,0|1,0,0]=2 683 B8R0.23 CC(=CC(O)=O)C(C)F Amb25108468 [0,0,0,0,1,0|2,0,1]=4 684 B8R0.23 CC(=CC(O)=O)C(C)N Amb24339945 [0,0,0,0,1,0|2,0,1]=4 685 B8R0.23 CC(=CC(O)=O)[N+]([O-])=O Amb24685014 [0,0,0,0,1,0|1,0,1]=3 686 B8R0.23 CC(=O)C(=O)CC(C)=O Amb25806867 [0,0,0,0,1,0|3,0,0]=4 687 B8R0.23 CC(=O)C(C)=NC(C)=O Amb25349449 [0,0,0,0,1,0|3,0,0]=4 688 B8R0.23 CC(=O)C(C)CC(O)=O Amb18292788 [0,0,0,0,1,0|1,0,1]=3 689 B8R0.23 CC(=O)C(Cl)CC(O)=O Amb24426109 [0,0,0,0,1,0|2,0,1]=4 690 B8R0.23 CC(=O)C(O)=CC(O)=O Amb25261166 [0,0,0,0,1,0|2,0,0]=3 691 B8R0.23 CC(=O)C(O)CC(O)=O Amb25341886 [0,0,0,0,1,0|2,0,1]=4 692 B8R0.23 CC(=O)CC(=O)C(O)=O Amb18642736 [0,0,0,0,1,0|2,0,0]=3 693 B8R0.23 CC(=O)CC(Br)C(O)=O Amb24710683 [0,0,0,0,1,0|2,0,1]=4 694 B8R0.23 CC(=O)CC(C)C(O)=S Amb24061827 [0,0,0,0,1,0|1,1,1]=4 695 B8R0.23 CC(=O)CC(N)C(O)=O Amb18832532 [0,0,0,0,1,0|2,0,1]=4 696 B8R0.23 CC(=O)CC(N)C(O)=O Amb22546289 [0,0,0,0,1,0|2,0,1]=4 697 B8R0.23 CC(=O)CC(O)C(O)=O Amb22500917 [0,0,0,0,1,0|2,0,1]=4 698 B8R0.23 CC(=O)C[C@@H](C)C(O)=O Amb24369598 [0,0,0,0,1,0|1,0,1]=3 699 B8R0.23 CC(=O)C[C@@H](N)C(O)=O Amb22745939 [0,0,0,0,1,0|2,0,1]=4 700 B8R0.23 CC(=O)C[C@H](O)C(O)=O Amb24358758 [0,0,0,0,1,0|2,0,1]=4 701 B8R0.23 CC(=O)N[C@H](C)C(O)=O Amb19944277 [0,0,0,0,1,0|2,0,1]=4 702 B8R0.23 CC(=O)OC(C)C(O)=O Amb22360672 [0,0,0,0,1,0|2,0,1]=4 703 B8R0.23 CC(=O)SC(C)C(O)=O Amb25719066 [0,0,0,0,1,0|2,0,1]=4 704 B8R0.23 CC(=O)[C@@H](C)CC(O)=O Amb25145964 [0,0,0,0,1,0|1,0,1]=3 705 B8R0.23 CC(=O)[C@@H](N)CC(O)=O Amb25064775 [0,0,0,0,1,0|2,0,1]=4 706 B8R0.23 CC(=O)[C@H](C)CC(O)=O Amb25360184 [0,0,0,0,1,0|1,0,1]=3 707 B8R0.23 CC(=O)\C(\C)=C/C(C)=O Amb24447751 [0,0,0,0,1,0|2,0,0]=3 708 B8R0.23 CC(=O)\C(\C)=C\C(C)=O Amb25773462 [0,0,0,0,1,0|2,0,0]=3 709 B8R0.23 CC(=O)\C(\C)=C\C(O)=O Amb22359749 [0,0,0,0,1,0|1,0,0]=2 710 B8R0.23 CC(=O)\C(\C)=C\[N+]([O-])=O Amb24730259 [0,0,0,0,1,0|2,0,1]=4 711 B8R0.23 CC(=O)\C(\C)=N/C(C)=O Amb24072927 [0,0,0,0,1,0|3,0,0]=4 712 B8R0.23 CC(=O)\C=C(/Br)\C(O)=O Amb24739508 [0,0,0,0,1,0|2,0,0]=3 713 B8R0.23 CC(=O)\C=C(/C)\C(O)=O Amb18642577 [0,0,0,0,1,0|1,0,0]=2 714 B8R0.23 CC(=O)\C=C(\C)/C(O)=O Amb24582978 [0,0,0,0,1,0|1,0,0]=2 715 B8R0.23 CC(=O)\C=C(\O)/C(O)=O Amb25856143 [0,0,0,0,1,0|2,0,0]=3 716 B8R0.23 CC(=S)CC(C)C(O)=O Amb24588975 [0,0,0,0,1,0|1,1,1]=4 717 B8R0.23 CC(C)=C(C)CC(O)=O Amb18642613 [0,0,0,0,1,0|2,0,0]=3 718 B8R0.23 CC(C)=CC(=O)C(O)=O Amb18642579 [0,0,0,0,1,0|3,0,0]=4 719 B8R0.23 CC(C)=C[C@@H](C)C(O)=O Amb25794277 [0,0,0,0,1,0|2,0,1]=4 720 B8R0.23 CC(CC(=O)Cl)C(=O)Cl Amb22167294 [0,0,0,0,1,0|2,0,1]=4 721 B8R0.23 CC(CC(O)=O)=P(O)=O Amb25264110 [0,0,0,0,1,0|1,0,0]=2 722 B8R0.23 CC(CC(O)=O)C(N)=O Amb25737942 [0,0,0,0,1,0|1,0,1]=3 723 B8R0.23 CC(CC(O)=O)S(C)=O Amb18974545 [0,0,0,0,1,0|2,0,1]=4 724 B8R0.23 CC(CN(C)O)C(O)=O Amb24540617 [0,0,0,0,1,0|2,0,1]=4 725 B8R0.23 CC(CS(C)=O)C(O)=O Amb18974546 [0,0,0,0,1,0|2,0,1]=4 726 B8R0.23 CC(O)=CC(=O)C(O)=O Amb25047399 [0,0,0,0,1,0|2,0,0]=3 727 B8R0.23 CC(O)C(C)CC(O)=O Amb18293276 [0,0,0,0,1,0|1,0,2]=4 728 B8R0.23 CC(O)CC(=O)C(O)=O Amb25789747 [0,0,0,0,1,0|2,0,1]=4 729 B8R0.23 CC(O)CC(C)C(O)=O Amb18293277 [0,0,0,0,1,0|1,0,2]=4 730 B8R0.23 CC(\C(=C\C(=O)O)\C)C Amb17506861 [0,0,0,0,1,0|2,0,1]=4 731 B8R0.23 CN(CC(O)=O)C(N)=N Amb22002328 [0,0,0,0,1,0|3,0,0]=4 732 B8R0.23 CN(CC(O)=O)C(N)=N Amb22167307 [0,0,0,0,1,0|3,0,0]=4 733 B8R0.23 CN(CC(O)=O)C(N)=S Amb25115737 [0,0,0,0,1,0|2,1,0]=4 734 B8R0.23 CN(CC(O)=O)[13C](N)=N Amb22367285 [0,0,0,0,1,0|3,0,0]=4 735 B8R0.23 C[C@@H](CC(O)=O)C(O)=O Amb22226742 [0,0,0,0,1,0|0,0,1]=2 736 B8R0.23 C[C@@H](O)CC(=O)C(O)=O Amb25239377 [0,0,0,0,1,0|2,0,1]=4 737 B8R0.23 C[C@H](CC(N)=O)C(N)=O Amb25126983 [0,0,0,0,1,0|2,0,1]=4 738 B8R0.23 C[C@H](CC(N)=O)C(O)=O Amb25077589 [0,0,0,0,1,0|1,0,1]=3 739 B8R0.23 C[C@H](CC(O)=O)C(O)=O Amb22225399 [0,0,0,0,1,0|0,0,1]=2 740 B8R0.23 C[C@H](O)CC(=O)C(O)=O Amb25859340 [0,0,0,0,1,0|2,0,1]=4 741 B8R0.23 C[C@H](O)C[C@@H](C)C(O)=O Amb25114249 [0,0,0,0,1,0|1,0,2]=4 742 B8R0.23 C[C@H](OC(N)=O)C(O)=O Amb24427686 [0,0,0,0,1,0|2,0,1]=4 743 B8R0.23 C\C(=C/C(C)=C)\C(O)=O Amb24523653 [0,0,0,0,1,0|2,0,0]=3 744 B8R0.23 C\C(=C/C(C)=O)\C(C)=C Amb25143380 [0,0,0,0,1,0|3,0,0]=4 745 B8R0.23 C\C(=C/C(C)C)\C(O)=O Amb18642616 [0,0,0,0,1,0|2,0,1]=4 746 B8R0.23 C\C(=C/C(C)O)\C(O)=O Amb18642769 [0,0,0,0,1,0|1,0,1]=3 747 B8R0.23 C\C(=C/C(O)=O)\C(C)F Amb25331272 [0,0,0,0,1,0|2,0,1]=4 748 B8R0.23 C\C(=C/C(O)=O)\[C@@H](C)N Amb24477674 [0,0,0,0,1,0|2,0,1]=4 749 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)N Amb24394205 [0,0,0,0,1,0|2,0,1]=4 750 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)O Amb24340136 [0,0,0,0,1,0|1,0,1]=3 751 B8R0.23 C\C(=C/[C@@H](C)N)\C(O)=O Amb24476675 [0,0,0,0,1,0|2,0,1]=4 752 B8R0.23 C\C(=C\C(C)=C)\C(C)=O Amb24478341 [0,0,0,0,1,0|3,0,0]=4 753 B8R0.23 C\C(=C\C(C)=O)\C(=C)Cl Amb25202638 [0,0,0,0,1,0|3,0,0]=4 754 B8R0.23 C\C(=C\C(C)N)\C(O)=O Amb25731207 [0,0,0,0,1,0|2,0,1]=4 755 B8R0.23 C\C(=C\C(C)O)\C(O)=O Amb24548753 [0,0,0,0,1,0|1,0,1]=3 756 B8R0.23 C\C(=C\C(N)=O)\C(N)=O Amb25146105 [0,0,0,0,1,0|2,0,0]=3 757 B8R0.23 C\C(=C\C(N)=O)\C(O)=O Amb25199871 [0,0,0,0,1,0|1,0,0]=2 758 B8R0.23 C\C(=C\C(O)=O)\C(=N)O Amb24387420 [0,0,0,0,1,0|1,0,0]=2 759 B8R0.23 C\C(=C\N(C)C)\C(O)=O Amb24740153 [0,0,0,0,1,0|3,0,0]=4 760 B8R0.23 ClC(=O)CC(=C)C(Cl)=O Amb17938995 [0,0,0,0,1,0|2,0,1]=4 761 B8R0.23 NC(=O)C(N)CC(O)=O Amb18124347 [0,0,0,0,1,0|2,0,1]=4 762 B8R0.23 NC(=O)C(O)CC(O)=O Amb25378786 [0,0,0,0,1,0|2,0,1]=4 763 B8R0.23 NC(=O)CC(=O)C(O)=O Amb25146116 [0,0,0,0,1,0|2,0,0]=3 764 B8R0.23 NC(=O)C[C@@H](C(=O)O)C Amb10843937 [0,0,0,0,1,0|1,0,1]=3 765 B8R0.23 NC(=O)C[C@@H](O)C(O)=O Amb24681022 [0,0,0,0,1,0|2,0,1]=4 766 B8R0.23 NC(=O)C[C@H](Br)C(O)=O Amb25137878 [0,0,0,0,1,0|2,0,1]=4 767 B8R0.23 NC(=O)C[C@H](C(=O)O)N Amb10071271 [0,0,0,0,1,0|2,0,1]=4 768 B8R0.23 NC(=O)C[C@H](Cl)C(O)=O Amb24479999 [0,0,0,0,1,0|2,0,1]=4 769 B8R0.23 NC(=O)C[C@H]([15NH2])C(O)=O Amb22338491 [0,0,0,0,1,0|2,0,1]=4 770 B8R0.23 NC(=O)NC(=O)C(O)=O Amb18124345 [0,0,0,0,1,0|3,0,0]=4 771 B8R0.23 NC(=O)[C@@H](N)CC(O)=O Amb19334954 [0,0,0,0,1,0|2,0,1]=4 772 B8R0.23 NC(=O)\C(\Cl)=C/C(N)=O Amb24598183 [0,0,0,0,1,0|3,0,0]=4 773 B8R0.23 NC(=O)\C(\Cl)=C\C(N)=O Amb25369859 [0,0,0,0,1,0|3,0,0]=4 774 B8R0.23 NC(=O)\C=C(\Cl)/C(O)=O Amb24540540 [0,0,0,0,1,0|2,0,0]=3 775 B8R0.23 NC(CC(O)=O)C(O)=O Amb22730002 [0,0,0,0,1,0|1,0,1]=3 776 B8R0.23 NC(CC(O)=O)C([O-])=O Amb20241398 [0,0,0,0,1,0|1,0,2]=4 777 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22167994 [0,0,0,0,1,0|1,0,2]=4 778 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22330537 [0,0,0,0,1,0|1,0,2]=4 779 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22337568 [0,0,0,0,1,0|1,0,2]=4 780 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22349433 [0,0,0,0,1,0|1,0,2]=4 781 B8R0.23 NC(CC(O)=O)[13C](O)=O Amb22351321 [0,0,0,0,1,0|1,0,1]=3 782 B8R0.23 NC(CC([O-])=O)C(O)=O Amb22731484 [0,0,0,0,1,0|1,0,2]=4 783 B8R0.23 NC(CS(O)=O)C(O)=O Amb21913242 [0,0,0,0,1,0|2,0,1]=4 784 B8R0.23 NC(C[13C](O)=O)C(O)=O Amb22362630 [0,0,0,0,1,0|1,0,1]=3 785 B8R0.23 NC(C[13C](O)=O)[13C](O)=O Amb22353605 [0,0,0,0,1,0|1,0,1]=3 786 B8R0.23 NC([13CH2]C(O)=O)C(O)=O Amb22336729 [0,0,0,0,1,0|1,0,1]=3 787 B8R0.23 N[13C@@H](CC(O)=O)[13C](O)=O Amb22353606 [0,0,0,0,1,0|1,0,1]=3 788 B8R0.23 N[13C](=O)[13CH2][13C@H](N)[13C](O)=O Amb22367522 [0,0,0,0,1,0|2,0,1]=4 789 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb20241378 [0,0,0,0,1,0|1,0,2]=4 790 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22337725 [0,0,0,0,1,0|1,0,2]=4 791 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22352336 [0,0,0,0,1,0|1,0,2]=4 792 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22748705 [0,0,0,0,1,0|1,0,2]=4 793 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22801032 [0,0,0,0,1,0|1,0,2]=4 794 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb20240565 [0,0,0,0,1,0|1,0,2]=4 795 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb22748769 [0,0,0,0,1,0|1,0,2]=4 796 B8R0.23 N[C@@H](C[13C](N)=O)C(O)=O Amb22353613 [0,0,0,0,1,0|2,0,1]=4 797 B8R0.23 N[C@@H]([13CH2][13C](O)=O)C(O)=O Amb22367550 [0,0,0,0,1,0|1,0,1]=3 798 B8R0.23 N[C@H](CC(N)=O)C(O)=O Amb17749060 [0,0,0,0,1,0|2,0,1]=4 799 B8R0.23 N[C@H](CC(O)=O)P(O)=O Amb25838846 [0,0,0,0,1,0|2,0,1]=4 800 B8R0.23 N[C@H](CS(O)=O)C(O)=O Amb24366002 [0,0,0,0,1,0|2,0,1]=4 801 B8R0.23 OC(=O)C(=O)C=C(Cl)Cl Amb25188933 [0,0,0,0,1,0|3,0,0]=4 802 B8R0.23 OC(=O)C(=S)CC(O)=O Amb25304511 [0,0,0,0,1,0|1,0,0]=2 803 B8R0.23 OC(=O)C(Cl)CS(O)=O Amb25708099 [0,0,0,0,1,0|2,0,1]=4 804 B8R0.23 OC(=O)C(F)CC(O)=O Amb25077170 [0,0,0,0,1,0|1,0,1]=3 805 B8R0.23 OC(=O)C(O)CC(=O)S Amb25690206 [0,0,0,0,1,0|1,1,1]=4 806 B8R0.23 OC(=O)C(O)CC(O)=O Amb21935660 [0,0,0,0,1,0|1,0,1]=3 807 B8R0.23 OC(=O)C(S)CC(O)=O Amb22729564 [0,0,0,0,1,0|1,0,1]=3 808 B8R0.23 OC(=O)CC(=C(Cl)Cl)Cl Amb2227973 [0,0,0,0,1,0|3,0,0]=4 809 B8R0.23 OC(=O)CC(=O)C(=O)C Amb17593364 [0,0,0,0,1,0|2,0,0]=3 810 B8R0.23 OC(=O)CC(C(=O)O)C Amb1935053 [0,0,0,0,1,0|0,0,1]=2 811 B8R0.23 OC(=O)CC(O)C(=O)Cl Amb25700438 [0,0,0,0,1,0|2,0,1]=4 812 B8R0.23 OC(=O)CC(O)C(O)=O Amb22734584 [0,0,0,0,1,0|1,0,1]=3 813 B8R0.23 OC(=O)CN(C(=O)C)C Amb1111693 [0,0,0,0,1,0|2,0,0]=3 814 B8R0.23 OC(=O)CN(C(=O)N)C Amb2371395 [0,0,0,0,1,0|2,0,0]=3 815 B8R0.23 OC(=O)CN(C(=S)S)C Amb1042470 [0,0,0,0,1,0|1,2,0]=4 816 B8R0.23 OC(=O)C[C@@H](C(=O)O)N Amb16232085 [0,0,0,0,1,0|1,0,1]=3 817 B8R0.23 OC(=O)[13CH](O)CC(O)=O Amb22367337 [0,0,0,0,1,0|1,0,1]=3 818 B8R0.23 OC(=O)[C@@H](Cl)CC(O)=O Amb20242425 [0,0,0,0,1,0|1,0,1]=3 819 B8R0.23 OC(=O)[C@@H](S)CC(O)=O Amb22504526 [0,0,0,0,1,0|1,0,1]=3 820 B8R0.23 OC(=O)[C@H](Br)CC(O)=O Amb22504149 [0,0,0,0,1,0|1,0,1]=3 821 B8R0.23 OC(=O)[C@H](Cl)CC(O)=O Amb20242424 [0,0,0,0,1,0|1,0,1]=3 822 B8R0.23 OC(=O)[C@H](S)CC(O)=O Amb25124090 [0,0,0,0,1,0|1,0,1]=3 823 B8R0.23 OC(=O)\C(\Br)=C/C(O)=O Amb25746120 [0,0,0,0,1,0|1,0,0]=2 824 B8R0.23 OC(=O)\C(\Cl)=C/C(O)=O Amb24481892 [0,0,0,0,1,0|1,0,0]=2 825 B8R0.23 OC(=O)\C(\F)=C/C(O)=O Amb18124397 [0,0,0,0,1,0|1,0,0]=2 826 B8R0.23 OC(=O)\C(\I)=C/C(O)=O Amb25736420 [0,0,0,0,1,0|1,0,0]=2 827 B8R0.23 OC(=O)\C=C(\C(=C)C)/C Amb17593311 [0,0,0,0,1,0|2,0,0]=3 828 B8R0.23 O[13C](=O)[13CH2][13CH]([13C](=O)O)O Amb17616665 [0,0,0,0,1,0|1,0,1]=3 829 B8R0.23 [13CH3]N(CC(O)=O)C(N)=N Amb22367286 [0,0,0,0,1,0|3,0,0]=4 830 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22337484 [0,0,0,0,1,0|2,0,1]=4 831 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22351412 [0,0,0,0,1,0|2,0,1]=4 832 B8R0.23 [15NH2]C(CC(O)=O)C(O)=O Amb22731529 [0,0,0,0,1,0|1,0,1]=3 833 B8R0.23 [15NH2][13C@@H]([13CH2][13C](O)=O)[13C](O)=O Amb22353584 [0,0,0,0,1,0|1,0,1]=3 834 B8R0.23 [15NH2][13CH](CC(O)=O)C(O)=O Amb22351286 [0,0,0,0,1,0|1,0,1]=3 835 B8R0.23 [15NH2][13C](=O)[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337495 [0,0,0,0,1,0|2,0,1]=4 836 B8R0.23 [15NH2][C@@H](CC(O)=O)[13C](O)=O Amb22367524 [0,0,0,0,1,0|1,0,1]=3 837 B8R0.23 [O-]C(=O)CC(O)C(O)=O Amb22734911 [0,0,0,0,1,0|1,0,2]=4 838 B10R0.96 CC(=CC(O)=O)SCC(O)=O Amb25384901 [0,0,0,0,0,1|1,0,0]=2 839 B10R0.96 CC(=O)CC(=O)NCC(O)=O Amb19011373 [0,0,0,0,0,1|3,0,0]=4 840 B10R0.96 CC(=O)CC(=O)\C=C\C(O)=O Amb25384109 [0,0,0,0,0,1|2,0,1]=4 841 B10R0.96 CC(=O)CC(C)=NCC(N)=O Amb24766233 [0,0,0,0,0,1|3,0,0]=4 842 B10R0.96 CC(=O)CC(C)=NCC(O)=O Amb25384127 [0,0,0,0,0,1|2,0,0]=3 843 B10R0.96 CC(=O)CCC(C)=CC(C)=O Amb24765428 [0,0,0,0,0,1|2,0,1]=4 844 B10R0.96 CC(=O)CC\C(\C)=C\C(C)=O Amb24765127 [0,0,0,0,0,1|2,0,1]=4 845 B10R0.96 CC(=O)NC(=O)NCC(O)=O Amb24373173 [0,0,0,0,0,1|3,0,0]=4 846 B10R0.96 CC(=O)NN(C)CCC(O)=O Amb24764551 [0,0,0,0,0,1|2,0,1]=4 847 B10R0.96 CC(=O)OC(C)\C=C\C(O)=O Amb25386024 [0,0,0,0,0,1|1,0,2]=4 848 B10R0.96 CC(=O)O[C@@H](C)\C=C\C(O)=O Amb25384174 [0,0,0,0,0,1|1,0,2]=4 849 B10R0.96 CC(=O)O\C(\C)=C/NC(C)=O Amb24411864 [0,0,0,0,0,1|3,0,0]=4 850 B10R0.96 CC(=O)O\C(\C)=C\CC(C)=O Amb24765351 [0,0,0,0,0,1|2,0,0]=3 851 B10R0.96 CC(=O)O\C=C(\C)/CC(C)=O Amb24765228 [0,0,0,0,0,1|3,0,0]=4 852 B10R0.96 CC(=O)SC(C)\C=C\C(O)=O Amb25385242 [0,0,0,0,0,1|1,0,2]=4 853 B10R0.96 CC(=O)SC=C(C)NC(C)=O Amb24513135 [0,0,0,0,0,1|3,0,0]=4 854 B10R0.96 CC(=O)\C=C(\C)/NCC(N)=O Amb24594399 [0,0,0,0,0,1|3,0,0]=4 855 B10R0.96 CC(C=C(C)O)=NCC(N)=O Amb24540837 [0,0,0,0,0,1|3,0,0]=4 856 B10R0.96 CC(CC(C)C)=CCC(O)=O Amb25385173 [0,0,0,0,0,1|2,0,1]=4 857 B10R0.96 CC(CC(O)=O)=NCC(O)=O Amb25385177 [0,0,0,0,0,1|1,0,0]=2 858 B10R0.96 CC(O)=CC(=O)CCC(O)=O Amb25386411 [0,0,0,0,0,1|2,0,1]=4 859 B10R0.96 CC(O)=CC(C)=NCC(O)=O Amb24533092 [0,0,0,0,0,1|2,0,0]=3 860 B10R0.96 CN(CC(N)=O)\C=C\C(O)=O Amb24755182 [0,0,0,0,0,1|2,0,1]=4 861 B10R0.96 C\C(=C/C(C)=O)\C=C\C(C)=O Amb25128224 [0,0,0,0,0,1|2,0,1]=4 862 B10R0.96 C\C(=C\C(C)=O)\C=C\C(C)=O Amb24486221 [0,0,0,0,0,1|2,0,1]=4 863 B10R0.96 C\C(=C\C(O)=O)\C=CC(O)=O Amb25273936 [0,0,0,0,0,1|0,0,1]=2 864 B10R0.96 C\C(=C\C(O)=O)\C=C\C(N)=O Amb25362081 [0,0,0,0,0,1|1,0,1]=3 865 B10R0.96 C\C(\CC(O)=O)=C\CC(C)=C Amb25386397 [0,0,0,0,0,1|2,0,0]=3 866 B10R0.96 C\C(\CCC(C)=C)=C/C(O)=O Amb25386194 [0,0,0,0,0,1|2,0,1]=4 867 B10R0.96 C\C(\CCC(O)=O)=C\C(C)=C Amb18125735 [0,0,0,0,0,1|2,0,1]=4 868 B10R0.96 NC(=O)CNC(=O)CC(O)=O Amb18315747 [0,0,0,0,0,1|3,0,0]=4 869 B10R0.96 NC(=O)C\C=C(/Cl)\CC(N)=O Amb24764764 [0,0,0,0,0,1|3,0,0]=4 870 B10R0.96 NC(=O)C\C=C(\Cl)/CC(N)=O Amb24766270 [0,0,0,0,0,1|3,0,0]=4 871 B10R0.96 NC(=O)NC(=O)\C=C\C(O)=O Amb24687667 [0,0,0,0,0,1|2,0,1]=4 872 B10R0.96 NC(CC(O)=O)CCC(O)=O Amb22552564 [0,0,0,0,0,1|1,0,2]=4 873 B10R0.96 N[C@@H](CC(O)=O)CCC(O)=O Amb22750585 [0,0,0,0,0,1|1,0,2]=4 874 B10R0.96 OC(=O)CCC(=O)CC(=O)C Amb10843902 [0,0,0,0,0,1|2,0,1]=4 875 B10R0.96 OC(=O)CCC(=O)CC(O)=O Amb17689277 [0,0,0,0,0,1|1,0,1]=3 876 B10R0.96 OC(=O)CC[C@@H](CC(=O)O)N Amb16232070 [0,0,0,0,0,1|1,0,2]=4 877 B10R0.96 OC(=O)CNC(=O)CC(O)=O Amb18800491 [0,0,0,0,0,1|2,0,0]=3 878 B10R0.96 OC(=O)C[13CH2][13C](=O)[13CH2][13C](=O)[13CH3] Amb17620214 [0,0,0,0,0,1|2,0,1]=4 879 B10R0.96 OC(=O)\C=C(\Cl)/C=C/C(O)=O Amb18127800 [0,0,0,0,0,1|1,0,1]=3 880 B10R0.96 OC(CC(O)=O)CCC(O)=O Amb22727761 [0,0,0,0,0,1|1,0,2]=4 881 B10R0.98 CC(=C\C=C\C(C)=C)C(O)=O Amb24519524 [0,0,0,0,0,1|2,0,1]=4 882 B10R0.98 CC(=NOCC(C)=C)C(O)=O Amb25384128 [0,0,0,0,0,1|3,0,0]=4 883 B10R0.98 CC(=NOCC(O)=O)C(O)=O Amb25384896 [0,0,0,0,0,1|1,0,0]=2 884 B10R0.98 CC(=O)C(C)=NNCC(O)=O Amb25382156 [0,0,0,0,0,1|2,0,0]=3 885 B10R0.98 CC(=O)C(C)=NOCC(O)=O Amb25385212 [0,0,0,0,0,1|2,0,0]=3 886 B10R0.98 CC(=O)CC\C=C(/C)\C(O)=O Amb18125973 [0,0,0,0,0,1|1,0,0]=2 887 B10R0.98 CC(=O)CC\C=C(\Cl)/C(C)=O Amb24765211 [0,0,0,0,0,1|3,0,0]=4 888 B10R0.98 CC(=O)NCC[C@@H](C)C(O)=O Amb25384439 [0,0,0,0,0,1|1,0,2]=4 889 B10R0.98 CC(=O)NCC[C@H](C)C(O)=O Amb25384440 [0,0,0,0,0,1|1,0,2]=4 890 B10R0.98 CC(=O)OC\C=C(/C)\C(O)=O Amb25386222 [0,0,0,0,0,1|1,0,0]=2 891 B10R0.98 CC(=O)\C(\C)=C/COC(C)=O Amb24765386 [0,0,0,0,0,1|2,0,0]=3 892 B10R0.98 CC(=O)\C(\C)=C\C=CC(O)=O Amb24740742 [0,0,0,0,0,1|1,0,1]=3 893 B10R0.98 CC(=O)\C(\C)=C\COC(C)=O Amb24766936 [0,0,0,0,0,1|2,0,0]=3 894 B10R0.98 CC(=O)\C(\C)=N\NCC(O)=O Amb24766874 [0,0,0,0,0,1|2,0,0]=3 895 B10R0.98 CC(=O)\C=C/C=C(/O)\C(O)=O Amb25151531 [0,0,0,0,0,1|2,0,1]=4 896 B10R0.98 CC(=O)\C=C\C=C(/C)\C(O)=O Amb25334982 [0,0,0,0,0,1|1,0,1]=3 897 B10R0.98 CC(=O)\C=C\C=C(C)C(O)=O Amb24687305 [0,0,0,0,0,1|1,0,1]=3 898 B10R0.98 CC(C)=C(C)C=CCC(C)=O Amb25370944 [0,0,0,0,0,1|3,0,0]=4 899 B10R0.98 CC(C)=C(C)C=CCC(O)=O Amb24557864 [0,0,0,0,0,1|2,0,0]=3 900 B10R0.98 CC(C)=C(C)\C=C\CC(C)=O Amb25318957 [0,0,0,0,0,1|3,0,0]=4 901 B10R0.98 CC(C)=C(C)\C=C\CC(O)=O Amb18644650 [0,0,0,0,0,1|2,0,0]=3 902 B10R0.98 CC(C)=CC\C=C(/C)\C(O)=O Amb24487858 [0,0,0,0,0,1|2,0,0]=3 903 B10R0.98 CC(CCCC(O)=O)C(O)=O Amb18645273 [0,0,0,0,0,1|0,0,2]=3 904 B10R0.98 CC(NCCC(O)=O)C(O)=O Amb18098310 [0,0,0,0,0,1|0,0,2]=3 905 B10R0.98 CC(O)C(C)\C=C\CC(O)=O Amb25386047 [0,0,0,0,0,1|1,0,2]=4 906 B10R0.98 CC(S\C=C\C(O)=O)C(O)=O Amb18647961 [0,0,0,0,0,1|0,0,2]=3 907 B10R0.98 C\C(=C/CCC(C)C)\C(O)=O Amb25386297 [0,0,0,0,0,1|2,0,1]=4 908 B10R0.98 C\C(=C/CCC(O)=O)\C(O)=O Amb25385138 [0,0,0,0,0,1|0,0,0]=1 909 B10R0.98 C\C(=C\C=C/C(O)=O)\C(O)=O Amb24487944 [0,0,0,0,0,1|0,0,1]=2 910 B10R0.98 C\C(=C\C=CC(O)=O)\C(O)=O Amb25173182 [0,0,0,0,0,1|0,0,1]=2 911 B10R0.98 C\C(=C\CCN(C)C)\C(O)=O Amb25385181 [0,0,0,0,0,1|3,0,0]=4 912 B10R0.98 C\C(=C\CNC(C)C)\C(O)=O Amb25381549 [0,0,0,0,0,1|2,0,1]=4 913 B10R0.98 C\C(=N\OCC(C)=C)\C(O)=O Amb24764864 [0,0,0,0,0,1|3,0,0]=4 914 B10R0.98 NC(=O)C(=O)\C=C\CC(O)=O Amb25384982 [0,0,0,0,0,1|2,0,0]=3 915 B10R0.98 NC(=O)\C(\O)=C\C=CC(O)=O Amb24602428 [0,0,0,0,0,1|2,0,1]=4 916 B10R0.98 NC(CCCC(O)=O)C(O)=O Amb22740152 [0,0,0,0,0,1|1,0,2]=4 917 B10R0.98 NC(CSCC(O)=O)C(O)=O Amb23566716 [0,0,0,0,0,1|1,0,2]=4 918 B10R0.98 NC(C\C=C\C(O)=O)C(O)=O Amb18126177 [0,0,0,0,0,1|1,0,2]=4 919 B10R0.98 NC(N=NCC(O)=O)C(O)=O Amb25384237 [0,0,0,0,0,1|2,0,1]=4 920 B10R0.98 NC(\N=N/CC(O)=O)C(O)=O Amb25383166 [0,0,0,0,0,1|2,0,1]=4 921 B10R0.98 N[C@@H](C\C=C\C(O)=O)C(O)=O Amb24763009 [0,0,0,0,0,1|1,0,2]=4 922 B10R0.98 N[C@H](CSCC(O)=O)C(O)=O Amb22745445 [0,0,0,0,0,1|1,0,2]=4 923 B10R0.98 N[C@H](C\C=C\C(O)=O)C(O)=O Amb25383155 [0,0,0,0,0,1|1,0,2]=4 924 B10R0.98 OC(=C\C=C\C(O)=O)C(O)=O Amb25209357 [0,0,0,0,0,1|1,0,1]=3 925 B10R0.98 OC(=O)C(=O)C\C=C\C(O)=O Amb24766946 [0,0,0,0,0,1|1,0,1]=3 926 B10R0.98 OC(=O)C(F)=C\C=C\C(O)=O Amb24682871 [0,0,0,0,0,1|1,0,1]=3 927 B10R0.98 OC(=O)C(O)\C=C\CC(O)=O Amb25383439 [0,0,0,0,0,1|1,0,1]=3 928 B10R0.98 OC(=O)CCCC(O)C(O)=O Amb21963897 [0,0,0,0,0,1|1,0,2]=4 929 B10R0.98 OC(=O)CCC[C@H](O)C(O)=O Amb22270000 [0,0,0,0,0,1|1,0,2]=4 930 B10R0.98 OC(=O)CCSC(C(=O)O)C Amb17501234 [0,0,0,0,0,1|0,0,2]=3 931 B10R0.98 OC(=O)CONC(=O)C(=O)O Amb16185780 [0,0,0,0,0,1|2,0,0]=3 932 B10R0.98 OC(=O)CSC[C@@H](C(=O)O)N Amb16232500 [0,0,0,0,0,1|1,0,2]=4 933 B10R0.98 OC(=O)\C(\Cl)=C\C=C\C(O)=O Amb18127799 [0,0,0,0,0,1|1,0,1]=3 934 B10R0.98 OC(=O)\C(\F)=C/C=C\C(O)=O Amb24739746 [0,0,0,0,0,1|1,0,1]=3 935 B10R0.98 OC(=O)\C(\O)=C/SCC(O)=O Amb25386410 [0,0,0,0,0,1|1,0,0]=2 936 B7R0.3 CC(=CCCO)C=O Amb25366501 [2,0,0,0,0,0|0,0,1]=3 937 B7R0.3 CC(C=O)=CCCBr Amb25366526 [2,0,0,0,0,0|1,0,1]=4 938 B7R0.3 CCC\C=C(/C)\C=O Amb25194656 [2,0,0,0,0,0|1,0,1]=4 939 B7R0.3 CCC\C=C(\C)/C=O Amb18641699 [2,0,0,0,0,0|1,0,1]=4 940 B7R0.3 CC\C(\C)=C/CC=O Amb24657093 [2,0,0,0,0,0|1,0,1]=4 941 B7R0.3 COC\C=C(\C)/C=O Amb24686454 [2,0,0,0,0,0|2,0,0]=4 942 B7R0.3 CO\C(\C)=C\CC=O Amb25365197 [2,0,0,0,0,0|2,0,0]=4 943 B7R0.3 C[C@H](CCC=O)C=O Amb24707164 [2,0,0,0,0,0|0,0,2]=4 944 B7R0.3 C\C(=C/Br)\C=C\C=O Amb24483114 [2,0,0,0,0,0|1,0,1]=4 945 B7R0.3 C\C(=C/Cl)\C=C\C=O Amb25742912 [2,0,0,0,0,0|1,0,1]=4 946 B7R0.3 C\C(\C=C)=C\CC=O Amb18641621 [2,0,0,0,0,0|1,0,0]=3 947 B7R0.3 C\C(\C=O)=C/CC=C Amb18123725 [2,0,0,0,0,0|1,0,0]=3 948 B7R0.3 C\C(\C=O)=C/CCBr Amb25783964 [2,0,0,0,0,0|1,0,1]=4 949 B7R0.3 C\C(\CO)=C\CC=C Amb24363586 [2,0,0,0,0,0|1,0,1]=4 950 B7R0.3 C\C=C(/C)\CCC=O Amb18641710 [2,0,0,0,0,0|1,0,1]=4 951 B7R0.3 C\C=C(\C)/C=C/C=O Amb24483010 [2,0,0,0,0,0|1,0,1]=4 952 B7R0.3 C\C=C(\C)/C=CC=O Amb24585180 [2,0,0,0,0,0|1,0,1]=4 953 B7R0.3 C\C=C(\C)/CCC=O Amb24425599 [2,0,0,0,0,0|1,0,1]=4 954 B7R0.3 C\C=C\C=C(/C)\C=O Amb25311292 [2,0,0,0,0,0|1,0,1]=4 955 B7R0.3 C\C=C\C=C(\C)/C=O Amb18124218 [2,0,0,0,0,0|1,0,1]=4 956 B7R0.3 O=CC(Cl)=CCC=O Amb24745897 [2,0,0,0,0,0|1,0,0]=3 957 B7R0.3 O=CCCC(=O)C=O Amb25024665 [2,0,0,0,0,0|1,0,1]=4 958 B7R0.3 O=C\C=C/C(=O)C=O Amb25743044 [2,0,0,0,0,0|1,0,1]=4 959 B7R0.3 OCC\C=C(/Br)\C=O Amb25289253 [2,0,0,0,0,0|1,0,1]=4 960 B7R0.3 OCC\C=C(\Cl)/C=O Amb24598291 [2,0,0,0,0,0|1,0,1]=4 961 B7R0.3 OCC\C=C(\F)/C=O Amb24714897 [2,0,0,0,0,0|1,0,1]=4 962 B7R0.3 O\C=C\C=C(/Br)\C=O Amb25690541 [2,0,0,0,0,0|1,0,1]=4 963 B7R0.3 O\C=C\C=C(/Cl)\C=O Amb25683477 [2,0,0,0,0,0|1,0,1]=4 964 B7R0.4 C#C\C=C\CC(O)=O Amb24409578 [2,0,0,0,0,0|1,0,1]=4 965 B7R0.4 C=CC\C=C\C(O)=O Amb18641681 [2,0,0,0,0,0|1,0,0]=3 966 B7R0.4 C=C\C=C\CC(N)=O Amb25848874 [2,0,0,0,0,0|2,0,0]=4 967 B7R0.4 CC(=C)C\C=C\C=O Amb18640955 [2,0,0,0,0,0|2,0,0]=4 968 B7R0.4 CC(=O)C\C=C\C=C Amb24711717 [2,0,0,0,0,0|2,0,0]=4 969 B7R0.4 CC(=O)C\C=C\CO Amb24583096 [2,0,0,0,0,0|1,0,1]=4 970 B7R0.4 CC(=O)N\C=C\C=O Amb18124245 [2,0,0,0,0,0|2,0,0]=4 971 B7R0.4 CC(=O)O\C=C\C=O Amb25237598 [2,0,0,0,0,0|2,0,0]=4 972 B7R0.4 CC(=O)S\C=C\C=O Amb24668965 [2,0,0,0,0,0|2,0,0]=4 973 B7R0.4 CC(O)C\C=C\C=O Amb18641799 [2,0,0,0,0,0|1,0,1]=4 974 B7R0.4 CC=C=CCC(O)=O Amb25118481 [2,0,0,0,0,0|1,0,1]=4 975 B7R0.4 CNC\C=C\C(O)=O Amb25368293 [2,0,0,0,0,0|2,0,0]=4 976 B7R0.4 COC\C=C\C(O)=O Amb18296423 [2,0,0,0,0,0|2,0,0]=4 977 B7R0.4 CO\C=C\CC(O)=O Amb25174889 [2,0,0,0,0,0|2,0,0]=4 978 B7R0.4 CSC\C=C\C(O)=O Amb18291627 [2,0,0,0,0,0|2,0,0]=4 979 B7R0.4 C[C@@H](O)C\C=C\C=O Amb25310809 [2,0,0,0,0,0|1,0,1]=4 980 B7R0.4 C\C(\O)=C\C=C/C=O Amb25096071 [2,0,0,0,0,0|1,0,1]=4 981 B7R0.4 C\C(\O)=C\C=CC=O Amb24741180 [2,0,0,0,0,0|1,0,1]=4 982 B7R0.4 C\C=C\C=C\C(=O)O Amb17784698 [2,0,0,0,0,0|1,0,1]=4 983 B7R0.4 C\C=C\CCC(=O)O Amb10071500 [2,0,0,0,0,0|1,0,1]=4 984 B7R0.4 N#CC\C=C\C(O)=O Amb18123863 [2,0,0,0,0,0|1,0,1]=4 985 B7R0.4 N#C\C=C/CC(O)=O Amb18641630 [2,0,0,0,0,0|1,0,1]=4 986 B7R0.4 NCC\C=C\C(O)=O Amb25266868 [2,0,0,0,0,0|1,0,1]=4 987 B7R0.4 NC\C=C\CC(O)=O Amb18641825 [2,0,0,0,0,0|1,0,1]=4 988 B7R0.4 O=CCCCC(=O)O Amb17593198 [2,0,0,0,0,0|0,0,2]=4 989 B7R0.4 OC(=O)CCNC=O Amb18290434 [2,0,0,0,0,0|1,0,1]=4 990 B7R0.4 OC(=O)CC\C=C\Br Amb25238247 [2,0,0,0,0,0|1,0,1]=4 991 B7R0.4 OC(=O)CC\C=C\Cl Amb25803087 [2,0,0,0,0,0|1,0,1]=4 992 B7R0.4 OC(=O)CSCC=O Amb24628311 [2,0,0,0,0,0|1,0,1]=4 993 B7R0.4 OC(=O)CS\C=C/Cl Amb24693896 [2,0,0,0,0,0|2,0,0]=4 994 B7R0.4 OC(=O)CS\C=C\Cl Amb18125504 [2,0,0,0,0,0|2,0,0]=4 995 B7R0.4 OC(=O)C\C=C/CS Amb18124361 [2,0,0,0,0,0|0,1,1]=4 996 B7R0.4 OC(=O)C\C=C\C=C Amb17593152 [2,0,0,0,0,0|1,0,0]=3 997 B7R0.4 OC(=O)C\C=C\C=O Amb24437944 [2,0,0,0,0,0|0,0,0]=2 998 B7R0.4 OC(=O)C\C=C\CBr Amb18125611 [2,0,0,0,0,0|1,0,1]=4 999 B7R0.4 OC(=O)C\C=C\CCl Amb18124409 [2,0,0,0,0,0|1,0,1]=4 1000 B7R0.4 OC(=O)C\C=C\CS Amb24693621 [2,0,0,0,0,0|0,1,1]=4 1001 B7R0.4 OC(=O)\C=C\C=CCl Amb24562254 [2,0,0,0,0,0|1,0,1]=4 1002 B7R0.4 OC(=O)\C=C\CCBr Amb25702661 [2,0,0,0,0,0|1,0,1]=4 1003 B7R0.4 OCC\C=C\C(O)=O Amb21929352 [2,0,0,0,0,0|0,0,1]=3 1004 B7R0.5 C=C(CC=C)C(O)=O Amb18641687 [2,0,0,0,0,0|1,0,1]=4 1005 B7R0.5 C=C\C=C(/Cl)\C(O)=O Amb18642910 [2,0,0,0,0,0|1,0,1]=4 1006 B7R0.5 C=C\C=C(/F)\C(O)=O Amb24402288 [2,0,0,0,0,0|1,0,1]=4 1007 B7R0.5 C=C\C=C(\N)/C(O)=O Amb25306109 [2,0,0,0,0,0|1,0,1]=4 1008 B7R0.5 CC(=C=CC)C(O)=O Amb24481354 [2,0,0,0,0,0|1,0,1]=4 1009 B7R0.5 CC(=CC#N)C(O)=O Amb24475374 [2,0,0,0,0,0|1,0,1]=4 1010 B7R0.5 CC(=CC=O)C(C)=C Amb25254165 [2,0,0,0,0,0|2,0,0]=4 1011 B7R0.5 CC(=CC=O)C(N)=O Amb24548847 [2,0,0,0,0,0|1,0,0]=3 1012 B7R0.5 CC(=CCBr)C(O)=O Amb24551921 [2,0,0,0,0,0|1,0,0]=3 1013 B7R0.5 CC(=CCCl)C(O)=O Amb25114258 [2,0,0,0,0,0|1,0,0]=3 1014 B7R0.5 CC(=CCN)C(O)=O Amb25845292 [2,0,0,0,0,0|1,0,0]=3 1015 B7R0.5 CC(=CCO)C(O)=O Amb24730294 [2,0,0,0,0,0|0,0,0]=2 1016 B7R0.5 CC(=O)C(=O)CC=O Amb24524264 [2,0,0,0,0,0|2,0,0]=4 1017 B7R0.5 CC(=O)\C(\C)=C/C=O Amb18641685 [2,0,0,0,0,0|1,0,0]=3 1018 B7R0.5 CC(=O)\C(\C)=C\C=C Amb24518382 [2,0,0,0,0,0|1,0,1]=4 1019 B7R0.5 CC(C=NO)C(O)=O Amb24616398 [2,0,0,0,0,0|1,0,1]=4 1020 B7R0.5 CC(CC=O)C(C)=O Amb18641772 [2,0,0,0,0,0|1,0,1]=4 1021 B7R0.5 CC(CCO)C(O)=O Amb18641949 [2,0,0,0,0,0|0,0,2]=4 1022 B7R0.5 CC(O)C(C)=CCO Amb25144974 [2,0,0,0,0,0|1,0,1]=4 1023 B7R0.5 CC\C=C(\Br)/C(O)=O Amb18125610 [2,0,0,0,0,0|1,0,1]=4 1024 B7R0.5 CC\C=C(\F)/C(O)=O Amb25326985 [2,0,0,0,0,0|1,0,1]=4 1025 B7R0.5 CC\C=C(\N)/C(O)=O Amb24349496 [2,0,0,0,0,0|1,0,1]=4 1026 B7R0.5 C[C@@H](C(=O)O)CC=C Amb10844040 [2,0,0,0,0,0|1,0,1]=4 1027 B7R0.5 C[C@@H](NC=O)C(O)=O Amb22746684 [2,0,0,0,0,0|1,0,1]=4 1028 B7R0.5 C[C@H](C(=O)O)CC=C Amb10844033 [2,0,0,0,0,0|1,0,1]=4 1029 B7R0.5 C[C@H](CCO)C(O)=O Amb24483065 [2,0,0,0,0,0|0,0,2]=4 1030 B7R0.5 C[C@H](NCO)C(O)=O Amb24401217 [2,0,0,0,0,0|1,0,1]=4 1031 B7R0.5 C\C(=C/C#C)\C(O)=O Amb24472639 [2,0,0,0,0,0|0,0,2]=4 1032 B7R0.5 C\C(=C/C=C)\C(O)=O Amb25258956 [2,0,0,0,0,0|0,0,1]=3 1033 B7R0.5 C\C(=C/CBr)\C(O)=O Amb24433947 [2,0,0,0,0,0|1,0,0]=3 1034 B7R0.5 C\C(=C/CC)\C(C)=O Amb25067970 [2,0,0,0,0,0|1,0,1]=4 1035 B7R0.5 C\C(=C/CCl)\C(O)=O Amb25844891 [2,0,0,0,0,0|1,0,0]=3 1036 B7R0.5 C\C(=C/CO)\C(C)=O Amb25188393 [2,0,0,0,0,0|1,0,0]=3 1037 B7R0.5 C\C(=C/CO)\C(O)=O Amb18641873 [2,0,0,0,0,0|0,0,0]=2 1038 B7R0.5 C\C(=C/OC)\C(O)=O Amb18641867 [2,0,0,0,0,0|1,0,1]=4 1039 B7R0.5 C\C(=C\CC)\C(C)=O Amb24575271 [2,0,0,0,0,0|1,0,1]=4 1040 B7R0.5 C\C(=C\CC)\C(N)=O Amb24706168 [2,0,0,0,0,0|1,0,1]=4 1041 B7R0.5 C\C=C\C(=O)C(O)=O Amb24568283 [2,0,0,0,0,0|2,0,0]=4 1042 B7R0.5 C\C=C\C(C)C(O)=O Amb18641786 [2,0,0,0,0,0|1,0,1]=4 1043 B7R0.5 C\C=C\[C@@H](C)C(O)=O Amb25719907 [2,0,0,0,0,0|1,0,1]=4 1044 B7R0.5 C\C=C\[C@H](C)C(O)=O Amb24481336 [2,0,0,0,0,0|1,0,1]=4 1045 B7R0.5 NC\C=C(/Br)\C(O)=O Amb24483175 [2,0,0,0,0,0|2,0,0]=4 1046 B7R0.5 NC\C=C(\Br)/C(O)=O Amb24627030 [2,0,0,0,0,0|2,0,0]=4 1047 B7R0.5 NC\C=C(\Cl)/C(O)=O Amb25231611 [2,0,0,0,0,0|2,0,0]=4 1048 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22746780 [2,0,0,0,0,0|1,0,1]=4 1049 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22748768 [2,0,0,0,0,0|1,0,1]=4 1050 B7R0.5 O=CCC(C(=O)O)N Amb16232081 [2,0,0,0,0,0|1,0,1]=4 1051 B7R0.5 O=CCN(C(=O)C)C Amb17080668 [2,0,0,0,0,0|2,0,0]=4 1052 B7R0.5 O=CNC(C(=O)O)C Amb1144629 [2,0,0,0,0,0|1,0,1]=4 1053 B7R0.5 OC(=O)C(=O)CCO Amb25677024 [2,0,0,0,0,0|1,0,1]=4 1054 B7R0.5 OC(=O)C(=O)\C=C\O Amb24699120 [2,0,0,0,0,0|1,0,0]=3 1055 B7R0.5 OC(=O)C(Cl)=CCBr Amb24621021 [2,0,0,0,0,0|2,0,0]=4 1056 B7R0.5 OC(=O)C(Cl)=CCCl Amb25836746 [2,0,0,0,0,0|2,0,0]=4 1057 B7R0.5 OC(=O)C(O)=CC=O Amb25339531 [2,0,0,0,0,0|1,0,0]=3 1058 B7R0.5 OC(=O)\C(\Br)=C/CO Amb24692651 [2,0,0,0,0,0|1,0,0]=3 1059 B7R0.5 OC(=O)\C(\Br)=C\C=O Amb25242509 [2,0,0,0,0,0|1,0,0]=3 1060 B7R0.5 OC(=O)\C(\Cl)=C/CO Amb24598039 [2,0,0,0,0,0|1,0,0]=3 1061 B7R0.5 OC(=O)\C(\F)=C/CO Amb25737076 [2,0,0,0,0,0|1,0,0]=3 1062 B7R0.5 OC(=O)\C(\O)=C\C=O Amb25082413 [2,0,0,0,0,0|1,0,0]=3 1063 B7R0.5 OC(CC=O)C(O)=O Amb25225249 [2,0,0,0,0,0|1,0,1]=4 1064 B7R0.6 C=C(Br)CCC(O)=O Amb18648212 [2,0,0,0,0,0|1,0,1]=4 1065 B7R0.6 C=C(Cl)CCC(O)=O Amb18642971 [2,0,0,0,0,0|1,0,1]=4 1066 B7R0.6 C=C(F)CCC(O)=O Amb25141041 [2,0,0,0,0,0|1,0,1]=4 1067 B7R0.6 CC(=C)CCC(=O)Cl Amb24640436 [2,0,0,0,0,0|1,0,1]=4 1068 B7R0.6 CC(=C)CCC(O)=O Amb18641793 [2,0,0,0,0,0|0,0,1]=3 1069 B7R0.6 CC(=C)\C=C\C(=O)O Amb17593153 [2,0,0,0,0,0|0,0,1]=3 1070 B7R0.6 CC(=C)\C=C\C(N)=O Amb25259797 [2,0,0,0,0,0|1,0,1]=4 1071 B7R0.6 CC(=CCC(=O)C)C Amb17593170 [2,0,0,0,0,0|1,0,1]=4 1072 B7R0.6 CC(=N)SCC(O)=O Amb25704672 [2,0,0,0,0,0|2,0,0]=4 1073 B7R0.6 CC(=O)C=CC(C)=O Amb22346013 [2,0,0,0,0,0|1,0,1]=4 1074 B7R0.6 CC(=O)CCC(=O)Cl Amb17142859 [2,0,0,0,0,0|1,0,1]=4 1075 B7R0.6 CC(=O)CCC(=O)N Amb17142854 [2,0,0,0,0,0|1,0,1]=4 1076 B7R0.6 CC(=O)CCC([O-])=O Amb22350071 [2,0,0,0,0,0|0,0,2]=4 1077 B7R0.6 CC(=O)CCP(O)=O Amb24647699 [2,0,0,0,0,0|1,0,1]=4 1078 B7R0.6 CC(=O)CSC(C)=C Amb25809979 [2,0,0,0,0,0|2,0,0]=4 1079 B7R0.6 CC(=O)NCC(=O)N Amb17231824 [2,0,0,0,0,0|2,0,0]=4 1080 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [2,0,0,0,0,0|1,0,0]=3 1081 B7R0.6 CC(=O)OCC(=O)Br Amb25032214 [2,0,0,0,0,0|2,0,0]=4 1082 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [2,0,0,0,0,0|1,0,0]=3 1083 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [2,0,0,0,0,0|2,0,0]=4 1084 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [2,0,0,0,0,0|2,0,0]=4 1085 B7R0.6 CC(=O)SCC(=O)O Amb17607669 [2,0,0,0,0,0|1,0,0]=3 1086 B7R0.6 CC(=O)SCC(C)=O Amb25131248 [2,0,0,0,0,0|2,0,0]=4 1087 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [2,0,0,0,0,0|2,0,0]=4 1088 B7R0.6 CC(=O)\C=C/C(C)=O Amb24551133 [2,0,0,0,0,0|1,0,1]=4 1089 B7R0.6 CC(=O)\C=C/C(O)=O Amb24662475 [2,0,0,0,0,0|0,0,1]=3 1090 B7R0.6 CC(=O)\C=C\C(=O)Cl Amb24643241 [2,0,0,0,0,0|1,0,1]=4 1091 B7R0.6 CC(=O)\C=C\C(C)=C Amb25232835 [2,0,0,0,0,0|1,0,1]=4 1092 B7R0.6 CC(=O)\C=C\C(N)=O Amb24516266 [2,0,0,0,0,0|1,0,1]=4 1093 B7R0.6 CC(=S)NCC(O)=O Amb24325138 [2,0,0,0,0,0|1,1,0]=4 1094 B7R0.6 CC(C)=CCC([O-])=O Amb22491058 [2,0,0,0,0,0|0,0,2]=4 1095 B7R0.6 CC(C)=NCC(O)=O Amb24481383 [2,0,0,0,0,0|1,0,1]=4 1096 B7R0.6 CC(Cl)=CCC(N)=O Amb25324975 [2,0,0,0,0,0|2,0,0]=4 1097 B7R0.6 CC(O)CCC(O)=O Amb18294804 [2,0,0,0,0,0|0,0,2]=4 1098 B7R0.6 CC(O)NCC(O)=O Amb25141558 [2,0,0,0,0,0|1,0,1]=4 1099 B7R0.6 CC(O)\C=C\C(O)=O Amb18641876 [2,0,0,0,0,0|0,0,2]=4 1100 B7R0.6 CS(=O)CCC(O)=O Amb18523762 [2,0,0,0,0,0|1,0,1]=4 1101 B7R0.6 CS(=O)NCC(O)=O Amb25237322 [2,0,0,0,0,0|2,0,0]=4 1102 B7R0.6 CS(=O)\C=C\C(O)=O Amb18642965 [2,0,0,0,0,0|1,0,1]=4 1103 B7R0.6 NC(=O)NCC(=O)O Amb16205895 [2,0,0,0,0,0|2,0,0]=4 1104 B7R0.6 NC(=O)OCC(O)=O Amb25777061 [2,0,0,0,0,0|2,0,0]=4 1105 B7R0.6 NC(=O)SCC(O)=O Amb24640543 [2,0,0,0,0,0|2,0,0]=4 1106 B7R0.6 OC(=O)C=CC(O)=O Amb22487311 [2,0,0,0,0,0|1,0,1]=4 1107 B7R0.6 OC(=O)C=CC(O)=O Amb22487315 [2,0,0,0,0,0|1,0,1]=4 1108 B7R0.6 OC(=O)CC=C(Cl)Cl Amb17593875 [2,0,0,0,0,0|2,0,0]=4 1109 B7R0.6 OC(=O)CC=C(F)F Amb25127059 [2,0,0,0,0,0|2,0,0]=4 1110 B7R0.6 OC(=O)CCC(=O)Cl Amb17593468 [2,0,0,0,0,0|1,0,1]=4 1111 B7R0.6 OC(=O)CCC(O)=O Amb22168124 [2,0,0,0,0,0|1,0,1]=4 1112 B7R0.6 OC(=O)CCC(O)=O Amb22349196 [2,0,0,0,0,0|1,0,1]=4 1113 B7R0.6 OC(=O)CCC(O)=O Amb22353352 [2,0,0,0,0,0|1,0,1]=4 1114 B7R0.6 OC(=O)CCC(O)=O Amb22360649 [2,0,0,0,0,0|1,0,1]=4 1115 B7R0.6 OC(=O)CNC(=O)Cl Amb25277149 [2,0,0,0,0,0|2,0,0]=4 1116 B7R0.6 OC(=O)C[13CH2][13C](O)=O Amb22353421 [2,0,0,0,0,0|1,0,1]=4 1117 B7R0.6 OC(=O)C\C=C(\F)/Cl Amb24599232 [2,0,0,0,0,0|2,0,0]=4 1118 B7R0.6 OC(=O)SCC(O)=O Amb24699018 [2,0,0,0,0,0|2,0,0]=4 1119 B7R0.6 OC(=O)[13CH2][13CH2]C(O)=O Amb22338081 [2,0,0,0,0,0|1,0,1]=4 1120 B7R0.6 OC(=O)[14CH2][14CH2]C(O)=O Amb22337597 [2,0,0,0,0,0|1,0,1]=4 1121 B7R0.6 OC(=O)\C=C/C(O)=O Amb22274309 [2,0,0,0,0,0|1,0,1]=4 1122 B7R0.6 OC(=O)\C=C/C(O)=O Amb22350132 [2,0,0,0,0,0|1,0,1]=4 1123 B7R0.6 OC(=O)\C=C\C(=O)O Amb10072561 [2,0,0,0,0,0|1,0,1]=4 1124 B7R0.6 OC(=O)\C=C\C(O)=O Amb22336584 [2,0,0,0,0,0|1,0,1]=4 1125 B7R0.6 OC(=O)\C=C\C(O)=O Amb22352586 [2,0,0,0,0,0|1,0,1]=4 1126 B7R0.6 OC(=O)\C=C\C(O)=O Amb22353441 [2,0,0,0,0,0|1,0,1]=4 1127 B7R0.6 OC(=O)\C=C\C(O)=O Amb22353537 [2,0,0,0,0,0|1,0,1]=4 1128 B7R0.6 OC(=O)\C=C\C(O)=O Amb22360655 [2,0,0,0,0,0|1,0,1]=4 1129 B7R0.6 OC(=O)\[13CH]=[13CH]\C(O)=O Amb22363150 [2,0,0,0,0,0|1,0,1]=4 1130 B7R0.6 OC(=O)\[14CH]=[14CH]/C(O)=O Amb22352435 [2,0,0,0,0,0|1,0,1]=4 1131 B7R0.6 OC(=S)CCC(O)=O Amb24586272 [2,0,0,0,0,0|1,0,1]=4 1132 B7R0.6 O[13C](=O)CC[13C](O)=O Amb22056173 [2,0,0,0,0,0|1,0,1]=4 1133 B7R0.6 O[13C](=O)[13CH2][13CH2][13C](O)=O Amb22056172 [2,0,0,0,0,0|1,0,1]=4 1134 B7R0.6 O[13C](=O)\[13CH]=[13CH]\[13C](O)=O Amb22055283 [2,0,0,0,0,0|1,0,1]=4 1135 B7R0.6 O[14C](=O)CC[14C](O)=O Amb22352661 [2,0,0,0,0,0|1,0,1]=4 1136 B7R0.6 [13CH3][13C](=O)[13CH2]CC(O)=O Amb22056002 [2,0,0,0,0,0|0,0,1]=3 1137 B7R0.6 [O-]C(=O)CCC(O)=O Amb22730137 [2,0,0,0,0,0|1,0,1]=4 1138 B7R0.6 [O-]C(=O)CCC(O)=O Amb22733837 [2,0,0,0,0,0|1,0,1]=4 1139 B7R0.6 [O-]C(=O)\C=C/C(O)=O Amb22168115 [2,0,0,0,0,0|1,0,1]=4 1140 B7R0.6 [O-]C(=O)\C=C\C(O)=O Amb22043387 [2,0,0,0,0,0|1,0,1]=4 1141 B7R0.6 [O-]C(=O)\C=C\C(O)=O Amb22734231 [2,0,0,0,0,0|1,0,1]=4 1142 B9R0.6 CC(C(C)CC=O)C(O)=O Amb18644133 [1,1,0,0,0,0|0,0,2]=4 1143 B9R0.6 C\C(\C(O)=O)=C(/Br)\COC Amb18130266 [1,1,0,0,0,0|2,0,0]=4 1144 B9R0.6 C\C(\C(O)=O)=C(\C)/CC=C Amb25239368 [1,1,0,0,0,0|1,0,0]=3 1145 B9R0.8 CC(=CCNO)C(=O)OC Amb24662668 [1,1,0,0,0,0|1,0,0]=3 1146 B9R0.8 COC(=O)C(=O)CCC=O Amb25699822 [1,1,0,0,0,0|1,0,1]=4 1147 B9R0.8 COC(=O)C(C)CCC=O Amb18644132 [1,1,0,0,0,0|0,0,2]=4 1148 B9R0.8 COC(=O)C(C)\C=C\C=O Amb18643813 [1,1,0,0,0,0|0,0,2]=4 1149 B9R0.8 C\C(=C/CC=O)\C(=O)CC Amb18124576 [1,1,0,0,0,0|1,0,0]=3 1150 B9R0.8 C\C(=C/CC=O)\C(=O)OC Amb18643814 [1,1,0,0,0,0|0,0,0]=2 1151 B9R0.8 C\C(=C/CCC)\C(=O)CO Amb25713633 [1,1,0,0,0,0|1,0,1]=4 1152 B9R0.8 C\C(=C\CNC)\C(=O)OC Amb24437828 [1,1,0,0,0,0|2,0,0]=4 1153 B9R0.8 C\C(=C\COC)\C(=O)OC Amb24719499 [1,1,0,0,0,0|2,0,0]=4 1154 B9R0.13 CCC(=CCNC)C(O)=O Amb25221722 [1,1,0,0,0,0|2,0,0]=4 1155 B9R0.13 CCC(=CCOC)C(O)=O Amb24410279 [1,1,0,0,0,0|2,0,0]=4 1156 B9R0.13 CCC(=CCON)C(O)=O Amb24663693 [1,1,0,0,0,0|2,0,0]=4 1157 B9R0.13 CCC\C=C(/CC)\C(O)=O Amb25228438 [1,1,0,0,0,0|1,0,1]=4 1158 B9R0.13 C\C=C(\OCC=C)/C(O)=O Amb25312247 [1,1,0,0,0,0|2,0,0]=4 1159 B9R0.13 C\C=C\C=C(/CC)\C(O)=O Amb18643598 [1,1,0,0,0,0|1,0,1]=4 1160 B9R0.42 CC(CC(C)C=O)C(O)=O Amb18644134 [1,1,0,0,0,0|0,0,2]=4 1161 B9R0.42 C\C(=C/C(C)CC)\C(O)=O Amb18643945 [1,1,0,0,0,0|1,0,1]=4 1162 B9R0.42 C\C=C(/C)\C=C(/C)\C(O)=O Amb24746728 [1,1,0,0,0,0|1,0,1]=4 1163 B9R0.47 CC(=C=CCCC)C(O)=O Amb24409524 [1,1,0,0,0,0|1,0,1]=4 1164 B9R0.47 CC(=CCCC#C)C(O)=O Amb25230847 [1,1,0,0,0,0|1,0,1]=4 1165 B9R0.47 CC(=O)\C(\C)=C/C=C\C=O Amb24480509 [1,1,0,0,0,0|1,0,1]=4 1166 B9R0.47 CC(=O)\C(\C)=C\CCC=C Amb24575983 [1,1,0,0,0,0|2,0,0]=4 1167 B9R0.47 CC(CCOC=O)C(O)=O Amb18644245 [1,1,0,0,0,0|0,0,2]=4 1168 B9R0.47 CC(\C=C\CC=C)C(O)=O Amb25070915 [1,1,0,0,0,0|1,0,1]=4 1169 B9R0.47 C\C(=C/CCC#C)\C(O)=O Amb24746703 [1,1,0,0,0,0|1,0,1]=4 1170 B9R0.47 C\C(=C/CCC#N)\C(O)=O Amb25339471 [1,1,0,0,0,0|1,0,1]=4 1171 B9R0.47 C\C(=C/CCC=C)\C(O)=O Amb18124587 [1,1,0,0,0,0|1,0,0]=3 1172 B9R0.47 C\C(=C/CCCC)\C(O)=O Amb18643947 [1,1,0,0,0,0|1,0,1]=4 1173 B9R0.47 C\C(=C/CCCCl)\C(O)=O Amb24462748 [1,1,0,0,0,0|1,0,1]=4 1174 B9R0.47 C\C(=C\C=CC#C)\C(O)=O Amb25245334 [1,1,0,0,0,0|1,0,1]=4 1175 B9R0.47 C\C(=C\C=CCO)\C(O)=O Amb25174910 [1,1,0,0,0,0|0,0,1]=3 1176 B9R0.47 C\C(=C\CCC=C)\C(O)=O Amb24585718 [1,1,0,0,0,0|1,0,0]=3 1177 B9R0.47 N\C(=C\C=CC=O)\C(O)=O Amb25175066 [1,1,0,0,0,0|1,0,1]=4 1178 B9R0.47 N\C(=C\C=C\C=O)\C(O)=O Amb24657315 [1,1,0,0,0,0|1,0,1]=4 1179 B9R0.47 OC(=O)C(=O)CCCC=O Amb25789953 [1,1,0,0,0,0|1,0,1]=4 1180 B9R0.47 OC(=O)C(=O)C\C=C\C=O Amb18643789 [1,1,0,0,0,0|1,0,1]=4 1181 B9R0.47 OC(=O)\C(\Cl)=C\SCCO Amb25256124 [1,1,0,0,0,0|1,0,1]=4 1182 B9R0.47 OC(=O)\C(\O)=C/C=C/C=O Amb25208968 [1,1,0,0,0,0|1,0,1]=4 1183 B9R0.47 OC(=O)\C(\O)=C\C=C\C=O Amb18643785 [1,1,0,0,0,0|1,0,1]=4 1184 B9R0.23 CC(=CO)C(N)=NC(N)=O Amb25132240 [1,1,0,0,0,0|2,0,0]=4 1185 B9R0.23 CC(=O)CC(=O)\C(\C)=C\C Amb25370650 [1,1,0,0,0,0|2,0,0]=4 1186 B9R0.23 CC(CC(O)=O)N(C)C=O Amb24670439 [1,1,0,0,0,0|1,0,1]=4 1187 B9R0.23 C\C(=C/C)\C(N)CC(O)=O Amb24377592 [1,1,0,0,0,0|1,0,1]=4 1188 B9R0.23 C\C(=C/C)\C(O)CC(O)=O Amb18644100 [1,1,0,0,0,0|1,0,1]=4 1189 B9R0.23 C\C(=C/N)\C(N)CC(O)=O Amb25761855 [1,1,0,0,0,0|1,0,1]=4 1190 B9R0.23 C\C=C(\C)/C(/C)=C\C(O)=O Amb25132096 [1,1,0,0,0,0|1,0,1]=4 1191 B9R0.24 COC(=O)CCC(C)C=O Amb18644121 [1,1,0,0,0,0|0,0,2]=4 1192 B9R0.24 COC(=O)CC[C@@H](C)C=O Amb25104821 [1,1,0,0,0,0|0,0,2]=4 1193 B9R0.24 C\C(\C=O)=C/CC(=O)OC Amb18643828 [1,1,0,0,0,0|0,0,0]=2 1194 B9R0.24 C\C(\C=O)=C/OC(=O)OC Amb25799337 [1,1,0,0,0,0|1,0,0]=3 1195 B9R0.24 C\C(\C=O)=C\CC(=O)OC Amb24655988 [1,1,0,0,0,0|0,0,0]=2 1196 B9R0.24 C\C(\C=O)=C\NC(=O)OC Amb24730546 [1,1,0,0,0,0|1,0,0]=3 1197 B9R0.43 CC(=O)CC\C(\C=O)=C\C Amb18643605 [1,1,0,0,0,0|1,0,1]=4 1198 B9R0.43 CCC(CC)=CCC(O)=O Amb24358562 [1,1,0,0,0,0|1,0,1]=4 1199 B9R0.43 CCC(CCC(O)=O)=CC Amb24480728 [1,1,0,0,0,0|1,0,1]=4 1200 B9R0.43 CCC(CCC(O)=O)C=O Amb25378745 [1,1,0,0,0,0|0,0,2]=4 1201 B9R0.43 CCN(CCC(O)=O)C=O Amb19010092 [1,1,0,0,0,0|1,0,1]=4 1202 B9R0.43 C\C=C(/CC)\C=C\C(O)=O Amb18643591 [1,1,0,0,0,0|1,0,1]=4 1203 B9R0.43 NCC(CCC(O)=O)=NO Amb24591142 [1,1,0,0,0,0|1,0,1]=4 1204 B9R0.48 C=CC\C(\Cl)=C/CC(O)=O Amb18645428 [1,1,0,0,0,0|2,0,0]=4 1205 B9R0.48 CC(=O)CN\C(\C)=C/C=O Amb18643711 [1,1,0,0,0,0|2,0,0]=4 1206 B9R0.48 CC(=O)\C=C/C(/C)=C\C=O Amb25739204 [1,1,0,0,0,0|1,0,1]=4 1207 B9R0.48 CC(CC#N)=CCC(O)=O Amb24480771 [1,1,0,0,0,0|1,0,1]=4 1208 B9R0.48 CC(CCC(C)=O)=CCO Amb24656003 [1,1,0,0,0,0|1,0,1]=4 1209 B9R0.48 CC(CCC(O)=O)=CC#C Amb24629994 [1,1,0,0,0,0|1,0,1]=4 1210 B9R0.48 CC(CCC(O)=O)=CC#N Amb25069291 [1,1,0,0,0,0|1,0,1]=4 1211 B9R0.48 CC(CCC(O)=O)NC=O Amb24602293 [1,1,0,0,0,0|0,0,2]=4 1212 B9R0.48 CC(CSC)=CCC(O)=O Amb25238257 [1,1,0,0,0,0|0,1,1]=4 1213 B9R0.48 C[C@@H](CC=O)CCC(O)=O Amb24505022 [1,1,0,0,0,0|0,0,2]=4 1214 B9R0.48 C\C(=C\CCl)\C=CC(O)=O Amb25339708 [1,1,0,0,0,0|1,0,1]=4 1215 B9R0.48 C\C(=C\CCl)\C=C\C(O)=O Amb24480556 [1,1,0,0,0,0|1,0,1]=4 1216 B9R0.48 C\C(\C=CC(O)=O)=C\CC Amb24562528 [1,1,0,0,0,0|1,0,1]=4 1217 B9R0.48 C\C(\C=C\C(O)=O)=C/CC Amb18643546 [1,1,0,0,0,0|1,0,1]=4 1218 B9R0.48 C\C(\CC=C)=C\CC(O)=O Amb24707088 [1,1,0,0,0,0|1,0,0]=3 1219 B9R0.48 C\C(\CCC(C)=O)=C/CO Amb25142674 [1,1,0,0,0,0|1,0,1]=4 1220 B9R0.48 C\C(\CCC(C)=O)=C\CO Amb25172142 [1,1,0,0,0,0|1,0,1]=4 1221 B9R0.48 C\C(\CCC(O)=O)=C/C#C Amb24460669 [1,1,0,0,0,0|1,0,1]=4 1222 B9R0.48 C\C(\CCC(O)=O)=C/CO Amb25694396 [1,1,0,0,0,0|0,0,1]=3 1223 B9R0.48 C\C(\CCC(O)=O)=C\SC Amb24520805 [1,1,0,0,0,0|0,1,1]=4 1224 B9R0.48 C\C(\CSC)=C\CC(O)=O Amb18126246 [1,1,0,0,0,0|0,1,1]=4 1225 B9R0.48 O/N=C/C(=O)CCC(O)=O Amb17689278 [1,1,0,0,0,0|1,0,1]=4 1226 B9R0.48 OC(=O)CCC(=O)CC=O Amb18644074 [1,1,0,0,0,0|1,0,1]=4 1227 B9R0.48 OC(=O)\C=C\C(=O)CC=O Amb18643788 [1,1,0,0,0,0|1,0,1]=4 1228 B9R0.48 OC(=O)\C=C\C(=O)\C=N\O Amb24524635 [1,1,0,0,0,0|1,0,1]=4 1229 B9R0.48 OC(=O)\C=C\C(\O)=C\C=O Amb24469239 [1,1,0,0,0,0|1,0,1]=4 1230 B9R0.64 CC(C)(CCC(O)=O)C=O Amb18644118 [1,1,0,0,0,0|0,0,2]=4 1231 B9R0.64 CC(C)(\C=C\C(O)=O)C=O Amb18643830 [1,1,0,0,0,0|0,0,2]=4 1232 B9R0.1 C=CC(=O)N\C=C\C(O)=O Amb24649046 [1,1,0,0,0,0|2,0,0]=4 1233 B9R0.1 CC(=C)C\C=C\C(=O)OC Amb24657689 [1,1,0,0,0,0|2,0,0]=4 1234 B9R0.1 CC(=C)\C=C\CC(=O)OC Amb24712606 [1,1,0,0,0,0|2,0,0]=4 1235 B9R0.1 CC(=O)C\C=C\C(=O)OC Amb24670506 [1,1,0,0,0,0|1,0,0]=3 1236 B9R0.1 CC(=O)\C=C\CC(=O)OC Amb25205440 [1,1,0,0,0,0|1,0,0]=3 1237 B9R0.1 CC(=O)\C=C\NC(=O)OC Amb25288496 [1,1,0,0,0,0|2,0,0]=4 1238 B9R0.1 CC(=O)\C=N\CC(=O)OC Amb25094290 [1,1,0,0,0,0|2,0,0]=4 1239 B9R0.1 CC(C=O)=CNCC(O)=O Amb25255566 [1,1,0,0,0,0|2,0,0]=4 1240 B9R0.1 CNC(=O)N\C=C\C(O)=O Amb22960481 [1,1,0,0,0,0|2,0,0]=4 1241 B9R0.1 COC(=O)C=C=CC(O)=O Amb25694013 [1,1,0,0,0,0|0,0,2]=4 1242 B9R0.1 COC(=O)COCC(O)=O Amb25305044 [1,1,0,0,0,0|1,0,1]=4 1243 B9R0.1 COC(=O)C\C=C\C(O)=O Amb25132100 [1,1,0,0,0,0|0,0,0]=2 1244 B9R0.1 COC(=O)NN=CC(O)=O Amb24427251 [1,1,0,0,0,0|2,0,0]=4 1245 B9R0.1 COC(=O)NNCC(O)=O Amb25317249 [1,1,0,0,0,0|2,0,0]=4 1246 B9R0.1 COC(=O)N\C=C/C(O)=O Amb25104759 [1,1,0,0,0,0|1,0,0]=3 1247 B9R0.1 COC(=O)N\C=C\C(N)=O Amb25222616 [1,1,0,0,0,0|2,0,0]=4 1248 B9R0.1 COC(=O)N\C=C\C(O)=O Amb24550444 [1,1,0,0,0,0|1,0,0]=3 1249 B9R0.1 COC(=O)\C=C/NC(N)=O Amb24624664 [1,1,0,0,0,0|2,0,0]=4 1250 B9R0.1 COC(=O)\C=C\CC(C)O Amb24396746 [1,1,0,0,0,0|1,0,1]=4 1251 B9R0.1 COC(=S)S\C=C\C(O)=O Amb24443125 [1,1,0,0,0,0|1,1,0]=4 1252 B9R0.1 CO[13C](=O)CCC[13C](=O)O Amb17618084 [1,1,0,0,0,0|0,0,2]=4 1253 B9R0.1 C\C(\C=O)=C/NCC(O)=O Amb25339921 [1,1,0,0,0,0|2,0,0]=4 1254 B9R0.1 C\C(\CO)=C/C=C/C(O)=O Amb24410692 [1,1,0,0,0,0|1,0,1]=4 1255 B9R0.1 NCC(=O)N\C=C\C(O)=O Amb24357725 [1,1,0,0,0,0|2,0,0]=4 1256 B9R0.1 OC(=O)CCNC(=O)CO Amb24478846 [1,1,0,0,0,0|1,0,1]=4 1257 B9R0.1 OC(=O)CN\C=C(/O)\C=O Amb25147598 [1,1,0,0,0,0|1,0,0]=3 1258 B9R0.1 OC(=O)\C=C\C=C(/Cl)\C=O Amb25060734 [1,1,0,0,0,0|1,0,1]=4 1259 B9R0.53 C=C(CC(O)=O)CC(O)=O Amb18644057 [1,1,0,0,0,0|0,0,1]=3 1260 B9R0.53 CC(=CC(O)=O)NC(N)=O Amb25314556 [1,1,0,0,0,0|2,0,0]=4 1261 B9R0.53 CC(=O)C=C(C)CC(C)=O Amb24740174 [1,1,0,0,0,0|2,0,0]=4 1262 B9R0.53 CC(=O)C=C(O)CC(C)=O Amb24609551 [1,1,0,0,0,0|2,0,0]=4 1263 B9R0.53 CC(=O)CC(=O)C=C(C)O Amb24647936 [1,1,0,0,0,0|2,0,0]=4 1264 B9R0.53 CC(=O)CC(=O)CC(O)=O Amb18644062 [1,1,0,0,0,0|1,0,1]=4 1265 B9R0.53 CC(=O)CC(=O)\C=C(\C)/O Amb25146890 [1,1,0,0,0,0|2,0,0]=4 1266 B9R0.53 CC(=O)C\C(\C)=C\C(O)=O Amb25833580 [1,1,0,0,0,0|1,0,0]=3 1267 B9R0.53 CC(=O)NC(=O)CC(O)=O Amb24671240 [1,1,0,0,0,0|2,0,0]=4 1268 B9R0.53 CC(=O)\C=C(/C)\CC(C)=O Amb24647875 [1,1,0,0,0,0|2,0,0]=4 1269 B9R0.53 CC(=O)\C=C(/C)\CC(O)=O Amb25838743 [1,1,0,0,0,0|1,0,0]=3 1270 B9R0.53 CC(=O)\C=C(\C)/CC(C)=O Amb25719264 [1,1,0,0,0,0|2,0,0]=4 1271 B9R0.53 CC(=O)\C=C(\C)/CC(O)=O Amb24446679 [1,1,0,0,0,0|1,0,0]=3 1272 B9R0.53 CC(C)=CC(=C)CC(O)=O Amb25799390 [1,1,0,0,0,0|2,0,0]=4 1273 B9R0.53 CC(CC(O)=O)=CC(O)=O Amb24556420 [1,1,0,0,0,0|0,0,0]=2 1274 B9R0.53 CN(CC(=O)O)CC(=O)O Amb1156001 [1,1,0,0,0,0|1,0,1]=4 1275 B9R0.53 C\C(\O)=C\C(\O)=C/C(O)=O Amb22730578 [1,1,0,0,0,0|1,0,1]=4 1276 B9R0.53 N=C(CC(O)=O)CC(O)=O Amb25703517 [1,1,0,0,0,0|0,0,1]=3 1277 B9R0.53 NC(CC(=O)O)CC(=O)O Amb16184013 [1,1,0,0,0,0|0,0,2]=4 1278 B9R0.53 OC(=O)C=C(Br)CC(O)=O Amb24573499 [1,1,0,0,0,0|0,0,0]=2 1279 B9R0.53 OC(=O)CC(Cl)CC(O)=O Amb18126464 [1,1,0,0,0,0|0,0,2]=4 1280 B9R0.53 OC(=O)CN(Br)CC(O)=O Amb25277216 [1,1,0,0,0,0|1,0,1]=4 1281 B9R0.53 OC(=O)CN(Cl)CC(O)=O Amb24482142 [1,1,0,0,0,0|1,0,1]=4 1282 B9R0.53 OC(=O)\C=C(/Br)\CC(O)=O Amb25123824 [1,1,0,0,0,0|0,0,0]=2 1283 B9R0.53 OC(CC(=O)O)CC(=O)O Amb17615401 [1,1,0,0,0,0|0,0,2]=4 1284 B9R0.53 ON(CC(O)=O)CC(O)=O Amb25062474 [1,1,0,0,0,0|1,0,1]=4 1285 B9R0.53 [NH3+]N(CC(O)=O)CC(O)=O Amb23453377 [1,1,0,0,0,0|1,0,1]=4 1286 B9R0.53 [NH3+]N(CC(O)=O)CC(O)=O Amb24121533 [1,1,0,0,0,0|1,0,1]=4 1287 B9R0.56 CC(C)(O)C\C=C\C(O)=O Amb18644104 [1,1,0,0,0,0|1,0,1]=4 1288 B9R0.56 OC(=O)\C=C\CP(O)(O)=O Amb24482251 [1,1,0,0,0,0|1,0,0]=3 1289 B9R0.56 OC(=O)\C=C\CS(O)(=O)=O Amb25185208 [1,1,0,0,0,0|1,0,0]=3 1290 B9R0.10 CC(CC(O)=O)P(C)(O)=O Amb25059136 [0,1,0,0,1,0|1,0,1]=4 1291 B9R0.10 CN(CC(O)=O)P(O)(O)=O Amb24651000 [0,1,0,0,1,0|2,0,0]=4 1292 B9R0.10 C[C@H](CC(O)=O)S(O)(=O)=O Amb25210783 [0,1,0,0,1,0|1,0,1]=4 1293 B9R0.11 CC(=O)C(C)(Br)CC(O)=O Amb24682759 [0,1,0,0,1,0|1,0,1]=4 1294 B9R0.11 CC(=O)C(C)(O)CC(O)=O Amb25733298 [0,1,0,0,1,0|1,0,1]=4 1295 B9R0.11 CC(=O)CC(C)(C)C(O)=O Amb18644092 [0,1,0,0,1,0|1,0,1]=4 1296 B9R0.11 CC(C)(CC(=O)Cl)C(O)=O Amb25211275 [0,1,0,0,1,0|1,0,1]=4 1297 B9R0.11 CC(C)(CC(N)=O)C(O)=O Amb24721912 [0,1,0,0,1,0|1,0,1]=4 1298 B9R0.11 CC(Cl)(CC(O)=O)C(O)=O Amb18126463 [0,1,0,0,1,0|0,0,1]=3 1299 B9R0.11 CC(N)(CC(O)=O)C(O)=O Amb22800383 [0,1,0,0,1,0|0,0,1]=3 1300 B9R0.11 CC(N)(CC(O)=O)P(O)=O Amb25701546 [0,1,0,0,1,0|1,0,1]=4 1301 B9R0.11 CC(O)(CC(N)=O)C(O)=O Amb24744548 [0,1,0,0,1,0|1,0,1]=4 1302 B9R0.11 CC(O)(CC(O)=O)C(N)=O Amb24669300 [0,1,0,0,1,0|1,0,1]=4 1303 B9R0.11 CC(O)(CC(O)=O)C(O)=O Amb22352645 [0,1,0,0,1,0|0,0,1]=3 1304 B9R0.11 CC(S)(CC(O)=O)C(O)=O Amb25053889 [0,1,0,0,1,0|0,0,1]=3 1305 B9R0.11 C[C@@](N)(CC(N)=O)C(O)=O Amb22225025 [0,1,0,0,1,0|1,0,1]=4 1306 B9R0.11 C[C@@](O)(CC(O)=O)C(O)=O Amb22336254 [0,1,0,0,1,0|0,0,1]=3 1307 B9R0.11 NC(N)(CC(O)=O)C(O)=O Amb24460545 [0,1,0,0,1,0|1,0,1]=4 1308 B9R0.11 OC(=O)C(O)(F)CC(O)=O Amb25798979 [0,1,0,0,1,0|1,0,1]=4 1309 B9R0.11 OC(=O)C(S)(S)CC(O)=O Amb22230560 [0,1,0,0,1,0|1,0,1]=4 1310 B9R0.11 OC(=O)CC(C(=O)O)(N)C Amb10807406 [0,1,0,0,1,0|0,0,1]=3 1311 B9R0.11 OC(=O)CC(C(=O)O)(O)O Amb16232015 [0,1,0,0,1,0|1,0,1]=4 1312 B9R0.11 OC(=O)C[C@@](C(=O)O)(N)C Amb10601663 [0,1,0,0,1,0|0,0,1]=3 1313 B9R0.11 OC(=O)C[C@](C(=O)O)(N)C Amb10601664 [0,1,0,0,1,0|0,0,1]=3 1314 B9R0.11 OC(=O)C[C@](C(=O)O)(N)C Amb17608152 [0,1,0,0,1,0|0,0,1]=3 1315 B9R0.39 C=NC(CC(O)=O)C(O)=O Amb24350770 [0,1,0,0,1,0|0,0,2]=4 1316 B9R0.39 CC(=O)C(=CC(C)=O)SC Amb24602999 [0,1,0,0,1,0|2,0,0]=4 1317 B9R0.39 CC(=O)C(CC(O)=O)CC Amb24410015 [0,1,0,0,1,0|1,0,1]=4 1318 B9R0.39 CC(=O)C(CC(O)=O)NC Amb18611382 [0,1,0,0,1,0|1,0,1]=4 1319 B9R0.39 CC(=O)CC(CC)C(O)=O Amb18644109 [0,1,0,0,1,0|1,0,1]=4 1320 B9R0.39 CC(=O)CC(NC)C(O)=O Amb25690263 [0,1,0,0,1,0|1,0,1]=4 1321 B9R0.39 CC(=O)N\C(=C/C)\C(O)=O Amb24669908 [0,1,0,0,1,0|2,0,0]=4 1322 B9R0.39 CC(=O)\C(=C\C(C)=O)\SC Amb25713608 [0,1,0,0,1,0|2,0,0]=4 1323 B9R0.39 CCC(=CC(N)=O)C(N)=O Amb24514933 [0,1,0,0,1,0|2,0,0]=4 1324 B9R0.39 CCC(=CC(O)=O)C(C)O Amb24568884 [0,1,0,0,1,0|1,0,1]=4 1325 B9R0.39 CCC(C(=O)O)CC(=O)O Amb10071696 [0,1,0,0,1,0|0,0,1]=3 1326 B9R0.39 CCC(CC(O)=O)=C(F)F Amb24482233 [0,1,0,0,1,0|2,0,0]=4 1327 B9R0.39 CCC(CP(O)=O)C(O)=O Amb24482481 [0,1,0,0,1,0|1,0,1]=4 1328 B9R0.39 CCN(C(=O)C)CC(=O)O Amb17399887 [0,1,0,0,1,0|2,0,0]=4 1329 B9R0.39 CCN(CC(O)=O)C(N)=O Amb18999255 [0,1,0,0,1,0|2,0,0]=4 1330 B9R0.39 CC[C@H](CC(O)=O)C(O)=O Amb24643194 [0,1,0,0,1,0|0,0,1]=3 1331 B9R0.39 CC\C(=C/C(O)=O)\C(O)=O Amb18644060 [0,1,0,0,1,0|0,0,0]=2 1332 B9R0.39 CC\C(=C\C(O)=O)\C(C)O Amb24654751 [0,1,0,0,1,0|1,0,1]=4 1333 B9R0.39 CNC(C(=O)O)CC(=O)O Amb1905634 [0,1,0,0,1,0|0,0,1]=3 1334 B9R0.39 CNC(CC(N)=O)C(O)=O Amb18644255 [0,1,0,0,1,0|1,0,1]=4 1335 B9R0.39 CNC(CS(O)=O)C(O)=O Amb25765774 [0,1,0,0,1,0|1,0,1]=4 1336 B9R0.39 CN[C@@H](CC(O)=O)C(O)=O Amb22748003 [0,1,0,0,1,0|0,0,1]=3 1337 B9R0.39 CN[C@@H](CS(O)=O)C(O)=O Amb24482415 [0,1,0,0,1,0|1,0,1]=4 1338 B9R0.39 COC(=CC(O)=O)C(O)=O Amb24615646 [0,1,0,0,1,0|0,0,0]=2 1339 B9R0.39 COC(CC(O)=O)C(N)=O Amb23536075 [0,1,0,0,1,0|1,0,1]=4 1340 B9R0.39 COC(CC(O)=O)C(O)=O Amb18124863 [0,1,0,0,1,0|0,0,1]=3 1341 B9R0.39 CON(CC(O)=O)C(N)=O Amb24359859 [0,1,0,0,1,0|2,0,0]=4 1342 B9R0.39 CO[C@@H](CC(O)=O)C(O)=O Amb25122107 [0,1,0,0,1,0|0,0,1]=3 1343 B9R0.39 CO\C(=C/C(O)=O)\C(O)=O Amb24480750 [0,1,0,0,1,0|0,0,0]=2 1344 B9R0.39 CO\C(=C\C(N)=O)\C(N)=O Amb25147503 [0,1,0,0,1,0|2,0,0]=4 1345 B9R0.39 CSC(CC(N)=O)C(O)=O Amb25694730 [0,1,0,0,1,0|1,0,1]=4 1346 B9R0.39 CSC(CC(O)=O)C(O)=O Amb18646024 [0,1,0,0,1,0|0,0,1]=3 1347 B9R0.39 CS[C@@H](CC(O)=O)C(O)=O Amb25191487 [0,1,0,0,1,0|0,0,1]=3 1348 B9R0.39 CS[C@H](CC(N)=O)C(O)=O Amb25101496 [0,1,0,0,1,0|1,0,1]=4 1349 B9R0.39 CS[C@H](CC(O)=O)C(O)=O Amb24423669 [0,1,0,0,1,0|0,0,1]=3 1350 B9R0.39 C\C=C(\CC(O)=O)/C(O)=O Amb25292254 [0,1,0,0,1,0|0,0,0]=2 1351 B9R0.39 N#CC(CC(O)=O)C(O)=O Amb24434922 [0,1,0,0,1,0|0,0,2]=4 1352 B9R0.39 NCC(CC(O)=O)C(O)=O Amb22546423 [0,1,0,0,1,0|0,0,1]=3 1353 B9R0.39 NCC(CC(O)=O)C(O)=O Amb24538047 [0,1,0,0,1,0|0,0,1]=3 1354 B9R0.39 NC[C@H](CC(O)=O)C(O)=O Amb25147272 [0,1,0,0,1,0|0,0,1]=3 1355 B9R0.39 NN[C@@H](CC(O)=O)C(O)=O Amb24117193 [0,1,0,0,1,0|1,0,1]=4 1356 B9R0.39 OC(=O)C(CBr)CC(O)=O Amb22752144 [0,1,0,0,1,0|0,0,1]=3 1357 B9R0.39 OC(=O)C(CC(O)=O)=CBr Amb25225990 [0,1,0,0,1,0|0,0,1]=3 1358 B9R0.39 OC(=O)C(CC(O)=O)=CCl Amb25321956 [0,1,0,0,1,0|0,0,1]=3 1359 B9R0.39 OC(=O)C(CC(O)=O)C=O Amb24732382 [0,1,0,0,1,0|0,0,2]=4 1360 B9R0.39 OC(=O)C(CC(O)=O)NO Amb24685872 [0,1,0,0,1,0|1,0,1]=4 1361 B9R0.39 OC(=O)C(CC(O)=O)NS Amb25808901 [0,1,0,0,1,0|1,0,1]=4 1362 B9R0.39 OC(=O)C(CCl)CC(O)=O Amb25840030 [0,1,0,0,1,0|0,0,1]=3 1363 B9R0.39 OC(=O)[C@H](CC(O)=O)NO Amb24117497 [0,1,0,0,1,0|1,0,1]=4 1364 B9R0.39 OC(=O)[C@H](CC(O)=O)NO Amb24630025 [0,1,0,0,1,0|1,0,1]=4 1365 B9R0.39 OC(=O)\C(=C/C(O)=O)\C=O Amb24568885 [0,1,0,0,1,0|0,0,1]=3 1366 B9R0.39 OC(=O)\C(=C\C(O)=O)\C=O Amb18644051 [0,1,0,0,1,0|0,0,1]=3 1367 B9R0.39 OC(=O)\C(\CBr)=C/C(O)=O Amb24477098 [0,1,0,0,1,0|0,0,0]=2 1368 B9R0.39 OC(=O)\C(\CC(O)=O)=C\Br Amb25758898 [0,1,0,0,1,0|0,0,1]=3 1369 B9R0.39 OC(=O)\C(\CC(O)=O)=N\O Amb24117074 [0,1,0,0,1,0|1,0,0]=3 1370 B9R0.39 OCC(CC(O)=O)C(O)=O Amb24629722 [0,1,0,0,1,0|0,0,1]=3 1371 B9R0.57 CC(=CP(O)(O)=O)C(O)=O Amb24677590 [0,1,0,0,1,0|1,0,0]=3 1372 B9R0.57 CC(=O)C(C)=CP(C)(O)=O Amb24511929 [0,1,0,0,1,0|2,0,0]=4 1373 B9R0.57 CC(CS(O)(=O)=O)C(O)=O Amb25101588 [0,1,0,0,1,0|1,0,1]=4 1374 B9R0.57 C\C(=C/P(O)(O)=O)\C(O)=O Amb25774905 [0,1,0,0,1,0|1,0,0]=3 1375 B9R0.57 OC(=O)C(=C)CP(O)(O)=O Amb17785031 [0,1,0,0,1,0|1,0,1]=4 1376 B9R0.57 OC(=O)C(=O)CP(=O)(O)O Amb17619389 [0,1,0,0,1,0|2,0,0]=4 1377 B9R0.79 C=C(C(N)C(O)=O)C(N)=O Amb25316245 [0,1,0,0,1,0|1,0,1]=4 1378 B9R0.79 C=C(C(N)C(O)=O)C(O)=O Amb18644186 [0,1,0,0,1,0|0,0,1]=3 1379 B9R0.79 C=C(C(O)=O)C(=C)C(O)=O Amb18643786 [0,1,0,0,1,0|0,0,1]=3 1380 B9R0.79 C=C(C(O)C(O)=O)C(O)=O Amb20671613 [0,1,0,0,1,0|0,0,1]=3 1381 B9R0.79 CC(=O)C(=C)C(O)C(O)=O Amb24563821 [0,1,0,0,1,0|1,0,1]=4 1382 B9R0.79 CC(=O)C(C)=C(C)C(O)=O Amb25273854 [0,1,0,0,1,0|1,0,0]=3 1383 B9R0.79 CC(=O)C(C)C(C)C(O)=O Amb24401092 [0,1,0,0,1,0|1,0,1]=4 1384 B9R0.79 CC(=O)C(C)C(N)C(O)=O Amb18202116 [0,1,0,0,1,0|1,0,1]=4 1385 B9R0.79 CC(=O)C(C)C(O)C(O)=O Amb25341155 [0,1,0,0,1,0|1,0,1]=4 1386 B9R0.79 CC(=O)C(O)C(C)C(O)=O Amb25255327 [0,1,0,0,1,0|1,0,1]=4 1387 B9R0.79 CC(=O)N(C)C(=C)C(O)=O Amb24117538 [0,1,0,0,1,0|2,0,0]=4 1388 B9R0.79 CC(=O)N(C)C(C)C(O)=O Amb18288022 [0,1,0,0,1,0|2,0,0]=4 1389 B9R0.79 CC(=O)N(C)[C@@H](C)C(O)=O Amb25709201 [0,1,0,0,1,0|2,0,0]=4 1390 B9R0.79 CC(=O)[C@@H](C)[C@H](C)C(O)=O Amb25771163 [0,1,0,0,1,0|1,0,1]=4 1391 B9R0.79 CC(=O)[C@@H](C)[C@H](N)C(O)=O Amb25703453 [0,1,0,0,1,0|1,0,1]=4 1392 B9R0.79 CC(=O)[C@@H](O)[C@H](C)C(O)=O Amb25077192 [0,1,0,0,1,0|1,0,1]=4 1393 B9R0.79 CC(=O)[C@H](C)[C@H](C)C(O)=O Amb25805859 [0,1,0,0,1,0|1,0,1]=4 1394 B9R0.79 CC(=O)[C@H](C)[C@H](O)C(O)=O Amb24376865 [0,1,0,0,1,0|1,0,1]=4 1395 B9R0.79 CC(C(=C)C(O)=O)C(O)=O Amb18644063 [0,1,0,0,1,0|0,0,1]=3 1396 B9R0.79 CC(C(O)=O)=C(C)C(O)=O Amb24712245 [0,1,0,0,1,0|0,0,0]=2 1397 B9R0.79 CC(C(O)=O)N(C)C(N)=O Amb18962712 [0,1,0,0,1,0|2,0,0]=4 1398 B9R0.79 CC(C(O)C(N)=O)C(O)=O Amb25728281 [0,1,0,0,1,0|1,0,1]=4 1399 B9R0.79 CC([C@@H](N)C(O)=O)C(O)=O Amb22745450 [0,1,0,0,1,0|0,0,1]=3 1400 B9R0.79 C[C@@H]([C@@H](C)C(O)=O)C(O)=O Amb22801175 [0,1,0,0,1,0|0,0,1]=3 1401 B9R0.79 C[C@@H]([C@H](N)C(O)=O)C(O)=O Amb22756698 [0,1,0,0,1,0|0,0,1]=3 1402 B9R0.79 C[C@H](C(=C)C(O)=O)C(O)=O Amb24480380 [0,1,0,0,1,0|0,0,1]=3 1403 B9R0.79 C[C@H]([C@@H](C)C(O)=O)C(N)=O Amb25113911 [0,1,0,0,1,0|1,0,1]=4 1404 B9R0.79 C[C@H]([C@H](Cl)C(O)=O)C(O)=O Amb25684803 [0,1,0,0,1,0|0,0,1]=3 1405 B9R0.79 C[C@H]([C@H](N)C(O)=O)C(O)=O Amb25324829 [0,1,0,0,1,0|0,0,1]=3 1406 B9R0.79 C\C(\C(N)=O)=C(/C)\C(N)=O Amb24584917 [0,1,0,0,1,0|2,0,0]=4 1407 B9R0.79 C\C(\C(N)=O)=C(\C)/C(O)=O Amb24479070 [0,1,0,0,1,0|1,0,0]=3 1408 B9R0.79 C\C(\C(O)=O)=C(/C)\C(O)=O Amb18644072 [0,1,0,0,1,0|0,0,0]=2 1409 B9R0.79 C\C(\C(O)=O)=C(\C)/C(O)=O Amb24308873 [0,1,0,0,1,0|0,0,0]=2 1410 B9R0.79 NC(=O)C(F)=C(F)C(O)=O Amb24571693 [0,1,0,0,1,0|2,0,0]=4 1411 B9R0.79 NC(=O)\C(\F)=C(\F)/C(O)=O Amb24634118 [0,1,0,0,1,0|2,0,0]=4 1412 B9R0.79 NC(C(Br)C(O)=O)C(O)=O Amb18657078 [0,1,0,0,1,0|1,0,1]=4 1413 B9R0.79 NC(C(Cl)C(O)=O)C(O)=O Amb18126453 [0,1,0,0,1,0|1,0,1]=4 1414 B9R0.79 NC(C(F)C(O)=O)C(O)=O Amb24061061 [0,1,0,0,1,0|1,0,1]=4 1415 B9R0.79 NC(C(N)C(O)=O)C(O)=O Amb18124865 [0,1,0,0,1,0|1,0,1]=4 1416 B9R0.79 NC(C(N)C(O)=O)C(O)=O Amb24117894 [0,1,0,0,1,0|1,0,1]=4 1417 B9R0.79 NC(C(O)=O)=C(N)C(O)=O Amb25349480 [0,1,0,0,1,0|1,0,0]=3 1418 B9R0.79 NC([C@H](O)C(O)=O)C(O)=O Amb24513602 [0,1,0,0,1,0|1,0,1]=4 1419 B9R0.79 N[C@@H](C(O)C(O)=O)C(O)=O Amb22229324 [0,1,0,0,1,0|1,0,1]=4 1420 B9R0.79 N[C@@H]([C@@H](O)C(O)=O)C(O)=O Amb24087715 [0,1,0,0,1,0|1,0,1]=4 1421 B9R0.79 N[C@@H]([C@@H](O)C(O)=O)C(O)=O Amb24117974 [0,1,0,0,1,0|1,0,1]=4 1422 B9R0.79 N[C@H]([C@@H](C(=O)O)N)C(=O)O Amb10072362 [0,1,0,0,1,0|1,0,1]=4 1423 B9R0.79 N[C@H]([C@@H](F)C(O)=O)C(O)=O Amb22229006 [0,1,0,0,1,0|1,0,1]=4 1424 B9R0.79 N[C@H]([C@@H](N)C(O)=O)C(O)=O Amb22802394 [0,1,0,0,1,0|1,0,1]=4 1425 B9R0.79 N[C@H]([C@@H](O)C(O)=O)C(O)=O Amb17942870 [0,1,0,0,1,0|1,0,1]=4 1426 B9R0.79 N[C@H]([C@H](F)C(O)=O)C(O)=O Amb24634454 [0,1,0,0,1,0|1,0,1]=4 1427 B9R0.79 N\C(\C(O)=O)=C(/N)\C(O)=O Amb24578776 [0,1,0,0,1,0|1,0,0]=3 1428 B9R0.79 OC(=O)C(=O)C(=O)C(O)=O Amb22234966 [0,1,0,0,1,0|1,0,0]=3 1429 B9R0.79 OC(=O)C(C(C(=O)O)C)Cl Amb17594150 [0,1,0,0,1,0|0,0,1]=3 1430 B9R0.79 OC(=O)C(C(C(=O)O)C)N Amb2099482 [0,1,0,0,1,0|0,0,1]=3 1431 B9R0.79 OC(=O)C(C(C(=O)O)C)O Amb17593680 [0,1,0,0,1,0|0,0,1]=3 1432 B9R0.79 OC(=O)C(C(C(=O)O)O)Cl Amb17594225 [0,1,0,0,1,0|1,0,1]=4 1433 B9R0.79 OC(=O)C(C(C(=O)O)O)O Amb16224824 [0,1,0,0,1,0|1,0,1]=4 1434 B9R0.79 OC(=O)C(C(C(=O)O)O)O Amb2553366 [0,1,0,0,1,0|1,0,1]=4 1435 B9R0.79 OC(=O)C(C(C(=O)O)O)O Amb2553386 [0,1,0,0,1,0|1,0,1]=4 1436 B9R0.79 OC(=O)C(Cl)=C(Cl)C(O)=O Amb25173036 [0,1,0,0,1,0|1,0,0]=3 1437 B9R0.79 OC(=O)C(F)C(Br)C(O)=O Amb24759132 [0,1,0,0,1,0|1,0,1]=4 1438 B9R0.79 OC(=O)C(F)C(F)C(O)=O Amb24482465 [0,1,0,0,1,0|1,0,1]=4 1439 B9R0.79 OC(=O)C(O)C(O)C(O)=O Amb22732623 [0,1,0,0,1,0|1,0,1]=4 1440 B9R0.79 OC(=O)C(O)C(O)C(O)=O Amb22747860 [0,1,0,0,1,0|1,0,1]=4 1441 B9R0.79 OC(=O)C(O)C(O)C(O)=O Amb22904195 [0,1,0,0,1,0|1,0,1]=4 1442 B9R0.79 OC(=O)C(O)C(O)C(O)=O Amb24107517 [0,1,0,0,1,0|1,0,1]=4 1443 B9R0.79 OC(=O)C(O)C(O)C(O)=O Amb24668916 [0,1,0,0,1,0|1,0,1]=4 1444 B9R0.79 OC(=O)[C@@H](Cl)[C@@H](Cl)C(O)=O Amb25146239 [0,1,0,0,1,0|1,0,1]=4 1445 B9R0.79 OC(=O)[C@@H](F)[C@H](Cl)C(O)=O Amb25061294 [0,1,0,0,1,0|1,0,1]=4 1446 B9R0.79 OC(=O)[C@@H](O)[C@@H](O)C(O)=O Amb22230832 [0,1,0,0,1,0|1,0,1]=4 1447 B9R0.79 OC(=O)[C@@H](O)[C@H](O)C(O)=O Amb19884028 [0,1,0,0,1,0|1,0,1]=4 1448 B9R0.79 OC(=O)[C@@H](O)[C@H](O)C(O)=O Amb22224835 [0,1,0,0,1,0|1,0,1]=4 1449 B9R0.79 OC(=O)[C@@H](O)[C@H](O)C(O)=O Amb22750609 [0,1,0,0,1,0|1,0,1]=4 1450 B9R0.79 OC(=O)[C@@H](O)[C@H](O)C(O)=O Amb22756774 [0,1,0,0,1,0|1,0,1]=4 1451 B9R0.79 OC(=O)[C@@H](O)[C@H](O)C(O)=O Amb22800414 [0,1,0,0,1,0|1,0,1]=4 1452 B9R0.79 OC(=O)[C@@H](O)[C@H](O)C(O)=O Amb22801138 [0,1,0,0,1,0|1,0,1]=4 1453 B9R0.79 OC(=O)[C@@H](O)[C@H](O)C(O)=O Amb22801799 [0,1,0,0,1,0|1,0,1]=4 1454 B9R0.79 OC(=O)[C@H](C(C(=O)O)C)N Amb16232531 [0,1,0,0,1,0|0,0,1]=3 1455 B9R0.79 OC(=O)[C@H](Cl)[C@@H](Cl)C(O)=O Amb24390367 [0,1,0,0,1,0|1,0,1]=4 1456 B9R0.79 OC(=O)[C@H](F)[C@H](Cl)C(O)=O Amb25774512 [0,1,0,0,1,0|1,0,1]=4 1457 B9R0.79 OC(=O)[C@H](O)[C@@H](O)C(O)=O Amb19884026 [0,1,0,0,1,0|1,0,1]=4 1458 B9R0.79 OC(=O)[C@H](O)[C@@H](O)C(O)=O Amb20240604 [0,1,0,0,1,0|1,0,1]=4 1459 B9R0.79 OC(=O)[C@H](O)[C@@H](O)C(O)=O Amb20670711 [0,1,0,0,1,0|1,0,1]=4 1460 B9R0.79 OC(=O)[C@H](S)[C@@H](S)C(O)=O Amb25374645 [0,1,0,0,1,0|1,0,1]=4 1461 B9R0.79 OC(=O)[C@H]([C@@H](C(=O)O)N)O Amb17615140 [0,1,0,0,1,0|1,0,1]=4 1462 B9R0.79 OC(=O)[C@H]([C@@H](C(=O)O)O)O Amb10604195 [0,1,0,0,1,0|1,0,1]=4 1463 B9R0.79 OC(=O)\C(\Br)=C(\Br)/C(O)=O Amb22347940 [0,1,0,0,1,0|1,0,0]=3 1464 B9R0.79 OC(=O)\C(\Cl)=C(\Cl)/C(O)=O Amb18522185 [0,1,0,0,1,0|1,0,0]=3 1465 B9R0.79 OC(=O)\C(\F)=C(\Cl)/C(O)=O Amb24711227 [0,1,0,0,1,0|1,0,0]=3 1466 B9R0.79 OC(=O)\C(\O)=C(/O)\C(O)=O Amb18511532 [0,1,0,0,1,0|1,0,0]=3 1467 B9R0.79 OC(C(F)C(O)=O)C(O)=O Amb24479232 [0,1,0,0,1,0|1,0,1]=4 1468 B9R0.79 OC(C(S)C(O)=O)C(O)=O Amb25776261 [0,1,0,0,1,0|1,0,1]=4 1469 B9R0.79 O[C@@H]([C@@H](Cl)C(O)=O)C(O)=O Amb24524583 [0,1,0,0,1,0|1,0,1]=4 1470 B9R0.79 O[C@@H]([C@H](Br)C(O)=O)C(O)=O Amb24680321 [0,1,0,0,1,0|1,0,1]=4 1471 B9R0.79 O[C@@H]([C@H](F)C(O)=O)C(O)=O Amb24470062 [0,1,0,0,1,0|1,0,1]=4 1472 B9R0.79 O[C@H]([C@@H](Cl)C(O)=O)C(O)=O Amb24390265 [0,1,0,0,1,0|1,0,1]=4 1473 B9R0.79 O\C(=C(\C(=O)O)/O)\C(=O)O Amb17593679 [0,1,0,0,1,0|1,0,0]=3 1474 B9R0.79 [2H]\C(\C(O)=O)=C(\[2H])/C(O)=O Amb22338640 [0,1,0,0,1,0|1,0,0]=3 1475 B11R0.33 CC(=CC(Cl)=CC(O)=O)C(O)=O Amb24511932 [0,1,0,0,0,1|1,0,1]=4 1476 B11R0.33 CC(=CC(O)=CC(O)=O)C(O)=O Amb24650889 [0,1,0,0,0,1|1,0,1]=4 1477 B11R0.33 CC(=O)\C=C(\NC(C(=O)O)C)/C Amb2551165 [0,1,0,0,0,1|2,0,0]=4 1478 B11R0.33 C\C(=C\C(\Cl)=C/C(O)=O)\C(O)=O Amb24341553 [0,1,0,0,0,1|1,0,1]=4 1479 B11R0.33 C\C(=C\C(\O)=C/C(O)=O)\C(O)=O Amb25264416 [0,1,0,0,0,1|1,0,1]=4 1480 B11R0.33 C\C(\C=C(/C)\C(O)=O)=C/C(O)=O Amb18647287 [0,1,0,0,0,1|0,0,1]=3 1481 B11R0.33 C\C(\C=C(C)C(O)=O)=C\C(O)=O Amb25326636 [0,1,0,0,0,1|0,0,1]=3 1482 B11R0.33 OC(=O)\C=C(\Cl)/C=C(/Cl)\C(O)=O Amb25195923 [0,1,0,0,0,1|1,0,1]=4 1483 B11R0.33 OC(=O)\C=C(\F)/C=C(/F)\C(O)=O Amb24464897 [0,1,0,0,0,1|1,0,1]=4 1484 B11R0.149 CC(=CC(O)=O)C(=O)NC(N)=O Amb24540784 [0,1,0,0,0,1|2,0,0]=4 1485 B11R0.149 CC(=CC(O)=O)C(C)=CC(O)=O Amb24519271 [0,1,0,0,0,1|0,0,1]=3 1486 B11R0.149 C\C(=C/C(O)=O)\C(\C)=C\C(O)=O Amb24692716 [0,1,0,0,0,1|0,0,1]=3 1487 B11R0.149 C\C(=C\C(O)=O)\C(=O)NC(N)=O Amb25320881 [0,1,0,0,0,1|2,0,0]=4 1488 B11R0.173 CC(\C=C\C(O)=O)C(=O)C(O)=O Amb21858926 [0,1,0,0,0,1|0,0,2]=4 1489 B11R0.173 OC(=O)CCN(C(C(=O)O)C)C Amb17561090 [0,1,0,0,0,1|1,0,1]=4 1490 B11R0.173 OC(=O)\C=C/C(/Cl)=C(/Cl)\C(O)=O Amb24579461 [0,1,0,0,0,1|1,0,1]=4 1491 B11R0.232 CC(C)(CC(O)=O)CCC(O)=O Amb22357103 [0,1,0,0,0,1|0,0,2]=4 1492 B11R0.150 CC(=C\C=C(\C)/C(O)=O)C(O)=O Amb25210693 [0,1,0,0,0,1|0,0,1]=3 1493 B11R0.150 CC(CCC(=C)C(O)=O)C(O)=O Amb24065778 [0,1,0,0,0,1|0,0,2]=4 1494 B11R0.150 CC(CCC(C)C(O)=O)C(O)=O Amb18127177 [0,1,0,0,0,1|0,0,2]=4 1495 B11R0.150 CC(SSC(C)C(O)=O)C(O)=O Amb22731793 [0,1,0,0,0,1|1,0,1]=4 1496 B11R0.150 C\C(=C/C=C(\O)/C(O)=O)\C(O)=O Amb25261543 [0,1,0,0,0,1|0,0,1]=3 1497 B11R0.150 NC(CNC(=O)C(O)=O)C(O)=O Amb18647934 [0,1,0,0,0,1|1,0,1]=4 1498 B11R0.202 OC(=O)CCSC(C(=O)O)(C)C Amb17501236 [0,1,0,0,0,1|0,0,2]=4 1499 B11R0.168 CC(=CC(N)C(O)=O)P(O)(O)=O Amb24557166 [0,2,0,0,0,0|1,0,0]=3 1500 B11R0.168 C\C(=C/[C@@H](N)C(O)=O)\P(O)(O)=O Amb25798885 [0,2,0,0,0,0|1,0,0]=3 1501 B11R0.52 CC(=CC(O)=O)C(C)(C)C(O)=O Amb25858101 [0,2,0,0,0,0|0,0,2]=4 1502 B11R0.206 CC(=O)C(C)C(=O)\C(\C)=C(\C)/O Amb24690604 [0,2,0,0,0,0|2,0,0]=4 1503 B11R0.206 CC(C(O)=O)\C(\C)=C(/C)\C(O)=O Amb25173635 [0,2,0,0,0,0|0,0,0]=2 1504 B11R0.206 CC(\C(\C)=C(/C)\C(C)=O)C(C)=O Amb25729214 [0,2,0,0,0,0|2,0,0]=4 1505 B11R0.206 OC(C(O)=C(O)C(O)=O)C(O)=O Amb24366635 [0,2,0,0,0,0|1,0,0]=3 1506 B11R0.282 N#C\C(=C(/CC(=O)N)\N)\C(=O)O Amb16186063 [0,2,0,0,0,0|1,0,1]=4 1507 B11R0.282 N#C\C(=C(\CC(=O)N)/N)\C(=O)O Amb16230011 [0,2,0,0,0,0|1,0,1]=4 1508 B11R0.282 N\C(\CC(O)=O)=C(/C#N)\C(N)=O Amb18647108 [0,2,0,0,0,0|1,0,1]=4 1509 B11R0.308 CC(C(O)=O)=C(C)CC(C)(C)O Amb25377884 [0,2,0,0,0,0|1,0,1]=4 1510 B11R0.308 C\C(\C(O)=O)=C(/C)\CC(C)(C)O Amb25321023 [0,2,0,0,0,0|1,0,1]=4 1511 B11R0.335 OC(=O)CS(=O)(=O)C(C(=O)O)C Amb17501652 [0,2,0,0,0,0|1,0,1]=4 1512 B11R0.169 CC(C(=O)O)SC(C(=O)O)(C)C Amb17501629 [0,2,0,0,0,0|1,0,1]=4 1513 B11R0.169 CC(C)(C[C@@H](N)C(O)=O)C(O)=O Amb19131979 [0,2,0,0,0,0|0,0,2]=4 1514 B11R0.169 C\C(=C\C(C)(C)C(O)=O)\C(O)=O Amb24634289 [0,2,0,0,0,0|0,0,0]=2 1515 B11R0.201 COC(=O)CCC(C)(C)C(O)=O Amb18127171 [0,2,0,0,0,0|0,0,2]=4 1516 B11R0.59 CCOC(=O)C(/C)=C/OC(C)=O Amb17844072 [0,2,0,0,0,0|2,0,0]=4 1517 B11R0.117 CC(CC(C)C(=O)OC)C(O)=O Amb18647808 [0,2,0,0,0,0|0,0,2]=4 1518 B11R0.120 COC(=O)CNC(=O)C(=O)OC Amb2447278 [0,2,0,0,0,0|2,0,0]=4 1519 B11R0.120 COC(=O)[C@@H](C)CCC(=O)OC Amb22799425 [0,2,0,0,0,0|0,0,2]=4 1520 B11R0.120 COC(=O)\C=C\C(=O)C(=O)OC Amb10071761 [0,2,0,0,0,0|1,0,1]=4 1521 B11R0.28 CC(=O)C=C\C(\C(O)=O)=C(\C)/N Amb24485278 [0,2,0,0,0,0|1,0,1]=4 1522 B11R0.28 OC(=O)CCC(C(=O)O)C(C)C Amb10553099 [0,2,0,0,0,0|0,0,2]=4 1523 B11R0.146 CCCC(C(=O)O)CCC(=O)O Amb17619597 [0,2,0,0,0,0|0,0,2]=4 1524 B11R0.275 CCC(C(=O)O)SC(C(=O)O)C Amb17501326 [0,2,0,0,0,0|1,0,1]=4 1525 B9R1.6 OC(=O)C1=CCCNC1 Amb10608557 [1,0,0,1,0,0|1,0,1]=4 1526 B9R1.6 OC(=O)C1=CCNCC1 Amb10843904 [1,0,0,1,0,0|2,0,0]=4 1527 B9R1.6 OC(=O)C=1CC=CNC1 Amb25293556 [1,0,0,1,0,0|2,0,0]=4 1528 B9R1.6 OC(=O)C=1CCOCC1 Amb18642574 [1,0,0,1,0,0|2,0,0]=4 1529 B9R1.6 OC(=O)C=1CNC=CC1 Amb25823057 [1,0,0,1,0,0|1,0,1]=4 1530 B9R1.6 OC(=O)C=1COCCC1 Amb19958529 [1,0,0,1,0,0|0,0,1]=3 1531 B9R1.6 OC(=O)C=1CSCCC1 Amb19515066 [1,0,0,1,0,0|0,1,1]=4 1532 B9R1.23 CC1=CC(CCl)OC1=O Amb24340254 [1,0,0,1,0,0|1,0,1]=4 1533 B9R1.23 CC1=CC(CO)NC1=O Amb25799453 [1,0,0,1,0,0|1,0,1]=4 1534 B9R1.23 CC1=C[C@H](CO)NC1=O Amb24685779 [1,0,0,1,0,0|1,0,1]=4 1535 B9R1.23 CC1=C[C@H](CO)OC1=O Amb25357559 [1,0,0,1,0,0|0,0,1]=3 1536 B9R1.23 CC1=C\C(=C\Br)\OC1=O Amb25800206 [1,0,0,1,0,0|1,0,1]=4 1537 B9R1.23 CC1C[C@@H](C=O)OC1=O Amb24389171 [1,0,0,1,0,0|0,0,2]=4 1538 B9R1.23 C[C@H]1C[C@@H](C=O)OC1=O Amb24587323 [1,0,0,1,0,0|0,0,2]=4 1539 B9R1.23 Cc1cc(C=O)oc1Br Amb18187323 [1,0,0,1,0,0|1,0,1]=4 1540 B9R1.23 Cc1cc(C=O)oc1N Amb18832858 [1,0,0,1,0,0|1,0,1]=4 1541 B9R1.23 NC1=CC(CO)OC1=O Amb25275545 [1,0,0,1,0,0|1,0,1]=4 1542 B9R1.23 OC[C@@H]1C=C(Br)C(=O)O1 Amb25782292 [1,0,0,1,0,0|1,0,1]=4 1543 B9R1.23 OC[C@@H]1C=C(Cl)C(=O)O1 Amb25296371 [1,0,0,1,0,0|1,0,1]=4 1544 B9R1.35 C=C1CC(=CC1)C(O)=O Amb25093101 [1,0,0,1,0,0|1,0,0]=3 1545 B9R1.35 CC(=O)C=1CC(=O)NC1 Amb24669843 [1,0,0,1,0,0|2,0,0]=4 1546 B9R1.35 CC(=O)C=1CC(O)CC1 Amb25134091 [1,0,0,1,0,0|1,0,1]=4 1547 B9R1.35 CC1CC(=CC1)C(O)=O Amb18642398 [1,0,0,1,0,0|1,0,1]=4 1548 B9R1.35 CN1CC(=CC1)C(O)=O Amb25032089 [1,0,0,1,0,0|2,0,0]=4 1549 B9R1.35 NC1CC(=CC1)C(O)=O Amb18642495 [1,0,0,1,0,0|1,0,1]=4 1550 B9R1.35 N[C@@H]1CC(=CC1)C(O)=O Amb25143919 [1,0,0,1,0,0|1,0,1]=4 1551 B9R1.35 N[C@H]1CC(=CC1)C(O)=O Amb25824589 [1,0,0,1,0,0|1,0,1]=4 1552 B9R1.35 O=C1CCC(=C1)C(=O)O Amb13883804 [1,0,0,1,0,0|0,0,2]=4 1553 B9R1.35 OC(=O)C1=CNC(=O)N1 Amb18278248 [1,0,0,1,0,0|2,0,0]=4 1554 B9R1.35 OC(=O)C1CC(=O)CS1 Amb24061425 [1,0,0,1,0,0|1,0,1]=4 1555 B9R1.35 OC(=O)C=1CC(=O)NC1 Amb18832707 [1,0,0,1,0,0|1,0,0]=3 1556 B9R1.35 OC(=O)C=1CC(=O)NN1 Amb18278720 [1,0,0,1,0,0|2,0,0]=4 1557 B9R1.35 OC(=O)C=1CC(=O)ON1 Amb25700026 [1,0,0,1,0,0|2,0,0]=4 1558 B9R1.35 OC(=O)C=1CC(O)CN1 Amb25141429 [1,0,0,1,0,0|1,0,1]=4 1559 B9R1.35 OC(=O)C=1NC(=O)CN1 Amb24387402 [1,0,0,1,0,0|2,0,0]=4 1560 B9R1.35 OC(=O)[C@@H]1CC(=O)CC1 Amb22746923 [1,0,0,1,0,0|0,0,2]=4 1561 B9R1.35 OC(=O)[C@@H]1CC(=O)CN1 Amb19516117 [1,0,0,1,0,0|1,0,1]=4 1562 B9R1.35 OC(=O)[C@@H]1CC(=O)CN1 Amb22747440 [1,0,0,1,0,0|1,0,1]=4 1563 B9R1.35 OC(=O)[C@H]1CC(=O)CN1 Amb25360885 [1,0,0,1,0,0|1,0,1]=4 1564 B9R1.35 OC(=O)c1c[nH]c(=O)[nH]1 Amb1208380 [1,0,0,1,0,0|2,0,0]=4 1565 B9R1.35 OC(=O)c1c[nH]c(=O)[s]1 Amb24084921 [1,0,0,1,0,0|2,0,0]=4 1566 B9R1.35 Oc1[n]c(co1)C(O)=O Amb24481698 [1,0,0,1,0,0|2,0,0]=4 1567 B9R1.35 Oc1[n]cc(o1)C(O)=O Amb25178101 [1,0,0,1,0,0|2,0,0]=4 1568 B9R1.35 Oc1ccc(o1)C(O)=O Amb18946939 [1,0,0,1,0,0|1,0,1]=4 1569 B9R1.69 CC1=CC=C(O)NC1=O Amb24579203 [1,0,0,1,0,0|1,0,1]=4 1570 B9R1.69 CC1=CCC(=O)NC1=O Amb25087726 [1,0,0,1,0,0|1,0,0]=3 1571 B9R1.69 CC1=CCC(O)CC1=O Amb25298400 [1,0,0,1,0,0|1,0,1]=4 1572 B9R1.69 CC1=CNC(=O)NC1=O Amb18511887 [1,0,0,1,0,0|2,0,0]=4 1573 B9R1.69 CC1CCC(=O)OC1=O Amb24117247 [1,0,0,1,0,0|0,0,2]=4 1574 B9R1.69 CC1SCC(=O)OC1=O Amb2431035 [1,0,0,1,0,0|1,0,1]=4 1575 B9R1.69 Cc1c[n]c(O)cc1O Amb20247814 [1,0,0,1,0,0|2,0,0]=4 1576 B9R1.69 O=C1CCC(=O)OC1=O Amb24620117 [1,0,0,1,0,0|1,0,1]=4 1577 B9R1.69 O=C1OC(=O)NC=C1Cl Amb24388063 [1,0,0,1,0,0|2,0,0]=4 1578 B9R1.69 O=C1OC(=O)NC=C1F Amb24477770 [1,0,0,1,0,0|2,0,0]=4 1579 B9R1.69 OC1=CCC(=O)NC1=O Amb25859496 [1,0,0,1,0,0|2,0,0]=4 1580 B9R1.95 CCC1CC(=C1)C(O)=O Amb25238748 [1,0,0,1,0,0|1,0,1]=4 1581 B9R1.110 CC(C(O)=O)=C1CNC1 Amb25228912 [1,0,0,1,0,0|2,0,0]=4 1582 B9R1.1 O=C1C=CC(=CO1)C=O Amb18124299 [1,0,0,1,0,0|0,0,2]=4 1583 B9R1.1 O=C1CCC(=CC1)C=O Amb18642167 [1,0,0,1,0,0|1,0,0]=3 1584 B9R1.49 CC1=CCC(=O)NC=C1 Amb24477803 [1,0,0,1,0,0|2,0,0]=4 1585 B9R1.55 CN1CC(C1=O)C(=O)O Amb17593354 [1,0,0,1,0,0|1,0,1]=4 1586 B9R1.86 OC(=O)CN1CC1C=O Amb24078335 [1,0,0,1,0,0|1,0,1]=4 1587 B9R1.53 OC(=O)\C=C/1\CC(=O)N1 Amb25845188 [1,0,0,1,0,0|1,0,0]=3 1588 B9R1.161 CC(=O)N1C=C1C(O)=O Amb25285793 [1,0,0,1,0,0|2,0,0]=4 1589 B9R1.161 OC(=O)C1CC1C(=O)O Amb1350467 [1,0,0,1,0,0|0,0,2]=4 1590 B9R1.161 OC(=O)[C@@H]1C[C@H]1C(O)=O Amb22901897 [1,0,0,1,0,0|0,0,2]=4 1591 B9R1.161 OC(=O)[C@@H]1O[C@H]1C(O)=O Amb22799776 [1,0,0,1,0,0|1,0,1]=4 1592 B9R1.161 OC(=O)[C@H]1O[C@@H]1C(O)=O Amb22262951 [1,0,0,1,0,0|1,0,1]=4 1593 B9R1.152 CC(=O)[C@]1(C)CC(=O)O1 Amb24340260 [0,0,0,1,1,0|1,0,1]=4 1594 B9R1.152 CC1(CC(=O)C1)C(O)=O Amb22406208 [0,0,0,1,1,0|1,0,1]=4 1595 B11R1.20 CC(=O)CC=1CCC(=O)CC1 Amb24443642 [0,0,0,1,0,1|2,0,0]=4 1596 B11R1.20 OC(=O)CC=1CCC(=O)CC1 Amb25139696 [0,0,0,1,0,1|1,0,0]=3 1597 B11R1.74 CC1=CC(=CC(=O)N1)C(O)=O Amb18125515 [0,0,0,1,0,1|1,0,1]=4 1598 B11R1.74 CC1=CC(=NC(=O)N1)C(O)=O Amb18529631 [0,0,0,1,0,1|1,0,1]=4 1599 B11R1.74 CC1=CC(=O)OC(=C1)C(=O)Cl Amb25114186 [0,0,0,1,0,1|1,0,1]=4 1600 B11R1.74 CC1=CC(=O)OC(=C1)C(N)=O Amb19664809 [0,0,0,1,0,1|1,0,1]=4 1601 B11R1.74 CC1=CC(=O)OC(=C1)C(O)=O Amb18125634 [0,0,0,1,0,1|0,0,1]=3 1602 B11R1.74 CC1=CC(C=C(C)O1)C(O)=O Amb24548592 [0,0,0,1,0,1|2,0,0]=4 1603 B11R1.74 CC=1C=C(NC(=O)N1)C(O)=O Amb18529650 [0,0,0,1,0,1|1,0,1]=4 1604 B11R1.74 CC=1CC(CC(=O)C1)C(O)=O Amb18644614 [0,0,0,1,0,1|1,0,1]=4 1605 B11R1.74 Cc1cc([n]c(O)[n]1)C(O)=O Amb20623077 [0,0,0,1,0,1|1,0,1]=4 1606 B11R1.74 OC(=O)C1=CC(=O)CC(=O)O1 Amb25805348 [0,0,0,1,0,1|1,0,1]=4 1607 B11R1.74 OC(=O)C1=CC(F)=CC(=O)O1 Amb25337479 [0,0,0,1,0,1|1,0,1]=4 1608 B11R1.74 OC(=O)C1=CC(O)=CC(=O)O1 Amb18644775 [0,0,0,1,0,1|1,0,1]=4 1609 B11R1.75 OC(=O)CCC1CC(=O)OC1 Amb18644988 [0,0,0,1,0,1|0,0,2]=4 1610 B11R1.75 OC(=O)CCC1COC(=O)N1 Amb24358987 [0,0,0,1,0,1|0,0,2]=4 1611 B11R1.75 OC(=O)CSC1CC(=O)OC1 Amb25111201 [0,0,0,1,0,1|1,0,1]=4 1612 B11R1.75 OC(=O)\C=C/C1COC(=O)O1 Amb25858098 [0,0,0,1,0,1|0,0,2]=4 1613 B11R1.75 OC(=O)\C=C\C1COC(=O)O1 Amb24519254 [0,0,0,1,0,1|0,0,2]=4 1614 B11R1.108 C=C1CC(C1C(O)=O)C(O)=O Amb25109156 [0,0,0,1,0,1|0,0,2]=4 1615 B11R1.167 CC(=O)C1CC(=O)CC=C1C Amb25834426 [0,0,0,1,0,1|2,0,0]=4 1616 B11R1.167 CC1=CCC(=O)CC1C(O)=O Amb24677688 [0,0,0,1,0,1|1,0,0]=3 1617 B11R1.167 CC1=CCC(=O)C[C@@H]1C(O)=O Amb25772753 [0,0,0,1,0,1|1,0,0]=3 1618 B11R1.167 CC1=CCC(O)CC1C(O)=O Amb25241210 [0,0,0,1,0,1|1,0,1]=4 1619 B11R1.167 CC1=CNC(=O)C=C1C(O)=O Amb18201203 [0,0,0,1,0,1|2,0,0]=4 1620 B11R1.167 CC=1C=CC(=O)NC1C(O)=O Amb18125522 [0,0,0,1,0,1|1,0,1]=4 1621 B11R1.167 CC=1C=CC(=O)OC1C(O)=O Amb18125635 [0,0,0,1,0,1|0,0,1]=3 1622 B11R1.167 CC=1OCC(=O)NC1C(O)=O Amb25738432 [0,0,0,1,0,1|2,0,0]=4 1623 B11R1.167 OC(=O)C1=NC(=O)CC=C1Cl Amb22497440 [0,0,0,1,0,1|2,0,0]=4 1624 B11R1.167 Oc1ccc(c(n1)C(=O)O)C Amb17593822 [0,0,0,1,0,1|1,0,1]=4 1625 B11R1.645 CC/1=CC(=O)C\C1=C/C(O)=O Amb25298445 [0,0,0,1,0,1|1,0,1]=4 1626 B11R1.645 CC/1=CC(=O)O\C1=C/C(O)=O Amb25363276 [0,0,0,1,0,1|0,0,1]=3 1627 B11R1.645 CC1=CC(=O)OC1=CC(O)=O Amb24726303 [0,0,0,1,0,1|0,0,1]=3 1628 B11R1.645 CC1=CC(=O)OC1CC(O)=O Amb18125925 [0,0,0,1,0,1|0,0,1]=3 1629 B11R1.645 CC=1NC(=O)OC1CC(O)=O Amb18830674 [0,0,0,1,0,1|0,0,0]=2 1630 B11R1.645 CC=1NC(=O)SC1CC(O)=O Amb18041895 [0,0,0,1,0,1|0,1,0]=3 1631 B11R1.645 CC=1NC(=S)SC1CC(O)=O Amb18949300 [0,0,0,1,0,1|0,2,0]=4 1632 B11R1.645 C[C@H]1CC(=O)O[C@H]1CC(O)=O Amb25361027 [0,0,0,1,0,1|0,0,2]=4 1633 B11R1.645 Cc1[nH]c(C)c(CC(O)=O)[n]1 Amb18062456 [0,0,0,1,0,1|2,0,0]=4 1634 B11R1.645 Cc1[n]c(C)oc1CC(C)=O Amb25117986 [0,0,0,1,0,1|2,0,0]=4 1635 B11R1.645 Cc1[n]c(Cl)[s]c1CC(O)=O Amb24365972 [0,0,0,1,0,1|1,1,0]=4 1636 B11R1.645 Cc1[n]c(N)oc1CC(O)=O Amb24555163 [0,0,0,1,0,1|1,0,0]=3 1637 B11R1.645 Cc1[s]c(Br)[n]c1CC(O)=O Amb18158935 [0,0,0,1,0,1|2,0,0]=4 1638 B11R1.645 Cc1[s]c(N)[n]c1CC(O)=O Amb24532960 [0,0,0,1,0,1|2,0,0]=4 1639 B11R1.645 Cc1[s]c(N)cc1CC(O)=O Amb18198590 [0,0,0,1,0,1|2,0,0]=4 1640 B11R1.645 Cc1[s]c(O)[n]c1CC(O)=O Amb18198070 [0,0,0,1,0,1|1,0,0]=3 1641 B11R1.645 Cc1[s]c(S)[n]c1CC(O)=O Amb25102121 [0,0,0,1,0,1|1,1,0]=4 1642 B11R1.645 Cc1cc(Br)[s]c1CC(O)=O Amb22009221 [0,0,0,1,0,1|1,1,0]=4 1643 B11R1.645 Cc1cc(C)c(CC(O)=O)o1 Amb18831041 [0,0,0,1,0,1|1,0,0]=3 1644 B11R1.645 Cc1cc(CC(O)=O)c(C)[nH]1 Amb18243531 [0,0,0,1,0,1|2,0,0]=4 1645 B11R1.645 Cc1cc(CC(O)=O)c(C)[s]1 Amb18285199 [0,0,0,1,0,1|2,0,0]=4 1646 B11R1.645 Cc1cc(CC(O)=O)c(C)o1 Amb18125679 [0,0,0,1,0,1|2,0,0]=4 1647 B11R1.645 Cc1cc(N)[s]c1CC(O)=O Amb18198589 [0,0,0,1,0,1|1,1,0]=4 1648 B11R1.645 Cc1cc([nH]c1CC(=O)O)C Amb17593828 [0,0,0,1,0,1|2,0,0]=4 1649 B11R1.645 Cc1nc(oc1CC(=O)O)C Amb17399990 [0,0,0,1,0,1|1,0,0]=3 1650 B11R1.645 Cc1nc(sc1CC(=O)O)Br Amb17409135 [0,0,0,1,0,1|1,1,0]=4 1651 B11R1.645 Cc1nc(sc1CC(=O)O)S Amb2371537 [0,0,0,1,0,1|0,2,0]=4 1652 B11R1.645 Cc1oc(N)cc1CC(O)=O Amb18830915 [0,0,0,1,0,1|2,0,0]=4 1653 B11R1.645 OC(=O)CC1OC(=O)C=C1Br Amb17596018 [0,0,0,1,0,1|1,0,1]=4 1654 B11R1.645 OC(=O)CC1OC(=O)C=C1Cl Amb24426193 [0,0,0,1,0,1|1,0,1]=4 1655 B11R1.645 OC(=O)CC1OC(=O)CC1=O Amb24664110 [0,0,0,1,0,1|1,0,1]=4 1656 B11R1.645 OC(=O)CC=1NC(=O)OC1O Amb24518997 [0,0,0,1,0,1|2,0,0]=4 1657 B11R1.645 OC(=O)C[C@@H]1OC(=O)C=C1O Amb24656939 [0,0,0,1,0,1|1,0,1]=4 1658 B11R1.645 OC(=O)\C=C/1\OC(=O)C=C1Br Amb25218842 [0,0,0,1,0,1|1,0,1]=4 1659 B11R1.645 OC(=O)\C=C/1\OC(=O)C=C1Cl Amb25322083 [0,0,0,1,0,1|1,0,1]=4 1660 B11R1.645 OC(=O)\C=C/1\OC(=O)C=C1F Amb24518301 [0,0,0,1,0,1|1,0,1]=4 1661 B11R1.645 OC(=O)\C=C\1/OC(=O)C=C1Br Amb25733435 [0,0,0,1,0,1|1,0,1]=4 1662 B11R1.645 OC(=O)\C=C\1/OC(=O)C=C1F Amb24068304 [0,0,0,1,0,1|1,0,1]=4 1663 B11R1.1039 CC1(CC(O)=O)C=CC(=O)O1 Amb18644777 [0,0,0,1,0,1|0,0,2]=4 1664 B11R1.1039 CC1(CCC(=O)O1)CC(O)=O Amb24635619 [0,0,0,1,0,1|0,0,2]=4 1665 B11R1.1039 C[C@@]1(CCC(=O)O1)CC(O)=O Amb25216920 [0,0,0,1,0,1|0,0,2]=4 1666 B11R1.1039 C[C@]1(CC(O)=O)C=CC(=O)O1 Amb25108147 [0,0,0,1,0,1|0,0,2]=4 1667 B11R1.21 CC(=O)C1=CC=C(C)C(=O)O1 Amb24722786 [0,0,0,1,0,1|1,0,1]=4 1668 B11R1.21 CC(=O)C1CC=C(C(=O)C1)C Amb1093909 [0,0,0,1,0,1|2,0,0]=4 1669 B11R1.21 CC1=CC=C(NC1=O)C(O)=O Amb18125523 [0,0,0,1,0,1|1,0,1]=4 1670 B11R1.21 CC1=CC=C(OC1=O)C(O)=O Amb18644609 [0,0,0,1,0,1|0,0,1]=3 1671 B11R1.21 CC1=CCC(CC1=O)C(O)=O Amb24373240 [0,0,0,1,0,1|1,0,0]=3 1672 B11R1.21 CC=1N=CC(NC1C)C(O)=O Amb24070867 [0,0,0,1,0,1|2,0,0]=4 1673 B11R1.21 Cc1[n]cc([n]c1O)C(O)=O Amb24455153 [0,0,0,1,0,1|1,0,1]=4 1674 B11R1.21 Cc1c[n]c(cc1O)C(O)=O Amb20248033 [0,0,0,1,0,1|1,0,1]=4 1675 B11R1.21 Cc1c[n]c(cc1O)C(O)=O Amb20667840 [0,0,0,1,0,1|1,0,1]=4 1676 B11R1.21 OC(=O)C1=CCC(=O)C(=O)O1 Amb25723163 [0,0,0,1,0,1|1,0,1]=4 1677 B11R1.21 OC(=O)c1ccc(c(c1)O)C Amb1229982 [0,0,0,1,0,1|1,0,1]=4 1678 B11R1.21 OC(=O)c1cnc(c(c1)O)C Amb13881250 [0,0,0,1,0,1|1,0,1]=4 1679 B11R1.80 CC(=O)CC1=NN(C)C(=O)O1 Amb24578591 [0,0,0,1,0,1|2,0,0]=4 1680 B11R1.80 CC(=O)CC1CC(=O)C(C)=C1 Amb24532462 [0,0,0,1,0,1|2,0,0]=4 1681 B11R1.80 CC(=O)\C=C\1/C=C(C)C(=O)O1 Amb25151568 [0,0,0,1,0,1|1,0,1]=4 1682 B11R1.80 CC1=CC(CC(O)=O)OC1=O Amb18125922 [0,0,0,1,0,1|0,0,0]=2 1683 B11R1.80 CC1=CC(CC1=O)=CC(O)=O Amb25227419 [0,0,0,1,0,1|1,0,1]=4 1684 B11R1.80 CC1=C\C(=C\C(O)=O)\OC1=O Amb25798903 [0,0,0,1,0,1|0,0,1]=3 1685 B11R1.80 CC1=C\C(\CC1=O)=C\C(O)=O Amb25713614 [0,0,0,1,0,1|1,0,1]=4 1686 B11R1.80 CN1CC(CC(O)=O)OC1=O Amb18830410 [0,0,0,1,0,1|1,0,1]=4 1687 B11R1.80 CN1N=C(CC(O)=O)OC1=O Amb24558950 [0,0,0,1,0,1|1,0,0]=3 1688 B11R1.80 Cc1[nH]c(CC(O)=O)cc1C Amb18831146 [0,0,0,1,0,1|2,0,0]=4 1689 B11R1.80 Cc1[n]c(CC(O)=O)[nH]c1C Amb18831034 [0,0,0,1,0,1|2,0,0]=4 1690 B11R1.80 Cc1[n]c(CC(O)=O)[nH]c1N Amb18830908 [0,0,0,1,0,1|2,0,0]=4 1691 B11R1.80 Cc1[s]c(CC(O)=O)cc1Br Amb25790421 [0,0,0,1,0,1|2,0,0]=4 1692 B11R1.80 Cc1c[n](CC(O)=O)[n]c1N Amb19148973 [0,0,0,1,0,1|2,0,0]=4 1693 B11R1.80 Cc1c[n](CC(O)=O)[n]c1N Amb22282213 [0,0,0,1,0,1|2,0,0]=4 1694 B11R1.80 Cc1cc(CC(O)=O)[s]c1Cl Amb24635345 [0,0,0,1,0,1|1,1,0]=4 1695 B11R1.80 Cc1oc(CC(N)=O)[n]c1C Amb24486613 [0,0,0,1,0,1|2,0,0]=4 1696 B11R1.80 Cc1oc(CC(O)=O)[n]c1C Amb18200536 [0,0,0,1,0,1|1,0,0]=3 1697 B11R1.80 Cc1oc(CC(O)=O)[n]c1Cl Amb18196844 [0,0,0,1,0,1|2,0,0]=4 1698 B11R1.80 Cc1oc(CC(O)=O)cc1N Amb18830914 [0,0,0,1,0,1|2,0,0]=4 1699 B11R1.80 OC(=O)C[C@@H]1C=C(F)C(=O)O1 Amb25724279 [0,0,0,1,0,1|1,0,0]=3 1700 B11R1.80 OC(=O)Cc1sc(c(n1)C)C Amb17138675 [0,0,0,1,0,1|1,1,0]=4 1701 B11R1.80 OC(=O)\C=C/1\C=C(F)C(=O)O1 Amb24068307 [0,0,0,1,0,1|1,0,1]=4 1702 B11R1.80 OC(=O)\C=C\1/C=C(Br)C(=O)O1 Amb25759030 [0,0,0,1,0,1|1,0,1]=4 1703 B11R1.80 OC(=O)\C=C\1/C=C(Cl)C(=O)O1 Amb25061140 [0,0,0,1,0,1|1,0,1]=4 1704 B11R1.175 CC(=C)C1CC(=CO1)C(O)=O Amb24078768 [0,0,0,1,0,1|2,0,0]=4 1705 B11R1.175 NC(=O)C1CC(=NO1)C(O)=O Amb25851274 [0,0,0,1,0,1|2,0,0]=4 1706 B11R1.175 OC(=O)C1=CCC(O1)C(O)=O Amb24565706 [0,0,0,1,0,1|1,0,0]=3 1707 B11R1.175 OC(=O)C1C=CC(O1)C(O)=O Amb24433954 [0,0,0,1,0,1|1,0,1]=4 1708 B11R1.175 OC(=O)C1CC(CO1)C(O)=O Amb23454154 [0,0,0,1,0,1|0,0,2]=4 1709 B11R1.175 OC(=O)C1CC(CS1)C(O)=O Amb18647960 [0,0,0,1,0,1|0,0,2]=4 1710 B11R1.175 OC(=O)C1CC(SS1)C(O)=O Amb24433441 [0,0,0,1,0,1|1,0,1]=4 1711 B11R1.175 OC(=O)C1CCC(C1)C(=O)O Amb2505466 [0,0,0,1,0,1|0,0,2]=4 1712 B11R1.175 OC(=O)C=1CC(=NN1)C(O)=O Amb24740714 [0,0,0,1,0,1|1,0,1]=4 1713 B11R1.175 OC(=O)C=1CC(CC1)C(O)=O Amb24365900 [0,0,0,1,0,1|0,0,0]=2 1714 B11R1.175 OC(=O)C=1CC(OC1)C(O)=O Amb25780021 [0,0,0,1,0,1|0,0,0]=2 1715 B11R1.175 OC(=O)C=1CC(ON1)C(O)=O Amb23453807 [0,0,0,1,0,1|1,0,0]=3 1716 B11R1.175 OC(=O)[C@@H]1C[C@@H](CN1)C(O)=O Amb22262950 [0,0,0,1,0,1|0,0,2]=4 1717 B11R1.175 OC(=O)[C@@H]1C[C@@H](CS1)C(O)=O Amb24692652 [0,0,0,1,0,1|0,0,2]=4 1718 B11R1.175 OC(=O)[C@@H]1C[C@H](CC1)C(O)=O Amb22744933 [0,0,0,1,0,1|0,0,2]=4 1719 B11R1.175 OC(=O)[C@@H]1C[C@H](CN1)C(O)=O Amb19930523 [0,0,0,1,0,1|0,0,2]=4 1720 B11R1.175 OC(=O)[C@@H]1C[C@H](CS1)C(O)=O Amb25295506 [0,0,0,1,0,1|0,0,2]=4 1721 B11R1.175 OC(=O)[C@@H]1C[C@H](NN1)C(O)=O Amb24626610 [0,0,0,1,0,1|1,0,1]=4 1722 B11R1.175 OC(=O)[C@H]1CC(CN1)C(O)=O Amb25701728 [0,0,0,1,0,1|0,0,2]=4 1723 B11R1.175 OC(=O)[C@H]1C[C@@H](CN1)C(O)=O Amb24559908 [0,0,0,1,0,1|0,0,2]=4 1724 B11R1.175 OC(=O)[C@H]1C[C@@H](NN1)C(O)=O Amb24061688 [0,0,0,1,0,1|1,0,1]=4 1725 B11R1.175 OC(=O)[C@H]1C[C@H](NN1)C(O)=O Amb24061689 [0,0,0,1,0,1|1,0,1]=4 1726 B11R1.175 OC(=O)[C@H]1C[C@H](SS1)C(O)=O Amb25101012 [0,0,0,1,0,1|1,0,1]=4 1727 B11R1.175 OC(=O)c1c[nH]c([n]1)C(O)=O Amb23451754 [0,0,0,1,0,1|1,0,1]=4 1728 B11R1.175 OC(=O)c1c[n]c([s]1)C(O)=O Amb24331714 [0,0,0,1,0,1|1,0,1]=4 1729 B11R1.175 OC(=O)c1c[n]c(o1)C(O)=O Amb25270783 [0,0,0,1,0,1|1,0,1]=4 1730 B11R1.175 OC(=O)c1c[s]c([n]1)C(O)=O Amb24739490 [0,0,0,1,0,1|1,0,1]=4 1731 B11R1.175 OC(=O)c1ccc(o1)C(=O)O Amb2229291 [0,0,0,1,0,1|1,0,1]=4 1732 B11R1.175 OC(=O)c1ccc(s1)C(=O)O Amb1149925 [0,0,0,1,0,1|1,0,1]=4 1733 B11R1.175 OC(=O)c1scc(c1)C(=O)O Amb13952464 [0,0,0,1,0,1|0,0,2]=4 1734 B11R1.314 CC(C(O)=O)=C1CCC(C)O1 Amb25176114 [0,0,0,1,0,1|1,0,1]=4 1735 B11R1.314 CC(C1CCC(=O)O1)C(O)=O Amb25249128 [0,0,0,1,0,1|0,0,2]=4 1736 B11R1.565 CC(=O)C=1CCC(=O)CCC1 Amb24357309 [0,0,0,1,0,1|2,0,0]=4 1737 B11R1.723 CC1(C=CC1C(O)=O)C(O)=O Amb24650921 [0,0,0,1,0,1|0,0,1]=3 1738 B11R1.730 OC(=O)C=1CS(=O)(=O)CCC1 Amb24390376 [0,0,0,1,0,1|1,0,1]=4 1739 B11R1.166 CC1=CC(=O)NC=C1C(O)=O Amb18125521 [0,1,0,1,0,0|2,0,0]=4 1740 B11R1.166 CC1CC=C(C(C)O1)C(O)=O Amb24487845 [0,1,0,1,0,0|1,0,1]=4 1741 B11R1.166 CC1NC(O)=NC=C1C(O)=O Amb18125935 [0,1,0,1,0,0|2,0,0]=4 1742 B11R1.166 CC1OC(=O)CC=C1C(C)O Amb25204582 [0,1,0,1,0,0|1,0,1]=4 1743 B11R1.166 CC1OC(=O)CCC1C(O)=O Amb24390903 [0,1,0,1,0,0|0,0,2]=4 1744 B11R1.166 CC=1NC(=O)C=CC1C(O)=O Amb22491681 [0,1,0,1,0,0|1,0,1]=4 1745 B11R1.166 CC=1NC(=O)CCC1C(O)=O Amb25087837 [0,1,0,1,0,0|1,0,1]=4 1746 B11R1.166 CC=1OC(=O)C=CC1C(O)=O Amb24184151 [0,1,0,1,0,0|0,0,1]=3 1747 B11R1.166 C[C@@H]1OC(=O)CC=C1[C@H](C)O Amb24661247 [0,1,0,1,0,0|1,0,1]=4 1748 B11R1.166 C[C@@H]1OC(=O)CC[C@H]1C(O)=O Amb24563812 [0,1,0,1,0,0|0,0,2]=4 1749 B11R1.166 Cc1[n]c(O)ccc1C(O)=O Amb18125514 [0,1,0,1,0,0|1,0,1]=4 1750 B11R1.166 O=C1CSC(=C(N1)C)C(=O)O Amb17112126 [0,1,0,1,0,0|2,0,0]=4 1751 B11R1.166 Oc1ncc(c(n1)C)C(=O)O Amb10603609 [0,1,0,1,0,0|2,0,0]=4 1752 B11R1.313 CC1=C(CC(O)=O)NNC1=O Amb18830805 [0,1,0,1,0,0|1,0,0]=3 1753 B11R1.313 CC1=C(CC(O)=O)NOC1=O Amb24579059 [0,1,0,1,0,0|0,0,0]=2 1754 B11R1.313 CC1=C(CC(O)=O)ONC1=O Amb18830672 [0,1,0,1,0,0|0,0,0]=2 1755 B11R1.313 CC1=C(CNC1=O)CC(O)=O Amb18125826 [0,1,0,1,0,0|1,0,0]=3 1756 B11R1.313 CC1C(CC(O)=O)=NNC1=O Amb18200265 [0,1,0,1,0,0|1,0,1]=4 1757 B11R1.313 CN1C(CC(O)=O)=CSC1=O Amb18534616 [0,1,0,1,0,0|1,1,0]=4 1758 B11R1.313 Cc1[nH]cc(CC(O)=O)c1C Amb18201136 [0,1,0,1,0,0|2,0,0]=4 1759 B11R1.313 Cc1[n][nH]c(CC(O)=O)c1C Amb18200771 [0,1,0,1,0,0|2,0,0]=4 1760 B11R1.313 Cc1[n]oc(CC(O)=O)c1Br Amb23592261 [0,1,0,1,0,0|2,0,0]=4 1761 B11R1.313 Cc1[n]oc(CC(O)=O)c1Cl Amb24390300 [0,1,0,1,0,0|2,0,0]=4 1762 B11R1.313 Cc1[s][n]c(CC(O)=O)c1C Amb18825430 [0,1,0,1,0,0|1,1,0]=4 1763 B11R1.313 Cc1c(Cl)[nH][n]c1CC(O)=O Amb18825181 [0,1,0,1,0,0|2,0,0]=4 1764 B11R1.313 Cc1c[nH]c(CC(O)=O)c1C Amb18831147 [0,1,0,1,0,0|2,0,0]=4 1765 B11R1.313 Cc1o[n]c(CC(O)=O)c1C Amb18830922 [0,1,0,1,0,0|1,0,0]=3 1766 B11R1.313 OC(=O)CC1COC(=O)C1=O Amb24627056 [0,1,0,1,0,0|1,0,1]=4 1767 B11R1.313 OC(=O)CC=1COC(=O)C1O Amb25710877 [0,1,0,1,0,0|1,0,0]=3 1768 B11R1.313 Oc1o[n]c(CC(O)=O)c1Cl Amb25365376 [0,1,0,1,0,0|1,0,1]=4 1769 B11R1.488 CC=1CP(C)(=O)CC1C(O)=O Amb24487848 [0,1,0,1,0,0|2,0,0]=4 1770 B11R1.490 CC1CC(=O)OC1(C)C(O)=O Amb18644983 [0,1,0,1,0,0|0,0,2]=4 1771 B11R1.490 C[C@@H]1CC(=O)O[C@]1(C)C(O)=O Amb25238261 [0,1,0,1,0,0|0,0,2]=4 1772 B11R1.519 CN1[C@H](C[C@@H]1C(O)=O)C(O)=O Amb25295430 [0,1,0,1,0,0|0,0,2]=4 1773 B11R1.672 CC1C(OC(=O)C1=O)C(O)=O Amb24634109 [0,1,0,1,0,0|1,0,1]=4 1774 B11R1.672 CC1C(OC(=O)C1C)C(O)=O Amb25111156 [0,1,0,1,0,0|0,0,2]=4 1775 B11R1.672 CC1C(OC(=O)N1C)C(O)=O Amb25217880 [0,1,0,1,0,0|1,0,1]=4 1776 B11R1.672 CC1N[C@@H](C(O)C1=O)C(O)=O Amb25319073 [0,1,0,1,0,0|1,0,1]=4 1777 B11R1.672 CC=1C(CC(=O)C1C)C(O)=O Amb24390869 [0,1,0,1,0,0|1,0,0]=3 1778 B11R1.672 CC=1C(OC(=O)C1C)C(N)=O Amb25111058 [0,1,0,1,0,0|1,0,0]=3 1779 B11R1.672 CC=1C(OC(=O)C1C)C(O)=O Amb24408855 [0,1,0,1,0,0|0,0,0]=2 1780 B11R1.672 Cc1c(oc(C)c1C)C(O)=O Amb22926543 [0,1,0,1,0,0|1,0,1]=4 1781 B11R1.672 OC(=O)C=1OC(=O)C(=O)C1O Amb25701387 [0,1,0,1,0,0|1,0,1]=4 1782 B11R1.708 OC(=O)CC1CCC1C(O)=O Amb25758770 [0,1,0,1,0,0|0,0,2]=4 1783 B11R1.708 OC(=O)C[C@@H]1CC[C@H]1C(O)=O Amb24612096 [0,1,0,1,0,0|0,0,2]=4 1784 B11R1.708 OC(=O)C[C@@H]1CN[C@H]1C(O)=O Amb19131121 [0,1,0,1,0,0|0,0,2]=4 1785 B11R1.1293 CC1C(C(O)=O)C1(C)C(O)=O Amb25201988 [0,1,0,1,0,0|0,0,2]=4 1786 B11R1.1293 C[C@@H]1[C@@H](C(O)=O)[C@@]1(C)C(O)=O Amb24512172 [0,1,0,1,0,0|0,0,2]=4 1787 B11R1.1389 NC1(CC(C1)C(O)=O)C(O)=O Amb23592289 [0,1,0,1,0,0|0,0,2]=4 1788 B11R1.1389 N[C@@]1(C[C@@H](C1)C(O)=O)C(O)=O Amb19297840 [0,1,0,1,0,0|0,0,2]=4 1789 B11R1.1389 N[C@@]1(C[C@H](C1)C(O)=O)C(O)=O Amb24468408 [0,1,0,1,0,0|0,0,2]=4 1790 B11R1.1391 OC(=O)CCC1(CC1)C(O)=O Amb25385134 [0,1,0,1,0,0|0,0,2]=4 1791 B11R1.1391 OC(=O)CNC1(CC1)C(O)=O Amb25382128 [0,1,0,1,0,0|1,0,1]=4 1792 B11R1.22 COC(=O)C1=COC(=O)C=C1 Amb18796753 [0,1,0,1,0,0|0,0,2]=4 1793 B11R1.22 COC(=O)C=1CCC(=O)CC1 Amb24380856 [0,1,0,1,0,0|1,0,0]=3 1794 B11R1.22 COC(=O)C=1CNC(=O)NC1 Amb24444796 [0,1,0,1,0,0|2,0,0]=4 1795 B11R1.22 ONC(=O)C1=COC(=O)C=C1 Amb25246009 [0,1,0,1,0,0|0,0,2]=4 1796 B11R1.48 CCC1CC(OC1=O)C(O)=O Amb17806220 [0,1,0,1,0,0|0,0,2]=4 1797 B11R1.48 Cc1cc([s]c1C=O)C(O)=O Amb20528197 [0,1,0,1,0,0|0,1,1]=4 1798 B11R1.48 Cc1cc(oc1CC)C(O)=O Amb18685127 [0,1,0,1,0,0|1,0,1]=4 1799 B11R1.48 Cc1oc(cc1CC)C(O)=O Amb18644617 [0,1,0,1,0,0|1,0,1]=4 1800 B11R1.48 Cc1oc(cc1CCl)C(O)=O Amb24488128 [0,1,0,1,0,0|1,0,1]=4 1801 B11R1.48 Cc1oc(cc1CN)C(O)=O Amb22587991 [0,1,0,1,0,0|1,0,1]=4 1802 B11R1.48 Cc1oc(cc1CO)C(O)=O Amb18285035 [0,1,0,1,0,0|1,0,1]=4 1803 B11R1.48 Cc1oc(cc1CS)C(O)=O Amb18285051 [0,1,0,1,0,0|1,0,1]=4 1804 B11R1.48 Cc1oc(cc1SC)C(O)=O Amb19334672 [0,1,0,1,0,0|1,0,1]=4 1805 B11R1.90 NC(=O)N\C=C/1\CCOC1=O Amb25073938 [0,1,0,1,0,0|2,0,0]=4 1806 B11R1.90 NC(=O)N\C=C\1/CCOC1=O Amb21984663 [0,1,0,1,0,0|2,0,0]=4 1807 B11R1.90 OC(=O)CCC1=CCCC1=O Amb18125691 [0,1,0,1,0,0|1,0,1]=4 1808 B11R1.90 OC(=O)CCC1CCOC1=O Amb10669454 [0,1,0,1,0,0|0,0,2]=4 1809 B11R1.90 OC(=O)CN[C@@H]1CCOC1=O Amb25112698 [0,1,0,1,0,0|1,0,1]=4 1810 B11R1.296 COC(=O)N(C)C=1CC(=O)C1 Amb25271010 [0,1,0,1,0,0|2,0,0]=4 1811 B11R1.849 COC(=O)C/1C\C1=C\C(O)=O Amb25362160 [0,1,0,1,0,0|0,0,2]=4 1812 B11R1.849 COC(=O)C1CC1=CC(O)=O Amb25261373 [0,1,0,1,0,0|0,0,2]=4 1813 B11R1.853 COC(=O)C1CC(C1)C(O)=O Amb22504357 [0,1,0,1,0,0|0,0,2]=4 1814 B11R1.853 COC(=O)C1CC(O1)C(O)=O Amb25853830 [0,1,0,1,0,0|1,0,1]=4 1815 B11R1.853 COC(=O)N1CC(C1)C(O)=O Amb24486045 [0,1,0,1,0,0|1,0,1]=4 1816 B11R1.853 COC(=O)[C@@H]1C[C@@H](N1)C(O)=O Amb25264053 [0,1,0,1,0,0|1,0,1]=4 1817 B11R1.888 COC(=O)C1(C)CC1C(O)=O Amb25104877 [0,1,0,1,0,0|0,0,2]=4 1818 B11R1.142 CC(\C=C/1\CCC1O)C(O)=O Amb25804153 [0,1,0,1,0,0|1,0,1]=4 1819 B11R1.226 CC(C=O)=C1C=C(C)C(=O)O1 Amb24587026 [0,1,0,1,0,0|1,0,1]=4 1820 B11R1.226 CC1=CC(CC1O)C(=O)OC Amb24371253 [0,1,0,1,0,0|1,0,1]=4 1821 B11R1.226 CC1=C[C@@H](CC1=O)C(=O)OC Amb25706927 [0,1,0,1,0,0|1,0,0]=3 1822 B11R1.226 CC1=C[C@@H](C[C@@H]1O)C(=O)OC Amb25221006 [0,1,0,1,0,0|1,0,1]=4 1823 B11R1.226 COC(=O)c1cc(C)c(C)o1 Amb17672641 [0,1,0,1,0,0|1,0,1]=4 1824 B11R1.226 C\C(\C=O)=C/1\C=C(C)C(=O)O1 Amb18125356 [0,1,0,1,0,0|1,0,1]=4 1825 B11R1.321 CC(C(O)=O)=C1CC(C1)OC Amb25148295 [0,1,0,1,0,0|1,0,1]=4 1826 B11R1.868 COC(=O)[C@H]1C[C@@]1(C)C(O)=O Amb25363170 [0,1,0,1,0,0|0,0,2]=4 1827 B11R1.416 CCC1(CCC(=O)O1)C(O)=O Amb17705275 [0,1,0,1,0,0|0,0,2]=4 1828 B11R1.416 CC[C@@]1(CCC(=O)O1)C(O)=O Amb24532969 [0,1,0,1,0,0|0,0,2]=4 1829 B11R1.416 CC[C@]1(CCC(=O)O1)C(O)=O Amb24647527 [0,1,0,1,0,0|0,0,2]=4 1830 B11R1.416 NCC1(CCC(=O)O1)C(O)=O Amb25060776 [0,1,0,1,0,0|0,0,2]=4 1831 B11R1.416 OC(=O)C1(CCl)CCC(=O)O1 Amb18648181 [0,1,0,1,0,0|0,0,2]=4 1832 B11R1.416 OC(=O)[C@@]1(CCC(=O)O1)CO Amb24729549 [0,1,0,1,0,0|0,0,2]=4 1833 B11R1.418 CCC1(CC1C(O)=O)C(O)=O Amb25772933 [0,1,0,1,0,0|0,0,2]=4 1834 B11R1.418 CC[C@@]1(O[C@H]1C(O)=O)C(O)=O Amb24692745 [0,1,0,1,0,0|1,0,1]=4 1835 B11R1.418 CC[C@]1(C[C@@H]1C(O)=O)C(O)=O Amb24511921 [0,1,0,1,0,0|0,0,2]=4 1836 B11R1.418 COC1(CC1C(O)=O)C(O)=O Amb24385414 [0,1,0,1,0,0|0,0,2]=4 1837 B11R1.418 CS[C@@]1(C[C@@H]1C(O)=O)C(O)=O Amb24580417 [0,1,0,1,0,0|0,0,2]=4 1838 B11R1.418 CS[C@]1(C[C@H]1C(O)=O)C(O)=O Amb25176096 [0,1,0,1,0,0|0,0,2]=4 1839 B11R1.487 CC1(C=C(O)C(=O)O1)C(O)=O Amb24739429 [0,1,0,1,0,0|1,0,0]=3 1840 B11R1.487 CC1(CC(=C)C(=O)O1)C(O)=O Amb25108189 [0,1,0,1,0,0|0,0,2]=4 1841 B11R1.487 CC1(CC(=O)C(O)=C1)C(O)=O Amb25738433 [0,1,0,1,0,0|2,0,0]=4 1842 B11R1.487 CC1(CC(N)C(=O)O1)C(O)=O Amb24561712 [0,1,0,1,0,0|0,0,2]=4 1843 B11R1.487 CC1=CC(C)(OC1=O)C(C)O Amb25284295 [0,1,0,1,0,0|1,0,1]=4 1844 B11R1.487 CC1=C[C@](C)(OC1=O)C(C)O Amb25190363 [0,1,0,1,0,0|1,0,1]=4 1845 B11R1.487 CC1=C[C@](C)(O[C@@H]1C)C(O)=O Amb24511948 [0,1,0,1,0,0|1,0,1]=4 1846 B11R1.487 CC1=C[C@](C)(O[C@H]1C)C(O)=O Amb25322102 [0,1,0,1,0,0|1,0,1]=4 1847 B11R1.487 CC1SC(C)(OC1=O)C(O)=O Amb24488008 [0,1,0,1,0,0|1,0,1]=4 1848 B11R1.487 C[C@]1(CC(=C)C(=O)O1)C(O)=O Amb25783891 [0,1,0,1,0,0|0,0,2]=4 1849 B11R1.1387 CC1(CC1(C)C(O)=O)C(O)=O Amb25373993 [0,1,0,1,0,0|0,0,2]=4 1850 B11R1.1387 CC1(CC1(Cl)C(O)=O)C(O)=O Amb25363285 [0,1,0,1,0,0|0,0,2]=4 1851 B11R1.1387 CC1(OC1(C)C(O)=O)C(O)=O Amb25315650 [0,1,0,1,0,0|1,0,1]=4 1852 B7R0.2 C=C(CC(O)=O)C=C Amb24561923 [1,0,0,0,1,0|1,0,1]=4 1853 B7R0.2 CC(=CC(O)=O)C#C Amb25687994 [1,0,0,0,1,0|1,0,1]=4 1854 B7R0.2 CC(=CC(O)=O)C=O Amb25378040 [1,0,0,0,1,0|0,0,0]=2 1855 B7R0.2 CC(=CC(O)=O)OC Amb24699194 [1,0,0,0,1,0|2,0,0]=4 1856 B7R0.2 CC(=O)CC(=S)C=O Amb25142738 [1,0,0,0,1,0|2,0,0]=4 1857 B7R0.2 CC(=O)CN(C)C=O Amb25134136 [1,0,0,0,1,0|2,0,0]=4 1858 B7R0.2 CC(=O)\C=C(\C)/C=O Amb18641689 [1,0,0,0,1,0|1,0,0]=3 1859 B7R0.2 CC(CC(C)=O)=CCl Amb25685302 [1,0,0,0,1,0|2,0,0]=4 1860 B7R0.2 CC(CC(C)=O)C=O Amb18641789 [1,0,0,0,1,0|1,0,1]=4 1861 B7R0.2 CC(CC(N)=O)=CCl Amb25663357 [1,0,0,0,1,0|2,0,0]=4 1862 B7R0.2 CC(CC(O)=O)=C=C Amb25265849 [1,0,0,0,1,0|1,0,1]=4 1863 B7R0.2 CC(CC(O)=O)=CCl Amb25802122 [1,0,0,0,1,0|1,0,0]=3 1864 B7R0.2 CC(CC(O)=O)C=C Amb18641774 [1,0,0,0,1,0|1,0,1]=4 1865 B7R0.2 CC(CC(O)=O)C=O Amb25836603 [1,0,0,0,1,0|0,0,1]=3 1866 B7R0.2 CC(CC(O)=O)CO Amb18198168 [1,0,0,0,1,0|0,0,2]=4 1867 B7R0.2 CC(CO)=CC(O)=O Amb24689918 [1,0,0,0,1,0|0,0,1]=3 1868 B7R0.2 CC(CS)=CC(O)=O Amb25073137 [1,0,0,0,1,0|0,1,1]=4 1869 B7R0.2 CN(CC(O)=O)C=O Amb18951578 [1,0,0,0,1,0|1,0,0]=3 1870 B7R0.2 C[C@@H](CC(C)=O)C=O Amb24379584 [1,0,0,0,1,0|1,0,1]=4 1871 B7R0.2 C[C@@H](O)\C=C(/C)\C=O Amb25827172 [1,0,0,0,1,0|1,0,1]=4 1872 B7R0.2 C[C@H](CC(O)=O)C=C Amb25791667 [1,0,0,0,1,0|1,0,1]=4 1873 B7R0.2 C\C(=C/C(N)=O)\C=C Amb24523763 [1,0,0,0,1,0|2,0,0]=4 1874 B7R0.2 C\C(=C/C(O)=O)\C=O Amb25138216 [1,0,0,0,1,0|0,0,0]=2 1875 B7R0.2 C\C(=C\C(O)=O)\C=C Amb18641686 [1,0,0,0,1,0|1,0,0]=3 1876 B7R0.2 C\C(=C\C(O)=O)\C=O Amb24579433 [1,0,0,0,1,0|0,0,0]=2 1877 B7R0.2 C\C(\C=C)=C/C(C)=O Amb25234874 [1,0,0,0,1,0|2,0,0]=4 1878 B7R0.2 C\C(\C=O)=C\C(C)=C Amb18641616 [1,0,0,0,1,0|2,0,0]=4 1879 B7R0.2 C\C(\CBr)=C/C(O)=O Amb23538399 [1,0,0,0,1,0|1,0,1]=4 1880 B7R0.2 C\C(\CC(C)=O)=N\O Amb24457353 [1,0,0,0,1,0|2,0,0]=4 1881 B7R0.2 C\C(\CC(N)=O)=C\C Amb25055448 [1,0,0,0,1,0|2,0,0]=4 1882 B7R0.2 C\C(\CC(O)=O)=C\C Amb24481339 [1,0,0,0,1,0|1,0,0]=3 1883 B7R0.2 C\C(\CC(O)=O)=N/O Amb25064289 [1,0,0,0,1,0|1,0,0]=3 1884 B7R0.2 C\C(\CC)=C\C(O)=O Amb18281014 [1,0,0,0,1,0|1,0,1]=4 1885 B7R0.2 C\C(\CO)=C/C(C)=O Amb25240045 [1,0,0,0,1,0|1,0,1]=4 1886 B7R0.2 C\C(\CO)=C/C(O)=O Amb18641871 [1,0,0,0,1,0|0,0,1]=3 1887 B7R0.2 C\C(\CO)=C\C(C)=O Amb24518297 [1,0,0,0,1,0|1,0,1]=4 1888 B7R0.2 C\C=C(\Cl)/CC(O)=O Amb25174797 [1,0,0,0,1,0|2,0,0]=4 1889 B7R0.2 NC(CO)=CC(O)=O Amb24628694 [1,0,0,0,1,0|1,0,1]=4 1890 B7R0.2 N[C@H](CC(O)=O)C=O Amb24643781 [1,0,0,0,1,0|1,0,1]=4 1891 B7R0.2 O=NN(CC(=O)O)C Amb17618622 [1,0,0,0,1,0|2,0,0]=4 1892 B7R0.2 OC(=O)CC(=O)NO Amb24444078 [1,0,0,0,1,0|2,0,0]=4 1893 B7R0.2 OC(=O)CC(F)C=O Amb25114270 [1,0,0,0,1,0|1,0,1]=4 1894 B7R0.2 OC(=O)CN(O)C=O Amb25367291 [1,0,0,0,1,0|2,0,0]=4 1895 B7R0.2 OC(=O)\C=C(/Cl)\C=O Amb24452824 [1,0,0,0,1,0|1,0,0]=3 1896 B7R0.16 BrC(C(=O)O)C(=O)O Amb17594708 [0,0,0,0,2,0|1,0,1]=4 1897 B7R0.16 C=C(C(O)=O)C(O)=O Amb24481368 [0,0,0,0,2,0|0,0,1]=3 1898 B7R0.16 CC(=C(C(=O)O)C)C Amb17593186 [0,0,0,0,2,0|2,0,0]=4 1899 B7R0.16 CC(=C(N)O)C(C)=O Amb24741192 [0,0,0,0,2,0|2,0,0]=4 1900 B7R0.16 CC(=O)C(=O)C(O)=O Amb24101563 [0,0,0,0,2,0|2,0,0]=4 1901 B7R0.16 CC(C(=O)O)C(=O)C Amb10601660 [0,0,0,0,2,0|1,0,1]=4 1902 B7R0.16 CC(C(O)=O)=C(C)Br Amb24557990 [0,0,0,0,2,0|2,0,0]=4 1903 B7R0.16 CC(C(O)=O)=C(C)Cl Amb24481381 [0,0,0,0,2,0|2,0,0]=4 1904 B7R0.16 CC(C(O)=O)=C(C)N Amb24527948 [0,0,0,0,2,0|2,0,0]=4 1905 B7R0.16 CC(C(O)=O)=C(Cl)Cl Amb24373832 [0,0,0,0,2,0|2,0,0]=4 1906 B7R0.16 CC(C(O)=O)=C(F)F Amb24702881 [0,0,0,0,2,0|2,0,0]=4 1907 B7R0.16 CC(C(O)=O)S(O)=O Amb25680146 [0,0,0,0,2,0|1,0,1]=4 1908 B7R0.16 C\C(\C(O)=O)=C(\C)/Br Amb18124498 [0,0,0,0,2,0|2,0,0]=4 1909 B7R0.16 C\C(\O)=C(\N)/C(O)=O Amb25320750 [0,0,0,0,2,0|2,0,0]=4 1910 B7R0.16 N=C(C(O)=O)C(O)=O Amb24334530 [0,0,0,0,2,0|1,0,0]=3 1911 B7R0.16 NC(=O)C(=O)C(O)=O Amb25344375 [0,0,0,0,2,0|2,0,0]=4 1912 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,0,0,0,2,0|1,0,1]=4 1913 B7R0.16 OC(=O)C(=O)C(O)=O Amb18641943 [0,0,0,0,2,0|1,0,0]=3 1914 B7R0.16 OC(=O)C(=O)C(O)=O Amb22230802 [0,0,0,0,2,0|1,0,0]=3 1915 B7R0.16 OC(=O)C(=S)C(O)=O Amb24544781 [0,0,0,0,2,0|1,0,0]=3 1916 B7R0.16 OC(=O)C(Cl)C(O)=O Amb18643353 [0,0,0,0,2,0|1,0,1]=4 1917 B7R0.16 OC(=O)C(F)C(O)=O Amb24055884 [0,0,0,0,2,0|1,0,1]=4 1918 B7R0.16 OC(C(=O)O)C(=O)O Amb1215315 [0,0,0,0,2,0|1,0,1]=4 1919 B9R0.4 CC(=O)C=C(C)\C=C\C=O Amb24595251 [1,0,0,0,0,1|1,0,1]=4 1920 B9R0.4 C\C(=C\C(O)=O)\C=CC=C Amb25316740 [1,0,0,0,0,1|1,0,1]=4 1921 B9R0.4 C\C(=C\C(O)=O)\C=CC=O Amb24562641 [1,0,0,0,0,1|0,0,1]=3 1922 B9R0.4 C\C(=C\C(O)=O)\C=C\C=C Amb24746708 [1,0,0,0,0,1|1,0,1]=4 1923 B9R0.4 C\C(\CC(O)=O)=C\CSC Amb24726319 [1,0,0,0,0,1|2,0,0]=4 1924 B9R0.4 C\C(\CCC=C)=C/C(O)=O Amb18643565 [1,0,0,0,0,1|1,0,1]=4 1925 B9R0.4 C\C(\CCC=C)=C\C(O)=O Amb25242614 [1,0,0,0,0,1|1,0,1]=4 1926 B9R0.4 OC(=O)\C=C(\O)/C=CC=O Amb25370890 [1,0,0,0,0,1|1,0,1]=4 1927 B9R0.55 C=C(Cl)CN\C=C\C(O)=O Amb25308536 [1,0,0,0,0,1|2,0,0]=4 1928 B9R0.55 CC(=C)CN\C=C\C(O)=O Amb25804662 [1,0,0,0,0,1|2,0,0]=4 1929 B9R0.55 CC(=C)CO\C=C\C(O)=O Amb18643826 [1,0,0,0,0,1|2,0,0]=4 1930 B9R0.55 CC(=C)\C=C\CCC(O)=O Amb24565556 [1,0,0,0,0,1|2,0,0]=4 1931 B9R0.55 CC(=O)CC\C=C\C(=O)O Amb17593589 [1,0,0,0,0,1|1,0,0]=3 1932 B9R0.55 CC(=O)C\C=C\CC(C)=O Amb25227383 [1,0,0,0,0,1|2,0,0]=4 1933 B9R0.55 CC(=O)N\C=C\CC(N)=O Amb24584165 [1,0,0,0,0,1|2,0,0]=4 1934 B9R0.55 CC(=O)OC\C=C\C(C)=O Amb25205418 [1,0,0,0,0,1|2,0,0]=4 1935 B9R0.55 CC(=O)OC\C=C\C(O)=O Amb24454652 [1,0,0,0,0,1|1,0,0]=3 1936 B9R0.55 CC(=O)O\C=C\CC(O)=O Amb25844728 [1,0,0,0,0,1|1,0,0]=3 1937 B9R0.55 CC(=O)O\N=C/CC(O)=O Amb24392947 [1,0,0,0,0,1|2,0,0]=4 1938 B9R0.55 CC(=O)\C=C\C=C/C(O)=O Amb18643490 [1,0,0,0,0,1|1,0,1]=4 1939 B9R0.55 CC(=O)\C=C\C=C\C(O)=O Amb24395663 [1,0,0,0,0,1|1,0,1]=4 1940 B9R0.55 CC(O)CC\C=C\C(O)=O Amb24680771 [1,0,0,0,0,1|1,0,1]=4 1941 B9R0.55 CC(O)CN\C=C\C(O)=O Amb24479663 [1,0,0,0,0,1|1,0,1]=4 1942 B9R0.55 CC(O)\C=C\CCC(O)=O Amb24453133 [1,0,0,0,0,1|1,0,1]=4 1943 B9R0.55 NC(=O)CC\C=C\C(N)=O Amb25111607 [1,0,0,0,0,1|2,0,0]=4 1944 B9R0.55 NC(=O)CN\C=C\C(O)=O Amb25342855 [1,0,0,0,0,1|1,0,0]=3 1945 B9R0.55 NC(=O)C\C=C\CC(N)=O Amb25856677 [1,0,0,0,0,1|2,0,0]=4 1946 B9R0.55 NC(=O)\C=C/SCC(O)=O Amb25061265 [1,0,0,0,0,1|1,0,0]=3 1947 B9R0.55 NC(=O)\C=C\CCC(O)=O Amb25146295 [1,0,0,0,0,1|1,0,0]=3 1948 B9R0.55 OC(=O)C=NOCC(O)=O Amb25175100 [1,0,0,0,0,1|1,0,0]=3 1949 B9R0.55 OC(=O)CCC=CC(O)=O Amb20622952 [1,0,0,0,0,1|0,0,0]=2 1950 B9R0.55 OC(=O)CCCCC(O)=O Amb22043229 [1,0,0,0,0,1|0,0,2]=4 1951 B9R0.55 OC(=O)CCCCC(O)=O Amb22167453 [1,0,0,0,0,1|0,0,2]=4 1952 B9R0.55 OC(=O)CCCCC(O)=O Amb22336279 [1,0,0,0,0,1|0,0,2]=4 1953 B9R0.55 OC(=O)CCCCC(O)=O Amb22338188 [1,0,0,0,0,1|0,0,2]=4 1954 B9R0.55 OC(=O)CCCCC(O)=O Amb22351345 [1,0,0,0,0,1|0,0,2]=4 1955 B9R0.55 OC(=O)CCCCC(O)=O Amb22351401 [1,0,0,0,0,1|0,0,2]=4 1956 B9R0.55 OC(=O)CCCCC(O)=O Amb22351452 [1,0,0,0,0,1|0,0,2]=4 1957 B9R0.55 OC(=O)CCCCC(O)=O Amb22351586 [1,0,0,0,0,1|0,0,2]=4 1958 B9R0.55 OC(=O)CCCCC(O)=O Amb22353360 [1,0,0,0,0,1|0,0,2]=4 1959 B9R0.55 OC(=O)CCCCC(O)=O Amb22363211 [1,0,0,0,0,1|0,0,2]=4 1960 B9R0.55 OC(=O)CC\C=C\C(O)=O Amb24117843 [1,0,0,0,0,1|0,0,0]=2 1961 B9R0.55 OC(=O)CNCCC(O)=O Amb18098292 [1,0,0,0,0,1|0,0,2]=4 1962 B9R0.55 OC(=O)CNNCC(O)=O Amb23438062 [1,0,0,0,0,1|1,0,1]=4 1963 B9R0.55 OC(=O)COCCC(O)=O Amb25046530 [1,0,0,0,0,1|0,0,2]=4 1964 B9R0.55 OC(=O)CSCCC(=O)O Amb17594067 [1,0,0,0,0,1|0,0,2]=4 1965 B9R0.55 OC(=O)C\C=C/CC(O)=O Amb25132103 [1,0,0,0,0,1|0,0,0]=2 1966 B9R0.55 OC(=O)\C=C\C#CC(O)=O Amb25324015 [1,0,0,0,0,1|0,0,1]=3 1967 B9R0.55 OC(=O)\C=C\COS(=O)=O Amb25363399 [1,0,0,0,0,1|1,0,1]=4 1968 B9R0.55 OC(=O)\C=C\SCC(O)=O Amb18645625 [1,0,0,0,0,1|0,0,0]=2 1969 B9R0.55 O[13C](=O)CCCC[13C](O)=O Amb22338172 [1,0,0,0,0,1|0,0,2]=4 1970 B11R0.6 CC(=O)N\C(\C)=C/SCC(C)=O Amb24753936 [0,0,0,0,0,2|2,0,0]=4 1971 B11R0.85 CN(CCC(=O)O)CCC(=O)O Amb16187108 [0,0,0,0,0,2|1,0,1]=4 1972 B11R0.85 CN(CCC(O)=O)CCC(O)=O Amb24117217 [0,0,0,0,0,2|1,0,1]=4 1973 B11R0.85 OC(=O)CCC(=O)NCC(O)=O Amb17940408 [0,0,0,0,0,2|1,0,1]=4 1974 B11R0.85 OC(=O)\C=C\C(=O)NCC(O)=O Amb19006231 [0,0,0,0,0,2|1,0,1]=4 1975 B11R0.29 OC(=O)CCCCC(C(=O)O)C Amb10844066 [0,0,0,0,0,2|0,0,2]=4 1976 B11R0.29 OC(=O)CCCSC(C(=O)O)C Amb17503620 [0,0,0,0,0,2|0,0,2]=4