0 B7R0.16 BrC(C(=O)Cl)C(C)C Amb17569838 [0,0,0,0,0,0|3,0,0]=3 1 B7R0.16 BrC(C(=O)O)C(=O)O Amb17594708 [0,0,0,0,0,0|2,0,1]=3 2 B7R0.16 C=C(Br)C(O)C(O)=O Amb24692957 [0,0,0,0,0,0|2,0,2]=4 3 B7R0.16 C=C(Br)[C@H](N)C(O)=O Amb24383876 [0,0,0,0,0,0|1,0,2]=3 4 B7R0.16 C=C(C(F)F)C(O)=O Amb24117234 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.16 C=C(C(O)=O)C(O)=O Amb24481368 [0,0,0,0,0,0|2,0,2]=4 6 B7R0.16 C=C(Cl)C(N)C(O)=O Amb18643039 [0,0,0,0,0,0|1,0,2]=3 7 B7R0.16 C=C(F)C(N)C(O)=O Amb18641967 [0,0,0,0,0,0|1,0,2]=3 8 B7R0.16 CC(=C(C(=O)O)Br)C Amb17594579 [0,0,0,0,0,0|2,0,2]=4 9 B7R0.16 CC(=C(C(=O)O)C)C Amb17593186 [0,0,0,0,0,0|2,0,2]=4 10 B7R0.16 CC(=C)C(=O)C(C)O Amb25245802 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.16 CC(=C)C(=O)[C@@H](C)O Amb24434621 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.16 CC(=C)C(=O)[C@H](C)O Amb25064672 [0,0,0,0,0,0|3,0,1]=4 13 B7R0.16 CC(=C)C(C)C(O)=O Amb18641781 [0,0,0,0,0,0|2,0,1]=3 14 B7R0.16 CC(=C)C(N)C(F)F Amb24720668 [0,0,0,0,0,0|4,0,0]=4 15 B7R0.16 CC(=C)C(N)C(O)=O Amb18641831 [0,0,0,0,0,0|1,0,1]=2 16 B7R0.16 CC(=C)[C@@H](C)C(O)=O Amb25355239 [0,0,0,0,0,0|2,0,1]=3 17 B7R0.16 CC(=C)[C@@H](N)C(=C)O Amb25308010 [0,0,0,0,0,0|2,0,1]=3 18 B7R0.16 CC(=O)C(=C)C(C)C Amb25713676 [0,0,0,0,0,0|3,0,1]=4 19 B7R0.16 CC(=O)C(=O)C(C)Br Amb24055325 [0,0,0,0,0,0|3,0,1]=4 20 B7R0.16 CC(=O)C(=O)C(C)Cl Amb24483301 [0,0,0,0,0,0|3,0,1]=4 21 B7R0.16 CC(=O)C(=O)C(C)O Amb25173440 [0,0,0,0,0,0|2,0,1]=3 22 B7R0.16 CC(=O)C(=O)C(O)=O Amb24101563 [0,0,0,0,0,0|1,0,3]=4 23 B7R0.16 CC(=O)C(Br)C(C)=C Amb24533829 [0,0,0,0,0,0|3,0,1]=4 24 B7R0.16 CC(=O)C(Br)C(C)=O Amb22000680 [0,0,0,0,0,0|2,0,2]=4 25 B7R0.16 CC(=O)C(Br)C(N)=O Amb24483263 [0,0,0,0,0,0|2,0,2]=4 26 B7R0.16 CC(=O)C(C)C(=O)S Amb25094430 [0,0,0,0,0,0|1,1,2]=4 27 B7R0.16 CC(=O)C(Cl)C(N)=O Amb24056422 [0,0,0,0,0,0|2,0,2]=4 28 B7R0.16 CC(=O)C(F)C(C)=O Amb19889779 [0,0,0,0,0,0|2,0,2]=4 29 B7R0.16 CC(=O)C(F)C(F)F Amb25697000 [0,0,0,0,0,0|4,0,0]=4 30 B7R0.16 CC(=O)C(N)C(O)=O Amb21962887 [0,0,0,0,0,0|0,0,2]=2 31 B7R0.16 CC(=O)C(O)C(C)=C Amb24614054 [0,0,0,0,0,0|3,0,1]=4 32 B7R0.16 CC(=O)C(S)=C(C)O Amb25327947 [0,0,0,0,0,0|2,0,2]=4 33 B7R0.16 CC(=O)\C(\F)=C(\C)/O Amb24571214 [0,0,0,0,0,0|2,0,2]=4 34 B7R0.16 CC(Br)C(=O)C(O)=O Amb23400913 [0,0,0,0,0,0|2,0,1]=3 35 B7R0.16 CC(Br)C(=O)C([O-])=O Amb19516024 [0,0,0,0,0,0|2,0,2]=4 36 B7R0.16 CC(Br)C(Br)[N+]([O-])=O Amb24545947 [0,0,0,0,0,0|3,0,1]=4 37 B7R0.16 CC(Br)C(Cl)C(C)O Amb25232311 [0,0,0,0,0,0|3,0,1]=4 38 B7R0.16 CC(Br)C(N)C(O)=O Amb25775046 [0,0,0,0,0,0|1,0,0]=1 39 B7R0.16 CC(C(=C)Br)C(O)=O Amb24483212 [0,0,0,0,0,0|2,0,2]=4 40 B7R0.16 CC(C(=C)C(=O)O)C Amb17593189 [0,0,0,0,0,0|2,0,1]=3 41 B7R0.16 CC(C(=O)C)C(=O)C Amb1152249 [0,0,0,0,0,0|2,0,2]=4 42 B7R0.16 CC(C(=O)N)C(=O)C Amb10552518 [0,0,0,0,0,0|2,0,2]=4 43 B7R0.16 CC(C(=O)O)C(=O)C Amb10601660 [0,0,0,0,0,0|1,0,2]=3 44 B7R0.16 CC(C(=O)O)C(C)C Amb17087469 [0,0,0,0,0,0|2,0,0]=2 45 B7R0.16 CC(C(C(=O)C)Br)C Amb2389580 [0,0,0,0,0,0|3,0,0]=3 46 B7R0.16 CC(C(C(=O)C)C)O Amb17593202 [0,0,0,0,0,0|2,0,0]=2 47 B7R0.16 CC(C(C(=O)O)Br)O Amb17594710 [0,0,0,0,0,0|1,0,0]=1 48 B7R0.16 CC(C(C(=O)O)C)O Amb17615515 [0,0,0,0,0,0|1,0,0]=1 49 B7R0.16 CC(C(C(=O)O)Cl)O Amb17593522 [0,0,0,0,0,0|1,0,0]=1 50 B7R0.16 CC(C(C(=O)O)N)F Amb10838661 [0,0,0,0,0,0|1,0,0]=1 51 B7R0.16 CC(C(C(=O)O)N)S Amb17593434 [0,0,0,0,0,0|0,1,0]=1 52 B7R0.16 CC(C(C(F)F)N)N Amb13953209 [0,0,0,0,0,0|3,0,1]=4 53 B7R0.16 CC(C(C)=O)S(C)=O Amb24481498 [0,0,0,0,0,0|3,0,1]=4 54 B7R0.16 CC(C(C)Br)C(O)=O Amb25111271 [0,0,0,0,0,0|2,0,0]=2 55 B7R0.16 CC(C(C)Cl)C(N)=O Amb25785669 [0,0,0,0,0,0|3,0,0]=3 56 B7R0.16 CC(C(C)N)C(C)=O Amb24411022 [0,0,0,0,0,0|3,0,0]=3 57 B7R0.16 CC(C(C)N)C(C)O Amb25293031 [0,0,0,0,0,0|3,0,1]=4 58 B7R0.16 CC(C(C)N)C(O)=O Amb18124261 [0,0,0,0,0,0|2,0,0]=2 59 B7R0.16 CC(C(C)O)C(N)=O Amb24481579 [0,0,0,0,0,0|2,0,0]=2 60 B7R0.16 CC(C(C)O)C(N)=S Amb24583963 [0,0,0,0,0,0|2,1,0]=3 61 B7R0.16 CC(C(C)S)C(O)=O Amb25842057 [0,0,0,0,0,0|1,1,0]=2 62 B7R0.16 CC(C(N)=O)N(C)C Amb25679024 [0,0,0,0,0,0|4,0,0]=4 63 B7R0.16 CC(C(N)=S)C(O)=O Amb24745670 [0,0,0,0,0,0|2,1,1]=4 64 B7R0.16 CC(C(O)=O)=C(C)Br Amb24557990 [0,0,0,0,0,0|2,0,2]=4 65 B7R0.16 CC(C(O)=O)=C(C)Cl Amb24481381 [0,0,0,0,0,0|2,0,2]=4 66 B7R0.16 CC(C(O)=O)=C(C)N Amb24527948 [0,0,0,0,0,0|2,0,2]=4 67 B7R0.16 CC(C(O)=O)N(C)Br Amb24743147 [0,0,0,0,0,0|3,0,0]=3 68 B7R0.16 CC(C(O)=O)N(C)C Amb21955631 [0,0,0,0,0,0|3,0,0]=3 69 B7R0.16 CC(C(O)=O)N(C)N Amb22372039 [0,0,0,0,0,0|3,0,0]=3 70 B7R0.16 CC(C(O)=O)N(C)O Amb24714002 [0,0,0,0,0,0|2,0,0]=2 71 B7R0.16 CC(C(O)=O)S(C)=O Amb18950743 [0,0,0,0,0,0|2,0,1]=3 72 B7R0.16 CC(C(O)=O)S(O)=O Amb25680146 [0,0,0,0,0,0|3,0,0]=3 73 B7R0.16 CC(C(O)C)C(O)C Amb2583260 [0,0,0,0,0,0|2,0,1]=3 74 B7R0.16 CC(C)=C(Cl)C(O)=O Amb18642954 [0,0,0,0,0,0|2,0,2]=4 75 B7R0.16 CC(C)=C(F)C(C)O Amb25220424 [0,0,0,0,0,0|3,0,1]=4 76 B7R0.16 CC(C)=C(F)C(O)=O Amb20669103 [0,0,0,0,0,0|2,0,2]=4 77 B7R0.16 CC(C)=C(S)C(O)=O Amb25360161 [0,0,0,0,0,0|2,0,2]=4 78 B7R0.16 CC(C)C(=C)C(N)=O Amb24709685 [0,0,0,0,0,0|3,0,1]=4 79 B7R0.16 CC(C)C(=S)C(O)=O Amb25244596 [0,0,0,0,0,0|2,0,1]=3 80 B7R0.16 CC(C)C(Br)C(Br)=O Amb17666947 [0,0,0,0,0,0|3,0,0]=3 81 B7R0.16 CC(C)C(Br)C(N)=S Amb24524277 [0,0,0,0,0,0|3,1,0]=4 82 B7R0.16 CC(C)C(C)C(C)=C Amb24649761 [0,0,0,0,0,0|4,0,0]=4 83 B7R0.16 CC(C)C(C)C(C)=O Amb17940267 [0,0,0,0,0,0|3,0,0]=3 84 B7R0.16 CC(C)C(C)C(C)O Amb24640694 [0,0,0,0,0,0|3,0,1]=4 85 B7R0.16 CC(C)C(C)C(N)=O Amb25810126 [0,0,0,0,0,0|3,0,0]=3 86 B7R0.16 CC(C)C(C)S(C)=O Amb24528110 [0,0,0,0,0,0|4,0,0]=4 87 B7R0.16 CC(C)C(C)S([O-])=O Amb25685559 [0,0,0,0,0,0|3,0,1]=4 88 B7R0.16 CC(C)C(Cl)C(=C)Cl Amb25360075 [0,0,0,0,0,0|4,0,0]=4 89 B7R0.16 CC(C)C(Cl)C(=O)Cl Amb24483174 [0,0,0,0,0,0|3,0,0]=3 90 B7R0.16 CC(C)C(Cl)C(C)=C Amb24483132 [0,0,0,0,0,0|4,0,0]=4 91 B7R0.16 CC(C)C(Cl)C(C)=O Amb24483197 [0,0,0,0,0,0|3,0,0]=3 92 B7R0.16 CC(C)C(Cl)C(C)O Amb25124794 [0,0,0,0,0,0|3,0,1]=4 93 B7R0.16 CC(C)C(Cl)C(N)=O Amb25337426 [0,0,0,0,0,0|3,0,0]=3 94 B7R0.16 CC(C)C(Cl)S(C)=O Amb24482117 [0,0,0,0,0,0|4,0,0]=4 95 B7R0.16 CC(C)C(F)C(=O)Cl Amb25142402 [0,0,0,0,0,0|3,0,0]=3 96 B7R0.16 CC(C)C(F)C(N)=O Amb24616703 [0,0,0,0,0,0|3,0,0]=3 97 B7R0.16 CC(C)C(F)C(O)=O Amb19957386 [0,0,0,0,0,0|2,0,0]=2 98 B7R0.16 CC(C)C(N)B(O)O Amb24482349 [0,0,0,0,0,0|2,0,1]=3 99 B7R0.16 CC(C)C(N)C(=O)S Amb25064101 [0,0,0,0,0,0|1,1,0]=2 100 B7R0.16 CC(C)C(N)C(C)=C Amb18641748 [0,0,0,0,0,0|3,0,0]=3 101 B7R0.16 CC(C)C(N)C(C)=O Amb23536905 [0,0,0,0,0,0|2,0,0]=2 102 B7R0.16 CC(C)C(N)C(C)C Amb20668320 [0,0,0,0,0,0|3,0,1]=4 103 B7R0.16 CC(C)C(N)C(C)F Amb25339711 [0,0,0,0,0,0|3,0,1]=4 104 B7R0.16 CC(C)C(N)C(C)O Amb18641932 [0,0,0,0,0,0|2,0,1]=3 105 B7R0.16 CC(C)C(N)C(F)F Amb24054178 [0,0,0,0,0,0|3,0,1]=4 106 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [0,0,0,0,0,0|2,0,0]=2 107 B7R0.16 CC(C)C(N)C(N)=S Amb19148044 [0,0,0,0,0,0|2,1,0]=3 108 B7R0.16 CC(C)C(N)[13C](O)=O Amb22338653 [0,0,0,0,0,0|1,0,0]=1 109 B7R0.16 CC(C)C(O)C(C)=O Amb25087800 [0,0,0,0,0,0|3,0,0]=3 110 B7R0.16 CC(C)C(O)C(N)=N Amb24447862 [0,0,0,0,0,0|4,0,0]=4 111 B7R0.16 CC(C)C(O)C(N)=O Amb25124434 [0,0,0,0,0,0|3,0,0]=3 112 B7R0.16 CC(C)C(S)C(N)=O Amb25315643 [0,0,0,0,0,0|3,0,0]=3 113 B7R0.16 CC(C)C(S)C(O)=O Amb18282761 [0,0,0,0,0,0|2,0,0]=2 114 B7R0.16 CC(C)C([15NH2])C(O)=O Amb22363191 [0,0,0,0,0,0|1,0,0]=1 115 B7R0.16 CC(C)N(C)C(=O)Cl Amb25807313 [0,0,0,0,0,0|4,0,0]=4 116 B7R0.16 CC(C)N(N)C(N)=O Amb24679360 [0,0,0,0,0,0|3,0,0]=3 117 B7R0.16 CC(C)N(O)C(N)=O Amb18202545 [0,0,0,0,0,0|4,0,0]=4 118 B7R0.16 CC(C)[13CH](N)C(O)=O Amb22367349 [0,0,0,0,0,0|1,0,0]=1 119 B7R0.16 CC(C)[C@@H](Br)C(=O)Cl Amb25708357 [0,0,0,0,0,0|3,0,0]=3 120 B7R0.16 CC(C)[C@@H](C)C(C)=O Amb24753185 [0,0,0,0,0,0|3,0,0]=3 121 B7R0.16 CC(C)[C@@H](Cl)B(O)O Amb25109627 [0,0,0,0,0,0|3,0,1]=4 122 B7R0.16 CC(C)[C@@H](Cl)C(O)=O Amb22353101 [0,0,0,0,0,0|2,0,0]=2 123 B7R0.16 CC(C)[C@@H](F)C(O)=O Amb25083215 [0,0,0,0,0,0|2,0,0]=2 124 B7R0.16 CC(C)[C@@H](N)C(C)=O Amb25757023 [0,0,0,0,0,0|2,0,0]=2 125 B7R0.16 CC(C)[C@@H](N)C(C)O Amb24575417 [0,0,0,0,0,0|2,0,1]=3 126 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [0,0,0,0,0,0|2,0,0]=2 127 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [0,0,0,0,0,0|2,0,0]=2 128 B7R0.16 CC(C)[C@@H](N)C(O)=O Amb22746777 [0,0,0,0,0,0|1,0,0]=1 129 B7R0.16 CC(C)[C@@H](N)[C@@H](C)O Amb24540375 [0,0,0,0,0,0|2,0,1]=3 130 B7R0.16 CC(C)[C@@H](N)[C@H](C)N Amb24713159 [0,0,0,0,0,0|3,0,1]=4 131 B7R0.16 CC(C)[C@@H](O)C(C)=O Amb24379445 [0,0,0,0,0,0|3,0,0]=3 132 B7R0.16 CC(C)[C@@H](O)[C@H](C)O Amb24332475 [0,0,0,0,0,0|3,0,1]=4 133 B7R0.16 CC(C)[C@@H](S)C(O)=O Amb25320674 [0,0,0,0,0,0|2,0,0]=2 134 B7R0.16 CC(C)[C@H](N)C(=O)Cl Amb25679283 [0,0,0,0,0,0|2,0,0]=2 135 B7R0.16 CC(C)[C@H](N)C(=O)S Amb24427323 [0,0,0,0,0,0|1,1,0]=2 136 B7R0.16 CC(C)[C@H](N)C(C)F Amb25325181 [0,0,0,0,0,0|3,0,1]=4 137 B7R0.16 CC(C)[C@H](N)C(F)F Amb25291007 [0,0,0,0,0,0|3,0,1]=4 138 B7R0.16 CC(C)[C@H](N)C(N)=S Amb24714667 [0,0,0,0,0,0|2,1,0]=3 139 B7R0.16 CC(C)[C@H](N)C(O)=O Amb22351111 [0,0,0,0,0,0|1,0,0]=1 140 B7R0.16 CC(C)[C@H](N)[13C](O)=O Amb22354046 [0,0,0,0,0,0|1,0,0]=1 141 B7R0.16 CC(C)[C@H](N)[C@@H](C)O Amb24611787 [0,0,0,0,0,0|2,0,1]=3 142 B7R0.16 CC(C)[C@H](O)C(=O)Cl Amb25285621 [0,0,0,0,0,0|3,0,0]=3 143 B7R0.16 CC(C)[C@H](O)C(C)=O Amb25723739 [0,0,0,0,0,0|3,0,0]=3 144 B7R0.16 CC(C)[C@H](O)[C@@H](C)O Amb24591386 [0,0,0,0,0,0|3,0,1]=4 145 B7R0.16 CC(C)[C@H](O)[C@H](C)O Amb25043671 [0,0,0,0,0,0|3,0,1]=4 146 B7R0.16 CC(C)[C@H](S)C(O)=O Amb25662094 [0,0,0,0,0,0|2,0,0]=2 147 B7R0.16 CC(Cl)=C(Cl)C(O)=O Amb25272743 [0,0,0,0,0,0|2,0,2]=4 148 B7R0.16 CC(Cl)C(=C)C(O)=O Amb24701921 [0,0,0,0,0,0|2,0,1]=3 149 B7R0.16 CC(Cl)C(C)C(=O)Cl Amb25209986 [0,0,0,0,0,0|3,0,0]=3 150 B7R0.16 CC(Cl)C(Cl)C(C)=O Amb25713717 [0,0,0,0,0,0|3,0,0]=3 151 B7R0.16 CC(Cl)C(Cl)C(N)=O Amb24357982 [0,0,0,0,0,0|3,0,0]=3 152 B7R0.16 CC(Cl)C(Cl)S(=O)Cl Amb25232963 [0,0,0,0,0,0|4,0,0]=4 153 B7R0.16 CC(Cl)C(N)C(C)Cl Amb24634266 [0,0,0,0,0,0|3,0,1]=4 154 B7R0.16 CC(Cl)C(N)C(O)=O Amb25269614 [0,0,0,0,0,0|1,0,0]=1 155 B7R0.16 CC(Cl)C(O)C(C)=C Amb25257975 [0,0,0,0,0,0|4,0,0]=4 156 B7R0.16 CC(Cl)C(O)C(O)=O Amb25222028 [0,0,0,0,0,0|2,0,0]=2 157 B7R0.16 CC(F)C(Br)C(O)=O Amb25304346 [0,0,0,0,0,0|2,0,0]=2 158 B7R0.16 CC(F)C(F)C(O)=O Amb24687273 [0,0,0,0,0,0|2,0,0]=2 159 B7R0.16 CC(F)C(O)C(O)=O Amb24385715 [0,0,0,0,0,0|2,0,0]=2 160 B7R0.16 CC(N(C(=O)N)C)C Amb1132046 [0,0,0,0,0,0|4,0,0]=4 161 B7R0.16 CC(N)C(N)C(O)=O Amb17678795 [0,0,0,0,0,0|1,0,0]=1 162 B7R0.16 CC(N)C(N)C(O)=O Amb22728051 [0,0,0,0,0,0|1,0,0]=1 163 B7R0.16 CC(N)C(O)C(C)=C Amb24525272 [0,0,0,0,0,0|4,0,0]=4 164 B7R0.16 CC(N)C(O)C(O)=O Amb18641970 [0,0,0,0,0,0|2,0,0]=2 165 B7R0.16 CC(N)[C@H](N)C(O)=O Amb25083113 [0,0,0,0,0,0|1,0,0]=1 166 B7R0.16 CC(O)=C(O)C(C)O Amb25227909 [0,0,0,0,0,0|2,0,1]=3 167 B7R0.16 CC(O)C(=C)C(C)O Amb25788463 [0,0,0,0,0,0|2,0,2]=4 168 B7R0.16 CC(O)C(=C)C(N)=O Amb24694487 [0,0,0,0,0,0|2,0,1]=3 169 B7R0.16 CC(O)C(=O)C(C)O Amb24665807 [0,0,0,0,0,0|2,0,2]=4 170 B7R0.16 CC(O)C(=O)C(O)=O Amb24481396 [0,0,0,0,0,0|1,0,1]=2 171 B7R0.16 CC(O)C(F)C(F)F Amb24457779 [0,0,0,0,0,0|3,0,1]=4 172 B7R0.16 CC(O)C(N)C(C)=O Amb25026434 [0,0,0,0,0,0|1,0,0]=1 173 B7R0.16 CC(O)C(N)C(C)O Amb24374632 [0,0,0,0,0,0|1,0,1]=2 174 B7R0.16 CC(O)C(N)C(N)=O Amb18641954 [0,0,0,0,0,0|1,0,0]=1 175 B7R0.16 CC(O)C(N)P(O)=O Amb24428649 [0,0,0,0,0,0|1,0,0]=1 176 B7R0.16 CC(O)C(N)P(O)O Amb25305040 [0,0,0,0,0,0|1,0,1]=2 177 B7R0.16 CC(O)C(O)C(O)=O Amb18124272 [0,0,0,0,0,0|1,0,0]=1 178 B7R0.16 CC(O)C(O)C(O)O Amb25792462 [0,0,0,0,0,0|1,0,2]=3 179 B7R0.16 CC(O)N(C)C(O)=O Amb22641864 [0,0,0,0,0,0|2,0,0]=2 180 B7R0.16 CC(O)[C@@H](C)C(O)=O Amb25857406 [0,0,0,0,0,0|1,0,0]=1 181 B7R0.16 CC(S)C(Cl)C(N)=O Amb24483091 [0,0,0,0,0,0|2,1,0]=3 182 B7R0.16 CC(S)[C@@H](N)C(O)=O Amb24606864 [0,0,0,0,0,0|0,1,0]=1 183 B7R0.16 CC(S)[C@H](N)C(O)=O Amb25684204 [0,0,0,0,0,0|0,1,0]=1 184 B7R0.16 CC([C@@H](C)N)C(O)=O Amb24680995 [0,0,0,0,0,0|2,0,0]=2 185 B7R0.16 CN(C)C(=N)C(O)=O Amb18641880 [0,0,0,0,0,0|2,0,2]=4 186 B7R0.16 CN(C)C(=S)C(O)=O Amb24068793 [0,0,0,0,0,0|3,0,1]=4 187 B7R0.16 CN(C)C(N)C(O)=O Amb24746695 [0,0,0,0,0,0|2,0,0]=2 188 B7R0.16 C[C@@H](C(=O)O)C(C)C Amb10844600 [0,0,0,0,0,0|2,0,0]=2 189 B7R0.16 C[C@@H](C(N)=O)N(C)C Amb25031426 [0,0,0,0,0,0|4,0,0]=4 190 B7R0.16 C[C@@H](C(O)=O)N(C)C Amb22587534 [0,0,0,0,0,0|3,0,0]=3 191 B7R0.16 C[C@@H](C(O)=O)N(C)Cl Amb24640409 [0,0,0,0,0,0|3,0,0]=3 192 B7R0.16 C[C@@H](Cl)[C@@H](Br)C(O)=O Amb24526448 [0,0,0,0,0,0|2,0,0]=2 193 B7R0.16 C[C@@H](Cl)[C@@H](O)C(O)=O Amb24445574 [0,0,0,0,0,0|2,0,0]=2 194 B7R0.16 C[C@@H](F)[C@H](N)C(O)=O Amb25789807 [0,0,0,0,0,0|1,0,0]=1 195 B7R0.16 C[C@@H](N)[C@@H](N)C(O)=O Amb22745396 [0,0,0,0,0,0|1,0,0]=1 196 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb22745441 [0,0,0,0,0,0|1,0,0]=1 197 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb24481409 [0,0,0,0,0,0|1,0,0]=1 198 B7R0.16 C[C@@H](O)C(C)C(O)=O Amb24469914 [0,0,0,0,0,0|1,0,0]=1 199 B7R0.16 C[C@@H](O)C(N)C(C)O Amb24394814 [0,0,0,0,0,0|1,0,1]=2 200 B7R0.16 C[C@@H](O)[13C@H](N)[13C](O)=O Amb22336905 [0,0,0,0,0,0|0,0,0]=0 201 B7R0.16 C[C@@H](O)[C@@H](C)C(O)=O Amb24481394 [0,0,0,0,0,0|1,0,0]=1 202 B7R0.16 C[C@@H](O)[C@@H](N)C(C)=O Amb25238428 [0,0,0,0,0,0|1,0,0]=1 203 B7R0.16 C[C@@H](O)[C@@H](O)C(C)=O Amb24701454 [0,0,0,0,0,0|2,0,0]=2 204 B7R0.16 C[C@@H](O)[C@H](F)C(O)=O Amb24470562 [0,0,0,0,0,0|1,0,0]=1 205 B7R0.16 C[C@@H](O)[C@H](N)C(C)O Amb25141789 [0,0,0,0,0,0|1,0,1]=2 206 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O Amb17942942 [0,0,0,0,0,0|1,0,0]=1 207 B7R0.16 C[C@@H](O)[C@H](N)C(O)=O Amb22351168 [0,0,0,0,0,0|0,0,0]=0 208 B7R0.16 C[C@@H](O)[C@H](O)C(C)=O Amb24481484 [0,0,0,0,0,0|2,0,0]=2 209 B7R0.16 C[C@@H](O)[C@H]([15NH2])C(O)=O Amb22353591 [0,0,0,0,0,0|0,0,0]=0 210 B7R0.16 C[C@@H](S)[C@@H](N)C(O)=O Amb24333717 [0,0,0,0,0,0|0,1,0]=1 211 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24117242 [0,0,0,0,0,0|0,1,0]=1 212 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24726915 [0,0,0,0,0,0|0,1,0]=1 213 B7R0.16 C[C@@H]([C@@H](C)N)C(O)=O Amb24410324 [0,0,0,0,0,0|2,0,0]=2 214 B7R0.16 C[C@@H]([C@@H](C)O)C(=C)Br Amb25144623 [0,0,0,0,0,0|3,0,0]=3 215 B7R0.16 C[C@@H]([C@H](C(=O)O)C)O Amb10844569 [0,0,0,0,0,0|1,0,0]=1 216 B7R0.16 C[C@@H]([C@H](C)O)C(C)=C Amb25091688 [0,0,0,0,0,0|3,0,0]=3 217 B7R0.16 C[C@H](Br)[C@H](N)C(O)=O Amb24711401 [0,0,0,0,0,0|1,0,0]=1 218 B7R0.16 C[C@H](C(=O)O)C(C)C Amb10844601 [0,0,0,0,0,0|2,0,0]=2 219 B7R0.16 C[C@H](C(N)=O)N(C)C Amb24687546 [0,0,0,0,0,0|4,0,0]=4 220 B7R0.16 C[C@H](C(O)=O)N(C)C Amb22586633 [0,0,0,0,0,0|3,0,0]=3 221 B7R0.16 C[C@H](F)[C@H](N)C(O)=O Amb25805291 [0,0,0,0,0,0|1,0,0]=1 222 B7R0.16 C[C@H](N)C(=C)C(O)=O Amb24631906 [0,0,0,0,0,0|2,0,1]=3 223 B7R0.16 C[C@H](N)C(O)C(N)=O Amb24431514 [0,0,0,0,0,0|3,0,0]=3 224 B7R0.16 C[C@H](N)C(O)C(O)=O Amb24649032 [0,0,0,0,0,0|2,0,0]=2 225 B7R0.16 C[C@H](N)[C@@H](F)C(N)=O Amb25825111 [0,0,0,0,0,0|3,0,0]=3 226 B7R0.16 C[C@H](N)[C@@H](F)C(O)=O Amb25293984 [0,0,0,0,0,0|2,0,0]=2 227 B7R0.16 C[C@H](N)[C@@H](N)C(O)=O Amb17678796 [0,0,0,0,0,0|1,0,0]=1 228 B7R0.16 C[C@H](N)[C@H](F)C(N)=O Amb24483015 [0,0,0,0,0,0|3,0,0]=3 229 B7R0.16 C[C@H](N)[C@H](N)C(O)=O Amb17678797 [0,0,0,0,0,0|1,0,0]=1 230 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb19929490 [0,0,0,0,0,0|2,0,0]=2 231 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb24407396 [0,0,0,0,0,0|2,0,0]=2 232 B7R0.16 C[C@H](O)C(=C)[C@H](C)O Amb25741466 [0,0,0,0,0,0|2,0,2]=4 233 B7R0.16 C[C@H](O)C(N)C(O)=O Amb24377632 [0,0,0,0,0,0|0,0,0]=0 234 B7R0.16 C[C@H](O)[C@@H](O)C(C)=C Amb24719527 [0,0,0,0,0,0|3,0,0]=3 235 B7R0.16 C[C@H](O)[C@@H](O)C(O)=O Amb25844932 [0,0,0,0,0,0|1,0,0]=1 236 B7R0.16 C[C@H](O)[C@H](N)C(N)=O Amb25746274 [0,0,0,0,0,0|1,0,0]=1 237 B7R0.16 C[C@H](O)[C@H](O)C(=C)Br Amb25333755 [0,0,0,0,0,0|3,0,0]=3 238 B7R0.16 C[C@H](O)[C@H](O)C(C)=C Amb24688259 [0,0,0,0,0,0|3,0,0]=3 239 B7R0.16 C[C@H](S)[C@H](N)C(O)=O Amb25131648 [0,0,0,0,0,0|0,1,0]=1 240 B7R0.16 C[C@H]([C@@H](C(=O)N)N)O Amb16183845 [0,0,0,0,0,0|1,0,0]=1 241 B7R0.16 C[C@H]([C@@H](C(=O)O)C)O Amb10844572 [0,0,0,0,0,0|1,0,0]=1 242 B7R0.16 C[C@H]([C@@H](C)N)C(C)=O Amb25254240 [0,0,0,0,0,0|3,0,0]=3 243 B7R0.16 C[C@H]([C@@H](C)N)C(O)=O Amb25679842 [0,0,0,0,0,0|2,0,0]=2 244 B7R0.16 C[C@H]([C@@H](C)O)C(C)=O Amb25144117 [0,0,0,0,0,0|2,0,0]=2 245 B7R0.16 C[C@H]([C@@H](C)O)N(C)C Amb25306535 [0,0,0,0,0,0|4,0,0]=4 246 B7R0.16 C[C@H]([C@@H]([13C](=O)O)N)O Amb17620634 [0,0,0,0,0,0|0,0,0]=0 247 B7R0.16 C[C@H]([C@H](C)N)[C@@H](C)O Amb25242605 [0,0,0,0,0,0|3,0,1]=4 248 B7R0.16 C[C@H]([C@H](C)O)S(C)=O Amb24332098 [0,0,0,0,0,0|3,0,0]=3 249 B7R0.16 C[C@H]([C@H](C)O)[C@@H](C)O Amb24445952 [0,0,0,0,0,0|2,0,1]=3 250 B7R0.16 C[C@H]([C@H](C)S)C(O)=O Amb24481380 [0,0,0,0,0,0|1,1,0]=2 251 B7R0.16 C\C(\C(O)=O)=C(\C)/Br Amb18124498 [0,0,0,0,0,0|2,0,2]=4 252 B7R0.16 C\C(\O)=C(/O)\C(C)O Amb24364699 [0,0,0,0,0,0|2,0,1]=3 253 B7R0.16 C\C(\O)=C(\N)/C(O)=O Amb25320750 [0,0,0,0,0,0|0,0,2]=2 254 B7R0.16 Cl[C@H](C(=O)O)C(C)C Amb16232072 [0,0,0,0,0,0|2,0,0]=2 255 B7R0.16 N=C(C(O)=O)C(O)=O Amb24334530 [0,0,0,0,0,0|1,0,3]=4 256 B7R0.16 NC(=O)C(Cl)C(O)=O Amb25756168 [0,0,0,0,0,0|2,0,2]=4 257 B7R0.16 NC(=O)C(F)C(O)=O Amb25376646 [0,0,0,0,0,0|2,0,2]=4 258 B7R0.16 NC(=O)C(N)C(O)=O Amb24552728 [0,0,0,0,0,0|1,0,2]=3 259 B7R0.16 NC(=O)C(O)C(O)=O Amb24548669 [0,0,0,0,0,0|2,0,2]=4 260 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,0,0,0,0,0|1,0,1]=2 261 B7R0.16 NC(C(Cl)Cl)C(O)=O Amb24433439 [0,0,0,0,0,0|2,0,0]=2 262 B7R0.16 NC(C(F)F)C(O)=O Amb24713127 [0,0,0,0,0,0|2,0,0]=2 263 B7R0.16 NC(C(O)=O)S(O)=O Amb24464759 [0,0,0,0,0,0|2,0,0]=2 264 B7R0.16 NC(C(O)O)C(O)=O Amb25682498 [0,0,0,0,0,0|1,0,0]=1 265 B7R0.16 N[C@@H](C(Cl)Cl)C(O)=O Amb25101008 [0,0,0,0,0,0|2,0,0]=2 266 B7R0.16 N[C@@H](C(F)F)C(O)=O Amb24433723 [0,0,0,0,0,0|2,0,0]=2 267 B7R0.16 N[C@H](C(=O)N)C(C)C Amb16183986 [0,0,0,0,0,0|2,0,0]=2 268 B7R0.16 N[C@H](C(=O)N)C(C)C Amb16231400 [0,0,0,0,0,0|2,0,0]=2 269 B7R0.16 N[C@H](C(F)F)C(O)=O Amb24659125 [0,0,0,0,0,0|2,0,0]=2 270 B7R0.16 OC(=O)C(=O)C(Br)Br Amb24179214 [0,0,0,0,0,0|3,0,1]=4 271 B7R0.16 OC(=O)C(=O)C(Cl)Cl Amb24652562 [0,0,0,0,0,0|3,0,1]=4 272 B7R0.16 OC(=O)C(=O)C(F)Br Amb25111221 [0,0,0,0,0,0|3,0,1]=4 273 B7R0.16 OC(=O)C(=O)C(O)=O Amb18641943 [0,0,0,0,0,0|2,0,2]=4 274 B7R0.16 OC(=O)C(=O)C(O)=O Amb22230802 [0,0,0,0,0,0|2,0,2]=4 275 B7R0.16 OC(=O)C(=S)C(O)=O Amb24544781 [0,0,0,0,0,0|2,0,2]=4 276 B7R0.16 OC(=O)C(Cl)C(Cl)Cl Amb24426145 [0,0,0,0,0,0|3,0,0]=3 277 B7R0.16 OC(=O)C(Cl)C(O)=O Amb18643353 [0,0,0,0,0,0|2,0,1]=3 278 B7R0.16 OC(=O)C(F)C(O)=O Amb24055884 [0,0,0,0,0,0|2,0,1]=3 279 B7R0.16 OC(C(=O)O)C(=O)O Amb1215315 [0,0,0,0,0,0|2,0,1]=3 280 B7R0.16 OC(C(=O)O)C(C)C Amb2582547 [0,0,0,0,0,0|2,0,0]=2 281 B7R0.16 OC(C(F)F)C(O)=O Amb25074883 [0,0,0,0,0,0|3,0,0]=3 282 B7R0.16 OC(C(O)=O)S(O)=O Amb24551214 [0,0,0,0,0,0|3,0,0]=3 283 B7R0.16 O[C@@H](C(=O)O)C(C)C Amb10071589 [0,0,0,0,0,0|2,0,0]=2 284 B7R0.16 [13CH3]C([13CH3])C(=O)C([O-])=O Amb22353581 [0,0,0,0,0,0|2,0,2]=4 285 B7R0.16 [13CH3]C([13CH3])[13C](=O)[13C]([O-])=O Amb22338387 [0,0,0,0,0,0|2,0,2]=4 286 B7R0.16 [13CH3][13C@@H](O)[13C@H]([15NH2])[13C](O)=O Amb22353590 [0,0,0,0,0,0|0,0,0]=0 287 B7R0.16 [13CH3][13CH]([13CH3])[13C@H]([15NH2])[13C](O)=O Amb22338876 [0,0,0,0,0,0|1,0,0]=1 288 B7R0.16 [14CH3][14CH](O)[14CH](N)[14C](O)=O Amb22352529 [0,0,0,0,0,0|0,0,0]=0 289 B6R0.2 C=C(Br)CC(O)=O Amb24479176 [1,0,0,0,0,0|1,0,2]=4 290 B6R0.2 CC(=C)CC(=O)C Amb17593075 [1,0,0,0,0,0|2,0,1]=4 291 B6R0.2 CC(=CC(=O)O)C Amb1485519 [1,0,0,0,0,0|1,0,2]=4 292 B6R0.2 CC(=N)CC(N)=O Amb25259783 [1,0,0,0,0,0|2,0,1]=4 293 B6R0.2 CC(=O)CC(=O)Br Amb24422459 [1,0,0,0,0,0|1,0,2]=4 294 B6R0.2 CC(=O)CC(C)=N Amb22345922 [1,0,0,0,0,0|2,0,1]=4 295 B6R0.2 CC(=O)CC(C)=O Amb22727963 [1,0,0,0,0,0|1,0,2]=4 296 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [1,0,0,0,0,0|1,0,1]=3 297 B6R0.2 CC(=O)CC(C)[O-] Amb22729909 [1,0,0,0,0,0|1,0,1]=3 298 B6R0.2 CC(=O)CC(Cl)Cl Amb24476084 [1,0,0,0,0,0|3,0,0]=4 299 B6R0.2 CC(=O)CC(F)F Amb24669174 [1,0,0,0,0,0|3,0,0]=4 300 B6R0.2 CC(=O)CC(O)=O Amb22348460 [1,0,0,0,0,0|0,0,2]=3 301 B6R0.2 CC(=O)CC(O)=S Amb24689856 [1,0,0,0,0,0|0,1,2]=4 302 B6R0.2 CC(=O)CC(O)O Amb25273111 [1,0,0,0,0,0|2,0,0]=3 303 B6R0.2 CC(=O)CC([O-])=O Amb22265051 [1,0,0,0,0,0|0,0,3]=4 304 B6R0.2 CC(=O)CS(C)=O Amb25025354 [1,0,0,0,0,0|2,0,1]=4 305 B6R0.2 CC(=O)C[S+](C)C Amb24614662 [1,0,0,0,0,0|3,0,0]=4 306 B6R0.2 CC(=S)CC(N)=O Amb24479846 [1,0,0,0,0,0|1,1,1]=4 307 B6R0.2 CC(Br)=CC(O)=O Amb25347173 [1,0,0,0,0,0|1,0,2]=4 308 B6R0.2 CC(Br)CC(C)=C Amb24365286 [1,0,0,0,0,0|3,0,0]=4 309 B6R0.2 CC(Br)CC(C)O Amb25139315 [1,0,0,0,0,0|2,0,1]=4 310 B6R0.2 CC(Br)CC(N)=N Amb25700372 [1,0,0,0,0,0|3,0,0]=4 311 B6R0.2 CC(Br)CC(N)=O Amb24635749 [1,0,0,0,0,0|2,0,0]=3 312 B6R0.2 CC(Br)OC(C)=O Amb19958925 [1,0,0,0,0,0|3,0,0]=4 313 B6R0.2 CC(C)CC(=C)Br Amb22583739 [1,0,0,0,0,0|3,0,0]=4 314 B6R0.2 CC(C)CC([O-])=O Amb22732147 [1,0,0,0,0,0|1,0,1]=3 315 B6R0.2 CC(C)CC([O-])=O Amb22732282 [1,0,0,0,0,0|1,0,1]=3 316 B6R0.2 CC(C)CC([O-])=O Amb22734041 [1,0,0,0,0,0|1,0,1]=3 317 B6R0.2 CC(C)CC([O-])=O Amb22734425 [1,0,0,0,0,0|1,0,1]=3 318 B6R0.2 CC(C)CS(N)=O Amb24527860 [1,0,0,0,0,0|3,0,0]=4 319 B6R0.2 CC(C)CS([O-])=O Amb19930010 [1,0,0,0,0,0|2,0,1]=4 320 B6R0.2 CC(C)C[13C](O)=O Amb22336513 [1,0,0,0,0,0|1,0,0]=2 321 B6R0.2 CC(C)C[13C]([O-])=O Amb22336662 [1,0,0,0,0,0|1,0,1]=3 322 B6R0.2 CC(C)C[N+]([O-])=O Amb17672613 [1,0,0,0,0,0|2,0,1]=4 323 B6R0.2 CC(C)NC(=O)F Amb24567697 [1,0,0,0,0,0|3,0,0]=4 324 B6R0.2 CC(C)OC(=C)O Amb24086570 [1,0,0,0,0,0|3,0,0]=4 325 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [1,0,0,0,0,0|3,0,0]=4 326 B6R0.2 CC(C)SC(N)=O Amb24461669 [1,0,0,0,0,0|3,0,0]=4 327 B6R0.2 CC(CC(=C)C)O Amb17593083 [1,0,0,0,0,0|2,0,0]=3 328 B6R0.2 CC(CC(=N)N)C Amb10066934 [1,0,0,0,0,0|3,0,0]=4 329 B6R0.2 CC(CC(=O)C)Cl Amb17593234 [1,0,0,0,0,0|2,0,0]=3 330 B6R0.2 CC(CC(=O)C)N Amb2583230 [1,0,0,0,0,0|2,0,0]=3 331 B6R0.2 CC(CC(=O)C)O Amb17593091 [1,0,0,0,0,0|1,0,0]=2 332 B6R0.2 CC(CC(Cl)C)O Amb17593253 [1,0,0,0,0,0|2,0,1]=4 333 B6R0.2 CC(CC(O)C)O Amb10068523 [1,0,0,0,0,0|1,0,1]=3 334 B6R0.2 CC(Cl)CC(C)=C Amb24558200 [1,0,0,0,0,0|3,0,0]=4 335 B6R0.2 CC(Cl)CP(O)O Amb25061243 [1,0,0,0,0,0|2,0,1]=4 336 B6R0.2 CC(Cl)NC(=O)Cl Amb24480662 [1,0,0,0,0,0|3,0,0]=4 337 B6R0.2 CC(Cl)OC(C)=O Amb24058273 [1,0,0,0,0,0|3,0,0]=4 338 B6R0.2 CC(Cl)OC(N)=O Amb24372683 [1,0,0,0,0,0|3,0,0]=4 339 B6R0.2 CC(Cl)SC(C)=O Amb24625146 [1,0,0,0,0,0|3,0,0]=4 340 B6R0.2 CC(F)=CC(O)=O Amb24676595 [1,0,0,0,0,0|1,0,2]=4 341 B6R0.2 CC(F)CC(O)=O Amb24561809 [1,0,0,0,0,0|1,0,0]=2 342 B6R0.2 CC(F)C[N+]([O-])=O Amb25024317 [1,0,0,0,0,0|2,0,1]=4 343 B6R0.2 CC(I)=CC(O)=O Amb24668934 [1,0,0,0,0,0|1,0,2]=4 344 B6R0.2 CC(I)CC(C)O Amb25743469 [1,0,0,0,0,0|2,0,1]=4 345 B6R0.2 CC(I)CC(N)=O Amb25783800 [1,0,0,0,0,0|2,0,0]=3 346 B6R0.2 CC(N)=CC(O)=O Amb25856437 [1,0,0,0,0,0|1,0,2]=4 347 B6R0.2 CC(N)CC(=O)Cl Amb25830663 [1,0,0,0,0,0|2,0,0]=3 348 B6R0.2 CC(N)CC(C)=C Amb25064223 [1,0,0,0,0,0|3,0,0]=4 349 B6R0.2 CC(N)CC(C)=O Amb22587050 [1,0,0,0,0,0|2,0,0]=3 350 B6R0.2 CC(N)CC(N)=N Amb25051498 [1,0,0,0,0,0|3,0,0]=4 351 B6R0.2 CC(N)CC(N)=O Amb18281237 [1,0,0,0,0,0|2,0,0]=3 352 B6R0.2 CC(N)CC(N)=S Amb25198821 [1,0,0,0,0,0|2,1,0]=4 353 B6R0.2 CC(N)CC(O)=O Amb19888354 [1,0,0,0,0,0|1,0,0]=2 354 B6R0.2 CC(NC(=O)N)C Amb1104587 [1,0,0,0,0,0|3,0,0]=4 355 B6R0.2 CC(O)=CC(O)O Amb24431523 [1,0,0,0,0,0|2,0,1]=4 356 B6R0.2 CC(O)C=C(C)C Amb22229846 [1,0,0,0,0,0|2,0,1]=4 357 B6R0.2 CC(O)C=C(Cl)Cl Amb25801932 [1,0,0,0,0,0|2,0,1]=4 358 B6R0.2 CC(O)CC(=C)Br Amb24618620 [1,0,0,0,0,0|2,0,0]=3 359 B6R0.2 CC(O)CC(C)N Amb18640217 [1,0,0,0,0,0|2,0,1]=4 360 B6R0.2 CC(O)CC(N)=S Amb24479794 [1,0,0,0,0,0|1,1,0]=3 361 B6R0.2 CC(O)CC(O)=O Amb22348403 [1,0,0,0,0,0|0,0,0]=1 362 B6R0.2 CC(O)CC(O)O Amb25716084 [1,0,0,0,0,0|0,0,2]=3 363 B6R0.2 CC(O)CC(S)=S Amb25215114 [1,0,0,0,0,0|0,2,0]=3 364 B6R0.2 CC(O)CP(O)=O Amb24406357 [1,0,0,0,0,0|1,0,0]=2 365 B6R0.2 CC(O)NC(N)=N Amb24736099 [1,0,0,0,0,0|3,0,0]=4 366 B6R0.2 CC(O)NC(N)=O Amb25811550 [1,0,0,0,0,0|2,0,0]=3 367 B6R0.2 CC(O)OC(C)O Amb25662319 [1,0,0,0,0,0|2,0,1]=4 368 B6R0.2 CC(O)OC(N)=O Amb24669632 [1,0,0,0,0,0|2,0,0]=3 369 B6R0.2 CC(O)SC(C)=O Amb24544015 [1,0,0,0,0,0|2,0,0]=3 370 B6R0.2 CC(O)\C=C(\C)/S Amb25800756 [1,0,0,0,0,0|1,1,1]=4 371 B6R0.2 CC(P)CC(C)O Amb25792365 [1,0,0,0,0,0|2,0,1]=4 372 B6R0.2 CC(S)CC(C)=O Amb24600676 [1,0,0,0,0,0|1,1,0]=3 373 B6R0.2 CC(S)CC(C)O Amb24122653 [1,0,0,0,0,0|1,1,1]=4 374 B6R0.2 CC(S)CC(N)=O Amb24479823 [1,0,0,0,0,0|1,1,0]=3 375 B6R0.2 CC(S)CC(O)=O Amb18281031 [1,0,0,0,0,0|0,1,0]=2 376 B6R0.2 CN(Br)CC(O)=O Amb25745878 [1,0,0,0,0,0|2,0,0]=3 377 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [1,0,0,0,0,0|3,0,0]=4 378 B6R0.2 CN(C)CC([O-])=O Amb22002291 [1,0,0,0,0,0|2,0,1]=4 379 B6R0.2 CN(C)CS(O)=O Amb25376029 [1,0,0,0,0,0|3,0,0]=4 380 B6R0.2 CN(CC(=O)N)C Amb17231806 [1,0,0,0,0,0|3,0,0]=4 381 B6R0.2 CN(C[C@@H](O)C)C Amb10844893 [1,0,0,0,0,0|3,0,0]=4 382 B6R0.2 CN(Cl)CC(O)=O Amb24455857 [1,0,0,0,0,0|2,0,0]=3 383 B6R0.2 CN(N)CC(O)=O Amb23592296 [1,0,0,0,0,0|2,0,0]=3 384 B6R0.2 CN(O)CC(O)=O Amb24732008 [1,0,0,0,0,0|1,0,0]=2 385 B6R0.2 CS(=O)CC(N)=O Amb24394100 [1,0,0,0,0,0|2,0,1]=4 386 B6R0.2 CS(=O)CC(O)=O Amb18957960 [1,0,0,0,0,0|1,0,1]=3 387 B6R0.2 CS(C)=CC(O)=O Amb25717234 [1,0,0,0,0,0|2,0,1]=4 388 B6R0.2 C[13CH](O)C[13C]([O-])=O Amb22338641 [1,0,0,0,0,0|0,0,1]=2 389 B6R0.2 C[C@@H](CC(=O)O)N Amb16184012 [1,0,0,0,0,0|1,0,0]=2 390 B6R0.2 C[C@@H](Cl)CC(=O)Cl Amb25321802 [1,0,0,0,0,0|2,0,0]=3 391 B6R0.2 C[C@@H](N)CC(N)=O Amb25789836 [1,0,0,0,0,0|2,0,0]=3 392 B6R0.2 C[C@@H](O)C=C(C)C Amb25700154 [1,0,0,0,0,0|2,0,1]=4 393 B6R0.2 C[C@@H](O)CC(=C)Br Amb25045702 [1,0,0,0,0,0|2,0,0]=3 394 B6R0.2 C[C@@H](O)CC(C)O Amb25083401 [1,0,0,0,0,0|1,0,1]=3 395 B6R0.2 C[C@@H](O)CC(N)=O Amb25746564 [1,0,0,0,0,0|1,0,0]=2 396 B6R0.2 C[C@@H](O)CN(C)C Amb22746407 [1,0,0,0,0,0|3,0,0]=4 397 B6R0.2 C[C@@H](O)C[C@@H](C)N Amb24568258 [1,0,0,0,0,0|2,0,1]=4 398 B6R0.2 C[C@@H](O)C[C@H](C)N Amb24479559 [1,0,0,0,0,0|2,0,1]=4 399 B6R0.2 C[C@@H](S)CC(O)=O Amb24480921 [1,0,0,0,0,0|0,1,0]=2 400 B6R0.2 C[C@H](Br)CC(O)=O Amb24432019 [1,0,0,0,0,0|1,0,0]=2 401 B6R0.2 C[C@H](CC(=O)O)N Amb16184009 [1,0,0,0,0,0|1,0,0]=2 402 B6R0.2 C[C@H](Cl)CC(=O)Cl Amb25053837 [1,0,0,0,0,0|2,0,0]=3 403 B6R0.2 C[C@H](Cl)CC(O)=O Amb25259323 [1,0,0,0,0,0|1,0,0]=2 404 B6R0.2 C[C@H](F)CC(O)=O Amb24586490 [1,0,0,0,0,0|1,0,0]=2 405 B6R0.2 C[C@H](O)C=C(C)C Amb24734239 [1,0,0,0,0,0|2,0,1]=4 406 B6R0.2 C[C@H](O)CC(C)=O Amb24334071 [1,0,0,0,0,0|1,0,0]=2 407 B6R0.2 C[C@H](O)CC(C)N Amb25835759 [1,0,0,0,0,0|2,0,1]=4 408 B6R0.2 C[C@H](O)CC(C)O Amb25381310 [1,0,0,0,0,0|1,0,1]=3 409 B6R0.2 C[C@H](O)CC(O)=O Amb22232025 [1,0,0,0,0,0|0,0,0]=1 410 B6R0.2 C[C@H](O)C[C@@H](C)N Amb24351024 [1,0,0,0,0,0|2,0,1]=4 411 B6R0.2 C[C@H](O)C[C@H](C)O Amb20242416 [1,0,0,0,0,0|1,0,1]=3 412 B6R0.2 C[C@H](S)CC(O)=O Amb25190038 [1,0,0,0,0,0|0,1,0]=2 413 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [1,0,0,0,0,0|3,0,0]=4 414 B6R0.2 C[NH+](C)CC(O)=O Amb24113881 [1,0,0,0,0,0|2,0,0]=3 415 B6R0.2 C\C(\Br)=C\C(O)=O Amb25662428 [1,0,0,0,0,0|1,0,2]=4 416 B6R0.2 C\C(\Cl)=C/C(O)=O Amb18123483 [1,0,0,0,0,0|1,0,2]=4 417 B6R0.2 C\C(\Cl)=C\C(O)=O Amb23556468 [1,0,0,0,0,0|1,0,2]=4 418 B6R0.2 C\C(\I)=C\C(O)=O Amb24741877 [1,0,0,0,0,0|1,0,2]=4 419 B6R0.2 C\C(\O)=C\C(C)=O Amb22034390 [1,0,0,0,0,0|1,0,2]=4 420 B6R0.2 N=C(Cl)CC(O)=O Amb25796071 [1,0,0,0,0,0|2,0,1]=4 421 B6R0.2 NC(=O)CC(Cl)Cl Amb24479899 [1,0,0,0,0,0|3,0,0]=4 422 B6R0.2 NC(=O)CC(O)O Amb25810087 [1,0,0,0,0,0|2,0,0]=3 423 B6R0.2 NC(F)CC(O)=O Amb24479804 [1,0,0,0,0,0|2,0,0]=3 424 B6R0.2 N[C@@H](CC(=O)O)O Amb16232006 [1,0,0,0,0,0|1,0,0]=2 425 B6R0.2 N[C@@H](F)CC(O)=O Amb25854307 [1,0,0,0,0,0|2,0,0]=3 426 B6R0.2 O=C(Cl)CC(Cl)Cl Amb24478549 [1,0,0,0,0,0|3,0,0]=4 427 B6R0.2 OB(CC(C)C)O Amb2447316 [1,0,0,0,0,0|2,0,1]=4 428 B6R0.2 OB(O)CC(O)=O Amb24053058 [1,0,0,0,0,0|2,0,0]=3 429 B6R0.2 OC(=O)CC(=S)N Amb17465742 [1,0,0,0,0,0|1,1,1]=4 430 B6R0.2 OC(=O)CC(F)Br Amb25336987 [1,0,0,0,0,0|2,0,0]=3 431 B6R0.2 OC(=O)CC(F)F Amb22001551 [1,0,0,0,0,0|2,0,0]=3 432 B6R0.2 OC(=O)CC(O)=O Amb21935659 [1,0,0,0,0,0|1,0,1]=3 433 B6R0.2 OC(=O)CC(O)=O Amb22230690 [1,0,0,0,0,0|1,0,1]=3 434 B6R0.2 OC(=O)CC(O)=O Amb22230927 [1,0,0,0,0,0|1,0,1]=3 435 B6R0.2 OC(=O)CN(Cl)Cl Amb25133084 [1,0,0,0,0,0|3,0,0]=4 436 B6R0.2 OC(=O)[13CH2]C(O)=O Amb22337806 [1,0,0,0,0,0|1,0,1]=3 437 B6R0.2 O[13C](=O)C[13C](O)=O Amb22353218 [1,0,0,0,0,0|1,0,1]=3 438 B6R0.2 O[13C](=O)[13CH2][13C](O)=O Amb22363192 [1,0,0,0,0,0|1,0,1]=3 439 B6R0.2 O[14C](=O)O[14C](O)=O Amb22362831 [1,0,0,0,0,0|2,0,1]=4 440 B6R0.2 [13CH3]C(O)[13CH2]C([O-])=O Amb22351144 [1,0,0,0,0,0|0,0,1]=2 441 B6R0.2 [BH3-][S+](C)CC(O)=O Amb24480870 [1,0,0,0,0,0|2,0,0]=3 442 B6R0.2 [O-]C(=O)CC(F)F Amb24117960 [1,0,0,0,0,0|2,0,1]=4 443 B6R0.2 [O-]C(=O)C[C@@H](O)C Amb10844672 [1,0,0,0,0,0|0,0,1]=2 444 B6R0.3 C#CC(O)C(O)=O Amb22731622 [1,0,0,0,0,0|1,0,2]=4 445 B6R0.3 C#C[C@H](N)C(N)=O Amb25200269 [1,0,0,0,0,0|1,0,2]=4 446 B6R0.3 C#C[C@H](N)C(O)=O Amb22350666 [1,0,0,0,0,0|0,0,2]=3 447 B6R0.3 C=C(CF)C(O)=O Amb25215375 [1,0,0,0,0,0|2,0,1]=4 448 B6R0.3 C=C(CI)C(O)=O Amb24419641 [1,0,0,0,0,0|2,0,1]=4 449 B6R0.3 C=C(CN)C(O)=O Amb25200864 [1,0,0,0,0,0|2,0,1]=4 450 B6R0.3 C=C(CO)C(=O)Cl Amb25169545 [1,0,0,0,0,0|2,0,1]=4 451 B6R0.3 C=C(CO)C(O)=O Amb18121817 [1,0,0,0,0,0|1,0,1]=3 452 B6R0.3 C=CC(Br)C(O)=O Amb24453871 [1,0,0,0,0,0|1,0,2]=4 453 B6R0.3 C=CC(N)C(F)F Amb25256902 [1,0,0,0,0,0|3,0,0]=4 454 B6R0.3 C=CC(N)C(N)=O Amb24689093 [1,0,0,0,0,0|1,0,2]=4 455 B6R0.3 C=CC(N)C(O)=O Amb20240543 [1,0,0,0,0,0|0,0,2]=3 456 B6R0.3 C=CC(O)C(O)=O Amb24061247 [1,0,0,0,0,0|1,0,2]=4 457 B6R0.3 C=C[C@@H](N)C(O)=O Amb20241335 [1,0,0,0,0,0|0,0,2]=3 458 B6R0.3 C=C[C@@H](N)C(O)=O Amb22756048 [1,0,0,0,0,0|0,0,2]=3 459 B6R0.3 C=C[C@@H](O)C(O)=O Amb25146844 [1,0,0,0,0,0|1,0,2]=4 460 B6R0.3 C=C[C@H](O)C(O)=O Amb25118468 [1,0,0,0,0,0|1,0,2]=4 461 B6R0.3 CC(=C)C(Br)CO Amb25707965 [1,0,0,0,0,0|3,0,0]=4 462 B6R0.3 CC(=C)C(N)CS Amb18641941 [1,0,0,0,0,0|2,1,0]=4 463 B6R0.3 CC(=C)C(O)C=O Amb24457056 [1,0,0,0,0,0|2,0,1]=4 464 B6R0.3 CC(=C)C(O)CO Amb23570510 [1,0,0,0,0,0|3,0,0]=4 465 B6R0.3 CC(=C)[C@@H](N)CO Amb25693320 [1,0,0,0,0,0|2,0,0]=3 466 B6R0.3 CC(=C)[C@@H](O)CO Amb25747414 [1,0,0,0,0,0|3,0,0]=4 467 B6R0.3 CC(=C)[C@H](O)CO Amb24439174 [1,0,0,0,0,0|3,0,0]=4 468 B6R0.3 CC(=CO)C(O)=O Amb25745269 [1,0,0,0,0,0|1,0,2]=4 469 B6R0.3 CC(=O)C(=C)CO Amb24571845 [1,0,0,0,0,0|2,0,1]=4 470 B6R0.3 CC(=O)C(Br)CO Amb24649743 [1,0,0,0,0,0|2,0,0]=3 471 B6R0.3 CC(=O)C(Cl)CF Amb24594938 [1,0,0,0,0,0|3,0,0]=4 472 B6R0.3 CC(=O)C(Cl)CO Amb25321596 [1,0,0,0,0,0|2,0,0]=3 473 B6R0.3 CC(=O)C(F)CO Amb24725289 [1,0,0,0,0,0|2,0,0]=3 474 B6R0.3 CC(=O)C(N)=CO Amb25264865 [1,0,0,0,0,0|0,0,3]=4 475 B6R0.3 CC(=O)C(N)C#N Amb25304788 [1,0,0,0,0,0|2,0,1]=4 476 B6R0.3 CC(=O)C(N)CN Amb24479898 [1,0,0,0,0,0|2,0,0]=3 477 B6R0.3 CC(=O)C(N)CO Amb18640011 [1,0,0,0,0,0|1,0,0]=2 478 B6R0.3 CC(=O)C(N)CS Amb24479874 [1,0,0,0,0,0|1,1,0]=3 479 B6R0.3 CC(=O)C(O)C=O Amb24715304 [1,0,0,0,0,0|1,0,2]=4 480 B6R0.3 CC(=O)C(O)CN Amb24636554 [1,0,0,0,0,0|3,0,0]=4 481 B6R0.3 CC(=O)C([Na])C=O Amb25858759 [1,0,0,0,0,0|1,0,2]=4 482 B6R0.3 CC(=O)[C@@H](N)CO Amb22745043 [1,0,0,0,0,0|1,0,0]=2 483 B6R0.3 CC(=O)[C@@H](O)CCl Amb24401543 [1,0,0,0,0,0|3,0,0]=4 484 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [1,0,0,0,0,0|2,0,0]=3 485 B6R0.3 CC(=O)[C@H](O)CCl Amb25169511 [1,0,0,0,0,0|3,0,0]=4 486 B6R0.3 CC(=O)[C@H](O)CO Amb25838797 [1,0,0,0,0,0|2,0,0]=3 487 B6R0.3 CC(Br)C(=O)C=O Amb24478903 [1,0,0,0,0,0|2,0,1]=4 488 B6R0.3 CC(Br)C(Cl)C=C Amb24736705 [1,0,0,0,0,0|3,0,0]=4 489 B6R0.3 CC(Br)C(Cl)C=O Amb25828586 [1,0,0,0,0,0|2,0,0]=3 490 B6R0.3 CC(Br)C(N)CC Amb24544717 [1,0,0,0,0,0|2,0,1]=4 491 B6R0.3 CC(Br)C(S)CO Amb24479553 [1,0,0,0,0,0|2,0,1]=4 492 B6R0.3 CC(C#C)C(O)=O Amb25085390 [1,0,0,0,0,0|1,0,2]=4 493 B6R0.3 CC(C#N)C(C)O Amb18121116 [1,0,0,0,0,0|2,0,1]=4 494 B6R0.3 CC(C(=O)C)CO Amb10844844 [1,0,0,0,0,0|2,0,0]=3 495 B6R0.3 CC(C(=O)O)C#N Amb17210512 [1,0,0,0,0,0|2,0,1]=4 496 B6R0.3 CC(C(O)C)CN Amb10068614 [1,0,0,0,0,0|2,0,1]=4 497 B6R0.3 CC(C)C(=C)C=O Amb18639179 [1,0,0,0,0,0|2,0,1]=4 498 B6R0.3 CC(C)C(C)NO Amb25254785 [1,0,0,0,0,0|3,0,0]=4 499 B6R0.3 CC(C)C(Cl)C=C Amb24565720 [1,0,0,0,0,0|3,0,0]=4 500 B6R0.3 CC(C)C(Cl)C=O Amb18123761 [1,0,0,0,0,0|2,0,0]=3 501 B6R0.3 CC(C)C(I)C=O Amb25745826 [1,0,0,0,0,0|2,0,0]=3 502 B6R0.3 CC(C)C(N)C#N Amb19514958 [1,0,0,0,0,0|2,0,1]=4 503 B6R0.3 CC(C)C(N)C=C Amb23536604 [1,0,0,0,0,0|2,0,0]=3 504 B6R0.3 CC(C)C(N)C=O Amb25063407 [1,0,0,0,0,0|1,0,0]=2 505 B6R0.3 CC(C)C(N)CF Amb24620348 [1,0,0,0,0,0|2,0,1]=4 506 B6R0.3 CC(C)C(N)CN Amb19283589 [1,0,0,0,0,0|2,0,1]=4 507 B6R0.3 CC(C)C(N)NN Amb24386051 [1,0,0,0,0,0|3,0,0]=4 508 B6R0.3 CC(C)C(O)C=C Amb22346222 [1,0,0,0,0,0|3,0,0]=4 509 B6R0.3 CC(C)C(S)C=O Amb25827516 [1,0,0,0,0,0|2,0,0]=3 510 B6R0.3 CC(C)C(S)CO Amb25809908 [1,0,0,0,0,0|2,0,1]=4 511 B6R0.3 CC(C)N(C)C=O Amb24271077 [1,0,0,0,0,0|3,0,0]=4 512 B6R0.3 CC(C)[C@@H](Br)CO Amb25109146 [1,0,0,0,0,0|2,0,1]=4 513 B6R0.3 CC(C)[C@@H](Cl)C=O Amb25189961 [1,0,0,0,0,0|2,0,0]=3 514 B6R0.3 CC(C)[C@@H](F)C=O Amb25358933 [1,0,0,0,0,0|2,0,0]=3 515 B6R0.3 CC(C)[C@@H](I)C=O Amb24695477 [1,0,0,0,0,0|2,0,0]=3 516 B6R0.3 CC(C)[C@@H](N)C=C Amb24425059 [1,0,0,0,0,0|2,0,0]=3 517 B6R0.3 CC(C)[C@@H](N)CBr Amb24739073 [1,0,0,0,0,0|2,0,1]=4 518 B6R0.3 CC(C)[C@@H](N)CO Amb22745159 [1,0,0,0,0,0|1,0,1]=3 519 B6R0.3 CC(C)[C@@H](O)C=C Amb25682322 [1,0,0,0,0,0|3,0,0]=4 520 B6R0.3 CC(C)[C@@H](O)CO Amb25662102 [1,0,0,0,0,0|2,0,1]=4 521 B6R0.3 CC(C)[C@H](Br)C=O Amb25360935 [1,0,0,0,0,0|2,0,0]=3 522 B6R0.3 CC(C)[C@H](C)CO Amb24332267 [1,0,0,0,0,0|2,0,1]=4 523 B6R0.3 CC(C)[C@H](Cl)C=O Amb25053420 [1,0,0,0,0,0|2,0,0]=3 524 B6R0.3 CC(C)[C@H](F)C=O Amb25169558 [1,0,0,0,0,0|2,0,0]=3 525 B6R0.3 CC(C)[C@H](N)C#C Amb25190055 [1,0,0,0,0,0|2,0,1]=4 526 B6R0.3 CC(C)[C@H](N)CC Amb24480517 [1,0,0,0,0,0|2,0,1]=4 527 B6R0.3 CC(C)[C@H](N)CCl Amb24502642 [1,0,0,0,0,0|2,0,1]=4 528 B6R0.3 CC(C)[C@H](O)C=O Amb25292428 [1,0,0,0,0,0|2,0,0]=3 529 B6R0.3 CC(C)[C@H](O)CO Amb25320597 [1,0,0,0,0,0|2,0,1]=4 530 B6R0.3 CC(C=C)C(O)=O Amb21618706 [1,0,0,0,0,0|1,0,2]=4 531 B6R0.3 CC(C=O)C(C)=C Amb18639176 [1,0,0,0,0,0|2,0,1]=4 532 B6R0.3 CC(C=O)C(C)=O Amb18639572 [1,0,0,0,0,0|1,0,2]=4 533 B6R0.3 CC(C=O)C(F)F Amb25746789 [1,0,0,0,0,0|3,0,0]=4 534 B6R0.3 CC(C=O)N(C)C Amb25771612 [1,0,0,0,0,0|3,0,0]=4 535 B6R0.3 CC(CBr)C(C)=O Amb25296678 [1,0,0,0,0,0|3,0,0]=4 536 B6R0.3 CC(CBr)C(O)=O Amb22002601 [1,0,0,0,0,0|2,0,0]=3 537 B6R0.3 CC(CC)C(O)Br Amb24635628 [1,0,0,0,0,0|2,0,1]=4 538 B6R0.3 CC(CCl)C(=O)Cl Amb24479841 [1,0,0,0,0,0|3,0,0]=4 539 B6R0.3 CC(CCl)C(=O)S Amb24410197 [1,0,0,0,0,0|2,1,0]=4 540 B6R0.3 CC(CCl)C(C)O Amb25662521 [1,0,0,0,0,0|2,0,1]=4 541 B6R0.3 CC(CCl)C(N)=O Amb25061744 [1,0,0,0,0,0|3,0,0]=4 542 B6R0.3 CC(CCl)C(O)=O Amb18522181 [1,0,0,0,0,0|2,0,0]=3 543 B6R0.3 CC(CF)C(C)=O Amb25253758 [1,0,0,0,0,0|3,0,0]=4 544 B6R0.3 CC(CF)C(O)=O Amb24432331 [1,0,0,0,0,0|2,0,0]=3 545 B6R0.3 CC(CI)C(O)=O Amb25695307 [1,0,0,0,0,0|2,0,0]=3 546 B6R0.3 CC(CN)C(=O)Cl Amb24525988 [1,0,0,0,0,0|3,0,0]=4 547 B6R0.3 CC(CN)C(C)=O Amb18639690 [1,0,0,0,0,0|3,0,0]=4 548 B6R0.3 CC(CO)C(C)=C Amb24539367 [1,0,0,0,0,0|3,0,0]=4 549 B6R0.3 CC(CO)C(C)Cl Amb24479460 [1,0,0,0,0,0|2,0,1]=4 550 B6R0.3 CC(CO)C(C)I Amb24410940 [1,0,0,0,0,0|2,0,1]=4 551 B6R0.3 CC(CO)C(C)N Amb18122199 [1,0,0,0,0,0|2,0,1]=4 552 B6R0.3 CC(CO)C(C)S Amb22641872 [1,0,0,0,0,0|1,1,1]=4 553 B6R0.3 CC(CO)C([O-])=O Amb24123145 [1,0,0,0,0,0|1,0,1]=3 554 B6R0.3 CC(CO)S(C)=O Amb25173825 [1,0,0,0,0,0|3,0,0]=4 555 B6R0.3 CC(CS)C(C)=O Amb25830693 [1,0,0,0,0,0|2,1,0]=4 556 B6R0.3 CC(CS)C(C)O Amb24334206 [1,0,0,0,0,0|1,1,1]=4 557 B6R0.3 CC(CS)C(N)=O Amb25759660 [1,0,0,0,0,0|2,1,0]=4 558 B6R0.3 CC(Cl)C(Br)C=O Amb25258050 [1,0,0,0,0,0|2,0,0]=3 559 B6R0.3 CC(Cl)C(Cl)C=O Amb18643662 [1,0,0,0,0,0|2,0,0]=3 560 B6R0.3 CC(Cl)C(S)CO Amb25102279 [1,0,0,0,0,0|2,0,1]=4 561 B6R0.3 CC(F)C(Br)CO Amb25109242 [1,0,0,0,0,0|2,0,1]=4 562 B6R0.3 CC(F)C(I)CO Amb25293778 [1,0,0,0,0,0|2,0,1]=4 563 B6R0.3 CC(F)C(N)C#N Amb24479148 [1,0,0,0,0,0|2,0,1]=4 564 B6R0.3 CC(F)C(N)CC Amb25024885 [1,0,0,0,0,0|2,0,1]=4 565 B6R0.3 CC(I)C(F)CO Amb25325094 [1,0,0,0,0,0|2,0,1]=4 566 B6R0.3 CC(N)C(N)=NO Amb25144101 [1,0,0,0,0,0|2,0,1]=4 567 B6R0.3 CC(N)C(N)C=C Amb25731884 [1,0,0,0,0,0|2,0,0]=3 568 B6R0.3 CC(N)C(N)CC Amb25186066 [1,0,0,0,0,0|2,0,1]=4 569 B6R0.3 CC(N)C(O)CO Amb24583121 [1,0,0,0,0,0|2,0,1]=4 570 B6R0.3 CC(N=C)C(O)=O Amb24591339 [1,0,0,0,0,0|2,0,1]=4 571 B6R0.3 CC(NBr)C(O)=O Amb24677636 [1,0,0,0,0,0|3,0,0]=4 572 B6R0.3 CC(NCl)C(O)=O Amb25267473 [1,0,0,0,0,0|3,0,0]=4 573 B6R0.3 CC(NN)C(C)O Amb24333986 [1,0,0,0,0,0|3,0,0]=4 574 B6R0.3 CC(NN)C(O)=O Amb18640367 [1,0,0,0,0,0|3,0,0]=4 575 B6R0.3 CC(O)=C(Br)C=O Amb25810089 [1,0,0,0,0,0|1,0,2]=4 576 B6R0.3 CC(O)=C(O)C=O Amb25747147 [1,0,0,0,0,0|1,0,2]=4 577 B6R0.3 CC(O)C(=N)NO Amb19516866 [1,0,0,0,0,0|1,0,2]=4 578 B6R0.3 CC(O)C(=O)CO Amb25333809 [1,0,0,0,0,0|1,0,2]=4 579 B6R0.3 CC(O)C(=O)NO Amb25348818 [1,0,0,0,0,0|2,0,1]=4 580 B6R0.3 CC(O)C(Br)C=O Amb25702152 [1,0,0,0,0,0|1,0,0]=2 581 B6R0.3 CC(O)C(C)=NO Amb24379868 [1,0,0,0,0,0|2,0,1]=4 582 B6R0.3 CC(O)C(Cl)C#N Amb25059168 [1,0,0,0,0,0|2,0,1]=4 583 B6R0.3 CC(O)C(Cl)C=C Amb25723922 [1,0,0,0,0,0|2,0,0]=3 584 B6R0.3 CC(O)C(Cl)CO Amb24633291 [1,0,0,0,0,0|1,0,1]=3 585 B6R0.3 CC(O)C(N)C=C Amb25076566 [1,0,0,0,0,0|1,0,0]=2 586 B6R0.3 CC(O)C(N)C=O Amb24480424 [1,0,0,0,0,0|0,0,0]=1 587 B6R0.3 CC(O)C(N)CN Amb19328774 [1,0,0,0,0,0|1,0,1]=3 588 B6R0.3 CC(O)C(N)CN Amb22059292 [1,0,0,0,0,0|1,0,1]=3 589 B6R0.3 CC(O)C(O)C#C Amb25662567 [1,0,0,0,0,0|2,0,1]=4 590 B6R0.3 CC(O)C(O)C=O Amb18122303 [1,0,0,0,0,0|1,0,0]=2 591 B6R0.3 CC(O)C(O)CBr Amb24478957 [1,0,0,0,0,0|2,0,1]=4 592 B6R0.3 CC(O)C(O)CCl Amb24622417 [1,0,0,0,0,0|2,0,1]=4 593 B6R0.3 CC(O)C(O)CO Amb22227692 [1,0,0,0,0,0|1,0,1]=3 594 B6R0.3 CC(O)C(O)OC Amb24448133 [1,0,0,0,0,0|3,0,0]=4 595 B6R0.3 CC(O)C(S)CBr Amb24440821 [1,0,0,0,0,0|2,0,1]=4 596 B6R0.3 CC(O)C(S)CS Amb25043650 [1,0,0,0,0,0|1,1,1]=4 597 B6R0.3 CC(O)[C@@H](N)CC Amb24453251 [1,0,0,0,0,0|1,0,1]=3 598 B6R0.3 CC(O)[C@@H](N)CO Amb22800884 [1,0,0,0,0,0|0,0,1]=2 599 B6R0.3 CC(O)\C(\C)=C\Br Amb25689239 [1,0,0,0,0,0|2,0,1]=4 600 B6R0.3 CC(OC)C(C)O Amb22757090 [1,0,0,0,0,0|3,0,0]=4 601 B6R0.3 CC(OC)[C@@H](C)O Amb25831986 [1,0,0,0,0,0|3,0,0]=4 602 B6R0.3 CC(ON)C(O)=O Amb24479235 [1,0,0,0,0,0|3,0,0]=4 603 B6R0.3 CC(SC)C(C)O Amb25326277 [1,0,0,0,0,0|3,0,0]=4 604 B6R0.3 CC=C(C)C(C)O Amb22232295 [1,0,0,0,0,0|2,0,1]=4 605 B6R0.3 CCC(=C)C(=O)Cl Amb22353554 [1,0,0,0,0,0|2,0,1]=4 606 B6R0.3 CCC(=C)C(N)=O Amb24480748 [1,0,0,0,0,0|2,0,1]=4 607 B6R0.3 CCC(=C)C(O)=O Amb18639591 [1,0,0,0,0,0|1,0,1]=3 608 B6R0.3 CCC(=O)C(N)=O Amb22011827 [1,0,0,0,0,0|2,0,1]=4 609 B6R0.3 CCC(=O)C(O)=O Amb22274199 [1,0,0,0,0,0|1,0,1]=3 610 B6R0.3 CCC(=O)C([O-])=O Amb22360646 [1,0,0,0,0,0|1,0,2]=4 611 B6R0.3 CCC(B(O)O)C Amb10071974 [1,0,0,0,0,0|2,0,1]=4 612 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [1,0,0,0,0,0|2,0,0]=3 613 B6R0.3 CCC(Br)C(C)=O Amb24615269 [1,0,0,0,0,0|2,0,0]=3 614 B6R0.3 CCC(Br)C(Cl)=O Amb17666758 [1,0,0,0,0,0|2,0,0]=3 615 B6R0.3 CCC(Br)[N+]([O-])=O Amb17673702 [1,0,0,0,0,0|2,0,1]=4 616 B6R0.3 CCC(C(=O)Cl)N Amb17593240 [1,0,0,0,0,0|1,0,0]=2 617 B6R0.3 CCC(C(=O)N)Br Amb13952819 [1,0,0,0,0,0|2,0,0]=3 618 B6R0.3 CCC(C(=O)N)N Amb1914080 [1,0,0,0,0,0|1,0,0]=2 619 B6R0.3 CCC(C(=O)O)S Amb17501370 [1,0,0,0,0,0|1,0,0]=2 620 B6R0.3 CCC(C(C)C)N Amb10610298 [1,0,0,0,0,0|2,0,1]=4 621 B6R0.3 CCC(C(O)C)O Amb2227553 [1,0,0,0,0,0|2,0,1]=4 622 B6R0.3 CCC(C)C(=C)Br Amb22583745 [1,0,0,0,0,0|3,0,0]=4 623 B6R0.3 CCC(C)S([O-])=O Amb19893328 [1,0,0,0,0,0|2,0,1]=4 624 B6R0.3 CCC(Cl)C(=C)Cl Amb24426218 [1,0,0,0,0,0|3,0,0]=4 625 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [1,0,0,0,0,0|2,0,0]=3 626 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [1,0,0,0,0,0|2,0,0]=3 627 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [1,0,0,0,0,0|2,0,0]=3 628 B6R0.3 CCC(F)C(C)=O Amb24736393 [1,0,0,0,0,0|2,0,0]=3 629 B6R0.3 CCC(F)C(N)=O Amb25811426 [1,0,0,0,0,0|2,0,0]=3 630 B6R0.3 CCC(F)C(O)=O Amb25716167 [1,0,0,0,0,0|1,0,0]=2 631 B6R0.3 CCC(I)C(N)=O Amb25131171 [1,0,0,0,0,0|2,0,0]=3 632 B6R0.3 CCC(N)C(=O)S Amb24479075 [1,0,0,0,0,0|0,1,0]=2 633 B6R0.3 CCC(N)C(C)=O Amb18202785 [1,0,0,0,0,0|1,0,0]=2 634 B6R0.3 CCC(N)C(N)=S Amb24573684 [1,0,0,0,0,0|1,1,0]=3 635 B6R0.3 CCC(N)N(C)C Amb24480382 [1,0,0,0,0,0|3,0,0]=4 636 B6R0.3 CCC(N)P(O)=O Amb25269903 [1,0,0,0,0,0|1,0,0]=2 637 B6R0.3 CCC(O)C(=C)Br Amb25236591 [1,0,0,0,0,0|3,0,0]=4 638 B6R0.3 CCC(O)C(C)=O Amb25336501 [1,0,0,0,0,0|2,0,0]=3 639 B6R0.3 CCC(O)C(N)=O Amb24116514 [1,0,0,0,0,0|2,0,0]=3 640 B6R0.3 CCC(O)C(N)=S Amb23449332 [1,0,0,0,0,0|2,1,0]=4 641 B6R0.3 CCC(O)C(O)=O Amb22352315 [1,0,0,0,0,0|1,0,0]=2 642 B6R0.3 CCC(O)C(O)=O Amb22360643 [1,0,0,0,0,0|1,0,0]=2 643 B6R0.3 CCC(O)C([O-])=O Amb17943026 [1,0,0,0,0,0|1,0,1]=3 644 B6R0.3 CCC(O)C([O-])=O Amb24325325 [1,0,0,0,0,0|1,0,1]=3 645 B6R0.3 CCC(O)P(O)=O Amb25169578 [1,0,0,0,0,0|2,0,0]=3 646 B6R0.3 CCC(S)C(N)=O Amb24479879 [1,0,0,0,0,0|2,0,0]=3 647 B6R0.3 CCN(C)C(C)=O Amb22753516 [1,0,0,0,0,0|3,0,0]=4 648 B6R0.3 CCN(N)C(N)=S Amb25187761 [1,0,0,0,0,0|2,1,0]=4 649 B6R0.3 CCN(O)C(N)=O Amb24669876 [1,0,0,0,0,0|3,0,0]=4 650 B6R0.3 CC[C@@H](Br)C(=O)Cl Amb24582761 [1,0,0,0,0,0|2,0,0]=3 651 B6R0.3 CC[C@@H](Br)C(N)=O Amb25025862 [1,0,0,0,0,0|2,0,0]=3 652 B6R0.3 CC[C@@H](C)C(=O)Cl Amb24577241 [1,0,0,0,0,0|2,0,0]=3 653 B6R0.3 CC[C@@H](C)C(N)=O Amb22232008 [1,0,0,0,0,0|2,0,0]=3 654 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [1,0,0,0,0,0|2,0,0]=3 655 B6R0.3 CC[C@@H](Cl)C(O)=O Amb22800493 [1,0,0,0,0,0|1,0,0]=2 656 B6R0.3 CC[C@@H](F)C(O)=O Amb24669143 [1,0,0,0,0,0|1,0,0]=2 657 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [1,0,0,0,0,0|1,0,0]=2 658 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [1,0,0,0,0,0|1,0,0]=2 659 B6R0.3 CC[C@@H](O)C(C)=O Amb25108045 [1,0,0,0,0,0|2,0,0]=3 660 B6R0.3 CC[C@@H](O)C(O)=O Amb22369401 [1,0,0,0,0,0|1,0,0]=2 661 B6R0.3 CC[C@H](Br)C(N)=O Amb24365914 [1,0,0,0,0,0|2,0,0]=3 662 B6R0.3 CC[C@H](Br)C(O)=O Amb20242441 [1,0,0,0,0,0|1,0,0]=2 663 B6R0.3 CC[C@H](C(=O)O)N Amb16233349 [1,0,0,0,0,0|0,0,0]=1 664 B6R0.3 CC[C@H](C)B(O)O Amb25746615 [1,0,0,0,0,0|2,0,1]=4 665 B6R0.3 CC[C@H](C)C(C)=O Amb24706969 [1,0,0,0,0,0|2,0,0]=3 666 B6R0.3 CC[C@H](C)C(N)=S Amb25266928 [1,0,0,0,0,0|2,1,0]=4 667 B6R0.3 CC[C@H](Cl)C(=O)Cl Amb24710023 [1,0,0,0,0,0|2,0,0]=3 668 B6R0.3 CC[C@H](Cl)C(O)=O Amb25190040 [1,0,0,0,0,0|1,0,0]=2 669 B6R0.3 CC[C@H](F)C(O)=O Amb24479776 [1,0,0,0,0,0|1,0,0]=2 670 B6R0.3 CC[C@H](O)C(C)=O Amb24332700 [1,0,0,0,0,0|2,0,0]=3 671 B6R0.3 CC[C@H](O)C(N)=O Amb25858046 [1,0,0,0,0,0|2,0,0]=3 672 B6R0.3 CC[N+](N)=C(C)N Amb25107724 [1,0,0,0,0,0|3,0,0]=4 673 B6R0.3 CN=C(Cl)C(O)=O Amb24446313 [1,0,0,0,0,0|2,0,1]=4 674 B6R0.3 CNC(=C)C(O)=O Amb25743212 [1,0,0,0,0,0|2,0,1]=4 675 B6R0.3 CNC(=N)C(O)=O Amb18639921 [1,0,0,0,0,0|1,0,2]=4 676 B6R0.3 CNC(=S)C(O)=O Amb24479905 [1,0,0,0,0,0|2,0,1]=4 677 B6R0.3 CNC(C)C(C)=O Amb24369529 [1,0,0,0,0,0|3,0,0]=4 678 B6R0.3 CNC(C)C(O)=O Amb19373699 [1,0,0,0,0,0|2,0,0]=3 679 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [1,0,0,0,0,0|3,0,0]=4 680 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [1,0,0,0,0,0|3,0,0]=4 681 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [1,0,0,0,0,0|3,0,0]=4 682 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [1,0,0,0,0,0|3,0,0]=4 683 B6R0.3 COC(=C)C(O)=O Amb18639906 [1,0,0,0,0,0|2,0,1]=4 684 B6R0.3 COC(=O)C(O)=O Amb22011503 [1,0,0,0,0,0|2,0,1]=4 685 B6R0.3 COC(Br)C(C)=O Amb25360111 [1,0,0,0,0,0|3,0,0]=4 686 B6R0.3 COC(N)C(N)=O Amb25178891 [1,0,0,0,0,0|2,0,0]=3 687 B6R0.3 COC(N)C(O)=O Amb24621851 [1,0,0,0,0,0|1,0,0]=2 688 B6R0.3 COC(O)C(O)=O Amb24479754 [1,0,0,0,0,0|2,0,0]=3 689 B6R0.3 CO[C@H](C)C(C)=O Amb24736032 [1,0,0,0,0,0|3,0,0]=4 690 B6R0.3 CSC(=O)C(O)=O Amb24731100 [1,0,0,0,0,0|2,0,1]=4 691 B6R0.3 CSC(=S)C(O)=O Amb25702678 [1,0,0,0,0,0|2,0,1]=4 692 B6R0.3 CSC(Br)C(O)=O Amb25169549 [1,0,0,0,0,0|2,0,0]=3 693 B6R0.3 CSC(C)C(=O)Cl Amb24742667 [1,0,0,0,0,0|3,0,0]=4 694 B6R0.3 CSC(F)C(O)=O Amb25043740 [1,0,0,0,0,0|2,0,0]=3 695 B6R0.3 CSC(O)C(C)=O Amb24479166 [1,0,0,0,0,0|3,0,0]=4 696 B6R0.3 CS[C@@H](C)C(O)=O Amb25173497 [1,0,0,0,0,0|2,0,0]=3 697 B6R0.3 C[C@@H](Br)[C@H](Cl)C=C Amb25147388 [1,0,0,0,0,0|3,0,0]=4 698 B6R0.3 C[C@@H](C#N)[C@H](C)O Amb25080465 [1,0,0,0,0,0|2,0,1]=4 699 B6R0.3 C[C@@H](C(=O)O)CN Amb10844022 [1,0,0,0,0,0|2,0,0]=3 700 B6R0.3 C[C@@H](C(=O)O)NC Amb16233347 [1,0,0,0,0,0|2,0,0]=3 701 B6R0.3 C[C@@H](C(=O)O)NC Amb16233348 [1,0,0,0,0,0|2,0,0]=3 702 B6R0.3 C[C@@H](C=O)C(C)=O Amb24666681 [1,0,0,0,0,0|1,0,2]=4 703 B6R0.3 C[C@@H](C=O)[C@@H](C)O Amb25714216 [1,0,0,0,0,0|1,0,0]=2 704 B6R0.3 C[C@@H](CBr)C(O)=O Amb24334368 [1,0,0,0,0,0|2,0,0]=3 705 B6R0.3 C[C@@H](CC)[C@H](C)O Amb24456969 [1,0,0,0,0,0|2,0,1]=4 706 B6R0.3 C[C@@H](CCl)[C@@H](C)O Amb25137880 [1,0,0,0,0,0|2,0,1]=4 707 B6R0.3 C[C@@H](CN)C(O)=O Amb22756746 [1,0,0,0,0,0|2,0,0]=3 708 B6R0.3 C[C@@H](CO)C(C)=C Amb25025795 [1,0,0,0,0,0|3,0,0]=4 709 B6R0.3 C[C@@H](CO)C(C)=O Amb25320503 [1,0,0,0,0,0|2,0,0]=3 710 B6R0.3 C[C@@H](CS)C(O)=O Amb24462697 [1,0,0,0,0,0|1,1,0]=3 711 B6R0.3 C[C@@H](Cl)[C@H](Cl)C=C Amb25321987 [1,0,0,0,0,0|3,0,0]=4 712 B6R0.3 C[C@@H](N)[C@@H](O)CO Amb19944286 [1,0,0,0,0,0|2,0,1]=4 713 B6R0.3 C[C@@H](NN)C(O)=O Amb24732969 [1,0,0,0,0,0|3,0,0]=4 714 B6R0.3 C[C@@H](NO)C(O)=O Amb24702625 [1,0,0,0,0,0|2,0,0]=3 715 B6R0.3 C[C@@H](O)C(=N)NO Amb22587591 [1,0,0,0,0,0|1,0,2]=4 716 B6R0.3 C[C@@H](O)[C@@H](Br)C#N Amb24479144 [1,0,0,0,0,0|2,0,1]=4 717 B6R0.3 C[C@@H](O)[C@@H](N)CC Amb24117049 [1,0,0,0,0,0|1,0,1]=3 718 B6R0.3 C[C@@H](O)[C@@H](O)CCl Amb24737856 [1,0,0,0,0,0|2,0,1]=4 719 B6R0.3 C[C@@H](O)[C@H](Br)C#N Amb25138244 [1,0,0,0,0,0|2,0,1]=4 720 B6R0.3 C[C@@H](O)[C@H](C)CO Amb25810619 [1,0,0,0,0,0|1,0,1]=3 721 B6R0.3 C[C@@H](O)[C@H](Cl)C#N Amb24502700 [1,0,0,0,0,0|2,0,1]=4 722 B6R0.3 C[C@@H](O)[C@H](Cl)C=C Amb25760329 [1,0,0,0,0,0|2,0,0]=3 723 B6R0.3 C[C@@H](O)[C@H](N)CC Amb24117050 [1,0,0,0,0,0|1,0,1]=3 724 B6R0.3 C[C@@H](O)[C@H](N)CN Amb19374892 [1,0,0,0,0,0|1,0,1]=3 725 B6R0.3 C[C@@H](O)[C@H](O)C#C Amb25705997 [1,0,0,0,0,0|2,0,1]=4 726 B6R0.3 C[C@@H](O)[C@H](O)C=C Amb25763019 [1,0,0,0,0,0|2,0,0]=3 727 B6R0.3 C[C@@H](O)[C@H](O)C=O Amb24398705 [1,0,0,0,0,0|1,0,0]=2 728 B6R0.3 C[C@@H](O)[C@H](O)CO Amb25084430 [1,0,0,0,0,0|1,0,1]=3 729 B6R0.3 C[C@H](Br)[C@H](Cl)C=C Amb24415438 [1,0,0,0,0,0|3,0,0]=4 730 B6R0.3 C[C@H](Br)[C@H](Cl)C=O Amb25779134 [1,0,0,0,0,0|2,0,0]=3 731 B6R0.3 C[C@H](C#N)[C@H](C)O Amb25792402 [1,0,0,0,0,0|2,0,1]=4 732 B6R0.3 C[C@H](C(=O)N)OC Amb17617080 [1,0,0,0,0,0|3,0,0]=4 733 B6R0.3 C[C@H](C(=O)O)CCl Amb10844008 [1,0,0,0,0,0|2,0,0]=3 734 B6R0.3 C[C@H](C(=O)O)NC Amb10844859 [1,0,0,0,0,0|2,0,0]=3 735 B6R0.3 C[C@H](C=C)[C@@H](C)O Amb25167394 [1,0,0,0,0,0|2,0,0]=3 736 B6R0.3 C[C@H](C=C)[C@H](C)O Amb25284228 [1,0,0,0,0,0|2,0,0]=3 737 B6R0.3 C[C@H](C=O)C(C)=O Amb25358934 [1,0,0,0,0,0|1,0,2]=4 738 B6R0.3 C[C@H](C=O)N(C)C Amb24333507 [1,0,0,0,0,0|3,0,0]=4 739 B6R0.3 C[C@H](CC)[C@H](C)O Amb25675718 [1,0,0,0,0,0|2,0,1]=4 740 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [1,0,0,0,0,0|3,0,0]=4 741 B6R0.3 C[C@H](CCl)C(O)=O Amb25133056 [1,0,0,0,0,0|2,0,0]=3 742 B6R0.3 C[C@H](CN)C(O)=O Amb24117452 [1,0,0,0,0,0|2,0,0]=3 743 B6R0.3 C[C@H](CN)[C@@H](C)O Amb24479790 [1,0,0,0,0,0|2,0,1]=4 744 B6R0.3 C[C@H](CO)S(C)=O Amb24334035 [1,0,0,0,0,0|3,0,0]=4 745 B6R0.3 C[C@H](CO)[C@H](C)Cl Amb24479757 [1,0,0,0,0,0|2,0,1]=4 746 B6R0.3 C[C@H](CS)C(O)=O Amb25228453 [1,0,0,0,0,0|1,1,0]=3 747 B6R0.3 C[C@H](Cl)[C@@H](Cl)C=C Amb24479764 [1,0,0,0,0,0|3,0,0]=4 748 B6R0.3 C[C@H](Cl)[C@H](Br)C=O Amb24479005 [1,0,0,0,0,0|2,0,0]=3 749 B6R0.3 C[C@H](Cl)[C@H](Cl)C=O Amb25810801 [1,0,0,0,0,0|2,0,0]=3 750 B6R0.3 C[C@H](N)[C@@H](O)C=C Amb25338363 [1,0,0,0,0,0|3,0,0]=4 751 B6R0.3 C[C@H](N)[C@@H](O)CO Amb25327107 [1,0,0,0,0,0|2,0,1]=4 752 B6R0.3 C[C@H](N)[C@H](O)CO Amb24479808 [1,0,0,0,0,0|2,0,1]=4 753 B6R0.3 C[C@H](N=C)C(O)=O Amb25720495 [1,0,0,0,0,0|2,0,1]=4 754 B6R0.3 C[C@H](NC)[C@@H](C)O Amb25113372 [1,0,0,0,0,0|3,0,0]=4 755 B6R0.3 C[C@H](NCl)C(O)=O Amb24460300 [1,0,0,0,0,0|3,0,0]=4 756 B6R0.3 C[C@H](NN)[C@@H](C)O Amb25745704 [1,0,0,0,0,0|3,0,0]=4 757 B6R0.3 C[C@H](O)C(=C)C=C Amb25098591 [1,0,0,0,0,0|2,0,1]=4 758 B6R0.3 C[C@H](O)C(=N)NO Amb22587550 [1,0,0,0,0,0|1,0,2]=4 759 B6R0.3 C[C@H](O)C(=O)C=C Amb24686568 [1,0,0,0,0,0|2,0,1]=4 760 B6R0.3 C[C@H](O)C(N)C#N Amb25824653 [1,0,0,0,0,0|1,0,1]=3 761 B6R0.3 C[C@H](O)C(O)C#N Amb25788081 [1,0,0,0,0,0|2,0,1]=4 762 B6R0.3 C[C@H](O)C(O)C=C Amb24748479 [1,0,0,0,0,0|2,0,0]=3 763 B6R0.3 C[C@H](O)C(O)CN Amb24365506 [1,0,0,0,0,0|2,0,1]=4 764 B6R0.3 C[C@H](O)[C@@H](C)CO Amb24480821 [1,0,0,0,0,0|1,0,1]=3 765 B6R0.3 C[C@H](O)[C@@H](O)C#C Amb24395353 [1,0,0,0,0,0|2,0,1]=4 766 B6R0.3 C[C@H](O)[C@@H](O)C=C Amb25675725 [1,0,0,0,0,0|2,0,0]=3 767 B6R0.3 C[C@H](O)[C@@H](O)CCl Amb24479499 [1,0,0,0,0,0|2,0,1]=4 768 B6R0.3 C[C@H](O)[C@H](C)CO Amb25127201 [1,0,0,0,0,0|1,0,1]=3 769 B6R0.3 C[C@H](O)[C@H](N)CO Amb24479858 [1,0,0,0,0,0|0,0,1]=2 770 B6R0.3 C[C@H](O)[C@H](O)C=C Amb25676499 [1,0,0,0,0,0|2,0,0]=3 771 B6R0.3 C[C@H](O)[C@H](O)CO Amb25185955 [1,0,0,0,0,0|1,0,1]=3 772 B6R0.3 C[C@H](OC)[C@@H](C)O Amb25084361 [1,0,0,0,0,0|3,0,0]=4 773 B6R0.3 C[C@H](OC)[C@H](C)O Amb25167384 [1,0,0,0,0,0|3,0,0]=4 774 B6R0.3 C[C@H](ON)C(O)=O Amb25853808 [1,0,0,0,0,0|3,0,0]=4 775 B6R0.3 C\C(=C/O)\C(O)=O Amb25140969 [1,0,0,0,0,0|1,0,2]=4 776 B6R0.3 C\C(=N\O)\C(O)=O Amb23523075 [1,0,0,0,0,0|2,0,1]=4 777 B6R0.3 C\C(\O)=C(\O)/C=O Amb25119300 [1,0,0,0,0,0|1,0,2]=4 778 B6R0.3 C\C=C(/Br)\C(O)=O Amb18646193 [1,0,0,0,0,0|1,0,2]=4 779 B6R0.3 C\C=C(/C)\C(C)O Amb24406752 [1,0,0,0,0,0|2,0,1]=4 780 B6R0.3 C\C=C(/Cl)\C(O)=O Amb18123515 [1,0,0,0,0,0|1,0,2]=4 781 B6R0.3 C\C=C(/O)\C(O)=O Amb22727962 [1,0,0,0,0,0|1,0,2]=4 782 B6R0.3 C\C=C(\Br)/C(C)O Amb24406032 [1,0,0,0,0,0|2,0,1]=4 783 B6R0.3 C\C=C(\C)/C(C)O Amb25025357 [1,0,0,0,0,0|2,0,1]=4 784 B6R0.3 C\C=C(\C)/[C@@H](C)O Amb25136106 [1,0,0,0,0,0|2,0,1]=4 785 B6R0.3 C\C=C(\N)/C(N)=O Amb24681313 [1,0,0,0,0,0|1,0,2]=4 786 B6R0.3 NC(=O)C(Cl)CCl Amb22228204 [1,0,0,0,0,0|3,0,0]=4 787 B6R0.3 NC(=O)C(Cl)CO Amb24392534 [1,0,0,0,0,0|2,0,0]=3 788 B6R0.3 NC(=O)C(F)CF Amb25128008 [1,0,0,0,0,0|3,0,0]=4 789 B6R0.3 NC(=O)C(F)CO Amb24507432 [1,0,0,0,0,0|2,0,0]=3 790 B6R0.3 NC(=O)[C@H](O)CO Amb25732480 [1,0,0,0,0,0|2,0,0]=3 791 B6R0.3 NC(C#N)C(O)=O Amb25328320 [1,0,0,0,0,0|1,0,1]=3 792 B6R0.3 NC(C(=O)N)C#N Amb1039452 [1,0,0,0,0,0|2,0,1]=4 793 B6R0.3 NC(C(=O)N)CO Amb17593097 [1,0,0,0,0,0|1,0,0]=2 794 B6R0.3 NC(C(=O)O)CF Amb10839589 [1,0,0,0,0,0|1,0,0]=2 795 B6R0.3 NC(C(=O)O)CS Amb13961966 [1,0,0,0,0,0|0,1,0]=2 796 B6R0.3 NC(C(C)C)C#N Amb1129748 [1,0,0,0,0,0|2,0,1]=4 797 B6R0.3 NC(C=O)C(O)=O Amb24349579 [1,0,0,0,0,0|0,0,2]=3 798 B6R0.3 NC(C=S)C(O)=O Amb25227802 [1,0,0,0,0,0|0,1,1]=3 799 B6R0.3 NC(CCl)C(O)=O Amb19651457 [1,0,0,0,0,0|1,0,0]=2 800 B6R0.3 NC(CCl)C(O)=O Amb21961077 [1,0,0,0,0,0|1,0,0]=2 801 B6R0.3 NC(CI)C(O)=O Amb25177412 [1,0,0,0,0,0|1,0,0]=2 802 B6R0.3 NC(CO)[13C](O)=O Amb22353217 [1,0,0,0,0,0|0,0,0]=1 803 B6R0.3 NC(CS)C(N)=O Amb18641990 [1,0,0,0,0,0|1,1,0]=3 804 B6R0.3 NC(CS)C(O)=O Amb22489523 [1,0,0,0,0,0|0,1,0]=2 805 B6R0.3 NC(CS)P(O)=O Amb25772157 [1,0,0,0,0,0|1,1,0]=3 806 B6R0.3 NC([13CH2]S)C(O)=O Amb22054824 [1,0,0,0,0,0|0,1,0]=2 807 B6R0.3 NCC(=O)C(O)=O Amb24361938 [1,0,0,0,0,0|2,0,1]=4 808 B6R0.3 NCC(C(=O)O)Cl Amb17593263 [1,0,0,0,0,0|2,0,0]=3 809 B6R0.3 NCC(C(=O)O)S Amb17593238 [1,0,0,0,0,0|2,0,0]=3 810 B6R0.3 NCC(Cl)C(N)=O Amb25173817 [1,0,0,0,0,0|3,0,0]=4 811 B6R0.3 NCC(F)C(O)=O Amb22733051 [1,0,0,0,0,0|2,0,0]=3 812 B6R0.3 NCC(N)C(N)=O Amb18122079 [1,0,0,0,0,0|2,0,0]=3 813 B6R0.3 NCC(N)C(O)=O Amb22899095 [1,0,0,0,0,0|1,0,0]=2 814 B6R0.3 NC[C@@H](F)C(O)=O Amb25824168 [1,0,0,0,0,0|2,0,0]=3 815 B6R0.3 NC[C@@H](N)C(O)=O Amb22745957 [1,0,0,0,0,0|1,0,0]=2 816 B6R0.3 NC[C@@H](O)C(O)=O Amb22169412 [1,0,0,0,0,0|2,0,0]=3 817 B6R0.3 NC[C@@H](S)C(N)=O Amb25106293 [1,0,0,0,0,0|3,0,0]=4 818 B6R0.3 NC[C@H](N)C(N)=O Amb24470655 [1,0,0,0,0,0|2,0,0]=3 819 B6R0.3 NOC(F)C(O)=O Amb24446310 [1,0,0,0,0,0|3,0,0]=4 820 B6R0.3 NOC(O)C(O)=O Amb24735537 [1,0,0,0,0,0|3,0,0]=4 821 B6R0.3 N[13CH2][13C@H]([13C](=O)O)F Amb17608076 [1,0,0,0,0,0|2,0,0]=3 822 B6R0.3 N[13CH2][13CH]([13C](=O)O)F Amb17614381 [1,0,0,0,0,0|2,0,0]=3 823 B6R0.3 N[14CH]([14CH2]O)[14C](O)=O Amb22362940 [1,0,0,0,0,0|0,0,0]=1 824 B6R0.3 N[C@@H](CCl)C(O)=O Amb22232860 [1,0,0,0,0,0|1,0,0]=2 825 B6R0.3 N[C@@H](CI)C(O)=O Amb25767583 [1,0,0,0,0,0|1,0,0]=2 826 B6R0.3 N[C@@H](CO)C(O)=O Amb22351170 [1,0,0,0,0,0|0,0,0]=1 827 B6R0.3 N[C@@H](CS)C(=O)Cl Amb24562196 [1,0,0,0,0,0|1,1,0]=3 828 B6R0.3 N[C@@H](CS)C(N)=O Amb23437751 [1,0,0,0,0,0|1,1,0]=3 829 B6R0.3 N[C@@H](CS)[13C](O)=O Amb22350380 [1,0,0,0,0,0|0,1,0]=2 830 B6R0.3 N[C@H](C(=O)O)CN Amb16183820 [1,0,0,0,0,0|1,0,0]=2 831 B6R0.3 N[C@H](CF)C(O)=O Amb24479910 [1,0,0,0,0,0|1,0,0]=2 832 B6R0.3 N[C@H](CO)C(N)=O Amb22886957 [1,0,0,0,0,0|1,0,0]=2 833 B6R0.3 N[C@H](CS)C(O)=O Amb17942912 [1,0,0,0,0,0|0,1,0]=2 834 B6R0.3 N\C(=N/O)\C(=O)N Amb16186552 [1,0,0,0,0,0|2,0,1]=4 835 B6R0.3 N\C(=N/O)\C(O)=O Amb24670890 [1,0,0,0,0,0|1,0,1]=3 836 B6R0.3 O=C(Cl)C(F)CCl Amb25324478 [1,0,0,0,0,0|3,0,0]=4 837 B6R0.3 O=C(S)C(Cl)CCl Amb25112062 [1,0,0,0,0,0|2,1,0]=4 838 B6R0.3 O=CC(C(=O)C)Br Amb17232509 [1,0,0,0,0,0|1,0,2]=4 839 B6R0.3 O=CC(C(C)C)Br Amb17594091 [1,0,0,0,0,0|2,0,0]=3 840 B6R0.3 O=CC(C(C)C)C Amb17593082 [1,0,0,0,0,0|2,0,0]=3 841 B6R0.3 O=CC(C(C)C)O Amb17593092 [1,0,0,0,0,0|2,0,0]=3 842 B6R0.3 OC(=O)C(=O)CBr Amb10068671 [1,0,0,0,0,0|2,0,1]=4 843 B6R0.3 OC(=O)C(=O)CCl Amb16233358 [1,0,0,0,0,0|2,0,1]=4 844 B6R0.3 OC(=O)C(=O)CF Amb22008247 [1,0,0,0,0,0|2,0,1]=4 845 B6R0.3 OC(=O)C(=O)CF Amb22274202 [1,0,0,0,0,0|2,0,1]=4 846 B6R0.3 OC(=O)C(=O)CS Amb22360785 [1,0,0,0,0,0|1,1,1]=4 847 B6R0.3 OC(=O)C(Br)CCl Amb24478864 [1,0,0,0,0,0|2,0,0]=3 848 B6R0.3 OC(=O)C(CF)Br Amb10605519 [1,0,0,0,0,0|2,0,0]=3 849 B6R0.3 OC(=O)C(Cl)=NO Amb25839923 [1,0,0,0,0,0|2,0,1]=4 850 B6R0.3 OC(=O)C(Cl)C=O Amb24480969 [1,0,0,0,0,0|1,0,2]=4 851 B6R0.3 OC(=O)C(Cl)CBr Amb25227429 [1,0,0,0,0,0|2,0,0]=3 852 B6R0.3 OC(=O)C(Cl)CCl Amb22228245 [1,0,0,0,0,0|2,0,0]=3 853 B6R0.3 OC(=O)C(Cl)CF Amb24669144 [1,0,0,0,0,0|2,0,0]=3 854 B6R0.3 OC(=O)C(Cl)CS Amb18643661 [1,0,0,0,0,0|1,1,0]=3 855 B6R0.3 OC(=O)C(F)C=O Amb22055301 [1,0,0,0,0,0|1,0,2]=4 856 B6R0.3 OC(=O)C(F)CF Amb24746801 [1,0,0,0,0,0|2,0,0]=3 857 B6R0.3 OC(=O)C(S)=NO Amb24479775 [1,0,0,0,0,0|2,0,1]=4 858 B6R0.3 OC(=O)C(S)CS Amb18643295 [1,0,0,0,0,0|1,1,0]=3 859 B6R0.3 OC(=O)[C@H](Cl)CCl Amb25141566 [1,0,0,0,0,0|2,0,0]=3 860 B6R0.3 OC(=O)\C(\Cl)=C/O Amb24479774 [1,0,0,0,0,0|1,0,2]=4 861 B6R0.3 OC(C=O)C(O)=O Amb18640325 [1,0,0,0,0,0|1,0,2]=4 862 B6R0.3 OC(CBr)C(O)=O Amb24061932 [1,0,0,0,0,0|2,0,0]=3 863 B6R0.3 OC(CCl)P(O)=O Amb25069434 [1,0,0,0,0,0|3,0,0]=4 864 B6R0.3 OC(CO)C(O)Cl Amb25210424 [1,0,0,0,0,0|2,0,1]=4 865 B6R0.3 OC(CS)C(O)=O Amb18642053 [1,0,0,0,0,0|1,1,0]=3 866 B6R0.3 OC(O)[C@@H](O)CO Amb24480839 [1,0,0,0,0,0|1,0,2]=4 867 B6R0.3 OC(O)[C@H](O)CO Amb25317667 [1,0,0,0,0,0|1,0,2]=4 868 B6R0.3 OCC(Br)C(O)=O Amb18126327 [1,0,0,0,0,0|1,0,0]=2 869 B6R0.3 OCC(C(=O)O)F Amb17593117 [1,0,0,0,0,0|1,0,0]=2 870 B6R0.3 OCC(C(=O)O)O Amb17593103 [1,0,0,0,0,0|1,0,0]=2 871 B6R0.3 OCC(C(O)C)N Amb17593100 [1,0,0,0,0,0|0,0,1]=2 872 B6R0.3 OCC(Cl)C(O)=O Amb18124304 [1,0,0,0,0,0|1,0,0]=2 873 B6R0.3 OC[C@@H](C(=O)O)Br Amb10601700 [1,0,0,0,0,0|1,0,0]=2 874 B6R0.3 OC[C@@H](C(=O)O)C Amb10844567 [1,0,0,0,0,0|1,0,0]=2 875 B6R0.3 OC[C@@H](C(C)C)C Amb17613247 [1,0,0,0,0,0|2,0,1]=4 876 B6R0.3 OC[C@H](C(=O)O)C Amb10844554 [1,0,0,0,0,0|1,0,0]=2 877 B6R0.3 OC[C@H](O)C(O)=O Amb22226732 [1,0,0,0,0,0|1,0,0]=2 878 B6R0.3 ONC(O)C(O)=O Amb25832155 [1,0,0,0,0,0|2,0,0]=3 879 B6R0.3 O[13C](=O)C(=O)CBr Amb22363329 [1,0,0,0,0,0|2,0,1]=4 880 B6R0.3 O[C@@H](CCl)C(O)=O Amb22225325 [1,0,0,0,0,0|2,0,0]=3 881 B6R0.3 O[C@@H](CF)C(O)=O Amb24117272 [1,0,0,0,0,0|2,0,0]=3 882 B6R0.3 O[C@@H](CS)C(O)=O Amb24428282 [1,0,0,0,0,0|1,1,0]=3 883 B6R0.3 O[C@H](CCl)C(O)=O Amb22388611 [1,0,0,0,0,0|2,0,0]=3 884 B6R0.3 O\C(=N\O)\C(O)=O Amb24462565 [1,0,0,0,0,0|2,0,1]=4 885 B6R0.3 [13CH3]CC(=O)C([O-])=O Amb22353582 [1,0,0,0,0,0|1,0,2]=4 886 B6R0.3 [13CH3][13CH2][13CH](O)[13C](O)=O Amb22350316 [1,0,0,0,0,0|1,0,0]=2 887 B6R0.3 [15NH2][13C@@H]([13CH2]S)[13C](O)=O Amb22354011 [1,0,0,0,0,0|0,1,0]=2 888 B6R0.3 [15NH2][C@@H](CO)C(O)=O Amb22353589 [1,0,0,0,0,0|0,0,0]=1 889 B6R0.3 [O-]C(=O)C(=O)CO Amb22360656 [1,0,0,0,0,0|1,0,2]=4 890 B6R0.3 [O-]C(=O)C(O)CO Amb22045196 [1,0,0,0,0,0|1,0,1]=3 891 B6R0.3 [O-]C(=O)[C@@H](O)CO Amb22799769 [1,0,0,0,0,0|1,0,1]=3 892 B6R0.3 [O-]C(=O)[C@H](C[S-])N Amb17621353 [1,0,0,0,0,0|0,1,1]=3 893 B6R0.3 [O-][N+](=O)C(Br)CO Amb24479795 [1,0,0,0,0,0|2,0,1]=4 894 B6R0.3 [O-][N+](=O)C(CO)C Amb17600148 [1,0,0,0,0,0|2,0,1]=4 895 B8R0.2 C=C(C(O)CO)C(O)=O Amb18642874 [0,1,0,0,0,0|1,0,1]=3 896 B8R0.2 C=C(C=C)[C@H](N)C(O)=O Amb24580353 [0,1,0,0,0,0|1,0,2]=4 897 B8R0.2 C=CC(O)C(N)C(O)=O Amb18642830 [0,1,0,0,0,0|0,0,1]=2 898 B8R0.2 C=C[C@@H](O)[C@H](N)C(O)=O Amb25111565 [0,1,0,0,0,0|0,0,1]=2 899 B8R0.2 C=C[C@H](O)[C@H](N)C(O)=O Amb25328036 [0,1,0,0,0,0|0,0,1]=2 900 B8R0.2 CC(=C)C(C)C(=O)CO Amb25262676 [0,1,0,0,0,0|2,0,1]=4 901 B8R0.2 CC(=C)[C@@H](N)C(=O)OC Amb24744947 [0,1,0,0,0,0|1,0,1]=3 902 B8R0.2 CC(=NO)C(C)C(C)=O Amb24572272 [0,1,0,0,0,0|2,0,1]=4 903 B8R0.2 CC(=NO)C(C)C(N)=O Amb24476690 [0,1,0,0,0,0|2,0,1]=4 904 B8R0.2 CC(=O)C(=C)C(C)CO Amb24588893 [0,1,0,0,0,0|2,0,1]=4 905 B8R0.2 CC(=O)C(=C)[C@@H](C)CO Amb25064620 [0,1,0,0,0,0|2,0,1]=4 906 B8R0.2 CC(=O)C(=O)C(C)OC Amb25730184 [0,1,0,0,0,0|2,0,1]=4 907 B8R0.2 CC(=O)C(=O)C(O)CO Amb25830733 [0,1,0,0,0,0|2,0,1]=4 908 B8R0.2 CC(=O)C(=O)[C@@H](O)CO Amb25697046 [0,1,0,0,0,0|2,0,1]=4 909 B8R0.2 CC(=O)C(Br)C(=O)OC Amb22499701 [0,1,0,0,0,0|1,0,2]=4 910 B8R0.2 CC(=O)C(C)C(=O)NO Amb24096632 [0,1,0,0,0,0|1,0,2]=4 911 B8R0.2 CC(=O)C(N)C(=O)CC Amb24744767 [0,1,0,0,0,0|1,0,2]=4 912 B8R0.2 CC(=O)C(N)C(=O)NC Amb25146054 [0,1,0,0,0,0|1,0,2]=4 913 B8R0.2 CC(=O)C(N)C(=O)OC Amb21520335 [0,1,0,0,0,0|0,0,2]=3 914 B8R0.2 CC(=O)C(N)C(=O)OC Amb22491080 [0,1,0,0,0,0|0,0,2]=3 915 B8R0.2 CC(=O)C(O)C(=O)CO Amb25082771 [0,1,0,0,0,0|1,0,2]=4 916 B8R0.2 CC(=O)C(O)C(Cl)CC Amb24588006 [0,1,0,0,0,0|3,0,0]=4 917 B8R0.2 CC(=O)C(O)C(O)C=O Amb24633454 [0,1,0,0,0,0|2,0,1]=4 918 B8R0.2 CC(=O)[C@@H](O)[C@@H](O)C=O Amb25032290 [0,1,0,0,0,0|2,0,1]=4 919 B8R0.2 CC(=O)[C@H](C)C(=O)OC Amb24378331 [0,1,0,0,0,0|1,0,2]=4 920 B8R0.2 CC(=O)[C@H](O)C(=O)CO Amb25756996 [0,1,0,0,0,0|1,0,2]=4 921 B8R0.2 CC(=O)[C@H](O)[C@H](O)CO Amb24477828 [0,1,0,0,0,0|2,0,0]=3 922 B8R0.2 CC(C#C)C(N)C(O)=O Amb25726710 [0,1,0,0,0,0|1,0,0]=2 923 B8R0.2 CC(C#C)C(O)C(O)=O Amb24417906 [0,1,0,0,0,0|2,0,0]=3 924 B8R0.2 CC(C#N)C(=O)C(O)=O Amb24680177 [0,1,0,0,0,0|2,0,1]=4 925 B8R0.2 CC(C(C)Br)C(=O)OC Amb25046683 [0,1,0,0,0,0|2,0,0]=3 926 B8R0.2 CC(C(C)C#C)C(N)=O Amb24683648 [0,1,0,0,0,0|3,0,0]=4 927 B8R0.2 CC(C(C)C#C)C(O)=O Amb25848905 [0,1,0,0,0,0|2,0,0]=3 928 B8R0.2 CC(C(C)C#N)C(O)=O Amb25062368 [0,1,0,0,0,0|2,0,0]=3 929 B8R0.2 CC(C(C)C=C)C(C)=O Amb25732466 [0,1,0,0,0,0|3,0,0]=4 930 B8R0.2 CC(C(C)C=C)C(O)=O Amb18642611 [0,1,0,0,0,0|2,0,0]=3 931 B8R0.2 CC(C(C)C=O)C(O)=O Amb24468282 [0,1,0,0,0,0|1,0,1]=3 932 B8R0.2 CC(C(C)CN)P(O)=O Amb24623943 [0,1,0,0,0,0|3,0,0]=4 933 B8R0.2 CC(C(C)CO)C(C)=O Amb25127275 [0,1,0,0,0,0|2,0,0]=3 934 B8R0.2 CC(C(C)Cl)C(=O)OC Amb24635801 [0,1,0,0,0,0|2,0,0]=3 935 B8R0.2 CC(C(C)Cl)S(=O)OC Amb24480066 [0,1,0,0,0,0|3,0,0]=4 936 B8R0.2 CC(C(C)N)C(=O)C#C Amb25232031 [0,1,0,0,0,0|3,0,0]=4 937 B8R0.2 CC(C(C)N)C(=O)NC Amb25296975 [0,1,0,0,0,0|3,0,0]=4 938 B8R0.2 CC(C(C)N)C(=O)NO Amb24355745 [0,1,0,0,0,0|2,0,0]=3 939 B8R0.2 CC(C(C)N)C(=O)OC Amb18642841 [0,1,0,0,0,0|2,0,0]=3 940 B8R0.2 CC(C(C)O)C(=O)OC Amb22059109 [0,1,0,0,0,0|1,0,0]=2 941 B8R0.2 CC(C(C)O)C(C)=C=C Amb25852889 [0,1,0,0,0,0|3,0,0]=4 942 B8R0.2 CC(C(C)O)S(=O)C=C Amb24642588 [0,1,0,0,0,0|3,0,0]=4 943 B8R0.2 CC(C(C)S)C(=O)NN Amb25704051 [0,1,0,0,0,0|2,1,0]=4 944 B8R0.2 CC(C(C)S)C(=O)OC Amb25682049 [0,1,0,0,0,0|1,1,0]=3 945 B8R0.2 CC(C(F)CC)C(O)=O Amb25836213 [0,1,0,0,0,0|2,0,0]=3 946 B8R0.2 CC(C(F)CN)P(O)=O Amb24524185 [0,1,0,0,0,0|3,0,0]=4 947 B8R0.2 CC(C(N)=O)N(C)CO Amb24744516 [0,1,0,0,0,0|3,0,0]=4 948 B8R0.2 CC(C(N)CC)C(O)=O Amb18832531 [0,1,0,0,0,0|2,0,0]=3 949 B8R0.2 CC(C(N)CN)C(O)=O Amb24532823 [0,1,0,0,0,0|2,0,0]=3 950 B8R0.2 CC(C(O)=O)N(C)C=O Amb18284942 [0,1,0,0,0,0|2,0,1]=4 951 B8R0.2 CC(C(O)=O)N(C)N=O Amb25041960 [0,1,0,0,0,0|2,0,1]=4 952 B8R0.2 CC(C(O)C#C)C(O)=O Amb25123215 [0,1,0,0,0,0|1,0,1]=3 953 B8R0.2 CC(C(O)C=C)C(O)=O Amb18642774 [0,1,0,0,0,0|1,0,1]=3 954 B8R0.2 CC(C(O)CCl)[N+]([O-])=O Amb24562846 [0,1,0,0,0,0|2,0,1]=4 955 B8R0.2 CC(C)C(Br)C(=O)C#N Amb24711291 [0,1,0,0,0,0|3,0,0]=4 956 B8R0.2 CC(C)C(C)C(=O)C=C Amb25743709 [0,1,0,0,0,0|3,0,0]=4 957 B8R0.2 CC(C)C(C)C(=O)CN Amb25147105 [0,1,0,0,0,0|3,0,0]=4 958 B8R0.2 CC(C)C(C)C(=O)NC Amb25755854 [0,1,0,0,0,0|3,0,0]=4 959 B8R0.2 CC(C)C(C)C(=O)NN Amb25212802 [0,1,0,0,0,0|3,0,0]=4 960 B8R0.2 CC(C)C(Cl)C(=O)C#N Amb24739558 [0,1,0,0,0,0|3,0,0]=4 961 B8R0.2 CC(C)C(Cl)C(=O)CCl Amb24596915 [0,1,0,0,0,0|3,0,0]=4 962 B8R0.2 CC(C)C(Cl)C(=O)OC Amb18799367 [0,1,0,0,0,0|2,0,0]=3 963 B8R0.2 CC(C)C(Cl)C(Cl)=NO Amb25053881 [0,1,0,0,0,0|3,0,0]=4 964 B8R0.2 CC(C)C(F)C(=O)NC Amb24748061 [0,1,0,0,0,0|3,0,0]=4 965 B8R0.2 CC(C)C(F)C(=O)NO Amb25092451 [0,1,0,0,0,0|2,0,0]=3 966 B8R0.2 CC(C)C(F)C(=O)OC Amb25144176 [0,1,0,0,0,0|2,0,0]=3 967 B8R0.2 CC(C)C(N)C(=C)CC Amb23536644 [0,1,0,0,0,0|3,0,0]=4 968 B8R0.2 CC(C)C(N)C(=O)C#C Amb24376987 [0,1,0,0,0,0|2,0,0]=3 969 B8R0.2 CC(C)C(N)C(=O)C=C Amb25315007 [0,1,0,0,0,0|2,0,0]=3 970 B8R0.2 CC(C)C(N)C(=O)CC Amb23536939 [0,1,0,0,0,0|2,0,0]=3 971 B8R0.2 CC(C)C(N)C(=O)CCl Amb18644035 [0,1,0,0,0,0|2,0,0]=3 972 B8R0.2 CC(C)C(N)C(=O)NC Amb20668407 [0,1,0,0,0,0|2,0,0]=3 973 B8R0.2 CC(C)C(N)C(=O)NN Amb18061950 [0,1,0,0,0,0|2,0,0]=3 974 B8R0.2 CC(C)C(N)C(=O)OCl Amb25211695 [0,1,0,0,0,0|1,0,0]=2 975 B8R0.2 CC(C)C(N)C(C)=C=C Amb24480326 [0,1,0,0,0,0|3,0,0]=4 976 B8R0.2 CC(C)C(N)C(O)C#C Amb25102594 [0,1,0,0,0,0|2,0,1]=4 977 B8R0.2 CC(C)C(N)C(O)CC Amb23536962 [0,1,0,0,0,0|2,0,1]=4 978 B8R0.2 CC(C)C(O)C(=C)C=O Amb25830547 [0,1,0,0,0,0|3,0,0]=4 979 B8R0.2 CC(C)C(O)C(=O)NC Amb24743373 [0,1,0,0,0,0|3,0,0]=4 980 B8R0.2 CC(C)C(O)C(=O)NO Amb25071171 [0,1,0,0,0,0|2,0,0]=3 981 B8R0.2 CC(C)C(O)C(=O)OC Amb24093829 [0,1,0,0,0,0|2,0,0]=3 982 B8R0.2 CC(C)C(O)\C(\N)=N/O Amb19737368 [0,1,0,0,0,0|3,0,0]=4 983 B8R0.2 CC(C)C(S)C(=O)NN Amb25130001 [0,1,0,0,0,0|3,0,0]=4 984 B8R0.2 CC(C)[C@@H](N)C(=O)CCl Amb24744707 [0,1,0,0,0,0|2,0,0]=3 985 B8R0.2 CC(C)[C@@H](N)C(=O)NC Amb18538476 [0,1,0,0,0,0|2,0,0]=3 986 B8R0.2 CC(C)[C@@H](N)C(=O)NO Amb24476696 [0,1,0,0,0,0|1,0,0]=2 987 B8R0.2 CC(C)[C@@H](O)C(=O)NN Amb25725418 [0,1,0,0,0,0|3,0,0]=4 988 B8R0.2 CC(C)[C@@H](O)C(=O)OC Amb22388621 [0,1,0,0,0,0|2,0,0]=3 989 B8R0.2 CC(C)[C@H](C)C(=O)CC Amb25116502 [0,1,0,0,0,0|3,0,0]=4 990 B8R0.2 CC(C)[C@H](N)C(=O)OBr Amb25337637 [0,1,0,0,0,0|1,0,0]=2 991 B8R0.2 CC(C)[C@H](N)C(C)=C=C Amb24477813 [0,1,0,0,0,0|3,0,0]=4 992 B8R0.2 CC(C)[C@H](N)[C@@H](O)CC Amb24477738 [0,1,0,0,0,0|2,0,1]=4 993 B8R0.2 CC(C)[C@H](N)[C@H](O)C#C Amb25077166 [0,1,0,0,0,0|2,0,1]=4 994 B8R0.2 CC(C)[C@H](N)[C@H](O)C=C Amb24476694 [0,1,0,0,0,0|2,0,1]=4 995 B8R0.2 CC(C)[C@H](N)[C@H](O)CCl Amb25293165 [0,1,0,0,0,0|2,0,1]=4 996 B8R0.2 CC(C)[C@H](O)C(=O)OC Amb22228179 [0,1,0,0,0,0|2,0,0]=3 997 B8R0.2 CC(C=C)C(Br)C(O)=O Amb25102712 [0,1,0,0,0,0|2,0,0]=3 998 B8R0.2 CC(C=C)C(F)C(C)=O Amb25839816 [0,1,0,0,0,0|3,0,0]=4 999 B8R0.2 CC(C=C)C(F)C(O)=O Amb24426918 [0,1,0,0,0,0|2,0,0]=3 1000 B8R0.2 CC(C=C)C(N)C(O)=O Amb18989861 [0,1,0,0,0,0|1,0,0]=2 1001 B8R0.2 CC(C=C)C(O)C(O)=O Amb18642750 [0,1,0,0,0,0|2,0,0]=3 1002 B8R0.2 CC(C=O)C(N)C(O)=O Amb24374650 [0,1,0,0,0,0|0,0,1]=2 1003 B8R0.2 CC(CC)C(Cl)C(=O)Cl Amb24635851 [0,1,0,0,0,0|3,0,0]=4 1004 B8R0.2 CC(CC)C(N)C(=O)S Amb24753871 [0,1,0,0,0,0|1,1,0]=3 1005 B8R0.2 CC(CC)C(N)C(N)=S Amb19374909 [0,1,0,0,0,0|2,1,0]=4 1006 B8R0.2 CC(CC)C(N)P(O)=O Amb24480138 [0,1,0,0,0,0|2,0,0]=3 1007 B8R0.2 CC(CC)C(N)P(O)O Amb24739487 [0,1,0,0,0,0|2,0,1]=4 1008 B8R0.2 CC(CC)C(O)C(N)=O Amb24112761 [0,1,0,0,0,0|3,0,0]=4 1009 B8R0.2 CC(CC)C(O)C(O)=O Amb18288809 [0,1,0,0,0,0|2,0,0]=3 1010 B8R0.2 CC(CC)C([15NH2])C(O)=O Amb22732430 [0,1,0,0,0,0|1,0,0]=2 1011 B8R0.2 CC(CC)[C@@H](Br)C(O)=O Amb25706427 [0,1,0,0,0,0|2,0,0]=3 1012 B8R0.2 CC(CC)[C@@H](Cl)C(O)=O Amb25360795 [0,1,0,0,0,0|2,0,0]=3 1013 B8R0.2 CC(CC)[C@@H](N)C(N)=O Amb18538475 [0,1,0,0,0,0|2,0,0]=3 1014 B8R0.2 CC(CC)[C@@H](O)C(O)=O Amb25083795 [0,1,0,0,0,0|2,0,0]=3 1015 B8R0.2 CC(CC)[C@H](F)C(O)=O Amb25679990 [0,1,0,0,0,0|2,0,0]=3 1016 B8R0.2 CC(CC)[C@H](O)C(O)=O Amb24700212 [0,1,0,0,0,0|2,0,0]=3 1017 B8R0.2 CC(CCl)[C@H](N)C(O)=O Amb24458196 [0,1,0,0,0,0|1,0,0]=2 1018 B8R0.2 CC(CF)C(N)C(O)=O Amb25223334 [0,1,0,0,0,0|1,0,0]=2 1019 B8R0.2 CC(CN)C(N)C(O)=O Amb25824065 [0,1,0,0,0,0|1,0,0]=2 1020 B8R0.2 CC(CN)C(O)C(O)=O Amb18642919 [0,1,0,0,0,0|2,0,0]=3 1021 B8R0.2 CC(CO)=C(N)C(O)=O Amb25031515 [0,1,0,0,0,0|0,0,2]=3 1022 B8R0.2 CC(CO)=C(O)C(O)=O Amb25757908 [0,1,0,0,0,0|1,0,2]=4 1023 B8R0.2 CC(CO)N(C)C(N)=O Amb24481821 [0,1,0,0,0,0|3,0,0]=4 1024 B8R0.2 CC(CO)[C@@H](O)C(C)=C Amb25284368 [0,1,0,0,0,0|3,0,0]=4 1025 B8R0.2 CC(Cl)C(Br)C(=O)OC Amb25123870 [0,1,0,0,0,0|2,0,0]=3 1026 B8R0.2 CC(Cl)C(N)C(=O)OC Amb18644494 [0,1,0,0,0,0|1,0,0]=2 1027 B8R0.2 CC(Cl)C(S)C(=O)OC Amb24595377 [0,1,0,0,0,0|2,0,0]=3 1028 B8R0.2 CC(F)C(Br)C(=O)OC Amb25086610 [0,1,0,0,0,0|2,0,0]=3 1029 B8R0.2 CC(F)C(O)C(=O)OC Amb24648246 [0,1,0,0,0,0|2,0,0]=3 1030 B8R0.2 CC(N)C(C)C(=O)NN Amb25189012 [0,1,0,0,0,0|3,0,0]=4 1031 B8R0.2 CC(N)C(O)C(=O)NC Amb24752298 [0,1,0,0,0,0|3,0,0]=4 1032 B8R0.2 CC(NC)C(N)C(O)=O Amb18642890 [0,1,0,0,0,0|1,0,0]=2 1033 B8R0.2 CC(NC)C(O)C(O)=O Amb24477689 [0,1,0,0,0,0|2,0,0]=3 1034 B8R0.2 CC(O)C(=O)C(=O)CO Amb24408420 [0,1,0,0,0,0|1,0,1]=3 1035 B8R0.2 CC(O)C(Br)C(=O)OC Amb24415051 [0,1,0,0,0,0|1,0,0]=2 1036 B8R0.2 CC(O)C(Br)C(C)CO Amb25799666 [0,1,0,0,0,0|2,0,1]=4 1037 B8R0.2 CC(O)C(Cl)C(=O)OC Amb25269533 [0,1,0,0,0,0|1,0,0]=2 1038 B8R0.2 CC(O)C(F)C(=O)OC Amb24481911 [0,1,0,0,0,0|1,0,0]=2 1039 B8R0.2 CC(O)C(N)C(=O)NC Amb24705029 [0,1,0,0,0,0|1,0,0]=2 1040 B8R0.2 CC(O)C(N)C(=O)NN Amb25343283 [0,1,0,0,0,0|1,0,0]=2 1041 B8R0.2 CC(O)C(N)C(O)=NO Amb24539768 [0,1,0,0,0,0|0,0,1]=2 1042 B8R0.2 CC(O)C(O)C(O)C=O Amb24711583 [0,1,0,0,0,0|1,0,1]=3 1043 B8R0.2 CC(O)C(O)\C(\C)=C/C Amb25847844 [0,1,0,0,0,0|3,0,0]=4 1044 B8R0.2 CC(O)[C@@H](O)[C@H](O)CO Amb24687810 [0,1,0,0,0,0|1,0,2]=4 1045 B8R0.2 CC(O)[C@H](N)C(=O)NC Amb25366384 [0,1,0,0,0,0|1,0,0]=2 1046 B8R0.2 CC(O)[C@H](N)C(=O)OC Amb25213074 [0,1,0,0,0,0|0,0,0]=1 1047 B8R0.2 CC(OC)C(Cl)C(C)=O Amb24480084 [0,1,0,0,0,0|2,0,0]=3 1048 B8R0.2 CC(OC)C(O)C(C)=C Amb24690397 [0,1,0,0,0,0|3,0,0]=4 1049 B8R0.2 CC(OC)C(O)C(N)=O Amb25706543 [0,1,0,0,0,0|2,0,0]=3 1050 B8R0.2 CC(OC)[C@@H](N)C(O)=O Amb25733335 [0,1,0,0,0,0|0,0,0]=1 1051 B8R0.2 CC(SC)C(N)C(O)=O Amb22228563 [0,1,0,0,0,0|0,1,0]=2 1052 B8R0.2 CC([C@@H](C)O)C(=O)OC Amb25077967 [0,1,0,0,0,0|1,0,0]=2 1053 B8R0.2 CC([C@H](C)O)C(=O)OC Amb25788911 [0,1,0,0,0,0|1,0,0]=2 1054 B8R0.2 CCC(=C)C(C)C(O)=O Amb25228831 [0,1,0,0,0,0|2,0,1]=4 1055 B8R0.2 CCC(=C)C(N)C(O)=O Amb18642707 [0,1,0,0,0,0|1,0,1]=3 1056 B8R0.2 CCC(=C)[C@H](N)C(O)=O Amb25828765 [0,1,0,0,0,0|1,0,1]=3 1057 B8R0.2 CCC(=O)C(=C)[C@@H](C)O Amb24467526 [0,1,0,0,0,0|2,0,1]=4 1058 B8R0.2 CCC(=O)C(=C)[C@H](C)O Amb25768509 [0,1,0,0,0,0|2,0,1]=4 1059 B8R0.2 CCC(=S)[C@H](N)C(O)=O Amb25111086 [0,1,0,0,0,0|0,1,1]=3 1060 B8R0.2 CCC(Br)C(Br)C(O)=O Amb24478770 [0,1,0,0,0,0|2,0,0]=3 1061 B8R0.2 CCC(C(C(=O)N)N)C Amb1105283 [0,1,0,0,0,0|2,0,0]=3 1062 B8R0.2 CCC(C(C(=O)N)N)C Amb1152621 [0,1,0,0,0,0|2,0,0]=3 1063 B8R0.2 CCC(C(C(=O)O)C)O Amb10844267 [0,1,0,0,0,0|1,0,0]=2 1064 B8R0.2 CCC(C(C(=O)O)Cl)C Amb17593752 [0,1,0,0,0,0|2,0,0]=3 1065 B8R0.2 CCC(C([N+](=O)[O-])C)O Amb17618435 [0,1,0,0,0,0|2,0,1]=4 1066 B8R0.2 CCC(C)C(=C)C(O)=O Amb18642655 [0,1,0,0,0,0|2,0,1]=4 1067 B8R0.2 CCC(C)C(=O)C(O)=O Amb22731530 [0,1,0,0,0,0|2,0,1]=4 1068 B8R0.2 CCC(C)C(C)C(N)=O Amb24746800 [0,1,0,0,0,0|3,0,0]=4 1069 B8R0.2 CCC(C)C(C)C(O)=O Amb18290719 [0,1,0,0,0,0|2,0,0]=3 1070 B8R0.2 CCC(F)C(N)C(O)=O Amb24764202 [0,1,0,0,0,0|1,0,0]=2 1071 B8R0.2 CCC(F)C(N)C(O)O Amb25204781 [0,1,0,0,0,0|1,0,2]=4 1072 B8R0.2 CCC(N)C(=C)C(O)=O Amb24558624 [0,1,0,0,0,0|2,0,1]=4 1073 B8R0.2 CCC(O)C(=C)C(N)=O Amb25265250 [0,1,0,0,0,0|2,0,1]=4 1074 B8R0.2 CCC(O)C(N)C(O)=O Amb18203168 [0,1,0,0,0,0|0,0,0]=1 1075 B8R0.2 CCC(O)C(O)C(C)=O Amb24736298 [0,1,0,0,0,0|2,0,0]=3 1076 B8R0.2 CCC(O)C(O)C(O)=O Amb24441607 [0,1,0,0,0,0|1,0,0]=2 1077 B8R0.2 CCC(O)[C@@H](N)C(O)=O Amb22750712 [0,1,0,0,0,0|0,0,0]=1 1078 B8R0.2 CCC(O)[C@H](N)C(O)=O Amb24364655 [0,1,0,0,0,0|0,0,0]=1 1079 B8R0.2 CCC(S)C(N)C(O)=O Amb24365228 [0,1,0,0,0,0|0,1,0]=2 1080 B8R0.2 CCC(S)[C@@H](N)C(O)=O Amb24604283 [0,1,0,0,0,0|0,1,0]=2 1081 B8R0.2 CCC([C@@H](C(=O)N)N)C Amb17231868 [0,1,0,0,0,0|2,0,0]=3 1082 B8R0.2 CCC([C@@H](C(=O)O)C)C Amb10844495 [0,1,0,0,0,0|2,0,0]=3 1083 B8R0.2 CCC([C@@H](C(=O)O)N)C Amb10844501 [0,1,0,0,0,0|1,0,0]=2 1084 B8R0.2 CCC([C@H](C(=O)O)N)C Amb10844500 [0,1,0,0,0,0|1,0,0]=2 1085 B8R0.2 CCN(C)[C@H](C)C(O)=O Amb25073540 [0,1,0,0,0,0|3,0,0]=4 1086 B8R0.2 CCS(=O)C(C)C(O)=O Amb18984976 [0,1,0,0,0,0|2,0,1]=4 1087 B8R0.2 CC[C@@H](C)C(=O)C(O)=O Amb25129590 [0,1,0,0,0,0|2,0,1]=4 1088 B8R0.2 CC[C@@H](C)[C@H](C)C(C)=O Amb25024740 [0,1,0,0,0,0|3,0,0]=4 1089 B8R0.2 CC[C@@H](N)[C@H](O)C(O)=O Amb22831530 [0,1,0,0,0,0|2,0,0]=3 1090 B8R0.2 CC[C@@H](O)[C@@H](N)C(O)=O Amb24087716 [0,1,0,0,0,0|0,0,0]=1 1091 B8R0.2 CC[C@@H](O)[C@H](N)C(N)=O Amb24670277 [0,1,0,0,0,0|1,0,0]=2 1092 B8R0.2 CC[C@@H](O)[C@H](N)C(O)=O Amb24105353 [0,1,0,0,0,0|0,0,0]=1 1093 B8R0.2 CC[C@@H](O)[C@H](O)C(O)=O Amb24431211 [0,1,0,0,0,0|1,0,0]=2 1094 B8R0.2 CC[C@@H]([C@@H](C(=O)N)N)C Amb10878815 [0,1,0,0,0,0|2,0,0]=3 1095 B8R0.2 CC[C@@H]([C@@H](C(=O)O)Br)Br Amb16233350 [0,1,0,0,0,0|2,0,0]=3 1096 B8R0.2 CC[C@@H]([C@@H](C(=O)O)C)C Amb10844498 [0,1,0,0,0,0|2,0,0]=3 1097 B8R0.2 CC[C@@H]([C@H](C(=O)O)O)C Amb10576171 [0,1,0,0,0,0|2,0,0]=3 1098 B8R0.2 CC[C@H](C)C(=C)C(O)=O Amb24699439 [0,1,0,0,0,0|2,0,1]=4 1099 B8R0.2 CC[C@H](C)[C@@H](C)C(O)=O Amb25056174 [0,1,0,0,0,0|2,0,0]=3 1100 B8R0.2 CC[C@H](C)[C@H](C)C(N)=O Amb25076764 [0,1,0,0,0,0|3,0,0]=4 1101 B8R0.2 CC[C@H](N)C(=C)C(O)=O Amb24468573 [0,1,0,0,0,0|2,0,1]=4 1102 B8R0.2 CC[C@H](N)[C@@H](O)C(O)=O Amb24449588 [0,1,0,0,0,0|2,0,0]=3 1103 B8R0.2 CC[C@H](N)[C@H](O)C(O)=O Amb24477817 [0,1,0,0,0,0|2,0,0]=3 1104 B8R0.2 CC[C@H](O)[C@H](N)C(N)=O Amb25113391 [0,1,0,0,0,0|1,0,0]=2 1105 B8R0.2 CC[C@H]([C@@H](C(=O)O)N)C Amb10068321 [0,1,0,0,0,0|1,0,0]=2 1106 B8R0.2 CN(C=O)C(O)C(O)=O Amb24069122 [0,1,0,0,0,0|2,0,1]=4 1107 B8R0.2 CNC(=O)C(N)C(N)=O Amb18124333 [0,1,0,0,0,0|1,0,2]=4 1108 B8R0.2 CNC(=O)[C@H](C(C)C)N Amb17231869 [0,1,0,0,0,0|2,0,0]=3 1109 B8R0.2 CNC(C)C(C)C(O)=O Amb25342967 [0,1,0,0,0,0|2,0,0]=3 1110 B8R0.2 CN[C@@H](C)[C@H](C)C(O)=O Amb25676912 [0,1,0,0,0,0|2,0,0]=3 1111 B8R0.2 COC(=O)C(=C)C(C)O Amb22351732 [0,1,0,0,0,0|1,0,1]=3 1112 B8R0.2 COC(=O)C(=O)C(Br)C Amb17621489 [0,1,0,0,0,0|2,0,1]=4 1113 B8R0.2 COC(=O)C(=O)C(C)C Amb17935756 [0,1,0,0,0,0|2,0,1]=4 1114 B8R0.2 COC(=O)C(C(C)C)N Amb1104996 [0,1,0,0,0,0|1,0,0]=2 1115 B8R0.2 COC(=O)C(C)C(C)=O Amb17939472 [0,1,0,0,0,0|1,0,2]=4 1116 B8R0.2 COC(=O)C(C)C(O)=O Amb18642868 [0,1,0,0,0,0|1,0,2]=4 1117 B8R0.2 COC(=O)C(C)S(C)=O Amb18181669 [0,1,0,0,0,0|2,0,1]=4 1118 B8R0.2 COC(=O)C(F)C(Cl)Cl Amb25691403 [0,1,0,0,0,0|3,0,0]=4 1119 B8R0.2 COC(=O)C(F)C(F)Cl Amb24480201 [0,1,0,0,0,0|3,0,0]=4 1120 B8R0.2 COC(=O)C(N)C(=C)N Amb24542847 [0,1,0,0,0,0|1,0,2]=4 1121 B8R0.2 COC(=O)C(N)C(F)F Amb25208569 [0,1,0,0,0,0|2,0,0]=3 1122 B8R0.2 COC(=O)C(N)C(N)=O Amb24478682 [0,1,0,0,0,0|1,0,2]=4 1123 B8R0.2 COC(=O)C(N)C(O)=O Amb22491276 [0,1,0,0,0,0|0,0,2]=3 1124 B8R0.2 COC(=O)C(O)C(F)F Amb24747328 [0,1,0,0,0,0|3,0,0]=4 1125 B8R0.2 COC(=O)C(O)C(O)=O Amb25255680 [0,1,0,0,0,0|1,0,2]=4 1126 B8R0.2 COC(=O)[C@@H](C(C)C)N Amb10604149 [0,1,0,0,0,0|1,0,0]=2 1127 B8R0.2 COC(=O)[C@@H](C(C)C)N Amb16183873 [0,1,0,0,0,0|1,0,0]=2 1128 B8R0.2 COC(=O)[C@H](N)C(O)=O Amb24695000 [0,1,0,0,0,0|0,0,2]=3 1129 B8R0.2 COC(=O)[C@H]([C@H](O)C)N Amb10844890 [0,1,0,0,0,0|0,0,0]=1 1130 B8R0.2 COC(C(C(=O)O)Br)C Amb16233352 [0,1,0,0,0,0|1,0,0]=2 1131 B8R0.2 COC(C(C(=O)O)C)C Amb10844268 [0,1,0,0,0,0|1,0,0]=2 1132 B8R0.2 COC(C)C(=C)C(O)=O Amb25706403 [0,1,0,0,0,0|1,0,1]=3 1133 B8R0.2 COC(C)C(N)C(O)=O Amb17938689 [0,1,0,0,0,0|0,0,0]=1 1134 B8R0.2 COC(C)[C@H](C)C(O)=O Amb25722336 [0,1,0,0,0,0|1,0,0]=2 1135 B8R0.2 CO[C@@H](C)C(=O)C(O)=O Amb24597638 [0,1,0,0,0,0|1,0,1]=3 1136 B8R0.2 CO[C@@H](C)[C@@H](C)C(O)=O Amb25263126 [0,1,0,0,0,0|1,0,0]=2 1137 B8R0.2 CO[C@@H](Cl)[C@H](Cl)C(C)=O Amb25162294 [0,1,0,0,0,0|3,0,0]=4 1138 B8R0.2 CO[C@@H]([C@@H](C(=O)O)N)C Amb16183892 [0,1,0,0,0,0|0,0,0]=1 1139 B8R0.2 CO[C@@H]([C@H](C(=O)O)N)C Amb10603094 [0,1,0,0,0,0|0,0,0]=1 1140 B8R0.2 CO[C@H](C)[C@H](C)C(O)=O Amb24358364 [0,1,0,0,0,0|1,0,0]=2 1141 B8R0.2 CO[C@H]([C@@H](C(=O)O)C)C Amb10844258 [0,1,0,0,0,0|1,0,0]=2 1142 B8R0.2 CSC(C)C(C)C(O)=O Amb18644375 [0,1,0,0,0,0|1,1,0]=3 1143 B8R0.2 CS[C@@H](C)[C@H](C)C(O)=O Amb24552609 [0,1,0,0,0,0|1,1,0]=3 1144 B8R0.2 C[C@@H](C#C)[C@H](N)C(O)=O Amb25783160 [0,1,0,0,0,0|1,0,0]=2 1145 B8R0.2 C[C@@H](C(O)=O)N(C)C=O Amb24558225 [0,1,0,0,0,0|2,0,1]=4 1146 B8R0.2 C[C@@H](C=C)[C@H](N)C(O)=O Amb24340139 [0,1,0,0,0,0|1,0,0]=2 1147 B8R0.2 C[C@@H](C=O)[C@H](N)C(O)=O Amb25142449 [0,1,0,0,0,0|0,0,1]=2 1148 B8R0.2 C[C@@H](CC)C(Br)C(O)=O Amb24635596 [0,1,0,0,0,0|2,0,0]=3 1149 B8R0.2 C[C@@H](CC)C(F)C(O)=O Amb25042866 [0,1,0,0,0,0|2,0,0]=3 1150 B8R0.2 C[C@@H](CC)C(O)C(O)=O Amb25088995 [0,1,0,0,0,0|2,0,0]=3 1151 B8R0.2 C[C@@H](CC)[C@@H](Br)C(O)=O Amb23401386 [0,1,0,0,0,0|2,0,0]=3 1152 B8R0.2 C[C@@H](CC)[C@@H](S)C(O)=O Amb24388715 [0,1,0,0,0,0|2,0,0]=3 1153 B8R0.2 C[C@@H](CC)[C@H](Cl)C(O)=O Amb22388560 [0,1,0,0,0,0|2,0,0]=3 1154 B8R0.2 C[C@@H](CC)[C@H](N)C(O)=O Amb22351114 [0,1,0,0,0,0|1,0,0]=2 1155 B8R0.2 C[C@@H](CC)[C@H]([15NH2])C(O)=O Amb22337867 [0,1,0,0,0,0|1,0,0]=2 1156 B8R0.2 C[C@@H](CO)[C@@H](N)C(O)=O Amb24117487 [0,1,0,0,0,0|0,0,0]=1 1157 B8R0.2 C[C@@H](CO)[C@H](N)C(O)=O Amb24117488 [0,1,0,0,0,0|0,0,0]=1 1158 B8R0.2 C[C@@H](Cl)[C@@H](N)C(=O)NO Amb24694002 [0,1,0,0,0,0|1,0,0]=2 1159 B8R0.2 C[C@@H](Cl)[C@H](Cl)C(=O)OC Amb24366616 [0,1,0,0,0,0|2,0,0]=3 1160 B8R0.2 C[C@@H](Cl)[C@H](O)C(=O)OC Amb25347697 [0,1,0,0,0,0|2,0,0]=3 1161 B8R0.2 C[C@@H](NC)[C@H](N)C(O)=O Amb24477707 [0,1,0,0,0,0|1,0,0]=2 1162 B8R0.2 C[C@@H](NC)[C@H](O)C(O)=O Amb25146143 [0,1,0,0,0,0|2,0,0]=3 1163 B8R0.2 C[C@@H](O)[C@@H](Br)[C@H](C)CO Amb24480008 [0,1,0,0,0,0|2,0,1]=4 1164 B8R0.2 C[C@@H](O)[C@@H](Cl)C(=O)OC Amb24479996 [0,1,0,0,0,0|1,0,0]=2 1165 B8R0.2 C[C@@H](O)[C@@H](N)C(=O)OC Amb22744992 [0,1,0,0,0,0|0,0,0]=1 1166 B8R0.2 C[C@@H](O)[C@@H](O)C(=O)OC Amb25320663 [0,1,0,0,0,0|1,0,0]=2 1167 B8R0.2 C[C@@H](O)[C@@H](O)[C@@H](O)CO Amb25056707 [0,1,0,0,0,0|1,0,2]=4 1168 B8R0.2 C[C@@H](O)[C@@H](O)[C@H](O)C=O Amb22229972 [0,1,0,0,0,0|1,0,1]=3 1169 B8R0.2 C[C@@H](O)[C@@H](O)[C@H](O)CO Amb25283309 [0,1,0,0,0,0|1,0,2]=4 1170 B8R0.2 C[C@@H](O)[C@H](Br)C(=O)OC Amb25109342 [0,1,0,0,0,0|1,0,0]=2 1171 B8R0.2 C[C@@H](O)[C@H](C)[C@@H](O)CC Amb25369460 [0,1,0,0,0,0|2,0,1]=4 1172 B8R0.2 C[C@@H](O)[C@H](N)C(=O)NC Amb24671233 [0,1,0,0,0,0|1,0,0]=2 1173 B8R0.2 C[C@@H](O)[C@H](N)C(=O)NO Amb22800603 [0,1,0,0,0,0|0,0,0]=1 1174 B8R0.2 C[C@@H](O)[C@H](O)C(=O)CO Amb24625788 [0,1,0,0,0,0|1,0,0]=2 1175 B8R0.2 C[C@@H](O)[C@H](O)[C@@H](O)C=O Amb25803604 [0,1,0,0,0,0|1,0,1]=3 1176 B8R0.2 C[C@@H](O)[C@H](O)[C@H](O)CO Amb25042518 [0,1,0,0,0,0|1,0,2]=4 1177 B8R0.2 C[C@@H](OC)[C@@H](N)C(O)=O Amb23438804 [0,1,0,0,0,0|0,0,0]=1 1178 B8R0.2 C[C@@H](OC)[C@H](Br)C(=O)Cl Amb25325034 [0,1,0,0,0,0|2,0,0]=3 1179 B8R0.2 C[C@@H](OC)[C@H](Cl)C(O)=O Amb25701678 [0,1,0,0,0,0|1,0,0]=2 1180 B8R0.2 C[C@@H](OC)[C@H](N)C(O)=O Amb23438882 [0,1,0,0,0,0|0,0,0]=1 1181 B8R0.2 C[C@@H](OC)[C@H](O)C(O)=O Amb25316180 [0,1,0,0,0,0|1,0,0]=2 1182 B8R0.2 C[C@@H](SC)[C@@H](N)C(O)=O Amb24666742 [0,1,0,0,0,0|0,1,0]=2 1183 B8R0.2 C[C@@H]([C@@H](C)C=C)C(O)=O Amb24721924 [0,1,0,0,0,0|2,0,0]=3 1184 B8R0.2 C[C@@H]([C@@H](C)C=O)C(O)=O Amb24470204 [0,1,0,0,0,0|1,0,1]=3 1185 B8R0.2 C[C@@H]([C@@H](C)CO)C(O)=O Amb24696822 [0,1,0,0,0,0|1,0,0]=2 1186 B8R0.2 C[C@@H]([C@@H](C)N)C(=O)OC Amb24698063 [0,1,0,0,0,0|2,0,0]=3 1187 B8R0.2 C[C@@H]([C@@H](C)O)C(=O)OC Amb24363609 [0,1,0,0,0,0|1,0,0]=2 1188 B8R0.2 C[C@@H]([C@@H](O)CC)C(O)=O Amb24427100 [0,1,0,0,0,0|1,0,0]=2 1189 B8R0.2 C[C@@H]([C@@H](O)CO)C(C)=C Amb25267090 [0,1,0,0,0,0|3,0,0]=4 1190 B8R0.2 C[C@@H]([C@H](C)O)C(=S)SC Amb25052209 [0,1,0,0,0,0|1,2,0]=4 1191 B8R0.2 C[C@@H]([C@H](N)CC)C(O)=O Amb24496209 [0,1,0,0,0,0|2,0,0]=3 1192 B8R0.2 C[C@@H]([C@H](O)C=C)C(O)=O Amb24622455 [0,1,0,0,0,0|1,0,1]=3 1193 B8R0.2 C[C@@H]([C@H](O)CC)C(C)=C Amb24672493 [0,1,0,0,0,0|3,0,0]=4 1194 B8R0.2 C[C@@H]([C@H](O)CC)C(O)=O Amb24472165 [0,1,0,0,0,0|1,0,0]=2 1195 B8R0.2 C[C@H](C(C)Br)C(=O)OC Amb25061347 [0,1,0,0,0,0|2,0,0]=3 1196 B8R0.2 C[C@H](C=C)[C@@H](N)C(O)=O Amb24460813 [0,1,0,0,0,0|1,0,0]=2 1197 B8R0.2 C[C@H](C=C)[C@H](Br)C(O)=O Amb25074908 [0,1,0,0,0,0|2,0,0]=3 1198 B8R0.2 C[C@H](C=C)[C@H](Cl)C(O)=O Amb24361246 [0,1,0,0,0,0|2,0,0]=3 1199 B8R0.2 C[C@H](C=C)[C@H](F)C(O)=O Amb25138124 [0,1,0,0,0,0|2,0,0]=3 1200 B8R0.2 C[C@H](C=O)[C@@H](O)C(C)=O Amb25768475 [0,1,0,0,0,0|2,0,1]=4 1201 B8R0.2 C[C@H](CC)C(N)C(O)=O Amb25206861 [0,1,0,0,0,0|1,0,0]=2 1202 B8R0.2 C[C@H](CC)[C@@H](Br)C(O)=O Amb24415133 [0,1,0,0,0,0|2,0,0]=3 1203 B8R0.2 C[C@H](CC)[C@H](Cl)C(O)=O Amb25147095 [0,1,0,0,0,0|2,0,0]=3 1204 B8R0.2 C[C@H](CC)[C@H](O)C(O)=O Amb25703176 [0,1,0,0,0,0|2,0,0]=3 1205 B8R0.2 C[C@H](CO)N(C)C(C)=O Amb24553314 [0,1,0,0,0,0|3,0,0]=4 1206 B8R0.2 C[C@H](CO)[C@@H](O)C(C)=C Amb24387757 [0,1,0,0,0,0|3,0,0]=4 1207 B8R0.2 C[C@H](Cl)[C@@H](N)C(=O)OC Amb24366062 [0,1,0,0,0,0|1,0,0]=2 1208 B8R0.2 C[C@H](Cl)[C@H](O)C(=O)OC Amb24479929 [0,1,0,0,0,0|2,0,0]=3 1209 B8R0.2 C[C@H](N)C(O)C(=O)OC Amb25238441 [0,1,0,0,0,0|2,0,0]=3 1210 B8R0.2 C[C@H](N)[C@H](O)C(=O)OC Amb24477818 [0,1,0,0,0,0|2,0,0]=3 1211 B8R0.2 C[C@H](NC)[C@@H](O)C(N)=O Amb25095009 [0,1,0,0,0,0|3,0,0]=4 1212 B8R0.2 C[C@H](NC)[C@H](O)C(O)=O Amb25755974 [0,1,0,0,0,0|2,0,0]=3 1213 B8R0.2 C[C@H](O)C(N)C(=O)OC Amb25302264 [0,1,0,0,0,0|0,0,0]=1 1214 B8R0.2 C[C@H](O)[C@@H](C)[C@@H](O)CC Amb25206574 [0,1,0,0,0,0|2,0,1]=4 1215 B8R0.2 C[C@H](O)[C@@H](N)C(=O)NO Amb25063917 [0,1,0,0,0,0|0,0,0]=1 1216 B8R0.2 C[C@H](O)[C@@H](O)C(=O)OC Amb25763009 [0,1,0,0,0,0|1,0,0]=2 1217 B8R0.2 C[C@H](O)[C@@H](O)[C@@H](O)C=O Amb24741570 [0,1,0,0,0,0|1,0,1]=3 1218 B8R0.2 C[C@H](O)[C@@H](O)[C@@H](O)CO Amb24615371 [0,1,0,0,0,0|1,0,2]=4 1219 B8R0.2 C[C@H](O)[C@H](C)[C@@H](O)CC Amb25369459 [0,1,0,0,0,0|2,0,1]=4 1220 B8R0.2 C[C@H](O)[C@H](O)C(=O)OC Amb25327481 [0,1,0,0,0,0|1,0,0]=2 1221 B8R0.2 C[C@H](O)[C@H](O)[C@@H](C)CO Amb24697820 [0,1,0,0,0,0|2,0,1]=4 1222 B8R0.2 C[C@H](O)[C@H](O)[C@@H](O)C=O Amb22229973 [0,1,0,0,0,0|1,0,1]=3 1223 B8R0.2 C[C@H](O)[C@H](O)[C@@H](O)CO Amb25045742 [0,1,0,0,0,0|1,0,2]=4 1224 B8R0.2 C[C@H](OC)[C@@H](Br)C(O)=O Amb24480242 [0,1,0,0,0,0|1,0,0]=2 1225 B8R0.2 C[C@H](OC)[C@@H](O)C(O)=O Amb25140960 [0,1,0,0,0,0|1,0,0]=2 1226 B8R0.2 C[C@H](S)[C@@H](N)C(=O)OC Amb24420424 [0,1,0,0,0,0|0,1,0]=2 1227 B8R0.2 C[C@H]([C@@H](C)O)C(=S)SC Amb24747683 [0,1,0,0,0,0|1,2,0]=4 1228 B8R0.2 C[C@H]([C@@H](C)O)C(C)=C=C Amb25219301 [0,1,0,0,0,0|3,0,0]=4 1229 B8R0.2 C[C@H]([C@@H](C)O)N(C)N=O Amb24471757 [0,1,0,0,0,0|3,0,0]=4 1230 B8R0.2 C[C@H]([C@@H](O)CC)C(C)=O Amb25096669 [0,1,0,0,0,0|2,0,0]=3 1231 B8R0.2 C[C@H]([C@H](C)C=C)C(C)=O Amb25266896 [0,1,0,0,0,0|3,0,0]=4 1232 B8R0.2 C[C@H]([C@H](C)C=C)C(O)=O Amb24528497 [0,1,0,0,0,0|2,0,0]=3 1233 B8R0.2 C[C@H]([C@H](C)O)C(=C)CC Amb24502361 [0,1,0,0,0,0|3,0,0]=4 1234 B8R0.2 C[C@H]([C@H](C)O)C(=O)CC Amb25086603 [0,1,0,0,0,0|2,0,0]=3 1235 B8R0.2 C[C@H]([C@H](C)O)C(=O)OC Amb25762229 [0,1,0,0,0,0|1,0,0]=2 1236 B8R0.2 C[C@H]([C@H](C)O)C(=S)SC Amb25706053 [0,1,0,0,0,0|1,2,0]=4 1237 B8R0.2 C[C@H]([C@H](C)O)\C(\C)=C/C Amb24687423 [0,1,0,0,0,0|3,0,0]=4 1238 B8R0.2 C[C@H]([C@H](N)CC)C(O)=O Amb25737884 [0,1,0,0,0,0|2,0,0]=3 1239 B8R0.2 C\C(=C/C)\C(N)C(O)=O Amb18642706 [0,1,0,0,0,0|1,0,1]=3 1240 B8R0.2 C\C(=C/C)\[C@@H](N)C(O)=O Amb24695637 [0,1,0,0,0,0|1,0,1]=3 1241 B8R0.2 C\C(=C\C)\C(O)C(O)=O Amb24495368 [0,1,0,0,0,0|2,0,1]=4 1242 B8R0.2 ClCC(C(C(=O)O)O)O Amb17593871 [0,1,0,0,0,0|1,0,0]=2 1243 B8R0.2 FC[C@H]([C@@H](C(=O)O)N)O Amb13883676 [0,1,0,0,0,0|0,0,0]=1 1244 B8R0.2 NC(=O)[C@@H](O)[C@@H](O)CO Amb24533413 [0,1,0,0,0,0|2,0,0]=3 1245 B8R0.2 NC(=O)[C@H](O)[C@@H](O)C#N Amb25185361 [0,1,0,0,0,0|2,0,1]=4 1246 B8R0.2 NC(=O)[C@H](O)[C@H](O)CO Amb25146059 [0,1,0,0,0,0|2,0,0]=3 1247 B8R0.2 NC(C(O)CO)C(O)=O Amb18642974 [0,1,0,0,0,0|0,0,0]=1 1248 B8R0.2 NC(CF)C(F)C(O)=O Amb24340267 [0,1,0,0,0,0|2,0,0]=3 1249 B8R0.2 NC(CO)C(O)C(O)=O Amb25270055 [0,1,0,0,0,0|2,0,0]=3 1250 B8R0.2 NCC(O)C(F)P(O)=O Amb25725015 [0,1,0,0,0,0|2,0,0]=3 1251 B8R0.2 NC[C@@H](F)[C@@H](F)C(O)=O Amb25366211 [0,1,0,0,0,0|2,0,0]=3 1252 B8R0.2 NC[C@@H](F)[C@H](F)C(O)=O Amb24452574 [0,1,0,0,0,0|2,0,0]=3 1253 B8R0.2 NC[C@H](O)[C@@H](O)C(O)=O Amb25323660 [0,1,0,0,0,0|1,0,0]=2 1254 B8R0.2 NC[C@H](O)[C@H](O)C(O)=O Amb25242625 [0,1,0,0,0,0|1,0,0]=2 1255 B8R0.2 N[C@@H](C(O)CBr)C(O)=O Amb24391545 [0,1,0,0,0,0|0,0,0]=1 1256 B8R0.2 N[C@@H](C(O)CCl)C(N)=O Amb24543859 [0,1,0,0,0,0|1,0,0]=2 1257 B8R0.2 N[C@@H](C(O)CF)C(O)=O Amb24426022 [0,1,0,0,0,0|0,0,0]=1 1258 B8R0.2 N[C@@H](CO)[C@H](O)C(O)=O Amb25738857 [0,1,0,0,0,0|2,0,0]=3 1259 B8R0.2 N[C@@H]([C@@H](O)CBr)C(O)=O Amb24480277 [0,1,0,0,0,0|0,0,0]=1 1260 B8R0.2 N[C@@H]([C@@H](O)CO)C(N)=O Amb24717733 [0,1,0,0,0,0|1,0,0]=2 1261 B8R0.2 N[C@@H]([C@@H](O)CO)C(O)=O Amb25678241 [0,1,0,0,0,0|0,0,0]=1 1262 B8R0.2 N[C@@H]([C@H](N)CO)C(O)=O Amb24761920 [0,1,0,0,0,0|1,0,0]=2 1263 B8R0.2 N[C@@H]([C@H](O)CCl)C(O)=O Amb25324441 [0,1,0,0,0,0|0,0,0]=1 1264 B8R0.2 N[C@@H]([C@H](O)CO)C(O)=O Amb24674136 [0,1,0,0,0,0|0,0,0]=1 1265 B8R0.2 N[C@H](C(=O)NO)C(O)=O Amb24476649 [0,1,0,0,0,0|1,0,1]=3 1266 B8R0.2 N[C@H](CO)[C@H](O)C(N)=O Amb24677605 [0,1,0,0,0,0|3,0,0]=4 1267 B8R0.2 N[C@H](CO)[C@H](O)C(O)=O Amb25090400 [0,1,0,0,0,0|2,0,0]=3 1268 B8R0.2 N[C@H]([C@@H](O)CO)C(=O)Cl Amb25707913 [0,1,0,0,0,0|1,0,0]=2 1269 B8R0.2 N[C@H]([C@@H](O)CO)C(O)=O Amb25836554 [0,1,0,0,0,0|0,0,0]=1 1270 B8R0.2 N[C@H]([C@H](O)CO)C(O)=O Amb24671346 [0,1,0,0,0,0|0,0,0]=1 1271 B8R0.2 O=C[C@@H]([C@@H]([C@H](O)C)O)O Amb10602917 [0,1,0,0,0,0|1,0,1]=3 1272 B8R0.2 OC(=O)C(Br)C(Br)CBr Amb22347644 [0,1,0,0,0,0|2,0,0]=3 1273 B8R0.2 OC(C(O)C=O)C(O)=O Amb18124399 [0,1,0,0,0,0|1,0,1]=3 1274 B8R0.2 OC(C(O)CBr)C(O)=O Amb24358122 [0,1,0,0,0,0|1,0,0]=2 1275 B8R0.2 OC(CF)C(Br)C(O)=O Amb25733261 [0,1,0,0,0,0|1,0,0]=2 1276 B8R0.2 OC(O)C(O)C(O)CO Amb25680590 [0,1,0,0,0,0|1,0,2]=4 1277 B8R0.2 OC(O)[C@@H](Cl)[C@H](O)CCl Amb25217000 [0,1,0,0,0,0|1,0,2]=4 1278 B8R0.2 OC(O)[C@@H](O)[C@H](O)CO Amb25225984 [0,1,0,0,0,0|1,0,2]=4 1279 B8R0.2 OC(O)[C@H](O)[C@H](O)CO Amb24532917 [0,1,0,0,0,0|1,0,2]=4 1280 B8R0.2 OCC(O)C(O)C(O)=O Amb22495524 [0,1,0,0,0,0|1,0,0]=2 1281 B8R0.2 OC[C@@H](O)[C@H](O)C(O)=O Amb22801448 [0,1,0,0,0,0|1,0,0]=2 1282 B8R0.2 OC[C@H](O)[C@@H](O)C([O-])=O Amb17943095 [0,1,0,0,0,0|1,0,1]=3 1283 B8R0.2 OC[C@H](O)[C@H](O)C(O)=O Amb25223742 [0,1,0,0,0,0|1,0,0]=2 1284 B8R0.2 ONC(=O)C(C(C)C)N Amb2439843 [0,1,0,0,0,0|1,0,0]=2 1285 B8R0.2 O[C@@H]([C@H](O)CBr)C(O)=O Amb24426113 [0,1,0,0,0,0|1,0,0]=2 1286 B8R0.2 O[C@@H]([C@H](O)CCl)C(O)=O Amb25836734 [0,1,0,0,0,0|1,0,0]=2 1287 B8R0.2 SCC(C(C(=O)O)C)C Amb17593702 [0,1,0,0,0,0|1,1,0]=3 1288 B8R0.2 [14CH3][14CH]([14CH2][14CH3])[14CH](N)[14C](O)=O Amb22362774 [0,1,0,0,0,0|1,0,0]=2 1289 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22552521 [0,1,0,0,0,0|1,0,1]=3 1290 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22733096 [0,1,0,0,0,0|1,0,1]=3 1291 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22734344 [0,1,0,0,0,0|1,0,1]=3 1292 B8R0.2 [O-]C(=O)[C@@H](O)[C@H](O)CO Amb22744783 [0,1,0,0,0,0|1,0,1]=3 1293 B8R0.18 CC(=C)C(CC)C(O)=O Amb18642606 [0,1,0,0,0,0|2,0,1]=4 1294 B8R0.18 CC(Br)C(CC)C(O)=O Amb25351353 [0,1,0,0,0,0|2,0,0]=3 1295 B8R0.18 CC(C(C(=O)O)C#N)C Amb10066977 [0,1,0,0,0,0|1,0,1]=3 1296 B8R0.18 CC(C)=C(ON)C(O)=O Amb24432339 [0,1,0,0,0,0|1,0,2]=4 1297 B8R0.18 CC(C)C(=C=C)C(O)=O Amb24446532 [0,1,0,0,0,0|2,0,1]=4 1298 B8R0.18 CC(C)C(=NO)C(O)=O Amb24597663 [0,1,0,0,0,0|1,0,2]=4 1299 B8R0.18 CC(C)C(C#N)C(C)=O Amb25810486 [0,1,0,0,0,0|2,0,1]=4 1300 B8R0.18 CC(C)C(C=C)C(O)=O Amb18642658 [0,1,0,0,0,0|2,0,0]=3 1301 B8R0.18 CC(C)C(C=O)C(O)=O Amb25122103 [0,1,0,0,0,0|2,0,0]=3 1302 B8R0.18 CC(C)C(CBr)C(O)=O Amb24429178 [0,1,0,0,0,0|2,0,0]=3 1303 B8R0.18 CC(C)C(CC)C(N)=O Amb25694336 [0,1,0,0,0,0|3,0,0]=4 1304 B8R0.18 CC(C)C(CC)C(O)=O Amb18972345 [0,1,0,0,0,0|2,0,0]=3 1305 B8R0.18 CC(C)C(CN)B(O)O Amb22831545 [0,1,0,0,0,0|2,0,1]=4 1306 B8R0.18 CC(C)C(CN)C(N)=O Amb18294193 [0,1,0,0,0,0|2,0,0]=3 1307 B8R0.18 CC(C)C(CN)C(O)=O Amb18987935 [0,1,0,0,0,0|1,0,0]=2 1308 B8R0.18 CC(C)C(CN)C(O)=O Amb19375052 [0,1,0,0,0,0|1,0,0]=2 1309 B8R0.18 CC(C)C(CO)C(C)=O Amb24370150 [0,1,0,0,0,0|3,0,0]=4 1310 B8R0.18 CC(C)C(CO)C(O)=O Amb24116921 [0,1,0,0,0,0|2,0,0]=3 1311 B8R0.18 CC(C)C(N=O)C(O)=O Amb25292210 [0,1,0,0,0,0|1,0,1]=3 1312 B8R0.18 CC(C)C(NBr)C(O)=O Amb24648440 [0,1,0,0,0,0|1,0,0]=2 1313 B8R0.18 CC(C)C(NC)C(=O)Cl Amb25139558 [0,1,0,0,0,0|2,0,0]=3 1314 B8R0.18 CC(C)C(NC)C(C)O Amb24763226 [0,1,0,0,0,0|2,0,1]=4 1315 B8R0.18 CC(C)C(NC)C(N)=O Amb18975189 [0,1,0,0,0,0|2,0,0]=3 1316 B8R0.18 CC(C)C(NC)C(O)=O Amb21961623 [0,1,0,0,0,0|1,0,0]=2 1317 B8R0.18 CC(C)C(NCl)C(O)=O Amb24480122 [0,1,0,0,0,0|1,0,0]=2 1318 B8R0.18 CC(C)C(NN)C(C)=C Amb25353119 [0,1,0,0,0,0|3,0,0]=4 1319 B8R0.18 CC(C)C(NN)C(O)=O Amb18642886 [0,1,0,0,0,0|1,0,0]=2 1320 B8R0.18 CC(C)C(OC)C(C)=O Amb24371549 [0,1,0,0,0,0|3,0,0]=4 1321 B8R0.18 CC(C)C(ON)C(O)=O Amb24477865 [0,1,0,0,0,0|1,0,0]=2 1322 B8R0.18 CC(C)C(SC)C(C)=O Amb24422371 [0,1,0,0,0,0|3,0,0]=4 1323 B8R0.18 CC(C)C(SC)C(N)=O Amb24476747 [0,1,0,0,0,0|3,0,0]=4 1324 B8R0.18 CC(C)[C@@H](CN)C(O)=O Amb22756745 [0,1,0,0,0,0|1,0,0]=2 1325 B8R0.18 CC(C)[C@@H](CN)C(O)=O Amb22756747 [0,1,0,0,0,0|1,0,0]=2 1326 B8R0.18 CC(C)[C@@H](CO)C(O)=O Amb24588987 [0,1,0,0,0,0|2,0,0]=3 1327 B8R0.18 CC(C)[C@@H](NC)C(O)=O Amb22231334 [0,1,0,0,0,0|1,0,0]=2 1328 B8R0.18 CC(C)[C@@H](NC)C(O)=O Amb22749002 [0,1,0,0,0,0|1,0,0]=2 1329 B8R0.18 CC(C)[C@@H](ON)C(O)=O Amb24117143 [0,1,0,0,0,0|1,0,0]=2 1330 B8R0.18 CC(C)[C@H](CC)C(C)=O Amb25064658 [0,1,0,0,0,0|3,0,0]=4 1331 B8R0.18 CC(C)[C@H](CN)C(O)=O Amb25283442 [0,1,0,0,0,0|1,0,0]=2 1332 B8R0.18 CC(C)[C@H](NC)C(N)=O Amb24376236 [0,1,0,0,0,0|2,0,0]=3 1333 B8R0.18 CC(C)[C@H](NO)C(N)=O Amb24540370 [0,1,0,0,0,0|2,0,0]=3 1334 B8R0.18 CC(C)[C@H](ON)C(O)=O Amb25785764 [0,1,0,0,0,0|1,0,0]=2 1335 B8R0.18 CC(Cl)C(OC)C(C)=O Amb24340310 [0,1,0,0,0,0|3,0,0]=4 1336 B8R0.18 CC(Cl)C(SC)C(N)=O Amb24634079 [0,1,0,0,0,0|3,0,0]=4 1337 B8R0.18 CC(Cl)C(SC)C(O)=O Amb18126488 [0,1,0,0,0,0|2,0,0]=3 1338 B8R0.18 CC(O)=C(N=O)C(O)=O Amb25727301 [0,1,0,0,0,0|0,0,3]=4 1339 B8R0.18 CC(O)C(C=C)C(O)=O Amb18642779 [0,1,0,0,0,0|1,0,0]=2 1340 B8R0.18 CC(O)C(CC)C(N)=O Amb24539570 [0,1,0,0,0,0|2,0,0]=3 1341 B8R0.18 CC(O)C(CC)C(O)=O Amb18990651 [0,1,0,0,0,0|1,0,0]=2 1342 B8R0.18 CC(O)C(CO)C(O)=O Amb24759475 [0,1,0,0,0,0|1,0,0]=2 1343 B8R0.18 CC(O)C(NC)C(O)=O Amb24680323 [0,1,0,0,0,0|0,0,0]=1 1344 B8R0.18 CC(O)C(NCl)C(O)=O Amb24408588 [0,1,0,0,0,0|0,0,0]=1 1345 B8R0.18 CC(O)C(NN)C(O)=O Amb18642940 [0,1,0,0,0,0|0,0,0]=1 1346 B8R0.18 CC(O)[C@@H](NC)C(O)=O Amb22800385 [0,1,0,0,0,0|0,0,0]=1 1347 B8R0.18 CC(O)[C@H](NCl)C(O)=O Amb25684733 [0,1,0,0,0,0|0,0,0]=1 1348 B8R0.18 CCC(C(O)=O)N(C)C Amb20627822 [0,1,0,0,0,0|3,0,0]=4 1349 B8R0.18 CCC(C(O)=O)N(C)N Amb25145584 [0,1,0,0,0,0|3,0,0]=4 1350 B8R0.18 CCC(C(O)=O)N(C)O Amb24609518 [0,1,0,0,0,0|2,0,0]=3 1351 B8R0.18 CCC(C(O)=O)P(O)=O Amb25205534 [0,1,0,0,0,0|3,0,0]=4 1352 B8R0.18 CCC(C(O)=O)S(C)=O Amb18290930 [0,1,0,0,0,0|2,0,1]=4 1353 B8R0.18 CC[C@@H](C(=O)O)N(O)O Amb16233002 [0,1,0,0,0,0|3,0,0]=4 1354 B8R0.18 CC[C@@H](C(O)=O)N(C)C Amb25823446 [0,1,0,0,0,0|3,0,0]=4 1355 B8R0.18 CN(C)C(CF)C(O)=O Amb25216064 [0,1,0,0,0,0|3,0,0]=4 1356 B8R0.18 CN(C)C(CO)C(O)=O Amb24407402 [0,1,0,0,0,0|3,0,0]=4 1357 B8R0.18 CN(C)[C@@H](CF)C(O)=O Amb24407184 [0,1,0,0,0,0|3,0,0]=4 1358 B8R0.18 CN(C)[C@@H](CS)C(O)=O Amb24120376 [0,1,0,0,0,0|3,0,0]=4 1359 B8R0.18 CN(C)[C@H](CS)C(O)=O Amb24405547 [0,1,0,0,0,0|3,0,0]=4 1360 B8R0.18 CN(O)C(C=C)C(O)=O Amb25302099 [0,1,0,0,0,0|2,0,0]=3 1361 B8R0.18 CNC(C(=O)C)C(C)C Amb2369975 [0,1,0,0,0,0|2,0,0]=3 1362 B8R0.18 CNC(C(O)=O)C(O)=O Amb24477701 [0,1,0,0,0,0|1,0,1]=3 1363 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb16183861 [0,1,0,0,0,0|1,0,0]=2 1364 B8R0.18 CSC(C(=O)O)C(C)C Amb17503902 [0,1,0,0,0,0|2,0,0]=3 1365 B8R0.18 C[C@@H](N)[C@@H](CC)C(O)=O Amb24709757 [0,1,0,0,0,0|2,0,0]=3 1366 B8R0.18 C[C@@H](O)[C@@H](NC)C(O)=O Amb24375967 [0,1,0,0,0,0|0,0,0]=1 1367 B8R0.18 C[C@@H](O)[C@H](CC)[N+]([O-])=O Amb24685175 [0,1,0,0,0,0|2,0,1]=4 1368 B8R0.18 C[C@@H](O)[C@H](CN)C(O)=O Amb24715545 [0,1,0,0,0,0|0,0,0]=1 1369 B8R0.18 C[C@@H](O)[C@H](NCl)C(O)=O Amb25124152 [0,1,0,0,0,0|0,0,0]=1 1370 B8R0.18 C[C@H](Cl)[C@H](SC)C(=O)Cl Amb25146223 [0,1,0,0,0,0|3,0,0]=4 1371 B8R0.18 C[C@H](O)[C@H](NC)C(C)=C Amb24574322 [0,1,0,0,0,0|2,0,0]=3 1372 B8R0.18 C[C@H](O)[C@H](NC)C(O)=O Amb24529115 [0,1,0,0,0,0|0,0,0]=1 1373 B8R0.18 C[C@H](O)[C@H](NN)C(O)=O Amb25032229 [0,1,0,0,0,0|0,0,0]=1 1374 B8R0.18 C\C(\O)=C(\C#N)/C(O)=O Amb25793575 [0,1,0,0,0,0|0,0,3]=4 1375 B8R0.18 C\C=C(/C(C)C)\C(O)=O Amb18642659 [0,1,0,0,0,0|2,0,1]=4 1376 B8R0.18 C\C=C(/[C@@H](C)O)\C(O)=O Amb25843942 [0,1,0,0,0,0|1,0,1]=3 1377 B8R0.18 OC(=O)C(C=O)C(O)=O Amb25188908 [0,1,0,0,0,0|2,0,1]=4 1378 B8R0.18 OC(=O)C(CF)C(F)F Amb24743896 [0,1,0,0,0,0|3,0,0]=4 1379 B8R0.18 OC(=O)C(CO)C(F)F Amb24559548 [0,1,0,0,0,0|3,0,0]=4 1380 B8R0.18 SCC(C(=O)O)C(C)C Amb17593703 [0,1,0,0,0,0|2,0,0]=3 1381 B8R0.27 BrC(C(Br)(C)C)C(=O)O Amb16192461 [0,1,0,0,0,0|2,0,0]=3 1382 B8R0.27 BrC(C(F)(C)C)C(=O)O Amb10605635 [0,1,0,0,0,0|2,0,0]=3 1383 B8R0.27 CC(=C)C(Cl)C(C)(C)O Amb25279514 [0,1,0,0,0,0|3,0,0]=4 1384 B8R0.27 CC(=C)C(N)C(C)(C)C Amb24426765 [0,1,0,0,0,0|3,0,0]=4 1385 B8R0.27 CC(=C)C(N)C(C)(F)F Amb25173482 [0,1,0,0,0,0|3,0,0]=4 1386 B8R0.27 CC(=C)C(O)C(C)(C)O Amb24626174 [0,1,0,0,0,0|3,0,0]=4 1387 B8R0.27 CC(=O)C(Br)C(C)(C)C Amb25761464 [0,1,0,0,0,0|3,0,0]=4 1388 B8R0.27 CC(=O)C(Br)C(C)(C)N Amb25111132 [0,1,0,0,0,0|3,0,0]=4 1389 B8R0.27 CC(=O)C(C(O)(C)C)O Amb17593385 [0,1,0,0,0,0|2,0,0]=3 1390 B8R0.27 CC(=O)C(Cl)C(C)(C)Br Amb25055869 [0,1,0,0,0,0|3,0,0]=4 1391 B8R0.27 CC(=O)C(Cl)C(C)(C)C Amb24480250 [0,1,0,0,0,0|3,0,0]=4 1392 B8R0.27 CC(=O)C(F)C(C)(C)C Amb25143423 [0,1,0,0,0,0|3,0,0]=4 1393 B8R0.27 CC(=O)C(N)C(F)(F)F Amb24433272 [0,1,0,0,0,0|3,0,0]=4 1394 B8R0.27 CC(=O)C(O)C(C)(C)Br Amb25045781 [0,1,0,0,0,0|3,0,0]=4 1395 B8R0.27 CC(=O)C(O)C(C)(C)Cl Amb24332989 [0,1,0,0,0,0|3,0,0]=4 1396 B8R0.27 CC(=O)C(S)C(C)(C)O Amb24747561 [0,1,0,0,0,0|2,0,0]=3 1397 B8R0.27 CC(=O)[C@@H](N)C(C)(C)C Amb24477755 [0,1,0,0,0,0|2,0,0]=3 1398 B8R0.27 CC(=O)[C@H](O)C(C)(C)C Amb25759285 [0,1,0,0,0,0|3,0,0]=4 1399 B8R0.27 CC(C(C)=O)C(C)(C)C Amb24756707 [0,1,0,0,0,0|3,0,0]=4 1400 B8R0.27 CC(C(C)=O)C(C)(C)F Amb25064500 [0,1,0,0,0,0|3,0,0]=4 1401 B8R0.27 CC(C(C)=O)C(C)(Cl)Cl Amb25086317 [0,1,0,0,0,0|3,0,0]=4 1402 B8R0.27 CC(C(C)Cl)S(O)(=O)=O Amb25241342 [0,1,0,0,0,0|3,0,0]=4 1403 B8R0.27 CC(C(C)N)S(O)(=O)=O Amb24355309 [0,1,0,0,0,0|3,0,0]=4 1404 B8R0.27 CC(C(C)O)S(C)(=O)=O Amb18180150 [0,1,0,0,0,0|2,0,1]=4 1405 B8R0.27 CC(C(F)(C)C)C(=O)O Amb10843986 [0,1,0,0,0,0|2,0,0]=3 1406 B8R0.27 CC(C(N)=O)C(C)(F)F Amb25084678 [0,1,0,0,0,0|3,0,0]=4 1407 B8R0.27 CC(C(O)=O)C(C)(C)N Amb24459511 [0,1,0,0,0,0|2,0,0]=3 1408 B8R0.27 CC(C(O)=O)C(F)(F)F Amb19148979 [0,1,0,0,0,0|3,0,0]=4 1409 B8R0.27 CC(C(O)=O)S(O)(=O)=O Amb25765487 [0,1,0,0,0,0|3,0,0]=4 1410 B8R0.27 CC(C(O)=O)[N+](C)(C)C Amb24759071 [0,1,0,0,0,0|3,0,0]=4 1411 B8R0.27 CC(C(O)=O)[N+](C)(C)N Amb25306005 [0,1,0,0,0,0|3,0,0]=4 1412 B8R0.27 CC(C(O)=O)[Si](O)(O)O Amb24429015 [0,1,0,0,0,0|2,1,0]=4 1413 B8R0.27 CC(C)(Br)C(=O)C(O)=O Amb24433030 [0,1,0,0,0,0|2,0,1]=4 1414 B8R0.27 CC(C)(C)C(=C)C(O)=O Amb18642653 [0,1,0,0,0,0|2,0,1]=4 1415 B8R0.27 CC(C)(C)C(Br)C(O)=O Amb18127181 [0,1,0,0,0,0|2,0,0]=3 1416 B8R0.27 CC(C)(C)C(Cl)C(O)=O Amb18125093 [0,1,0,0,0,0|2,0,0]=3 1417 B8R0.27 CC(C)(C)C(F)C(=O)Cl Amb24425221 [0,1,0,0,0,0|3,0,0]=4 1418 B8R0.27 CC(C)(C)C(N)C(=O)Cl Amb24548277 [0,1,0,0,0,0|2,0,0]=3 1419 B8R0.27 CC(C)(C)C(N)C(N)=O Amb18281879 [0,1,0,0,0,0|2,0,0]=3 1420 B8R0.27 CC(C)(C)C(N)C(N)=O Amb19373321 [0,1,0,0,0,0|2,0,0]=3 1421 B8R0.27 CC(C)(C)C(O)C(O)=O Amb19299856 [0,1,0,0,0,0|2,0,0]=3 1422 B8R0.27 CC(C)(C)[C@@H](Br)C(=O)Cl Amb24444825 [0,1,0,0,0,0|3,0,0]=4 1423 B8R0.27 CC(C)(C)[C@@H](Br)C(O)=O Amb22746895 [0,1,0,0,0,0|2,0,0]=3 1424 B8R0.27 CC(C)(C)[C@@H](N)C(=O)Cl Amb24611035 [0,1,0,0,0,0|2,0,0]=3 1425 B8R0.27 CC(C)(C)[C@@H](N)C(N)=O Amb22754654 [0,1,0,0,0,0|2,0,0]=3 1426 B8R0.27 CC(C)(C)[C@@H](N)C(N)=O Amb22899171 [0,1,0,0,0,0|2,0,0]=3 1427 B8R0.27 CC(C)(C)[C@@H](N)C(O)=O Amb22744938 [0,1,0,0,0,0|1,0,0]=2 1428 B8R0.27 CC(C)(C)[C@@H](O)C(O)=O Amb22225174 [0,1,0,0,0,0|2,0,0]=3 1429 B8R0.27 CC(C)(C)[C@H](Br)C(O)=O Amb22226488 [0,1,0,0,0,0|2,0,0]=3 1430 B8R0.27 CC(C)(C)[C@H](Cl)C(=O)Cl Amb25109864 [0,1,0,0,0,0|3,0,0]=4 1431 B8R0.27 CC(C)(C)[C@H](N)C(=O)Cl Amb24630153 [0,1,0,0,0,0|2,0,0]=3 1432 B8R0.27 CC(C)(C)[C@H](N)C(N)=O Amb24271101 [0,1,0,0,0,0|2,0,0]=3 1433 B8R0.27 CC(C)(C)[C@H](N)C(N)=O Amb25215486 [0,1,0,0,0,0|2,0,0]=3 1434 B8R0.27 CC(C)(Cl)C(Cl)C(O)=O Amb18126746 [0,1,0,0,0,0|2,0,0]=3 1435 B8R0.27 CC(C)(Cl)C(N)C(O)=O Amb25032131 [0,1,0,0,0,0|1,0,0]=2 1436 B8R0.27 CC(C)(Cl)[C@H](N)C(N)=O Amb25777000 [0,1,0,0,0,0|2,0,0]=3 1437 B8R0.27 CC(C)(F)C(=O)C(O)=O Amb25079631 [0,1,0,0,0,0|2,0,1]=4 1438 B8R0.27 CC(C)(F)[C@H](N)C(O)=O Amb24369670 [0,1,0,0,0,0|1,0,0]=2 1439 B8R0.27 CC(C)(N)C(N)C(O)=O Amb18642889 [0,1,0,0,0,0|1,0,0]=2 1440 B8R0.27 CC(C)(N)C(O)C(N)=O Amb25180844 [0,1,0,0,0,0|3,0,0]=4 1441 B8R0.27 CC(C)(N)C(O)C(O)=O Amb25075483 [0,1,0,0,0,0|2,0,0]=3 1442 B8R0.27 CC(C)(N)C(S)C(O)=O Amb24436486 [0,1,0,0,0,0|2,0,0]=3 1443 B8R0.27 CC(C)(O)C(=C)C(N)=O Amb24477733 [0,1,0,0,0,0|2,0,1]=4 1444 B8R0.27 CC(C)(O)C(=O)C(O)=O Amb25064348 [0,1,0,0,0,0|1,0,1]=3 1445 B8R0.27 CC(C)(O)C(Cl)C(O)=O Amb25101058 [0,1,0,0,0,0|1,0,0]=2 1446 B8R0.27 CC(C)(O)C(N)C(O)=O Amb18642914 [0,1,0,0,0,0|0,0,0]=1 1447 B8R0.27 CC(C)(O)C(O)C(N)=O Amb25732960 [0,1,0,0,0,0|2,0,0]=3 1448 B8R0.27 CC(C)(O)C(O)C(O)=O Amb25118477 [0,1,0,0,0,0|1,0,0]=2 1449 B8R0.27 CC(C)(O)[C@@H](O)C(=C)Br Amb25115452 [0,1,0,0,0,0|3,0,0]=4 1450 B8R0.27 CC(C)(S)C(=O)C(O)=O Amb24640907 [0,1,0,0,0,0|1,1,1]=4 1451 B8R0.27 CC(C)(S)C(N)C(N)=S Amb25690178 [0,1,0,0,0,0|1,2,0]=4 1452 B8R0.27 CC(C)C(N)C(C)(C)O Amb18642849 [0,1,0,0,0,0|2,0,1]=4 1453 B8R0.27 CC(C)C(N)P(C)(O)=O Amb25784649 [0,1,0,0,0,0|2,0,0]=3 1454 B8R0.27 CC(C)C(N)P(O)(O)=S Amb24443105 [0,1,0,0,0,0|2,0,1]=4 1455 B8R0.27 CC(C)[C@@H](N)C(C)(C)O Amb24579778 [0,1,0,0,0,0|2,0,1]=4 1456 B8R0.27 CC(C)[C@H](O)P(O)(O)=O Amb25681151 [0,1,0,0,0,0|3,0,0]=4 1457 B8R0.27 CC(Cl)(Cl)C(Cl)C(O)=O Amb25032276 [0,1,0,0,0,0|2,0,0]=3 1458 B8R0.27 CC(Cl)C(O)P(O)(O)=O Amb25227137 [0,1,0,0,0,0|3,0,0]=4 1459 B8R0.27 CC(F)(F)C(Cl)C(O)=O Amb24373113 [0,1,0,0,0,0|2,0,0]=3 1460 B8R0.27 CC(F)(F)[C@@H](N)C(O)=O Amb24618136 [0,1,0,0,0,0|1,0,0]=2 1461 B8R0.27 CC(F)(F)[C@H](N)C(O)=O Amb24641014 [0,1,0,0,0,0|1,0,0]=2 1462 B8R0.27 CC(N)C(O)S(O)(=O)=O Amb24717762 [0,1,0,0,0,0|3,0,0]=4 1463 B8R0.27 CC(O)C(Br)S(C)(=O)=O Amb23510578 [0,1,0,0,0,0|2,0,1]=4 1464 B8R0.27 CC(O)C(C)C(C)(C)O Amb24340511 [0,1,0,0,0,0|2,0,1]=4 1465 B8R0.27 CC(O)C(Cl)C(C)(C)O Amb24355303 [0,1,0,0,0,0|2,0,1]=4 1466 B8R0.27 CC(O)C(Cl)S(C)(=O)=O Amb23510536 [0,1,0,0,0,0|2,0,1]=4 1467 B8R0.27 CC(O)C(I)S(C)(=O)=O Amb23510622 [0,1,0,0,0,0|2,0,1]=4 1468 B8R0.27 CC(O)C(N)C(C)(C)C Amb25142025 [0,1,0,0,0,0|2,0,1]=4 1469 B8R0.27 CC(O)C(N)C(F)(F)F Amb24410176 [0,1,0,0,0,0|2,0,1]=4 1470 B8R0.27 CC(O)C(N)P(O)(O)=O Amb24524174 [0,1,0,0,0,0|1,0,0]=2 1471 B8R0.27 CC(O)C(O)C(C)(C)O Amb24448053 [0,1,0,0,0,0|2,0,1]=4 1472 B8R0.27 CC(O)C(O)P(O)(O)=O Amb25235589 [0,1,0,0,0,0|2,0,0]=3 1473 B8R0.27 CC(O)[C@@H](N)C(C)(C)C Amb24524203 [0,1,0,0,0,0|2,0,1]=4 1474 B8R0.27 CC(O)[C@H](N)C(C)(C)C Amb24384099 [0,1,0,0,0,0|2,0,1]=4 1475 B8R0.27 CC(O)[C@H](N)C(F)(F)F Amb25071146 [0,1,0,0,0,0|2,0,1]=4 1476 B8R0.27 CC([C@@H](S(=O)(=O)C)O)O Amb15691680 [0,1,0,0,0,0|2,0,1]=4 1477 B8R0.27 CP(C)(=O)C(O)C(O)=O Amb22231894 [0,1,0,0,0,0|2,0,1]=4 1478 B8R0.27 CS(=O)(=O)C(F)C(O)=O Amb25242777 [0,1,0,0,0,0|2,0,1]=4 1479 B8R0.27 C[C@@H](C(C)(C)C)C(=O)O Amb10844034 [0,1,0,0,0,0|2,0,0]=3 1480 B8R0.27 C[C@@H](C(N)=O)C(C)(C)C Amb24553257 [0,1,0,0,0,0|3,0,0]=4 1481 B8R0.27 C[C@@H](C(O)=O)C(F)(F)F Amb24120617 [0,1,0,0,0,0|3,0,0]=4 1482 B8R0.27 C[C@@H](N)[C@H](O)P(O)(O)=O Amb24390259 [0,1,0,0,0,0|3,0,0]=4 1483 B8R0.27 C[C@@H](O)[C@@H](N)C(C)(C)C Amb25698375 [0,1,0,0,0,0|2,0,1]=4 1484 B8R0.27 C[C@@H](O)[C@@H](O)P(O)(O)=O Amb25226258 [0,1,0,0,0,0|2,0,0]=3 1485 B8R0.27 C[C@@H](O)[C@H](N)P(O)(O)=O Amb24391488 [0,1,0,0,0,0|1,0,0]=2 1486 B8R0.27 C[C@@H](O)[C@H](O)P(O)(O)=O Amb25219228 [0,1,0,0,0,0|2,0,0]=3 1487 B8R0.27 C[C@H](C(C)(C)C)C(=O)O Amb10844023 [0,1,0,0,0,0|2,0,0]=3 1488 B8R0.27 C[C@H](C(C)=O)C(C)(C)C Amb25060195 [0,1,0,0,0,0|3,0,0]=4 1489 B8R0.27 C[C@H](C(O)=O)C(C)(C)Cl Amb24522973 [0,1,0,0,0,0|2,0,0]=3 1490 B8R0.27 C[C@H](C(O)=O)S(C)(=O)=O Amb24480187 [0,1,0,0,0,0|2,0,1]=4 1491 B8R0.27 C[C@H](Cl)[C@@H](O)P(O)(O)=O Amb24480009 [0,1,0,0,0,0|3,0,0]=4 1492 B8R0.27 C[C@H](N)[C@@H](O)P(O)(O)=O Amb24427545 [0,1,0,0,0,0|3,0,0]=4 1493 B8R0.27 C[C@H](O)[C@@H](Cl)P(O)(O)=O Amb25858138 [0,1,0,0,0,0|2,0,0]=3 1494 B8R0.27 C[C@H](O)[C@@H](O)C(C)(C)O Amb25845426 [0,1,0,0,0,0|2,0,1]=4 1495 B8R0.27 C[C@H](O)[C@H](N)C(C)(C)C Amb24644721 [0,1,0,0,0,0|2,0,1]=4 1496 B8R0.27 C[C@H](O)[C@H](N)C(F)(F)F Amb25851255 [0,1,0,0,0,0|2,0,1]=4 1497 B8R0.27 C[C@H](O)[C@H](O)P(O)(O)=O Amb25136255 [0,1,0,0,0,0|2,0,0]=3 1498 B8R0.27 C[C@H]([C@@H](C)O)S(C)(=O)=O Amb25332098 [0,1,0,0,0,0|2,0,1]=4 1499 B8R0.27 C[C@H]([C@H](C)O)S(C)(=O)=O Amb25226117 [0,1,0,0,0,0|2,0,1]=4 1500 B8R0.27 C[Si](C)(C)C(O)C(O)=O Amb25063843 [0,1,0,0,0,0|2,1,0]=4 1501 B8R0.27 Cl[C@H](C(C)(C)C)C(=O)O Amb10069805 [0,1,0,0,0,0|2,0,0]=3 1502 B8R0.27 NC(C(C)(C)C)C(=O)O Amb2371663 [0,1,0,0,0,0|1,0,0]=2 1503 B8R0.27 NC(C(Cl)Cl)P(O)(O)=O Amb25092293 [0,1,0,0,0,0|3,0,0]=4 1504 B8R0.27 NC(C(F)(F)F)C(=O)O Amb10607071 [0,1,0,0,0,0|2,0,0]=3 1505 B8R0.27 NC(C(F)F)S(O)(=O)=O Amb24478737 [0,1,0,0,0,0|3,0,0]=4 1506 B8R0.27 NC(C(O)=O)C(Cl)(Cl)Cl Amb24480186 [0,1,0,0,0,0|2,0,0]=3 1507 B8R0.27 NC(C(S)(C)C)C(=O)O Amb1907179 [0,1,0,0,0,0|0,1,0]=2 1508 B8R0.27 N[C@@H](C(C)(C)C)C(=O)O Amb16232019 [0,1,0,0,0,0|1,0,0]=2 1509 B8R0.27 N[C@@H](C(O)=O)C(F)(F)F Amb25378031 [0,1,0,0,0,0|2,0,0]=3 1510 B8R0.27 N[C@H](C(O)=O)C(Cl)(Cl)Cl Amb24480006 [0,1,0,0,0,0|2,0,0]=3 1511 B8R0.27 N[C@H](C(O)=O)C(F)(F)F Amb24650499 [0,1,0,0,0,0|2,0,0]=3 1512 B8R0.27 OC(=O)C(Br)C(F)(F)F Amb22274799 [0,1,0,0,0,0|3,0,0]=4 1513 B8R0.27 OC(=O)C(Br)S(O)(=O)=O Amb24375783 [0,1,0,0,0,0|3,0,0]=4 1514 B8R0.27 OC(=O)C(C(O)(C)C)Br Amb17595209 [0,1,0,0,0,0|1,0,0]=2 1515 B8R0.27 OC(=O)C(C(O)(C)C)C Amb10844263 [0,1,0,0,0,0|1,0,0]=2 1516 B8R0.27 OC(=O)C(Cl)S(O)(=O)=O Amb25724885 [0,1,0,0,0,0|3,0,0]=4 1517 B8R0.27 OC(=O)C(F)P(O)(O)=O Amb24520819 [0,1,0,0,0,0|3,0,0]=4 1518 B8R0.27 OC(=O)[C@@H](Br)S(O)(=O)=O Amb25218846 [0,1,0,0,0,0|3,0,0]=4 1519 B8R0.27 OC(=O)[C@@H](C(O)(C)C)C Amb10844262 [0,1,0,0,0,0|1,0,0]=2 1520 B8R0.27 OC(=O)[C@H](C(O)(C)C)C Amb10844272 [0,1,0,0,0,0|1,0,0]=2 1521 B8R0.27 OC(C(O)=O)C(Cl)(Cl)Cl Amb24467776 [0,1,0,0,0,0|3,0,0]=4 1522 B8R0.27 OC(C(O)=O)P(O)(O)=O Amb24117287 [0,1,0,0,0,0|3,0,0]=4 1523 B8R0.27 OC(C(O)=O)S(O)(=O)=O Amb24739659 [0,1,0,0,0,0|3,0,0]=4 1524 B8R0.27 O[C@@H](C(C)(C)C)C(=O)O Amb10603129 [0,1,0,0,0,0|2,0,0]=3 1525 B8R0.27 O[C@@H](C(F)(F)F)C(=O)O Amb10838306 [0,1,0,0,0,0|3,0,0]=4 1526 B8R0.27 O[C@H](C(F)(F)F)C(=O)O Amb10841493 [0,1,0,0,0,0|3,0,0]=4 1527 B8R0.27 [2H]C([2H])([2H])C(N)C(O)=O Amb22338765 [0,1,0,0,0,0|2,0,0]=3 1528 B8R0.27 [2H]C([2H])([2H])[C@@H](N)C(O)=O Amb22338907 [0,1,0,0,0,0|2,0,0]=3 1529 B8R0.27 [2H][13C]([2H])([2H])C(N)C(O)=O Amb22367222 [0,1,0,0,0,0|2,0,0]=3 1530 B8R0.37 CC(=C)C(C(=O)O)(C)C Amb15701602 [0,1,0,0,0,0|2,0,1]=4 1531 B8R0.37 CC(=C)C(C)(O)C(O)=O Amb18642760 [0,1,0,0,0,0|2,0,1]=4 1532 B8R0.37 CC(=O)C(C)(C)C(O)=O Amb18642784 [0,1,0,0,0,0|1,0,2]=4 1533 B8R0.37 CC(=O)C(C)(O)C(O)=O Amb18642870 [0,1,0,0,0,0|1,0,2]=4 1534 B8R0.37 CC(=O)C(C)(O)C(O)O Amb25833528 [0,1,0,0,0,0|3,0,0]=4 1535 B8R0.37 CC(=O)C(O)(O)C(O)=O Amb24101440 [0,1,0,0,0,0|1,0,2]=4 1536 B8R0.37 CC(Br)(C(O)=O)C(O)=O Amb24429036 [0,1,0,0,0,0|2,0,1]=4 1537 B8R0.37 CC(Br)C(C)(C)C(O)=O Amb25088460 [0,1,0,0,0,0|2,0,0]=3 1538 B8R0.37 CC(C(C(=O)C)(C)C)C Amb17593353 [0,1,0,0,0,0|3,0,0]=4 1539 B8R0.37 CC(C(C(=O)O)(C)C)C Amb17593377 [0,1,0,0,0,0|2,0,0]=3 1540 B8R0.37 CC(C)([C@H](C)O)C(C)O Amb24379987 [0,1,0,0,0,0|2,0,1]=4 1541 B8R0.37 CC(C)([C@H](C)O)[C@@H](C)O Amb25031316 [0,1,0,0,0,0|2,0,1]=4 1542 B8R0.37 CC(C)C(C)(Br)C(O)=O Amb24652574 [0,1,0,0,0,0|2,0,0]=3 1543 B8R0.37 CC(C)C(C)(C)C(N)=O Amb24548236 [0,1,0,0,0,0|3,0,0]=4 1544 B8R0.37 CC(C)C(C)(F)C(O)=O Amb24518491 [0,1,0,0,0,0|2,0,0]=3 1545 B8R0.37 CC(C)C(C)(N)P(O)=O Amb24567571 [0,1,0,0,0,0|2,0,0]=3 1546 B8R0.37 CC(C)C(C)(N)P(O)O Amb25361983 [0,1,0,0,0,0|2,0,1]=4 1547 B8R0.37 CC(C)C(C)(O)C(O)=O Amb18286212 [0,1,0,0,0,0|2,0,0]=3 1548 B8R0.37 CC(C)C(C)(S)C(N)=O Amb25316845 [0,1,0,0,0,0|3,0,0]=4 1549 B8R0.37 CC(C)C(C)(S)C(O)=O Amb25064233 [0,1,0,0,0,0|2,0,0]=3 1550 B8R0.37 CC(C)C(Cl)(Cl)C(O)=O Amb25188935 [0,1,0,0,0,0|2,0,0]=3 1551 B8R0.37 CC(C)[C@@](C)(S)C(N)=O Amb24460771 [0,1,0,0,0,0|3,0,0]=4 1552 B8R0.37 CC(C)[C@](C)(N)C(N)=O Amb25132092 [0,1,0,0,0,0|2,0,0]=3 1553 B8R0.37 CC(C)[C@](C)(S)C(N)=O Amb24411515 [0,1,0,0,0,0|3,0,0]=4 1554 B8R0.37 CC(Cl)C(C)(O)C(N)=O Amb25257976 [0,1,0,0,0,0|3,0,0]=4 1555 B8R0.37 CC(Cl)C(Cl)(Cl)C(=O)Cl Amb24418032 [0,1,0,0,0,0|3,0,0]=4 1556 B8R0.37 CC(Cl)C(Cl)(Cl)C(O)=O Amb22168920 [0,1,0,0,0,0|2,0,0]=3 1557 B8R0.37 CC(F)C(C)(C)C(O)=O Amb24695887 [0,1,0,0,0,0|2,0,0]=3 1558 B8R0.37 CC(F)C(C)(N)C(N)=O Amb25791580 [0,1,0,0,0,0|2,0,0]=3 1559 B8R0.37 CC(F)C(C)(N)C(O)=O Amb25844045 [0,1,0,0,0,0|1,0,0]=2 1560 B8R0.37 CC(N)(C(C)O)C(C)O Amb25328983 [0,1,0,0,0,0|1,0,1]=3 1561 B8R0.37 CC(N)C(C)(C)C(N)=O Amb24547757 [0,1,0,0,0,0|3,0,0]=4 1562 B8R0.37 CC(N)C(C)(C)C(O)=O Amb24681858 [0,1,0,0,0,0|2,0,0]=3 1563 B8R0.37 CC(N)C(F)(F)C(O)=O Amb25188946 [0,1,0,0,0,0|2,0,0]=3 1564 B8R0.37 CC(O)(C(F)F)C(O)=O Amb25842016 [0,1,0,0,0,0|3,0,0]=4 1565 B8R0.37 CC(O)(C(O)=O)C(O)=O Amb18124398 [0,1,0,0,0,0|2,0,1]=4 1566 B8R0.37 CC(O)C(C)(C)C(C)=C Amb25317607 [0,1,0,0,0,0|3,0,0]=4 1567 B8R0.37 CC(O)C(C)(C)C(C)=O Amb25282830 [0,1,0,0,0,0|2,0,0]=3 1568 B8R0.37 CC(O)C(C)(C)C(O)=O Amb18961474 [0,1,0,0,0,0|1,0,0]=2 1569 B8R0.37 CC(O)C(C)(C)[N+]([O-])=O Amb22361103 [0,1,0,0,0,0|2,0,1]=4 1570 B8R0.37 CC(O)C(C)(O)C(O)=O Amb18124401 [0,1,0,0,0,0|1,0,0]=2 1571 B8R0.37 CC([C@@](C(=O)O)(N)C)C Amb10603127 [0,1,0,0,0,0|1,0,0]=2 1572 B8R0.37 CC([C@@](C(=O)O)(O)C)C Amb16231522 [0,1,0,0,0,0|2,0,0]=3 1573 B8R0.37 CC([C@](C(=O)O)(N)C)C Amb16183901 [0,1,0,0,0,0|1,0,0]=2 1574 B8R0.37 CN(C)C(C)(C)C(O)=O Amb20627821 [0,1,0,0,0,0|3,0,0]=4 1575 B8R0.37 CS(=O)C(C)(C)C(O)=O Amb18644428 [0,1,0,0,0,0|2,0,1]=4 1576 B8R0.37 CS(=O)C(F)(F)C(O)=O Amb23586464 [0,1,0,0,0,0|2,0,1]=4 1577 B8R0.37 C[C@@H](Cl)[C@](C)(O)C(C)=O Amb24601035 [0,1,0,0,0,0|3,0,0]=4 1578 B8R0.37 C[C@@H](Cl)[C@](C)(O)C(O)=O Amb25360920 [0,1,0,0,0,0|2,0,0]=3 1579 B8R0.37 C[C@@H](N)C(C)(C)C(N)=O Amb25239049 [0,1,0,0,0,0|3,0,0]=4 1580 B8R0.37 C[C@@H](O)C(C)(C)C(O)=O Amb24465184 [0,1,0,0,0,0|1,0,0]=2 1581 B8R0.37 C[C@@H](O)[C@@](C)(O)C(C)=O Amb25662408 [0,1,0,0,0,0|2,0,0]=3 1582 B8R0.37 C[C@@H](O)[C@@](C)(O)C(O)=O Amb25842427 [0,1,0,0,0,0|1,0,0]=2 1583 B8R0.37 C[C@@H](O)[C@](C)(O)C(C)=C Amb24353037 [0,1,0,0,0,0|3,0,0]=4 1584 B8R0.37 C[C@@H](O)[C@](C)(O)C(C)=O Amb25767044 [0,1,0,0,0,0|2,0,0]=3 1585 B8R0.37 C[C@@](N)(C(F)F)C(O)=O Amb25329065 [0,1,0,0,0,0|2,0,0]=3 1586 B8R0.37 C[C@@](N)(C(O)=O)C(N)=O Amb25077574 [0,1,0,0,0,0|1,0,2]=4 1587 B8R0.37 C[C@H](O)C(C)(C)C(C)=O Amb24725317 [0,1,0,0,0,0|2,0,0]=3 1588 B8R0.37 C[C@H](O)C(C)(C)C(O)=O Amb25114676 [0,1,0,0,0,0|1,0,0]=2 1589 B8R0.37 C[C@H](O)[C@@](C)(N)C(O)=O Amb22232016 [0,1,0,0,0,0|0,0,0]=1 1590 B8R0.37 C[C@H](O)[C@](C)(Cl)C(O)=O Amb25772784 [0,1,0,0,0,0|1,0,0]=2 1591 B8R0.37 C[C@](N)(C(F)F)C(O)=O Amb25107781 [0,1,0,0,0,0|2,0,0]=3 1592 B8R0.37 FC(C(C(=O)O)(F)F)Br Amb10839241 [0,1,0,0,0,0|3,0,0]=4 1593 B8R0.37 FC(C(C(=O)O)(F)F)Cl Amb17594051 [0,1,0,0,0,0|3,0,0]=4 1594 B8R0.37 OC(=O)C(Br)(Br)C(O)=O Amb24707409 [0,1,0,0,0,0|2,0,1]=4 1595 B8R0.37 OC(=O)C(C(=O)O)(Cl)Cl Amb17594338 [0,1,0,0,0,0|2,0,1]=4 1596 B8R0.37 OC(=O)C(Cl)(Br)C(O)=O Amb25827170 [0,1,0,0,0,0|2,0,1]=4 1597 B8R0.37 OC(=O)C(Cl)(Cl)C(Cl)Cl Amb25377180 [0,1,0,0,0,0|3,0,0]=4 1598 B8R0.37 OC(=O)C(F)(Cl)C(Cl)Cl Amb25190584 [0,1,0,0,0,0|3,0,0]=4 1599 B8R0.37 OC(=O)C(F)(Cl)C(F)Cl Amb24444909 [0,1,0,0,0,0|3,0,0]=4 1600 B8R0.37 OC(=O)C(F)(F)C(O)=O Amb24088375 [0,1,0,0,0,0|2,0,1]=4 1601 B8R0.37 OC(O)(C(O)=O)C(O)=O Amb22002022 [0,1,0,0,0,0|2,0,1]=4 1602 B8R0.37 [2H]C(N)(C(C)C)C(O)=O Amb22367355 [0,1,0,0,0,0|1,0,0]=2 1603 B8R1.29 CC1(C)NC(=O)C1N Amb24416566 [0,0,0,1,0,0|2,0,0]=3 1604 B8R1.29 CC1(C)SC(=O)C1N Amb25836418 [0,0,0,1,0,0|1,1,0]=3 1605 B8R1.29 CC1C(=O)NC1(C)C Amb22490971 [0,0,0,1,0,0|3,0,0]=4 1606 B8R1.30 C=C1CC1(N)C(N)=O Amb25239007 [0,0,0,1,0,0|2,0,1]=4 1607 B8R1.30 C=C1CC1(N)C(O)=O Amb22274582 [0,0,0,1,0,0|1,0,1]=3 1608 B8R1.30 CC(=O)C1(C)CC1Cl Amb24481567 [0,0,0,1,0,0|3,0,0]=4 1609 B8R1.30 CC(=O)C1(C)CC1F Amb25248317 [0,0,0,1,0,0|3,0,0]=4 1610 B8R1.30 CC(=O)[C@@]1(C)C[C@H]1Br Amb25176069 [0,0,0,1,0,0|3,0,0]=4 1611 B8R1.30 CC(=O)[C@]1(C)C[C@@H]1Br Amb25242518 [0,0,0,1,0,0|3,0,0]=4 1612 B8R1.30 CC(=O)[C@]1(C)C[C@H]1Br Amb24698158 [0,0,0,1,0,0|3,0,0]=4 1613 B8R1.30 CC1(CC1Br)C(N)=O Amb24687532 [0,0,0,1,0,0|3,0,0]=4 1614 B8R1.30 CC1(CC1Cl)C(=O)Cl Amb25700456 [0,0,0,1,0,0|3,0,0]=4 1615 B8R1.30 CC1(CC1F)C(N)=O Amb24630009 [0,0,0,1,0,0|3,0,0]=4 1616 B8R1.30 CC1(CC1F)C(O)=O Amb24445672 [0,0,0,1,0,0|2,0,0]=3 1617 B8R1.30 CC1(OC1C)C(=O)O Amb17593199 [0,0,0,1,0,0|1,0,0]=2 1618 B8R1.30 CC1CC1(C)C(C)=O Amb24570372 [0,0,0,1,0,0|3,0,0]=4 1619 B8R1.30 CC1CC1(Cl)C(O)=O Amb25376529 [0,0,0,1,0,0|2,0,0]=3 1620 B8R1.30 CC1CC1(O)C(O)=O Amb24481340 [0,0,0,1,0,0|2,0,0]=3 1621 B8R1.30 CC1OC1(C)C(C)=O Amb25745803 [0,0,0,1,0,0|2,0,0]=3 1622 B8R1.30 CC1OC1(C)C(N)=O Amb24482460 [0,0,0,1,0,0|2,0,0]=3 1623 B8R1.30 CC1OC1(Cl)C(O)=O Amb24604328 [0,0,0,1,0,0|1,0,0]=2 1624 B8R1.30 C[C@@H]1C[C@@]1(C)C(O)=O Amb24680945 [0,0,0,1,0,0|2,0,0]=3 1625 B8R1.30 C[C@@H]1C[C@@]1(N)C(O)=O Amb23452877 [0,0,0,1,0,0|1,0,0]=2 1626 B8R1.30 C[C@@H]1C[C@]1(N)C(O)=O Amb23452872 [0,0,0,1,0,0|1,0,0]=2 1627 B8R1.30 C[C@@H]1C[C@]1(O)C(O)=O Amb24630291 [0,0,0,1,0,0|2,0,0]=3 1628 B8R1.30 C[C@@H]1O[C@@]1(C)C(N)=O Amb24760855 [0,0,0,1,0,0|2,0,0]=3 1629 B8R1.30 C[C@@H]1O[C@@]1(C)C(O)=O Amb25174091 [0,0,0,1,0,0|1,0,0]=2 1630 B8R1.30 C[C@@H]1O[C@@]1(C)[C@@H](C)O Amb25351482 [0,0,0,1,0,0|2,0,1]=4 1631 B8R1.30 C[C@@H]1O[C@@]1(C)[C@H](C)O Amb24627872 [0,0,0,1,0,0|2,0,1]=4 1632 B8R1.30 C[C@@H]1O[C@]1(C)[C@H](C)O Amb25369414 [0,0,0,1,0,0|2,0,1]=4 1633 B8R1.30 C[C@@]1(C[C@H]1Cl)C(O)=O Amb25025974 [0,0,0,1,0,0|2,0,0]=3 1634 B8R1.30 C[C@H]1CC1(N)C(O)=O Amb25064269 [0,0,0,1,0,0|1,0,0]=2 1635 B8R1.30 C[C@H]1C[C@@]1(O)C(O)=O Amb25174792 [0,0,0,1,0,0|2,0,0]=3 1636 B8R1.30 C[C@H]1C[C@]1(C)C(C)=O Amb24550104 [0,0,0,1,0,0|3,0,0]=4 1637 B8R1.30 C[C@H]1O[C@@]1(C)C(C)=O Amb25207221 [0,0,0,1,0,0|2,0,0]=3 1638 B8R1.30 C[C@H]1O[C@]1(C)[C@H](C)O Amb24608061 [0,0,0,1,0,0|2,0,1]=4 1639 B8R1.30 C[C@]1(C[C@@H]1F)C(O)=O Amb24053139 [0,0,0,1,0,0|2,0,0]=3 1640 B8R1.30 N[C@@]1(C[C@H]1Cl)C(O)=O Amb22748908 [0,0,0,1,0,0|1,0,0]=2 1641 B8R1.30 N[C@]1(C[C@@H]1Cl)C(O)=O Amb25245700 [0,0,0,1,0,0|1,0,0]=2 1642 B8R1.30 N[C@]1(C[C@H]1Br)C(O)=O Amb24567904 [0,0,0,1,0,0|1,0,0]=2 1643 B8R1.31 CC(=C)[C@@H]1CC[C@H]1O Amb24625276 [0,0,0,1,0,0|3,0,0]=4 1644 B8R1.31 CC(=O)C1COC1=O Amb24601316 [0,0,0,1,0,0|1,0,2]=4 1645 B8R1.31 CC(C)C1OCC1=O Amb23456090 [0,0,0,1,0,0|3,0,0]=4 1646 B8R1.31 CC(O)C1CCC1=O Amb24363437 [0,0,0,1,0,0|2,0,0]=3 1647 B8R1.31 CC(O)N1CCC1=O Amb24431543 [0,0,0,1,0,0|3,0,0]=4 1648 B8R1.31 CC1CCC1C(=O)Cl Amb25123268 [0,0,0,1,0,0|3,0,0]=4 1649 B8R1.31 CC1CCC1C(C)=O Amb25101506 [0,0,0,1,0,0|3,0,0]=4 1650 B8R1.31 CC1CCC1C(N)=O Amb24481452 [0,0,0,1,0,0|3,0,0]=4 1651 B8R1.31 CC1CCC1C(O)=O Amb21857447 [0,0,0,1,0,0|2,0,0]=3 1652 B8R1.31 CN1CCC1C(O)=O Amb22011586 [0,0,0,1,0,0|3,0,0]=4 1653 B8R1.31 CN1CC[C@@H]1C(O)=O Amb24183372 [0,0,0,1,0,0|3,0,0]=4 1654 B8R1.31 CN1CC[C@H]1C(O)=O Amb24699921 [0,0,0,1,0,0|3,0,0]=4 1655 B8R1.31 C[C@@H]1CC[C@H]1C(O)=O Amb25174793 [0,0,0,1,0,0|2,0,0]=3 1656 B8R1.31 C[C@@H]1CN[C@@H]1C(O)=O Amb24597629 [0,0,0,1,0,0|1,0,0]=2 1657 B8R1.31 C[C@H](O)[C@@H]1CNC1=O Amb25224413 [0,0,0,1,0,0|2,0,0]=3 1658 B8R1.31 C[C@H]1CC[C@@H]1C(O)=O Amb24561899 [0,0,0,1,0,0|2,0,0]=3 1659 B8R1.31 C[C@H]1CC[C@H]1C(O)=O Amb25259513 [0,0,0,1,0,0|2,0,0]=3 1660 B8R1.31 C[C@H]1CN[C@@H]1C(O)=O Amb24629618 [0,0,0,1,0,0|1,0,0]=2 1661 B8R1.31 NC(=O)C1CCC1Cl Amb24482516 [0,0,0,1,0,0|3,0,0]=4 1662 B8R1.31 NC(=O)[C@@H]1CC[C@@H]1Cl Amb25174435 [0,0,0,1,0,0|3,0,0]=4 1663 B8R1.31 NC(=O)[C@@H]1CC[C@H]1Cl Amb25024326 [0,0,0,1,0,0|3,0,0]=4 1664 B8R1.31 NC1CCC1C(N)=O Amb20248288 [0,0,0,1,0,0|3,0,0]=4 1665 B8R1.31 NC1COC1C(N)=O Amb25309396 [0,0,0,1,0,0|3,0,0]=4 1666 B8R1.31 NN1CCC1C(O)=O Amb25189887 [0,0,0,1,0,0|3,0,0]=4 1667 B8R1.31 N[C@@H]1CC[C@@H]1C(N)=O Amb24670123 [0,0,0,1,0,0|3,0,0]=4 1668 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24117048 [0,0,0,1,0,0|2,0,0]=3 1669 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24183584 [0,0,0,1,0,0|2,0,0]=3 1670 B8R1.31 N[C@@H]1CO[C@@H]1C(O)=O Amb24568133 [0,0,0,1,0,0|2,0,0]=3 1671 B8R1.31 N[C@@H]1CO[C@H]1C(O)=O Amb24681491 [0,0,0,1,0,0|2,0,0]=3 1672 B8R1.31 N[C@H]1CC[C@H]1C(N)=O Amb25326921 [0,0,0,1,0,0|3,0,0]=4 1673 B8R1.31 N[C@H]1CO[C@@H]1C(O)=O Amb25324265 [0,0,0,1,0,0|2,0,0]=3 1674 B8R1.31 O=C(Cl)C1CCC1Cl Amb25718688 [0,0,0,1,0,0|3,0,0]=4 1675 B8R1.31 O=C(Cl)[C@@H]1CC[C@@H]1Cl Amb25361006 [0,0,0,1,0,0|3,0,0]=4 1676 B8R1.31 OC(=O)C1C=CC1Cl Amb24482989 [0,0,0,1,0,0|2,0,1]=4 1677 B8R1.31 OC(=O)C1CCC1S Amb25830696 [0,0,0,1,0,0|1,1,0]=3 1678 B8R1.31 OC(=O)[C@@H]1CC[C@@H]1Cl Amb24514834 [0,0,0,1,0,0|2,0,0]=3 1679 B8R1.31 OC(=O)[C@@H]1CC[C@H]1Cl Amb24580965 [0,0,0,1,0,0|2,0,0]=3 1680 B8R1.31 OC1CCC1C(O)=O Amb24481384 [0,0,0,1,0,0|1,0,0]=2 1681 B8R1.31 OC=1CCC1C(O)=O Amb25119748 [0,0,0,1,0,0|1,0,2]=4 1682 B8R1.31 [C@H]1(CNC1=O)[C@@H](C)O Amb17843592 [0,0,0,1,0,0|2,0,0]=3 1683 B8R1.50 BrC1C(=O)COC1=O Amb17594578 [0,0,0,1,0,0|1,0,2]=4 1684 B8R1.50 C=C1C(N)COC1=O Amb18641720 [0,0,0,1,0,0|2,0,1]=4 1685 B8R1.50 C=C1[C@@H](N)COC1=O Amb24744705 [0,0,0,1,0,0|2,0,1]=4 1686 B8R1.50 C=C1[C@@H](O)COC1=O Amb24435902 [0,0,0,1,0,0|1,0,1]=3 1687 B8R1.50 CC1=CCC(O)C1O Amb25107667 [0,0,0,1,0,0|3,0,0]=4 1688 B8R1.50 CC1=NOC(=O)C1C Amb19958218 [0,0,0,1,0,0|2,0,1]=4 1689 B8R1.50 CC1C(C)CNC1=O Amb24334186 [0,0,0,1,0,0|3,0,0]=4 1690 B8R1.50 CC1C(C)ON=C1C Amb24585955 [0,0,0,1,0,0|3,0,0]=4 1691 B8R1.50 CC1C(C)SC=C1O Amb22167478 [0,0,0,1,0,0|2,1,0]=4 1692 B8R1.50 CC1C(C)SCC1=O Amb24687046 [0,0,0,1,0,0|2,1,0]=4 1693 B8R1.50 CC1C(N)COC1=O Amb18641824 [0,0,0,1,0,0|2,0,0]=3 1694 B8R1.50 CC1C(O)CNC1=O Amb24441657 [0,0,0,1,0,0|2,0,0]=3 1695 B8R1.50 CC1C(O)COC1=O Amb25357313 [0,0,0,1,0,0|1,0,0]=2 1696 B8R1.50 CC1C=CC(=O)C1C Amb25284741 [0,0,0,1,0,0|3,0,0]=4 1697 B8R1.50 CC1C=CC(=O)C1Cl Amb24634012 [0,0,0,1,0,0|3,0,0]=4 1698 B8R1.50 CC1CCC(=O)C1Br Amb24356701 [0,0,0,1,0,0|3,0,0]=4 1699 B8R1.50 CC1CCC(=O)C1N Amb25675652 [0,0,0,1,0,0|2,0,0]=3 1700 B8R1.50 CC1CCC(=O)C1O Amb25773264 [0,0,0,1,0,0|3,0,0]=4 1701 B8R1.50 CC1CNC(=O)C1Cl Amb24610736 [0,0,0,1,0,0|3,0,0]=4 1702 B8R1.50 CC1COC(=O)C1Cl Amb25240615 [0,0,0,1,0,0|2,0,0]=3 1703 B8R1.50 CC1COC(=O)C1N Amb24482307 [0,0,0,1,0,0|1,0,0]=2 1704 B8R1.50 CC1CSC(=O)C1N Amb25169595 [0,0,0,1,0,0|1,1,0]=3 1705 B8R1.50 CC1NNC(=O)C1O Amb25739720 [0,0,0,1,0,0|3,0,0]=4 1706 B8R1.50 CC1OC=C(O)C1=O Amb25128250 [0,0,0,1,0,0|2,0,1]=4 1707 B8R1.50 CC1OCC(=C)C1O Amb24527630 [0,0,0,1,0,0|3,0,0]=4 1708 B8R1.50 CC1OCC(=O)C1N Amb24601568 [0,0,0,1,0,0|1,0,0]=2 1709 B8R1.50 CC1OCC(O)C1O Amb25044548 [0,0,0,1,0,0|2,0,1]=4 1710 B8R1.50 CC1ON=C(N)C1Br Amb24642704 [0,0,0,1,0,0|3,0,0]=4 1711 B8R1.50 CC1ONC(=O)C1N Amb25063865 [0,0,0,1,0,0|1,0,0]=2 1712 B8R1.50 CC1SCC(O)C1N Amb24674196 [0,0,0,1,0,0|1,1,1]=4 1713 B8R1.50 CC1SOC(=O)C1N Amb24665733 [0,0,0,1,0,0|0,1,0]=2 1714 B8R1.50 CC=1COC(=O)C1N Amb25025754 [0,0,0,1,0,0|1,0,2]=4 1715 B8R1.50 CN1C(O)CNC1=O Amb25131298 [0,0,0,1,0,0|3,0,0]=4 1716 B8R1.50 CN1C(O)CSC1=O Amb25295689 [0,0,0,1,0,0|2,1,0]=4 1717 B8R1.50 CN1[C@H](O)CCC1=O Amb24684724 [0,0,0,1,0,0|3,0,0]=4 1718 B8R1.50 C[C@@H]1CCC(=O)C1C Amb25834175 [0,0,0,1,0,0|3,0,0]=4 1719 B8R1.50 C[C@@H]1CCC(=O)[C@H]1Br Amb24706631 [0,0,0,1,0,0|3,0,0]=4 1720 B8R1.50 C[C@@H]1CC[C@@H](O)[C@H]1N Amb25366548 [0,0,0,1,0,0|2,0,1]=4 1721 B8R1.50 C[C@@H]1COC(=O)[C@H]1N Amb25216668 [0,0,0,1,0,0|1,0,0]=2 1722 B8R1.50 C[C@@H]1NNC(=O)[C@@H]1O Amb24599440 [0,0,0,1,0,0|3,0,0]=4 1723 B8R1.50 C[C@@H]1OC[C@H](O)[C@@H]1O Amb25284508 [0,0,0,1,0,0|2,0,1]=4 1724 B8R1.50 C[C@@H]1OC[C@H](O)[C@H]1O Amb25176889 [0,0,0,1,0,0|2,0,1]=4 1725 B8R1.50 C[C@@H]1[C@@H](O)CC[C@H]1O Amb24748402 [0,0,0,1,0,0|2,0,1]=4 1726 B8R1.50 C[C@@H]1[C@@H](O)COC1=O Amb25176469 [0,0,0,1,0,0|1,0,0]=2 1727 B8R1.50 C[C@@H]1[C@H](O)CC[C@@H]1O Amb24675350 [0,0,0,1,0,0|2,0,1]=4 1728 B8R1.50 C[C@H]1C=CC(=O)[C@@H]1O Amb25024971 [0,0,0,1,0,0|3,0,0]=4 1729 B8R1.50 C[C@H]1C=CC(=O)[C@H]1C Amb25373043 [0,0,0,1,0,0|3,0,0]=4 1730 B8R1.50 C[C@H]1C=CC(=O)[C@H]1Cl Amb25348042 [0,0,0,1,0,0|3,0,0]=4 1731 B8R1.50 C[C@H]1CCC(=O)[C@H]1Br Amb25286608 [0,0,0,1,0,0|3,0,0]=4 1732 B8R1.50 C[C@H]1CCC(=O)[C@H]1C Amb24557180 [0,0,0,1,0,0|3,0,0]=4 1733 B8R1.50 C[C@H]1CCC(=O)[C@H]1Cl Amb24544320 [0,0,0,1,0,0|3,0,0]=4 1734 B8R1.50 C[C@H]1COC(=O)[C@@H]1N Amb25339475 [0,0,0,1,0,0|1,0,0]=2 1735 B8R1.50 C[C@H]1COC(=O)[C@@H]1O Amb25320667 [0,0,0,1,0,0|2,0,0]=3 1736 B8R1.50 C[C@H]1OCC(=O)[C@@H]1O Amb25026255 [0,0,0,1,0,0|2,0,0]=3 1737 B8R1.50 C[C@H]1OC[C@@H](O)[C@@H]1O Amb25239252 [0,0,0,1,0,0|2,0,1]=4 1738 B8R1.50 C[C@H]1ONC(=O)[C@H]1N Amb24514974 [0,0,0,1,0,0|1,0,0]=2 1739 B8R1.50 C[C@H]1[C@@H](C)CNC1=O Amb24761480 [0,0,0,1,0,0|3,0,0]=4 1740 B8R1.50 C[C@H]1[C@H](N)COC1=O Amb24514746 [0,0,0,1,0,0|2,0,0]=3 1741 B8R1.50 C[C@H]1[C@H](O)CCC1=O Amb24631662 [0,0,0,1,0,0|2,0,0]=3 1742 B8R1.50 NC1C(N)CNC1=O Amb18641832 [0,0,0,1,0,0|2,0,0]=3 1743 B8R1.50 NC1C(O)C=CC1O Amb25695094 [0,0,0,1,0,0|1,0,2]=4 1744 B8R1.50 NC1C(O)CCC1O Amb24381348 [0,0,0,1,0,0|1,0,1]=3 1745 B8R1.50 NC1C(O)CNC1=O Amb24374633 [0,0,0,1,0,0|1,0,0]=2 1746 B8R1.50 NC1C(O)COC1=O Amb25746355 [0,0,0,1,0,0|0,0,0]=1 1747 B8R1.50 NC1CNC(=O)C1O Amb24481564 [0,0,0,1,0,0|3,0,0]=4 1748 B8R1.50 NC1COC(=O)C1O Amb24724728 [0,0,0,1,0,0|2,0,0]=3 1749 B8R1.50 NC1[C@@H](O)CC[C@@H]1O Amb24515534 [0,0,0,1,0,0|1,0,1]=3 1750 B8R1.50 NC1[C@H](O)CC[C@H]1O Amb24566623 [0,0,0,1,0,0|1,0,1]=3 1751 B8R1.50 NC=1C(=O)OCC1Br Amb24553799 [0,0,0,1,0,0|1,0,2]=4 1752 B8R1.50 NC=1C(=O)OCC1Cl Amb25378846 [0,0,0,1,0,0|1,0,2]=4 1753 B8R1.50 N[C@@H]1[C@@H](O)C=C[C@H]1O Amb24481487 [0,0,0,1,0,0|1,0,2]=4 1754 B8R1.50 N[C@@H]1[C@@H](O)CC[C@H]1Cl Amb24515145 [0,0,0,1,0,0|2,0,1]=4 1755 B8R1.50 N[C@@H]1[C@@H](O)CC[C@H]1O Amb25041662 [0,0,0,1,0,0|1,0,1]=3 1756 B8R1.50 N[C@@H]1[C@@H](O)CNC1=O Amb24612410 [0,0,0,1,0,0|1,0,0]=2 1757 B8R1.50 N[C@@H]1[C@H](O)COC1=O Amb25260781 [0,0,0,1,0,0|0,0,0]=1 1758 B8R1.50 N[C@@H]1[C@H](O)COC1O Amb25174437 [0,0,0,1,0,0|0,0,2]=3 1759 B8R1.50 N[C@H]1CNC(=O)[C@@H]1O Amb24612411 [0,0,0,1,0,0|3,0,0]=4 1760 B8R1.50 N[C@H]1[C@@H](O)COC1=O Amb24697759 [0,0,0,1,0,0|0,0,0]=1 1761 B8R1.50 N[C@H]1[C@H](N)CNC1=O Amb24566659 [0,0,0,1,0,0|2,0,0]=3 1762 B8R1.50 N[C@H]1[C@H](O)COC1O Amb25366114 [0,0,0,1,0,0|0,0,2]=3 1763 B8R1.50 O=C1C(Br)COC1=O Amb25760646 [0,0,0,1,0,0|2,0,1]=4 1764 B8R1.50 OC1C(=O)COC1=O Amb25143349 [0,0,0,1,0,0|1,0,2]=4 1765 B8R1.50 OC1C(F)COC1=O Amb25831080 [0,0,0,1,0,0|2,0,0]=3 1766 B8R1.50 OC1C(O)CCC1O Amb24647664 [0,0,0,1,0,0|2,0,1]=4 1767 B8R1.50 OC1C(O)COC1=O Amb22730078 [0,0,0,1,0,0|1,0,0]=2 1768 B8R1.50 OC1C(O)COC1O Amb24419997 [0,0,0,1,0,0|1,0,2]=4 1769 B8R1.50 OC1C=CC(=O)C1Br Amb24398644 [0,0,0,1,0,0|2,0,1]=4 1770 B8R1.50 OC1C=CC(=O)C1O Amb25285676 [0,0,0,1,0,0|2,0,1]=4 1771 B8R1.50 OC1CCC(=O)C1=O Amb24432188 [0,0,0,1,0,0|2,0,1]=4 1772 B8R1.50 OC1CCC(=O)C1O Amb24627902 [0,0,0,1,0,0|2,0,0]=3 1773 B8R1.50 OC1CCC(=O)N1C Amb17615583 [0,0,0,1,0,0|3,0,0]=4 1774 B8R1.50 OC1CCC(O)C1Br Amb24677853 [0,0,0,1,0,0|2,0,1]=4 1775 B8R1.50 OC1CCC(O)C1Cl Amb24443795 [0,0,0,1,0,0|2,0,1]=4 1776 B8R1.50 OC1COC(=O)C1Br Amb24482051 [0,0,0,1,0,0|1,0,0]=2 1777 B8R1.50 OC1COC(=O)C1F Amb24529261 [0,0,0,1,0,0|1,0,0]=2 1778 B8R1.50 OC1[C@@H](O)CC[C@@H]1O Amb24569971 [0,0,0,1,0,0|2,0,1]=4 1779 B8R1.50 OC=1C(=O)OCC1O Amb23505710 [0,0,0,1,0,0|1,0,2]=4 1780 B8R1.50 OC=1CCC(O)C1O Amb25745324 [0,0,0,1,0,0|2,0,1]=4 1781 B8R1.50 OC=1COC(=O)C1Cl Amb22360617 [0,0,0,1,0,0|1,0,2]=4 1782 B8R1.50 O[C@@H]1C=CC(=O)[C@H]1Br Amb25273749 [0,0,0,1,0,0|2,0,1]=4 1783 B8R1.50 O[C@@H]1CC[C@@H](O)C1Cl Amb24540299 [0,0,0,1,0,0|2,0,1]=4 1784 B8R1.50 O[C@@H]1[C@@H](O)CC[C@H]1O Amb25045559 [0,0,0,1,0,0|2,0,1]=4 1785 B8R1.50 O[C@@H]1[C@@H](O)CN[C@H]1O Amb25259818 [0,0,0,1,0,0|2,0,1]=4 1786 B8R1.50 O[C@@H]1[C@@H](O)COC1=O Amb15692412 [0,0,0,1,0,0|1,0,0]=2 1787 B8R1.50 O[C@@H]1[C@@H](O)COC1O Amb24737731 [0,0,0,1,0,0|1,0,2]=4 1788 B8R1.50 O[C@@H]1[C@@H](O)CO[C@@H]1O Amb25271378 [0,0,0,1,0,0|1,0,2]=4 1789 B8R1.50 O[C@@H]1[C@H](O)CC[C@@H]1O Amb24731723 [0,0,0,1,0,0|2,0,1]=4 1790 B8R1.50 O[C@@H]1[C@H](O)COC1O Amb25280200 [0,0,0,1,0,0|1,0,2]=4 1791 B8R1.50 O[C@@H]1[C@H](O)CO[C@@H]1O Amb25176988 [0,0,0,1,0,0|1,0,2]=4 1792 B8R1.50 O[C@H]1CC[C@@H](O)[C@@H]1Br Amb25760794 [0,0,0,1,0,0|2,0,1]=4 1793 B8R1.50 O[C@H]1CC[C@@H](O)[C@@H]1Cl Amb25061345 [0,0,0,1,0,0|2,0,1]=4 1794 B8R1.50 O[C@H]1COC(=O)[C@H]1Br Amb10067848 [0,0,0,1,0,0|1,0,0]=2 1795 B8R1.50 O[C@H]1[C@@H](O)CO[C@@H]1O Amb25235698 [0,0,0,1,0,0|1,0,2]=4 1796 B8R1.50 O[C@H]1[C@H](F)COC1=O Amb25356232 [0,0,0,1,0,0|2,0,0]=3 1797 B8R1.50 O[C@H]1[C@H](O)COC1=O Amb24609731 [0,0,0,1,0,0|1,0,0]=2 1798 B8R1.50 O[C@H]1[C@H](O)COC1O Amb24601100 [0,0,0,1,0,0|1,0,2]=4 1799 B8R1.50 O[C@H]1[C@H](O)CO[C@@H]1O Amb25176471 [0,0,0,1,0,0|1,0,2]=4 1800 B8R1.54 C=C(C1CC1)C(O)=O Amb24481397 [0,0,0,1,0,0|2,0,1]=4 1801 B8R1.54 CC(C(=O)O)C1CC1 Amb17087493 [0,0,0,1,0,0|2,0,0]=3 1802 B8R1.54 CC(C1CC1)C(=O)Cl Amb25244618 [0,0,0,1,0,0|3,0,0]=4 1803 B8R1.54 CC(C1CC1)C(C)=O Amb25798488 [0,0,0,1,0,0|3,0,0]=4 1804 B8R1.54 CC(C1CC1)C(N)=O Amb23443624 [0,0,0,1,0,0|3,0,0]=4 1805 B8R1.54 CC(O)C(O)C1CO1 Amb25048168 [0,0,0,1,0,0|2,0,1]=4 1806 B8R1.54 C[C@@H](O)[C@H](N)C1CC1 Amb24604396 [0,0,0,1,0,0|2,0,1]=4 1807 B8R1.54 C[C@@H]([C@@H]1CO1)[C@@H](C)O Amb25356154 [0,0,0,1,0,0|2,0,1]=4 1808 B8R1.54 NC(=O)C(O)C1CC1 Amb20630809 [0,0,0,1,0,0|3,0,0]=4 1809 B8R1.54 NC(C1CC1)C(=O)Cl Amb25733572 [0,0,0,1,0,0|2,0,0]=3 1810 B8R1.54 NC(C1CC1)C(N)=O Amb18282442 [0,0,0,1,0,0|2,0,0]=3 1811 B8R1.54 NC(C1CC1)C(O)=O Amb19515010 [0,0,0,1,0,0|1,0,0]=2 1812 B8R1.54 N[C@@H](C1CC1)C(O)=O Amb19929447 [0,0,0,1,0,0|1,0,0]=2 1813 B8R1.54 O=C(C(=O)O)C1CC1 Amb16233327 [0,0,0,1,0,0|2,0,1]=4 1814 B8R1.54 OC(=O)C(Br)C1CC1 Amb24634830 [0,0,0,1,0,0|2,0,0]=3 1815 B8R1.54 OC(=O)C(Cl)C1CC1 Amb24333436 [0,0,0,1,0,0|2,0,0]=3 1816 B8R1.54 OC(C1CC1)C(O)=O Amb18282441 [0,0,0,1,0,0|2,0,0]=3 1817 B8R1.54 O[C@@H](C1CC1)C(O)=O Amb25312037 [0,0,0,1,0,0|2,0,0]=3 1818 B8R1.54 O[C@H](C1CC1)C(O)=O Amb25715899 [0,0,0,1,0,0|2,0,0]=3 1819 B8R1.77 CC(=O)C1CC1(C)C Amb22011884 [0,0,0,1,0,0|3,0,0]=4 1820 B8R1.77 CC1(C)C=C1C(O)=O Amb24746031 [0,0,0,1,0,0|2,0,1]=4 1821 B8R1.77 CC1(C)NC1C(O)=O Amb23401629 [0,0,0,1,0,0|1,0,0]=2 1822 B8R1.77 CC1(C)OC1C(N)=O Amb25324328 [0,0,0,1,0,0|3,0,0]=4 1823 B8R1.77 CC1(C)OC1C(O)=O Amb24481352 [0,0,0,1,0,0|2,0,0]=3 1824 B8R1.77 CC1(C)S[C@H]1C(O)=O Amb24445654 [0,0,0,1,0,0|2,0,0]=3 1825 B8R1.77 CC1(Cl)CC1C(O)=O Amb24629731 [0,0,0,1,0,0|2,0,0]=3 1826 B8R1.77 ClC(=O)C1CC1(C)C Amb16230811 [0,0,0,1,0,0|3,0,0]=4 1827 B8R1.77 NC(=O)[C@@H]1CC1(C)C Amb10072071 [0,0,0,1,0,0|3,0,0]=4 1828 B8R1.77 OC(=O)C1CC1(Br)Br Amb24651946 [0,0,0,1,0,0|3,0,0]=4 1829 B8R1.77 OC(=O)C1CC1(Cl)Cl Amb1106460 [0,0,0,1,0,0|3,0,0]=4 1830 B8R1.77 OC(=O)C1CC1(F)Cl Amb10841879 [0,0,0,1,0,0|3,0,0]=4 1831 B8R0.23 BrC(C(=O)O)CC(C)C Amb16233356 [0,0,0,0,0,1|2,0,0]=3 1832 B8R0.23 C=C(Br)CC(N)C(O)=O Amb24557771 [0,0,0,0,0,1|1,0,2]=4 1833 B8R0.23 C=C(Br)C[C@@H](N)C(O)=O Amb22746251 [0,0,0,0,0,1|1,0,2]=4 1834 B8R0.23 C=C(Cl)CC(N)C(O)=O Amb24411473 [0,0,0,0,0,1|1,0,2]=4 1835 B8R0.23 C=C(F)CC(N)C(O)=O Amb24580886 [0,0,0,0,0,1|1,0,2]=4 1836 B8R0.23 C=C(I)CC(N)C(O)=O Amb25842052 [0,0,0,0,0,1|1,0,2]=4 1837 B8R0.23 C=C(O)CC(O)C(O)O Amb24730260 [0,0,0,0,0,1|3,0,0]=4 1838 B8R0.23 CC(=C)C(C)CC(O)=O Amb18642614 [0,0,0,0,0,1|2,0,1]=4 1839 B8R0.23 CC(=C)C(N)CC(N)=O Amb24401112 [0,0,0,0,0,1|2,0,1]=4 1840 B8R0.23 CC(=C)C(O)CC(O)=O Amb18642756 [0,0,0,0,0,1|2,0,1]=4 1841 B8R0.23 CC(=C)CC(C)C(O)=O Amb24471924 [0,0,0,0,0,1|2,0,1]=4 1842 B8R0.23 CC(=C)CC(O)C(O)=O Amb24534477 [0,0,0,0,0,1|2,0,1]=4 1843 B8R0.23 CC(=C)C[C@@H](C(=O)O)C Amb10843988 [0,0,0,0,0,1|2,0,1]=4 1844 B8R0.23 CC(=C)C[C@@H](C)C(O)=O Amb24340253 [0,0,0,0,0,1|2,0,1]=4 1845 B8R0.23 CC(=C)C[C@@H](N)C(O)=O Amb22801689 [0,0,0,0,0,1|1,0,1]=3 1846 B8R0.23 CC(=C)C[C@H](N)C(O)=O Amb25757900 [0,0,0,0,0,1|1,0,1]=3 1847 B8R0.23 CC(=C)[C@@H](O)CC(O)=O Amb25789715 [0,0,0,0,0,1|2,0,1]=4 1848 B8R0.23 CC(=CC(O)=O)C(C)F Amb25108468 [0,0,0,0,0,1|2,0,1]=4 1849 B8R0.23 CC(=CC(O)=O)C(C)N Amb24339945 [0,0,0,0,0,1|2,0,1]=4 1850 B8R0.23 CC(=O)C(C)CC(O)=O Amb18292788 [0,0,0,0,0,1|1,0,2]=4 1851 B8R0.23 CC(=O)C(Cl)CC(O)=O Amb24426109 [0,0,0,0,0,1|1,0,2]=4 1852 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [0,0,0,0,0,1|1,0,2]=4 1853 B8R0.23 CC(=O)C(O)CC(O)=O Amb25341886 [0,0,0,0,0,1|1,0,2]=4 1854 B8R0.23 CC(=O)CC(Br)C(O)=O Amb24710683 [0,0,0,0,0,1|1,0,2]=4 1855 B8R0.23 CC(=O)CC(N)C(O)=O Amb18832532 [0,0,0,0,0,1|0,0,2]=3 1856 B8R0.23 CC(=O)CC(N)C(O)=O Amb22546289 [0,0,0,0,0,1|0,0,2]=3 1857 B8R0.23 CC(=O)CC(O)C(O)=O Amb22500917 [0,0,0,0,0,1|1,0,2]=4 1858 B8R0.23 CC(=O)C[C@@H](C)C(O)=O Amb24369598 [0,0,0,0,0,1|1,0,2]=4 1859 B8R0.23 CC(=O)C[C@@H](N)C(O)=O Amb22745939 [0,0,0,0,0,1|0,0,2]=3 1860 B8R0.23 CC(=O)C[C@H](O)C(O)=O Amb24358758 [0,0,0,0,0,1|1,0,2]=4 1861 B8R0.23 CC(=O)NC(C(=O)N)N Amb10558230 [0,0,0,0,0,1|1,0,2]=4 1862 B8R0.23 CC(=O)NC(O)C(O)=O Amb25146184 [0,0,0,0,0,1|1,0,2]=4 1863 B8R0.23 CC(=O)N[C@H](C)C(O)=O Amb19944277 [0,0,0,0,0,1|1,0,2]=4 1864 B8R0.23 CC(=O)OC(C)C(O)=O Amb22360672 [0,0,0,0,0,1|1,0,2]=4 1865 B8R0.23 CC(=O)SC(C)C(O)=O Amb25719066 [0,0,0,0,0,1|1,0,2]=4 1866 B8R0.23 CC(=O)[C@@H](C)CC(O)=O Amb25145964 [0,0,0,0,0,1|1,0,2]=4 1867 B8R0.23 CC(=O)[C@@H](N)CC(O)=O Amb25064775 [0,0,0,0,0,1|0,0,2]=3 1868 B8R0.23 CC(=O)[C@H](C)CC(O)=O Amb25360184 [0,0,0,0,0,1|1,0,2]=4 1869 B8R0.23 CC(=S)CC(C)C(O)=O Amb24588975 [0,0,0,0,0,1|1,1,1]=4 1870 B8R0.23 CC(=S)N[C@@H](C)C(O)=O Amb24529119 [0,0,0,0,0,1|1,1,1]=4 1871 B8R0.23 CC(C(=O)O)NC(C)C Amb10199874 [0,0,0,0,0,1|2,0,0]=3 1872 B8R0.23 CC(C(=O)O)NC(C)C Amb1110769 [0,0,0,0,0,1|2,0,0]=3 1873 B8R0.23 CC(C(=O)O)OC(C)C Amb10607866 [0,0,0,0,0,1|2,0,0]=3 1874 B8R0.23 CC(C(C)C)CC(=O)O Amb10844380 [0,0,0,0,0,1|2,0,0]=3 1875 B8R0.23 CC(C)=C[C@@H](C)C(O)=O Amb25794277 [0,0,0,0,0,1|2,0,1]=4 1876 B8R0.23 CC(C)=C[C@H](N)C(O)=O Amb24629144 [0,0,0,0,0,1|1,0,1]=3 1877 B8R0.23 CC(C)C(=C)CC(O)=O Amb25074109 [0,0,0,0,0,1|2,0,1]=4 1878 B8R0.23 CC(C)C(Br)CC(N)=O Amb25706465 [0,0,0,0,0,1|3,0,0]=4 1879 B8R0.23 CC(C)C(C)CC(C)=O Amb25835876 [0,0,0,0,0,1|3,0,0]=4 1880 B8R0.23 CC(C)C(C)CC(N)=O Amb25146130 [0,0,0,0,0,1|3,0,0]=4 1881 B8R0.23 CC(C)C(C)NC(C)=O Amb23329033 [0,0,0,0,0,1|3,0,0]=4 1882 B8R0.23 CC(C)C(C)OC(C)=O Amb24458336 [0,0,0,0,0,1|3,0,0]=4 1883 B8R0.23 CC(C)C(Cl)=CC(O)=O Amb24413053 [0,0,0,0,0,1|2,0,1]=4 1884 B8R0.23 CC(C)C(Cl)CC(=O)Cl Amb24479955 [0,0,0,0,0,1|3,0,0]=4 1885 B8R0.23 CC(C)C(Cl)SC(C)=O Amb24479957 [0,0,0,0,0,1|3,0,0]=4 1886 B8R0.23 CC(C)C(F)CC(O)=O Amb25854273 [0,0,0,0,0,1|2,0,0]=3 1887 B8R0.23 CC(C)C(N)=CC(O)=O Amb24481870 [0,0,0,0,0,1|1,0,1]=3 1888 B8R0.23 CC(C)C(N)CC(=O)Cl Amb24763731 [0,0,0,0,0,1|2,0,0]=3 1889 B8R0.23 CC(C)C(N)CC(=O)S Amb24477693 [0,0,0,0,0,1|1,1,0]=3 1890 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [0,0,0,0,0,1|2,0,0]=3 1891 B8R0.23 CC(C)C(N)CS(C)=O Amb25268163 [0,0,0,0,0,1|3,0,0]=4 1892 B8R0.23 CC(C)C(O)=CC(O)=O Amb24548066 [0,0,0,0,0,1|2,0,1]=4 1893 B8R0.23 CC(C)C(O)CC(C)=O Amb24079595 [0,0,0,0,0,1|3,0,0]=4 1894 B8R0.23 CC(C)C(O)CC(N)=O Amb24481942 [0,0,0,0,0,1|3,0,0]=4 1895 B8R0.23 CC(C)C(S)CC(C)=O Amb24736725 [0,0,0,0,0,1|3,0,0]=4 1896 B8R0.23 CC(C)CC(=C)C(O)=O Amb18642603 [0,0,0,0,0,1|2,0,1]=4 1897 B8R0.23 CC(C)CC(Br)C(N)=O Amb24423796 [0,0,0,0,0,1|3,0,0]=4 1898 B8R0.23 CC(C)CC(C)C(C)=O Amb24640121 [0,0,0,0,0,1|3,0,0]=4 1899 B8R0.23 CC(C)CC(C)C(N)=O Amb25733229 [0,0,0,0,0,1|3,0,0]=4 1900 B8R0.23 CC(C)CC(C)C(O)=O Amb18975244 [0,0,0,0,0,1|2,0,0]=3 1901 B8R0.23 CC(C)CC(Cl)C(N)=O Amb24534175 [0,0,0,0,0,1|3,0,0]=4 1902 B8R0.23 CC(C)CC(F)C(O)=O Amb24565634 [0,0,0,0,0,1|2,0,0]=3 1903 B8R0.23 CC(C)CC(N)B(O)O Amb25125820 [0,0,0,0,0,1|2,0,1]=4 1904 B8R0.23 CC(C)CC(N)C(C)=C Amb25764676 [0,0,0,0,0,1|3,0,0]=4 1905 B8R0.23 CC(C)CC(N)C(C)=O Amb18203220 [0,0,0,0,0,1|2,0,0]=3 1906 B8R0.23 CC(C)CC(N)C(C)=O Amb22899479 [0,0,0,0,0,1|2,0,0]=3 1907 B8R0.23 CC(C)CC(N)C(C)O Amb18642850 [0,0,0,0,0,1|2,0,1]=4 1908 B8R0.23 CC(C)CC(N)C(O)=O Amb22001061 [0,0,0,0,0,1|1,0,0]=2 1909 B8R0.23 CC(C)CC(N)[13C](O)=O Amb22363198 [0,0,0,0,0,1|1,0,0]=2 1910 B8R0.23 CC(C)CC(S)C(O)=O Amb18296292 [0,0,0,0,0,1|2,0,0]=3 1911 B8R0.23 CC(C)CC([15NH2])C(O)=O Amb22351200 [0,0,0,0,0,1|1,0,0]=2 1912 B8R0.23 CC(C)C[13CH](N)C(O)=O Amb22351309 [0,0,0,0,0,1|1,0,0]=2 1913 B8R0.23 CC(C)C[13CH](N)[13C](O)=O Amb22367336 [0,0,0,0,0,1|1,0,0]=2 1914 B8R0.23 CC(C)C[C@@H](Br)C(=O)Cl Amb25290167 [0,0,0,0,0,1|3,0,0]=4 1915 B8R0.23 CC(C)C[C@@H](Br)C(N)=O Amb25310991 [0,0,0,0,0,1|3,0,0]=4 1916 B8R0.23 CC(C)C[C@@H](Br)C(O)=O Amb24648832 [0,0,0,0,0,1|2,0,0]=3 1917 B8R0.23 CC(C)C[C@@H](Cl)C(O)=O Amb22800398 [0,0,0,0,0,1|2,0,0]=3 1918 B8R0.23 CC(C)C[C@@H](F)C(O)=O Amb24616998 [0,0,0,0,0,1|2,0,0]=3 1919 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [0,0,0,0,0,1|2,0,0]=3 1920 B8R0.23 CC(C)C[C@@H]([15NH2])C(O)=O Amb22801141 [0,0,0,0,0,1|1,0,0]=2 1921 B8R0.23 CC(C)C[C@H](Br)C(O)=O Amb22226489 [0,0,0,0,0,1|2,0,0]=3 1922 B8R0.23 CC(C)C[C@H](Cl)C(N)=O Amb25145996 [0,0,0,0,0,1|3,0,0]=4 1923 B8R0.23 CC(C)C[C@H](Cl)C(O)=O Amb22388637 [0,0,0,0,0,1|2,0,0]=3 1924 B8R0.23 CC(C)C[C@H](N)B(O)O Amb24578467 [0,0,0,0,0,1|2,0,1]=4 1925 B8R0.23 CC(C)C[C@H](N)C(=O)Cl Amb25842766 [0,0,0,0,0,1|2,0,0]=3 1926 B8R0.23 CC(C)C[C@H](N)C(O)=O Amb22351113 [0,0,0,0,0,1|1,0,0]=2 1927 B8R0.23 CC(C)C[C@H](N)C(O)O Amb24353011 [0,0,0,0,0,1|1,0,2]=4 1928 B8R0.23 CC(C)C[C@H](N)[C@@H](C)O Amb25851073 [0,0,0,0,0,1|2,0,1]=4 1929 B8R0.23 CC(C)C[C@H](O)C(N)=O Amb24548495 [0,0,0,0,0,1|3,0,0]=4 1930 B8R0.23 CC(C)C[C@H](S)C(O)=O Amb24457027 [0,0,0,0,0,1|2,0,0]=3 1931 B8R0.23 CC(C)N=C(Cl)C(O)=O Amb25799222 [0,0,0,0,0,1|2,0,1]=4 1932 B8R0.23 CC(C)NC(C)C(C)=O Amb18642711 [0,0,0,0,0,1|3,0,0]=4 1933 B8R0.23 CC(C)N[C@@H](C)C(N)=O Amb24749342 [0,0,0,0,0,1|3,0,0]=4 1934 B8R0.23 CC(C)N[C@H](C)C(N)=O Amb24680081 [0,0,0,0,0,1|3,0,0]=4 1935 B8R0.23 CC(C)OC(=O)C(O)=O Amb25709215 [0,0,0,0,0,1|2,0,1]=4 1936 B8R0.23 CC(C)SC(F)C(O)=O Amb24671129 [0,0,0,0,0,1|2,0,0]=3 1937 B8R0.23 CC(C)S[C@@H](C)C(O)=O Amb25108429 [0,0,0,0,0,1|2,0,0]=3 1938 B8R0.23 CC(C)[C@@H](N)CC(C)=C Amb25821833 [0,0,0,0,0,1|3,0,0]=4 1939 B8R0.23 CC(C)[C@@H](N)CC(O)=O Amb22226647 [0,0,0,0,0,1|1,0,0]=2 1940 B8R0.23 CC(C)[C@@H](O)CC(C)=O Amb25147078 [0,0,0,0,0,1|3,0,0]=4 1941 B8R0.23 CC(C)[C@@H](O)CC(O)=O Amb25761246 [0,0,0,0,0,1|2,0,0]=3 1942 B8R0.23 CC(C)[C@H](C)CC(C)=O Amb25188966 [0,0,0,0,0,1|3,0,0]=4 1943 B8R0.23 CC(C)[C@H](N)CC(C)=C Amb24715099 [0,0,0,0,0,1|3,0,0]=4 1944 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [0,0,0,0,0,1|2,0,0]=3 1945 B8R0.23 CC(C)[C@H](N)CC(O)=O Amb20240790 [0,0,0,0,0,1|1,0,0]=2 1946 B8R0.23 CC(C)[C@H](O)CC(C)=O Amb25135567 [0,0,0,0,0,1|3,0,0]=4 1947 B8R0.23 CC(C)[C@H](O)CC(O)=O Amb24561913 [0,0,0,0,0,1|2,0,0]=3 1948 B8R0.23 CC(C)\C(\Br)=C\C(O)=O Amb25074552 [0,0,0,0,0,1|2,0,1]=4 1949 B8R0.23 CC(C)\C=C(/F)\C(O)=O Amb18642877 [0,0,0,0,0,1|2,0,1]=4 1950 B8R0.23 CC(CC(C)=O)C(C)O Amb24339979 [0,0,0,0,0,1|2,0,0]=3 1951 B8R0.23 CC(CC(C)N)C(O)=O Amb20620336 [0,0,0,0,0,1|2,0,0]=3 1952 B8R0.23 CC(CC(C)O)C(C)=O Amb25682085 [0,0,0,0,0,1|2,0,0]=3 1953 B8R0.23 CC(CC(F)F)C(O)=O Amb22896466 [0,0,0,0,0,1|3,0,0]=4 1954 B8R0.23 CC(CC(O)=O)C(C)N Amb23536744 [0,0,0,0,0,1|2,0,0]=3 1955 B8R0.23 CC(CC(O)=O)N(C)N Amb25699365 [0,0,0,0,0,1|3,0,0]=4 1956 B8R0.23 CC(CC(O)=O)S(C)=O Amb18974545 [0,0,0,0,0,1|2,0,1]=4 1957 B8R0.23 CC(CN(C)O)C(O)=O Amb24540617 [0,0,0,0,0,1|2,0,0]=3 1958 B8R0.23 CC(CS(C)=O)C(O)=O Amb18974546 [0,0,0,0,0,1|2,0,1]=4 1959 B8R0.23 CC(Cl)CC(Cl)C(C)=O Amb25700978 [0,0,0,0,0,1|3,0,0]=4 1960 B8R0.23 CC(F)CC(N)C(O)=O Amb25803619 [0,0,0,0,0,1|1,0,0]=2 1961 B8R0.23 CC(N(CC(=O)O)C)C Amb10609863 [0,0,0,0,0,1|3,0,0]=4 1962 B8R0.23 CC(NC(C)=O)C(C)O Amb25188915 [0,0,0,0,0,1|2,0,0]=3 1963 B8R0.23 CC(NN(C)C)C(O)=O Amb24523085 [0,0,0,0,0,1|3,0,0]=4 1964 B8R0.23 CC(NS(C)=O)C(C)O Amb24737712 [0,0,0,0,0,1|3,0,0]=4 1965 B8R0.23 CC(NS(C)=O)C(O)=O Amb25241916 [0,0,0,0,0,1|2,0,1]=4 1966 B8R0.23 CC(O)=CC(=O)C(O)=O Amb25047399 [0,0,0,0,0,1|1,0,2]=4 1967 B8R0.23 CC(O)C(C)CC(C)O Amb25308000 [0,0,0,0,0,1|2,0,1]=4 1968 B8R0.23 CC(O)C(C)CC(O)=O Amb18293276 [0,0,0,0,0,1|1,0,0]=2 1969 B8R0.23 CC(O)C(N)CN(C)C Amb18203169 [0,0,0,0,0,1|3,0,0]=4 1970 B8R0.23 CC(O)C(O)CC(C)=C Amb24740055 [0,0,0,0,0,1|3,0,0]=4 1971 B8R0.23 CC(O)C(O)CC(C)=O Amb25708226 [0,0,0,0,0,1|2,0,0]=3 1972 B8R0.23 CC(O)CC(=O)C(O)=O Amb25789747 [0,0,0,0,0,1|1,0,1]=3 1973 B8R0.23 CC(O)CC(C)C(O)=O Amb18293277 [0,0,0,0,0,1|1,0,0]=2 1974 B8R0.23 CC(O)CC(N)C(O)=O Amb18642918 [0,0,0,0,0,1|0,0,0]=1 1975 B8R0.23 CC(O)CC(O)C(N)=O Amb24523077 [0,0,0,0,0,1|2,0,0]=3 1976 B8R0.23 CC(O)CN(C)C(C)=O Amb24072011 [0,0,0,0,0,1|3,0,0]=4 1977 B8R0.23 CC(O)CN(C)C(N)=O Amb25214415 [0,0,0,0,0,1|3,0,0]=4 1978 B8R0.23 CC(OC(C)=O)C(C)Br Amb25321799 [0,0,0,0,0,1|3,0,0]=4 1979 B8R0.23 CC(OC(C)=O)C(C)Cl Amb24480182 [0,0,0,0,0,1|3,0,0]=4 1980 B8R0.23 CC(OC(F)F)C(O)=O Amb24358717 [0,0,0,0,0,1|3,0,0]=4 1981 B8R0.23 CC(OP(=O)S)C(C)O Amb24421629 [0,0,0,0,0,1|2,1,0]=4 1982 B8R0.23 CC(S(=O)CC(=O)O)C Amb10608021 [0,0,0,0,0,1|3,0,0]=4 1983 B8R0.23 CC(S)CC(O)C(O)=O Amb25032270 [0,0,0,0,0,1|1,1,0]=3 1984 B8R0.23 CC(SC(N)=N)C(C)O Amb25858544 [0,0,0,0,0,1|3,0,0]=4 1985 B8R0.23 CC(SC(N)=S)C(C)O Amb25147127 [0,0,0,0,0,1|2,1,0]=4 1986 B8R0.23 CC(\C(=C\C(=O)O)\C)C Amb17506861 [0,0,0,0,0,1|2,0,1]=4 1987 B8R0.23 CN(C)CC(F)C(O)=O Amb25178248 [0,0,0,0,0,1|3,0,0]=4 1988 B8R0.23 CN(C)CC(N)C(N)=O Amb18984335 [0,0,0,0,0,1|3,0,0]=4 1989 B8R0.23 CN(C)CC(N)C(O)=O Amb22352274 [0,0,0,0,0,1|2,0,0]=3 1990 B8R0.23 CN(C)CC(N)C(O)=O Amb23558085 [0,0,0,0,0,1|2,0,0]=3 1991 B8R0.23 CN(C)C[C@@H](N)C(O)=O Amb19889770 [0,0,0,0,0,1|2,0,0]=3 1992 B8R0.23 CN(C)C[C@@H](N)C(O)=O Amb22800468 [0,0,0,0,0,1|2,0,0]=3 1993 B8R0.23 CN(C)C[C@H](N)C(O)=O Amb24078627 [0,0,0,0,0,1|2,0,0]=3 1994 B8R0.23 CN(C)C[C@H](O)C(O)=O Amb24372674 [0,0,0,0,0,1|3,0,0]=4 1995 B8R0.23 CS(=N)CC(N)C(O)=O Amb24374643 [0,0,0,0,0,1|2,0,0]=3 1996 B8R0.23 CS(=O)CC(N)C(O)=O Amb18125279 [0,0,0,0,0,1|1,0,1]=3 1997 B8R0.23 CS(=O)CC(O)C(O)=O Amb24692848 [0,0,0,0,0,1|2,0,1]=4 1998 B8R0.23 CS(=O)C[C@@H](C(=O)O)N Amb16232229 [0,0,0,0,0,1|1,0,1]=3 1999 B8R0.23 CS(=O)C[C@@H](N)C(O)=O Amb22745418 [0,0,0,0,0,1|1,0,1]=3 2000 B8R0.23 C[C@@H](C(=O)O)CC(C)C Amb10844070 [0,0,0,0,0,1|2,0,0]=3 2001 B8R0.23 C[C@@H](C(C)C)CC(=O)O Amb10844387 [0,0,0,0,0,1|2,0,0]=3 2002 B8R0.23 C[C@@H](CC(O)=O)C(Cl)Cl Amb24480304 [0,0,0,0,0,1|3,0,0]=4 2003 B8R0.23 C[C@@H](CC(O)=O)C(O)=O Amb22226742 [0,0,0,0,0,1|2,0,1]=4 2004 B8R0.23 C[C@@H](Cl)[C@H](C)OC(=O)Cl Amb25765785 [0,0,0,0,0,1|3,0,0]=4 2005 B8R0.23 C[C@@H](N)[C@@H](O)CC(O)=O Amb25188895 [0,0,0,0,0,1|2,0,0]=3 2006 B8R0.23 C[C@@H](N)[C@H](O)CP(O)=O Amb25236573 [0,0,0,0,0,1|3,0,0]=4 2007 B8R0.23 C[C@@H](NC(C)=O)[C@@H](C)Br Amb24366649 [0,0,0,0,0,1|3,0,0]=4 2008 B8R0.23 C[C@@H](O)CC(=O)C(O)=O Amb25239377 [0,0,0,0,0,1|1,0,1]=3 2009 B8R0.23 C[C@@H](O)CN(C)C(C)=O Amb24416218 [0,0,0,0,0,1|3,0,0]=4 2010 B8R0.23 C[C@@H](O)C[C@H](N)C(O)=O Amb25162814 [0,0,0,0,0,1|0,0,0]=1 2011 B8R0.23 C[C@@H](O)[C@@H](O)CC(O)=O Amb25267600 [0,0,0,0,0,1|1,0,0]=2 2012 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22168848 [0,0,0,0,0,1|0,0,0]=1 2013 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22756696 [0,0,0,0,0,1|0,0,0]=1 2014 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)Br Amb24480012 [0,0,0,0,0,1|3,0,0]=4 2015 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)Cl Amb25146769 [0,0,0,0,0,1|3,0,0]=4 2016 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)O Amb25333442 [0,0,0,0,0,1|2,0,0]=3 2017 B8R0.23 C[C@@H](OC(C)=O)[C@H](C)Br Amb24432955 [0,0,0,0,0,1|3,0,0]=4 2018 B8R0.23 C[C@@H](OC(C)=O)[C@H](C)Cl Amb24740430 [0,0,0,0,0,1|3,0,0]=4 2019 B8R0.23 C[C@@H](OC(F)F)C(O)=O Amb24389309 [0,0,0,0,0,1|3,0,0]=4 2020 B8R0.23 C[C@H](C(=O)O)CC(C)C Amb10844071 [0,0,0,0,0,1|2,0,0]=3 2021 B8R0.23 C[C@H](C(=O)O)CN(C)C Amb10844031 [0,0,0,0,0,1|3,0,0]=4 2022 B8R0.23 C[C@H](CC(C)=C)[C@@H](C)O Amb25113682 [0,0,0,0,0,1|3,0,0]=4 2023 B8R0.23 C[C@H](CC(O)=O)C(O)=O Amb22225399 [0,0,0,0,0,1|2,0,1]=4 2024 B8R0.23 C[C@H](Cl)C[C@H](N)C(O)=O Amb25849347 [0,0,0,0,0,1|1,0,0]=2 2025 B8R0.23 C[C@H](N)[C@@H](O)CC(O)=O Amb25727721 [0,0,0,0,0,1|2,0,0]=3 2026 B8R0.23 C[C@H](NC(C)=O)[C@@H](C)Br Amb25075106 [0,0,0,0,0,1|3,0,0]=4 2027 B8R0.23 C[C@H](NC(C)=O)[C@@H](C)O Amb25132762 [0,0,0,0,0,1|2,0,0]=3 2028 B8R0.23 C[C@H](NC(N)=O)[C@@H](C)Br Amb24480158 [0,0,0,0,0,1|3,0,0]=4 2029 B8R0.23 C[C@H](NC(N)=O)[C@@H](C)O Amb24562842 [0,0,0,0,0,1|2,0,0]=3 2030 B8R0.23 C[C@H](O)CC(=O)C(O)=O Amb25859340 [0,0,0,0,0,1|1,0,1]=3 2031 B8R0.23 C[C@H](O)CN(C)C(C)=O Amb24553313 [0,0,0,0,0,1|3,0,0]=4 2032 B8R0.23 C[C@H](O)C[C@@H](C)C(O)=O Amb25114249 [0,0,0,0,0,1|1,0,0]=2 2033 B8R0.23 C[C@H](O)C[C@H](N)C(O)=O Amb24461394 [0,0,0,0,0,1|0,0,0]=1 2034 B8R0.23 C[C@H](O)[C@@H](N)CN(C)C Amb25114644 [0,0,0,0,0,1|3,0,0]=4 2035 B8R0.23 C[C@H](O)[C@@H](O)C=C(C)C Amb24524489 [0,0,0,0,0,1|3,0,0]=4 2036 B8R0.23 C[C@H](O)[C@H](O)C=C(C)C Amb24421773 [0,0,0,0,0,1|3,0,0]=4 2037 B8R0.23 C[C@H](OC(C)=O)[C@@H](C)Br Amb24558149 [0,0,0,0,0,1|3,0,0]=4 2038 B8R0.23 C[C@H](OC(C)=O)[C@@H](C)O Amb24642757 [0,0,0,0,0,1|2,0,0]=3 2039 B8R0.23 C[S+](C)CC(N)C([O-])=O Amb25242630 [0,0,0,0,0,1|2,0,1]=4 2040 B8R0.23 C[S+](C)CC(O)C(O)=O Amb24373144 [0,0,0,0,0,1|3,0,0]=4 2041 B8R0.23 C\C(=C/C(C)C)\C(O)=O Amb18642616 [0,0,0,0,0,1|2,0,1]=4 2042 B8R0.23 C\C(=C/C(C)O)\C(O)=O Amb18642769 [0,0,0,0,0,1|1,0,1]=3 2043 B8R0.23 C\C(=C/C(O)=O)\C(C)F Amb25331272 [0,0,0,0,0,1|2,0,1]=4 2044 B8R0.23 C\C(=C/C(O)=O)\[C@@H](C)N Amb24477674 [0,0,0,0,0,1|2,0,1]=4 2045 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)N Amb24394205 [0,0,0,0,0,1|2,0,1]=4 2046 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)O Amb24340136 [0,0,0,0,0,1|1,0,1]=3 2047 B8R0.23 C\C(=C/[C@@H](C)N)\C(O)=O Amb24476675 [0,0,0,0,0,1|2,0,1]=4 2048 B8R0.23 C\C(=C\C(C)N)\C(O)=O Amb25731207 [0,0,0,0,0,1|2,0,1]=4 2049 B8R0.23 C\C(=C\C(C)O)\C(O)=O Amb24548753 [0,0,0,0,0,1|1,0,1]=3 2050 B8R0.23 C\C(\Cl)=C\C(Cl)C(O)=O Amb24710290 [0,0,0,0,0,1|2,0,1]=4 2051 B8R0.23 ClC(C(=O)O)CC(C)C Amb17593753 [0,0,0,0,0,1|2,0,0]=3 2052 B8R0.23 F[C@H](C(=O)O)CC(C)C Amb10841083 [0,0,0,0,0,1|2,0,0]=3 2053 B8R0.23 NC(=O)C(N)CC(O)=O Amb18124347 [0,0,0,0,0,1|1,0,2]=4 2054 B8R0.23 NC(=O)C[C@H](C(=O)O)N Amb10071271 [0,0,0,0,0,1|1,0,2]=4 2055 B8R0.23 NC(=O)C[C@H]([15NH2])C(O)=O Amb22338491 [0,0,0,0,0,1|1,0,2]=4 2056 B8R0.23 NC(=O)NC(N)C(O)=O Amb24418886 [0,0,0,0,0,1|1,0,2]=4 2057 B8R0.23 NC(=O)[C@@H](N)CC(O)=O Amb19334954 [0,0,0,0,0,1|1,0,2]=4 2058 B8R0.23 NC(=S)CC(N)C(O)=O Amb24728838 [0,0,0,0,0,1|1,1,1]=4 2059 B8R0.23 NC(C(=O)O)CC(F)F Amb13952714 [0,0,0,0,0,1|2,0,0]=3 2060 B8R0.23 NC(C(=O)O)CC(F)F Amb13952720 [0,0,0,0,0,1|2,0,0]=3 2061 B8R0.23 NC(C(C)C)CC(=O)O Amb2436060 [0,0,0,0,0,1|1,0,0]=2 2062 B8R0.23 NC(C=C(Cl)Cl)C(O)=O Amb22350718 [0,0,0,0,0,1|2,0,1]=4 2063 B8R0.23 NC(CC(F)Cl)C(O)=O Amb24339513 [0,0,0,0,0,1|2,0,0]=3 2064 B8R0.23 NC(CC(N)=O)C(Cl)Cl Amb25227960 [0,0,0,0,0,1|3,0,0]=4 2065 B8R0.23 NC(CC(O)=O)C(F)F Amb23570587 [0,0,0,0,0,1|2,0,0]=3 2066 B8R0.23 NC(CC(O)=O)C(O)=O Amb22730002 [0,0,0,0,0,1|1,0,1]=3 2067 B8R0.23 NC(CC(O)=O)C([O-])=O Amb20241398 [0,0,0,0,0,1|1,0,2]=4 2068 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22167994 [0,0,0,0,0,1|1,0,2]=4 2069 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22330537 [0,0,0,0,0,1|1,0,2]=4 2070 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22337568 [0,0,0,0,0,1|1,0,2]=4 2071 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22349433 [0,0,0,0,0,1|1,0,2]=4 2072 B8R0.23 NC(CC(O)=O)[13C](O)=O Amb22351321 [0,0,0,0,0,1|1,0,1]=3 2073 B8R0.23 NC(CC([O-])=O)C(O)=O Amb22731484 [0,0,0,0,0,1|1,0,2]=4 2074 B8R0.23 NC(CN(S)S)C(O)=O Amb24655070 [0,0,0,0,0,1|2,1,0]=4 2075 B8R0.23 NC(CS(=O)=O)C(O)=O Amb24480078 [0,0,0,0,0,1|2,0,1]=4 2076 B8R0.23 NC(CS(N)=O)C(O)=O Amb25139436 [0,0,0,0,0,1|2,0,1]=4 2077 B8R0.23 NC(CS(O)=O)C(O)=O Amb21913242 [0,0,0,0,0,1|2,0,0]=3 2078 B8R0.23 NC(C[13C](O)=O)C(O)=O Amb22362630 [0,0,0,0,0,1|1,0,1]=3 2079 B8R0.23 NC(C[13C](O)=O)[13C](O)=O Amb22353605 [0,0,0,0,0,1|1,0,1]=3 2080 B8R0.23 NC(C[N+]([O-])=O)C(O)=O Amb24642660 [0,0,0,0,0,1|2,0,1]=4 2081 B8R0.23 NC([13CH2]C(O)=O)C(O)=O Amb22336729 [0,0,0,0,0,1|1,0,1]=3 2082 B8R0.23 N[13C@@H](CC(O)=O)[13C](O)=O Amb22353606 [0,0,0,0,0,1|1,0,1]=3 2083 B8R0.23 N[13C](=O)[13CH2][13C@H](N)[13C](O)=O Amb22367522 [0,0,0,0,0,1|1,0,2]=4 2084 B8R0.23 N[C@@H](C(=O)N)CC(C)C Amb16183944 [0,0,0,0,0,1|2,0,0]=3 2085 B8R0.23 N[C@@H](C(C)C)CC(=O)O Amb16184024 [0,0,0,0,0,1|1,0,0]=2 2086 B8R0.23 N[C@@H](CB(O)O)C(O)=O Amb25844412 [0,0,0,0,0,1|2,0,0]=3 2087 B8R0.23 N[C@@H](CC(Cl)Cl)C(O)=O Amb24746791 [0,0,0,0,0,1|2,0,0]=3 2088 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb20241378 [0,0,0,0,0,1|1,0,2]=4 2089 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22337725 [0,0,0,0,0,1|1,0,2]=4 2090 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22352336 [0,0,0,0,0,1|1,0,2]=4 2091 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22748705 [0,0,0,0,0,1|1,0,2]=4 2092 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22801032 [0,0,0,0,0,1|1,0,2]=4 2093 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb20240565 [0,0,0,0,0,1|1,0,2]=4 2094 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb22748769 [0,0,0,0,0,1|1,0,2]=4 2095 B8R0.23 N[C@@H](C[13C](N)=O)C(O)=O Amb22353613 [0,0,0,0,0,1|1,0,2]=4 2096 B8R0.23 N[C@@H](C[N+]([O-])=O)C(O)=O Amb25710255 [0,0,0,0,0,1|2,0,1]=4 2097 B8R0.23 N[C@@H]([13CH2][13C](O)=O)C(O)=O Amb22367550 [0,0,0,0,0,1|1,0,1]=3 2098 B8R0.23 N[C@H](C(=O)N)CC(C)C Amb10670112 [0,0,0,0,0,1|2,0,0]=3 2099 B8R0.23 N[C@H](C(C)C)CC(=O)O Amb16184030 [0,0,0,0,0,1|1,0,0]=2 2100 B8R0.23 N[C@H](CC(F)F)C(O)=O Amb25117310 [0,0,0,0,0,1|2,0,0]=3 2101 B8R0.23 N[C@H](CC(N)=O)C(O)=O Amb17749060 [0,0,0,0,0,1|1,0,2]=4 2102 B8R0.23 N[C@H](CC(O)=O)P(O)=O Amb25838846 [0,0,0,0,0,1|2,0,0]=3 2103 B8R0.23 N[C@H](CN(S)S)C(O)=O Amb24564540 [0,0,0,0,0,1|2,1,0]=4 2104 B8R0.23 N[C@H](CS(O)=O)C(O)=O Amb24366002 [0,0,0,0,0,1|2,0,0]=3 2105 B8R0.23 OC(=O)C(Cl)CC(Cl)Cl Amb25350003 [0,0,0,0,0,1|3,0,0]=4 2106 B8R0.23 OC(=O)C(Cl)CS(O)=O Amb25708099 [0,0,0,0,0,1|3,0,0]=4 2107 B8R0.23 OC(=O)C(F)CC(O)=O Amb25077170 [0,0,0,0,0,1|2,0,1]=4 2108 B8R0.23 OC(=O)C(O)CC(O)=O Amb21935660 [0,0,0,0,0,1|2,0,1]=4 2109 B8R0.23 OC(=O)C(S)CC(O)=O Amb22729564 [0,0,0,0,0,1|2,0,1]=4 2110 B8R0.23 OC(=O)CC(C(=O)O)C Amb1935053 [0,0,0,0,0,1|2,0,1]=4 2111 B8R0.23 OC(=O)CC(O)C(O)=O Amb22734584 [0,0,0,0,0,1|2,0,1]=4 2112 B8R0.23 OC(=O)C[C@@H](C(=O)O)N Amb16232085 [0,0,0,0,0,1|1,0,1]=3 2113 B8R0.23 OC(=O)C[C@@H]([C@@H](O)C)N Amb16184021 [0,0,0,0,0,1|0,0,0]=1 2114 B8R0.23 OC(=O)[13CH](O)CC(O)=O Amb22367337 [0,0,0,0,0,1|2,0,1]=4 2115 B8R0.23 OC(=O)[C@@H](Cl)CC(Cl)Cl Amb25061364 [0,0,0,0,0,1|3,0,0]=4 2116 B8R0.23 OC(=O)[C@@H](Cl)CC(O)=O Amb20242425 [0,0,0,0,0,1|2,0,1]=4 2117 B8R0.23 OC(=O)[C@@H](S)CC(O)=O Amb22504526 [0,0,0,0,0,1|2,0,1]=4 2118 B8R0.23 OC(=O)[C@H](Br)CC(O)=O Amb22504149 [0,0,0,0,0,1|2,0,1]=4 2119 B8R0.23 OC(=O)[C@H](Cl)CC(O)=O Amb20242424 [0,0,0,0,0,1|2,0,1]=4 2120 B8R0.23 OC(=O)[C@H](S)CC(O)=O Amb25124090 [0,0,0,0,0,1|2,0,1]=4 2121 B8R0.23 OC(C(C)C)CC(=O)O Amb17231878 [0,0,0,0,0,1|2,0,0]=3 2122 B8R0.23 OC(CC(F)F)C(O)=O Amb25274709 [0,0,0,0,0,1|3,0,0]=4 2123 B8R0.23 OC(O)C[C@@H](O)C(O)=O Amb24524214 [0,0,0,0,0,1|2,0,0]=3 2124 B8R0.23 O[13C](=O)[13CH2][13CH]([13C](=O)O)O Amb17616665 [0,0,0,0,0,1|2,0,1]=4 2125 B8R0.23 O[C@H](C(=O)O)CC(C)C Amb16232074 [0,0,0,0,0,1|2,0,0]=3 2126 B8R0.23 O[C@H](CC(F)F)C(O)=O Amb24641140 [0,0,0,0,0,1|3,0,0]=4 2127 B8R0.23 [13CH3][13CH]([13CH3])[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337118 [0,0,0,0,0,1|1,0,0]=2 2128 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22337484 [0,0,0,0,0,1|1,0,2]=4 2129 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22351412 [0,0,0,0,0,1|1,0,2]=4 2130 B8R0.23 [15NH2]C(CC(O)=O)C(O)=O Amb22731529 [0,0,0,0,0,1|1,0,1]=3 2131 B8R0.23 [15NH2][13C@@H]([13CH2][13C](O)=O)[13C](O)=O Amb22353584 [0,0,0,0,0,1|1,0,1]=3 2132 B8R0.23 [15NH2][13CH](CC(O)=O)C(O)=O Amb22351286 [0,0,0,0,0,1|1,0,1]=3 2133 B8R0.23 [15NH2][13C](=O)[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337495 [0,0,0,0,0,1|1,0,2]=4 2134 B8R0.23 [15NH2][C@@H](CC(O)=O)[13C](O)=O Amb22367524 [0,0,0,0,0,1|1,0,1]=3 2135 B5R0.1 BC(=O)NCC Amb22343194 [2,0,0,0,0,0|2,0,0]=4 2136 B5R0.1 C=C(F)CCO Amb25747437 [2,0,0,0,0,0|2,0,0]=4 2137 B5R0.1 C=CCC(O)O Amb25144470 [2,0,0,0,0,0|2,0,0]=4 2138 B5R0.1 CC(=O)CC=O Amb17666764 [2,0,0,0,0,0|0,0,2]=4 2139 B5R0.1 CC(=O)CCBr Amb24078246 [2,0,0,0,0,0|2,0,0]=4 2140 B5R0.1 CC(=O)CCN Amb10067110 [2,0,0,0,0,0|2,0,0]=4 2141 B5R0.1 CC(=O)CCN Amb18632933 [2,0,0,0,0,0|2,0,0]=4 2142 B5R0.1 CC(Br)CC=O Amb25074611 [2,0,0,0,0,0|1,0,0]=3 2143 B5R0.1 CC(C)C[13CH]=O Amb22353955 [2,0,0,0,0,0|1,0,0]=3 2144 B5R0.1 CC(Cl)CC=O Amb18640602 [2,0,0,0,0,0|1,0,0]=3 2145 B5R0.1 CC(Cl)OC=O Amb25811235 [2,0,0,0,0,0|2,0,0]=4 2146 B5R0.1 CC(Cl)\C=C\O Amb22734803 [2,0,0,0,0,0|1,0,1]=4 2147 B5R0.1 CC(F)CCO Amb21951900 [2,0,0,0,0,0|1,0,1]=4 2148 B5R0.1 CC(N)CC=C Amb17673480 [2,0,0,0,0,0|2,0,0]=4 2149 B5R0.1 CC(N)CC=C Amb19515336 [2,0,0,0,0,0|2,0,0]=4 2150 B5R0.1 CC(N)CC=O Amb25292247 [2,0,0,0,0,0|1,0,0]=3 2151 B5R0.1 CC(O)C=C=O Amb25747435 [2,0,0,0,0,0|0,0,2]=4 2152 B5R0.1 CC(O)C=NO Amb24583649 [2,0,0,0,0,0|1,0,1]=4 2153 B5R0.1 CC(O)CCCl Amb24551052 [2,0,0,0,0,0|1,0,1]=4 2154 B5R0.1 CC(O)CCO Amb22227721 [2,0,0,0,0,0|0,0,1]=3 2155 B5R0.1 CC(O)CCO Amb22232248 [2,0,0,0,0,0|0,0,1]=3 2156 B5R0.1 CC(O)CCS Amb22359316 [2,0,0,0,0,0|0,1,1]=4 2157 B5R0.1 CC(O)CN=O Amb25746175 [2,0,0,0,0,0|1,0,0]=3 2158 B5R0.1 CC(O)CNO Amb24333693 [2,0,0,0,0,0|1,0,0]=3 2159 B5R0.1 CC(O)CON Amb21962618 [2,0,0,0,0,0|2,0,0]=4 2160 B5R0.1 CC(O)CON Amb22491794 [2,0,0,0,0,0|2,0,0]=4 2161 B5R0.1 CC(O)OC=C Amb25215838 [2,0,0,0,0,0|2,0,0]=4 2162 B5R0.1 CC(O)\C=C/Br Amb25809927 [2,0,0,0,0,0|1,0,1]=4 2163 B5R0.1 CC(O)\C=C/Cl Amb24635620 [2,0,0,0,0,0|1,0,1]=4 2164 B5R0.1 CC(O)\C=C/I Amb24373761 [2,0,0,0,0,0|1,0,1]=4 2165 B5R0.1 CC(O)\C=C\Br Amb24519445 [2,0,0,0,0,0|1,0,1]=4 2166 B5R0.1 CC(O)\C=C\Cl Amb25264104 [2,0,0,0,0,0|1,0,1]=4 2167 B5R0.1 CC(S)CC=O Amb18122380 [2,0,0,0,0,0|0,1,0]=3 2168 B5R0.1 CC(S)CCO Amb19148316 [2,0,0,0,0,0|0,1,1]=4 2169 B5R0.1 CC(S)NC=O Amb25835741 [2,0,0,0,0,0|1,1,0]=4 2170 B5R0.1 CCCB(O)O Amb2447105 [2,0,0,0,0,0|1,0,1]=4 2171 B5R0.1 CCCC(=C)Br Amb22583743 [2,0,0,0,0,0|2,0,0]=4 2172 B5R0.1 CCCC(=N)N Amb10610381 [2,0,0,0,0,0|2,0,0]=4 2173 B5R0.1 CCCC(=O)Br Amb22734023 [2,0,0,0,0,0|1,0,0]=3 2174 B5R0.1 CCCC(=S)Cl Amb24626931 [2,0,0,0,0,0|1,1,0]=4 2175 B5R0.1 CCCC(N)O Amb25147414 [2,0,0,0,0,0|1,0,1]=4 2176 B5R0.1 CCCC(O)=S Amb22229383 [2,0,0,0,0,0|0,1,0]=3 2177 B5R0.1 CCCC(O)Br Amb25106743 [2,0,0,0,0,0|1,0,1]=4 2178 B5R0.1 CCCC(O)Cl Amb22552567 [2,0,0,0,0,0|1,0,1]=4 2179 B5R0.1 CCCC([O-])=O Amb17772223 [2,0,0,0,0,0|0,0,1]=3 2180 B5R0.1 CCCC([O-])=O Amb22732283 [2,0,0,0,0,0|0,0,1]=3 2181 B5R0.1 CCCC([O-])=O Amb22732651 [2,0,0,0,0,0|0,0,1]=3 2182 B5R0.1 CCCN(C)O Amb25024622 [2,0,0,0,0,0|2,0,0]=4 2183 B5R0.1 CCCS(=O)Cl Amb25025566 [2,0,0,0,0,0|2,0,0]=4 2184 B5R0.1 CCCS(N)=O Amb24733579 [2,0,0,0,0,0|2,0,0]=4 2185 B5R0.1 CCCS(O)=O Amb24615072 [2,0,0,0,0,0|1,0,0]=3 2186 B5R0.1 CCCS([O-])=O Amb19929119 [2,0,0,0,0,0|1,0,1]=4 2187 B5R0.1 CCC[13C](O)=O Amb22337992 [2,0,0,0,0,0|0,0,0]=2 2188 B5R0.1 CCC[13C](O)=O Amb22338339 [2,0,0,0,0,0|0,0,0]=2 2189 B5R0.1 CCNC(=O)Br Amb24563760 [2,0,0,0,0,0|2,0,0]=4 2190 B5R0.1 CCNC(=O)Cl Amb25791793 [2,0,0,0,0,0|2,0,0]=4 2191 B5R0.1 CCNC(O)=S Amb24612743 [2,0,0,0,0,0|1,1,0]=4 2192 B5R0.1 CCOC([13CH3])=O Amb22363103 [2,0,0,0,0,0|2,0,0]=4 2193 B5R0.1 CCOP(O)=O Amb22360741 [2,0,0,0,0,0|2,0,0]=4 2194 B5R0.1 CCO[13C](C)=O Amb22363160 [2,0,0,0,0,0|2,0,0]=4 2195 B5R0.1 CCO[13C]([13CH3])=O Amb22351310 [2,0,0,0,0,0|2,0,0]=4 2196 B5R0.1 CCO[14C](N)=O Amb22732757 [2,0,0,0,0,0|2,0,0]=4 2197 B5R0.1 CCSC(N)=O Amb24394612 [2,0,0,0,0,0|2,0,0]=4 2198 B5R0.1 CC[13CH2]C(O)=O Amb22367520 [2,0,0,0,0,0|0,0,0]=2 2199 B5R0.1 CC[13CH2]C([O-])=O Amb22351787 [2,0,0,0,0,0|0,0,1]=3 2200 B5R0.1 CC[13CH2][13C](O)=O Amb22351790 [2,0,0,0,0,0|0,0,0]=2 2201 B5R0.1 CN(C)CC=O Amb22002191 [2,0,0,0,0,0|2,0,0]=4 2202 B5R0.1 CN(C)CC=O Amb22491245 [2,0,0,0,0,0|2,0,0]=4 2203 B5R0.1 CN(C)CC=O Amb22491584 [2,0,0,0,0,0|2,0,0]=4 2204 B5R0.1 CN(C)CC=O Amb22756473 [2,0,0,0,0,0|2,0,0]=4 2205 B5R0.1 CN(C)CC=O Amb23440511 [2,0,0,0,0,0|2,0,0]=4 2206 B5R0.1 CN(O)CCO Amb25234570 [2,0,0,0,0,0|1,0,1]=4 2207 B5R0.1 CNCC(=O)C Amb17621974 [2,0,0,0,0,0|2,0,0]=4 2208 B5R0.1 CNCC(=O)N Amb10610205 [2,0,0,0,0,0|2,0,0]=4 2209 B5R0.1 CNCC(C)=O Amb21959975 [2,0,0,0,0,0|2,0,0]=4 2210 B5R0.1 CNCC([O-])=O Amb20246714 [2,0,0,0,0,0|1,0,1]=4 2211 B5R0.1 CNCP(O)=O Amb24478116 [2,0,0,0,0,0|2,0,0]=4 2212 B5R0.1 COCC(=O)Br Amb25282928 [2,0,0,0,0,0|2,0,0]=4 2213 B5R0.1 COCC(=O)N Amb1153776 [2,0,0,0,0,0|2,0,0]=4 2214 B5R0.1 CS(=O)CC=O Amb25173706 [2,0,0,0,0,0|1,0,1]=4 2215 B5R0.1 CSCC(=O)Cl Amb24528357 [2,0,0,0,0,0|2,0,0]=4 2216 B5R0.1 CSCC(=O)O Amb1152425 [2,0,0,0,0,0|1,0,0]=3 2217 B5R0.1 CSCC(C)=O Amb20621731 [2,0,0,0,0,0|2,0,0]=4 2218 B5R0.1 CSCC(C)O Amb20622311 [2,0,0,0,0,0|2,0,0]=4 2219 B5R0.1 CSCC(N)=O Amb19515874 [2,0,0,0,0,0|2,0,0]=4 2220 B5R0.1 CSC[C@@H](C)O Amb24408899 [2,0,0,0,0,0|2,0,0]=4 2221 B5R0.1 CSC[C@H](C)O Amb24699036 [2,0,0,0,0,0|2,0,0]=4 2222 B5R0.1 C[13CH2]CC([O-])=O Amb22367521 [2,0,0,0,0,0|0,0,1]=3 2223 B5R0.1 C[C@@H](Cl)CC=C Amb25123337 [2,0,0,0,0,0|2,0,0]=4 2224 B5R0.1 C[C@@H](Cl)CCO Amb24478443 [2,0,0,0,0,0|1,0,1]=4 2225 B5R0.1 C[C@@H](N)CCO Amb19515999 [2,0,0,0,0,0|1,0,1]=4 2226 B5R0.1 C[C@@H](N)CCO Amb22746127 [2,0,0,0,0,0|1,0,1]=4 2227 B5R0.1 C[C@@H](O)C=C=O Amb25146481 [2,0,0,0,0,0|0,0,2]=4 2228 B5R0.1 C[C@@H](O)CC#N Amb22224888 [2,0,0,0,0,0|1,0,1]=4 2229 B5R0.1 C[C@@H](O)CC=C Amb22225370 [2,0,0,0,0,0|1,0,0]=3 2230 B5R0.1 C[C@@H](O)CC=O Amb24356009 [2,0,0,0,0,0|0,0,0]=2 2231 B5R0.1 C[C@@H](O)CCCl Amb24565032 [2,0,0,0,0,0|1,0,1]=4 2232 B5R0.1 C[C@@H](O)CCN Amb22736702 [2,0,0,0,0,0|1,0,1]=4 2233 B5R0.1 C[C@@H](O)\C=C\I Amb24334105 [2,0,0,0,0,0|1,0,1]=4 2234 B5R0.1 C[C@H](Cl)CC=C Amb24626620 [2,0,0,0,0,0|2,0,0]=4 2235 B5R0.1 C[C@H](N)CCO Amb19515998 [2,0,0,0,0,0|1,0,1]=4 2236 B5R0.1 C[C@H](N)CCO Amb24055217 [2,0,0,0,0,0|1,0,1]=4 2237 B5R0.1 C[C@H](O)CC#N Amb22736701 [2,0,0,0,0,0|1,0,1]=4 2238 B5R0.1 C[C@H](O)CC=C Amb22226758 [2,0,0,0,0,0|1,0,0]=3 2239 B5R0.1 C[C@H](O)CCI Amb24675161 [2,0,0,0,0,0|1,0,1]=4 2240 B5R0.1 C[C@H](O)CCN Amb22736705 [2,0,0,0,0,0|1,0,1]=4 2241 B5R0.1 C[C@H](O)CON Amb24557560 [2,0,0,0,0,0|2,0,0]=4 2242 B5R0.1 C\C=C\[C@H](C)O Amb25145549 [2,0,0,0,0,0|1,0,1]=4 2243 B5R0.1 N#CCC(O)=O Amb20247050 [2,0,0,0,0,0|1,0,1]=4 2244 B5R0.1 NC(=O)CCBr Amb21618712 [2,0,0,0,0,0|2,0,0]=4 2245 B5R0.1 NC(=O)CCCl Amb1127569 [2,0,0,0,0,0|2,0,0]=4 2246 B5R0.1 NC(=O)CNO Amb25199017 [2,0,0,0,0,0|2,0,0]=4 2247 B5R0.1 NC(=O)NCO Amb17674341 [2,0,0,0,0,0|2,0,0]=4 2248 B5R0.1 NC(=O)OCO Amb25662384 [2,0,0,0,0,0|2,0,0]=4 2249 B5R0.1 NCCC(=O)Cl Amb24117140 [2,0,0,0,0,0|2,0,0]=4 2250 B5R0.1 NCCC(=O)N Amb1137251 [2,0,0,0,0,0|2,0,0]=4 2251 B5R0.1 NCCC(=O)O Amb1935127 [2,0,0,0,0,0|1,0,0]=3 2252 B5R0.1 NCCP(O)=O Amb22168066 [2,0,0,0,0,0|2,0,0]=4 2253 B5R0.1 NOCC(=O)O Amb1154237 [2,0,0,0,0,0|2,0,0]=4 2254 B5R0.1 N[C@H](O)CCO Amb24421109 [2,0,0,0,0,0|1,0,1]=4 2255 B5R0.1 O=C(Br)CCBr Amb24624022 [2,0,0,0,0,0|2,0,0]=4 2256 B5R0.1 O=C(Br)CCCl Amb24474527 [2,0,0,0,0,0|2,0,0]=4 2257 B5R0.1 O=C(I)CCCl Amb25146462 [2,0,0,0,0,0|2,0,0]=4 2258 B5R0.1 O=CCC(Br)Br Amb25026607 [2,0,0,0,0,0|2,0,0]=4 2259 B5R0.1 OC(=O)CC=O Amb22169407 [2,0,0,0,0,0|0,0,2]=4 2260 B5R0.1 OC(=O)CCF Amb10603694 [2,0,0,0,0,0|1,0,0]=3 2261 B5R0.1 OC(=O)CI=O Amb25146428 [2,0,0,0,0,0|1,0,1]=4 2262 B5R0.1 OC(=O)CNBr Amb25053433 [2,0,0,0,0,0|2,0,0]=4 2263 B5R0.1 OC(=O)CNCl Amb24653229 [2,0,0,0,0,0|2,0,0]=4 2264 B5R0.1 OC(=O)CNI Amb25216175 [2,0,0,0,0,0|2,0,0]=4 2265 B5R0.1 OC(=O)CSCl Amb24597301 [2,0,0,0,0,0|2,0,0]=4 2266 B5R0.1 OC(=O)C[Hg]Cl Amb22347659 [2,0,0,0,0,0|2,0,0]=4 2267 B5R0.1 OC(O)CC=S Amb24478084 [2,0,0,0,0,0|1,1,0]=4 2268 B5R0.1 OCCS(=O)=O Amb24474283 [2,0,0,0,0,0|1,0,1]=4 2269 B5R0.1 OCOP(O)=O Amb24333194 [2,0,0,0,0,0|2,0,0]=4 2270 B5R0.1 OCOS(O)=O Amb25106091 [2,0,0,0,0,0|2,0,0]=4 2271 B5R0.1 ON=CC(O)=O Amb25046587 [2,0,0,0,0,0|1,0,1]=4 2272 B5R0.1 ONCC(O)=O Amb24120360 [2,0,0,0,0,0|1,0,0]=3 2273 B5R0.1 OP(=O)CC=O Amb25706451 [2,0,0,0,0,0|2,0,0]=4 2274 B5R0.1 OP(=O)CCBr Amb24634095 [2,0,0,0,0,0|2,0,0]=4 2275 B5R0.1 OP(=O)CCCl Amb24465178 [2,0,0,0,0,0|2,0,0]=4 2276 B5R0.1 O\N=C/C(=O)O Amb10601571 [2,0,0,0,0,0|1,0,1]=4 2277 B5R0.1 O\N=C\C(O)=O Amb20671938 [2,0,0,0,0,0|1,0,1]=4 2278 B5R0.1 [13CH3]CCC([O-])=O Amb22351845 [2,0,0,0,0,0|0,0,1]=3 2279 B5R0.1 [13CH3]C[13CH2]C([O-])=O Amb22351704 [2,0,0,0,0,0|0,0,1]=3 2280 B5R0.1 [13CH3][13CH2][13CH2][13C]([O-])=O Amb22353296 [2,0,0,0,0,0|0,0,1]=3 2281 B5R0.1 [15NH2]C[13CH2][13C](O)=O Amb22353834 [2,0,0,0,0,0|1,0,0]=3 2282 B5R0.1 [15NH2][13CH2][13CH2][13C](O)=O Amb22353457 [2,0,0,0,0,0|1,0,0]=3 2283 B5R0.1 [2H]C(=O)OCC Amb22336312 [2,0,0,0,0,0|2,0,0]=4 2284 B5R0.1 [C-]#[N+]CC(C)O Amb25810214 [2,0,0,0,0,0|2,0,0]=4 2285 B5R0.1 [O-]C(=O)CCBr Amb22229633 [2,0,0,0,0,0|1,0,1]=4 2286 B5R0.1 [O-]C(=O)CCCl Amb10604124 [2,0,0,0,0,0|1,0,1]=4 2287 B5R0.1 [O-]C(=O)CCCl Amb22051669 [2,0,0,0,0,0|1,0,1]=4 2288 B5R0.1 [O-]C(=O)CCO Amb22055495 [2,0,0,0,0,0|0,0,1]=3 2289 B5R0.3 BrCC(Br)C=O Amb17670591 [2,0,0,0,0,0|2,0,0]=4 2290 B5R0.3 C#C[C@@H](N)CO Amb24435241 [2,0,0,0,0,0|1,0,1]=4 2291 B5R0.3 C=CC(N)CO Amb19374935 [2,0,0,0,0,0|1,0,0]=3 2292 B5R0.3 C=CC(N)CS Amb18120558 [2,0,0,0,0,0|1,1,0]=4 2293 B5R0.3 C=C[C@@H](F)CO Amb24475877 [2,0,0,0,0,0|2,0,0]=4 2294 B5R0.3 C=C[C@@H](N)CN Amb24393077 [2,0,0,0,0,0|2,0,0]=4 2295 B5R0.3 C=C[C@@H](N)CO Amb19886656 [2,0,0,0,0,0|1,0,0]=3 2296 B5R0.3 C=C[C@@H](O)CO Amb22225315 [2,0,0,0,0,0|2,0,0]=4 2297 B5R0.3 C=C[C@H](F)CO Amb25043797 [2,0,0,0,0,0|2,0,0]=4 2298 B5R0.3 C=C[C@H](N)CN Amb25262259 [2,0,0,0,0,0|2,0,0]=4 2299 B5R0.3 C=C[C@H](N)CO Amb25147462 [2,0,0,0,0,0|1,0,0]=3 2300 B5R0.3 C=C[C@H](O)CO Amb19888350 [2,0,0,0,0,0|2,0,0]=4 2301 B5R0.3 CC(CBr)C=O Amb24478503 [2,0,0,0,0,0|2,0,0]=4 2302 B5R0.3 CC(CCl)C=O Amb24691518 [2,0,0,0,0,0|2,0,0]=4 2303 B5R0.3 CC(CF)C=O Amb24638421 [2,0,0,0,0,0|2,0,0]=4 2304 B5R0.3 CC(CO)C=C Amb22347861 [2,0,0,0,0,0|2,0,0]=4 2305 B5R0.3 CC(CO)C=O Amb25745800 [2,0,0,0,0,0|1,0,0]=3 2306 B5R0.3 CC(CS)C=O Amb25758635 [2,0,0,0,0,0|1,1,0]=4 2307 B5R0.3 CCC(=C)C=O Amb17940102 [2,0,0,0,0,0|1,0,1]=4 2308 B5R0.3 CCC(=O)C=O Amb22228532 [2,0,0,0,0,0|1,0,1]=4 2309 B5R0.3 CCC(Br)C=C Amb25703129 [2,0,0,0,0,0|2,0,0]=4 2310 B5R0.3 CCC(Br)C=O Amb18124003 [2,0,0,0,0,0|1,0,0]=3 2311 B5R0.3 CCC(C#N)N Amb10203825 [2,0,0,0,0,0|1,0,1]=4 2312 B5R0.3 CCC(C#N)N Amb1136995 [2,0,0,0,0,0|1,0,1]=4 2313 B5R0.3 CCC(CC)N Amb1154143 [2,0,0,0,0,0|1,0,1]=4 2314 B5R0.3 CCC(Cl)C=O Amb18122610 [2,0,0,0,0,0|1,0,0]=3 2315 B5R0.3 CCC(Cl)CO Amb22011826 [2,0,0,0,0,0|1,0,1]=4 2316 B5R0.3 CCC(F)C=O Amb24606916 [2,0,0,0,0,0|1,0,0]=3 2317 B5R0.3 CCC(I)C=O Amb25365077 [2,0,0,0,0,0|1,0,0]=3 2318 B5R0.3 CCC(I)CO Amb24444860 [2,0,0,0,0,0|1,0,1]=4 2319 B5R0.3 CCC(N)CN Amb19338113 [2,0,0,0,0,0|1,0,1]=4 2320 B5R0.3 CCC(N)CS Amb18122513 [2,0,0,0,0,0|0,1,1]=4 2321 B5R0.3 CCC(O)C=O Amb25347970 [2,0,0,0,0,0|1,0,0]=3 2322 B5R0.3 CCC(O)C=S Amb25115922 [2,0,0,0,0,0|1,1,0]=4 2323 B5R0.3 CCC(O)CO Amb22367049 [2,0,0,0,0,0|1,0,1]=4 2324 B5R0.3 CCC(S)C=O Amb18122377 [2,0,0,0,0,0|1,0,0]=3 2325 B5R0.3 CCN(C)C=O Amb20627285 [2,0,0,0,0,0|2,0,0]=4 2326 B5R0.3 CCN(N)C=O Amb24428031 [2,0,0,0,0,0|1,0,0]=3 2327 B5R0.3 CC[C@@H](C)CO Amb22799907 [2,0,0,0,0,0|1,0,1]=4 2328 B5R0.3 CC[C@@H](CO)C Amb10844611 [2,0,0,0,0,0|1,0,1]=4 2329 B5R0.3 CC[C@@H](Cl)C=O Amb24645873 [2,0,0,0,0,0|1,0,0]=3 2330 B5R0.3 CC[C@@H](N)C#C Amb24460811 [2,0,0,0,0,0|1,0,1]=4 2331 B5R0.3 CC[C@@H](N)C#N Amb25024729 [2,0,0,0,0,0|1,0,1]=4 2332 B5R0.3 CC[C@@H](N)CCl Amb24562851 [2,0,0,0,0,0|1,0,1]=4 2333 B5R0.3 CC[C@@H](N)CN Amb24120352 [2,0,0,0,0,0|1,0,1]=4 2334 B5R0.3 CC[C@@H](N)CS Amb24617754 [2,0,0,0,0,0|0,1,1]=4 2335 B5R0.3 CC[C@@H](O)C=C Amb24529645 [2,0,0,0,0,0|2,0,0]=4 2336 B5R0.3 CC[C@@H](O)CO Amb20241381 [2,0,0,0,0,0|1,0,1]=4 2337 B5R0.3 CC[C@H](Br)CO Amb25147674 [2,0,0,0,0,0|1,0,1]=4 2338 B5R0.3 CC[C@H](Cl)C=O Amb24478146 [2,0,0,0,0,0|1,0,0]=3 2339 B5R0.3 CC[C@H](N)C=C Amb24615622 [2,0,0,0,0,0|1,0,0]=3 2340 B5R0.3 CC[C@H](N)CCl Amb24461621 [2,0,0,0,0,0|1,0,1]=4 2341 B5R0.3 CC[C@H](O)C=O Amb24333959 [2,0,0,0,0,0|1,0,0]=3 2342 B5R0.3 CC[C@H](O)CO Amb20241380 [2,0,0,0,0,0|1,0,1]=4 2343 B5R0.3 CC\C(=N/O)\N Amb10609125 [2,0,0,0,0,0|1,0,1]=4 2344 B5R0.3 CC\C(=N\O)\N Amb1125701 [2,0,0,0,0,0|1,0,1]=4 2345 B5R0.3 CC\C(\N)=N\O Amb19883708 [2,0,0,0,0,0|1,0,1]=4 2346 B5R0.3 COC(N)CO Amb24615890 [2,0,0,0,0,0|1,0,1]=4 2347 B5R0.3 C[C@@H](CBr)C=O Amb25024867 [2,0,0,0,0,0|2,0,0]=4 2348 B5R0.3 C[C@@H](CO)C=C Amb25145603 [2,0,0,0,0,0|2,0,0]=4 2349 B5R0.3 C[C@@H](CO)C=O Amb24750144 [2,0,0,0,0,0|1,0,0]=3 2350 B5R0.3 NC(C=O)C=O Amb22751007 [2,0,0,0,0,0|0,0,2]=4 2351 B5R0.3 NC(CO)C#N Amb19372799 [2,0,0,0,0,0|1,0,1]=4 2352 B5R0.3 NC(CO)CCl Amb24680312 [2,0,0,0,0,0|1,0,1]=4 2353 B5R0.3 NC(CO)CF Amb20622637 [2,0,0,0,0,0|1,0,1]=4 2354 B5R0.3 NC(CO)CF Amb25734803 [2,0,0,0,0,0|1,0,1]=4 2355 B5R0.3 NC(CO)CO Amb22730767 [2,0,0,0,0,0|0,0,1]=3 2356 B5R0.3 NC(CO)CS Amb18640677 [2,0,0,0,0,0|0,1,1]=4 2357 B5R0.3 NCC(N)CO Amb24117147 [2,0,0,0,0,0|1,0,1]=4 2358 B5R0.3 NCC(O)C=O Amb24419762 [2,0,0,0,0,0|2,0,0]=4 2359 B5R0.3 NC[C@@H](N)CO Amb19374894 [2,0,0,0,0,0|1,0,1]=4 2360 B5R0.3 N[C@@H](CO)C#N Amb24417764 [2,0,0,0,0,0|1,0,1]=4 2361 B5R0.3 N[C@H](CO)CS Amb24560326 [2,0,0,0,0,0|0,1,1]=4 2362 B5R0.3 O=CC(Br)CCl Amb18647566 [2,0,0,0,0,0|2,0,0]=4 2363 B5R0.3 O=CC(Cl)CCl Amb18124314 [2,0,0,0,0,0|2,0,0]=4 2364 B5R0.3 OC(C=C)CO Amb17610151 [2,0,0,0,0,0|2,0,0]=4 2365 B5R0.3 OC(CF)C=O Amb25210931 [2,0,0,0,0,0|2,0,0]=4 2366 B5R0.3 OC(CI)C=O Amb25694739 [2,0,0,0,0,0|2,0,0]=4 2367 B5R0.3 OC(CO)C=O Amb21618959 [2,0,0,0,0,0|1,0,0]=3 2368 B5R0.3 OC(CO)CO Amb22052560 [2,0,0,0,0,0|1,0,1]=4 2369 B5R0.3 OC(CO)CO Amb22167864 [2,0,0,0,0,0|1,0,1]=4 2370 B5R0.3 OC(CO)CO Amb22349321 [2,0,0,0,0,0|1,0,1]=4 2371 B5R0.3 OC(CO)CO Amb22351872 [2,0,0,0,0,0|1,0,1]=4 2372 B5R0.3 OC(CO)CO Amb22353313 [2,0,0,0,0,0|1,0,1]=4 2373 B5R0.3 OC(CO)CO Amb22367100 [2,0,0,0,0,0|1,0,1]=4 2374 B5R0.3 OC(CO)CO Amb22730938 [2,0,0,0,0,0|1,0,1]=4 2375 B5R0.3 OC(CO)CO Amb22731173 [2,0,0,0,0,0|1,0,1]=4 2376 B5R0.3 OC([13CH2]O)[13CH2]O Amb22336314 [2,0,0,0,0,0|1,0,1]=4 2377 B5R0.3 OCC(=O)C=O Amb17593031 [2,0,0,0,0,0|1,0,1]=4 2378 B5R0.3 OCC(Br)C=O Amb18644196 [2,0,0,0,0,0|1,0,0]=3 2379 B5R0.3 OCC(Br)CO Amb22054566 [2,0,0,0,0,0|1,0,1]=4 2380 B5R0.3 OCC(C=O)Cl Amb17593122 [2,0,0,0,0,0|1,0,0]=3 2381 B5R0.3 OCC(CO)Cl Amb17611073 [2,0,0,0,0,0|1,0,1]=4 2382 B5R0.3 OCC(I)CO Amb25146352 [2,0,0,0,0,0|1,0,1]=4 2383 B5R0.3 OC[C@@H](O)C=O Amb20242417 [2,0,0,0,0,0|1,0,0]=3 2384 B5R0.3 O[13CH](CO)CO Amb22337993 [2,0,0,0,0,0|1,0,1]=4 2385 B5R0.3 O[13CH]([13CH2]O)[13CH2]O Amb22338082 [2,0,0,0,0,0|1,0,1]=4 2386 B5R0.3 O[14CH]([14CH2]O)[14CH2]O Amb22362924 [2,0,0,0,0,0|1,0,1]=4 2387 B5R0.3 O[C@@H](CBr)C=O Amb24626840 [2,0,0,0,0,0|2,0,0]=4 2388 B5R0.3 O[C@@H](CS)C=O Amb25709640 [2,0,0,0,0,0|1,1,0]=4 2389 B5R0.3 O[C@H](C=O)CO Amb16232009 [2,0,0,0,0,0|1,0,0]=3 2390 B5R0.3 O[C@H](CCl)C=O Amb25662443 [2,0,0,0,0,0|2,0,0]=4 2391 B5R0.5 CC(=C)C(O)=O Amb22230681 [2,0,0,0,0,0|1,0,1]=4 2392 B5R0.5 CC(=C)C(O)=O Amb22337777 [2,0,0,0,0,0|1,0,1]=4 2393 B5R0.5 CC(=C)C(O)=O Amb22351305 [2,0,0,0,0,0|1,0,1]=4 2394 B5R0.5 CC(=C)C(O)=O Amb22351871 [2,0,0,0,0,0|1,0,1]=4 2395 B5R0.5 CC(=C)C(O)=O Amb22351927 [2,0,0,0,0,0|1,0,1]=4 2396 B5R0.5 CC(=O)C(F)C Amb10841897 [2,0,0,0,0,0|2,0,0]=4 2397 B5R0.5 CC(=O)C(N)C Amb17593029 [2,0,0,0,0,0|1,0,0]=3 2398 B5R0.5 CC(=O)C(N)N Amb25810479 [2,0,0,0,0,0|2,0,0]=4 2399 B5R0.5 CC(=O)C(O)O Amb22436762 [2,0,0,0,0,0|2,0,0]=4 2400 B5R0.5 CC(=O)N(N)C Amb17593037 [2,0,0,0,0,0|2,0,0]=4 2401 B5R0.5 CC(Br)C(C)N Amb24474359 [2,0,0,0,0,0|1,0,1]=4 2402 B5R0.5 CC(Br)C(N)=O Amb22491874 [2,0,0,0,0,0|1,0,1]=4 2403 B5R0.5 CC(Br)[13C](O)=O Amb22351913 [2,0,0,0,0,0|1,0,0]=3 2404 B5R0.5 CC(C(=O)N)C Amb1153145 [2,0,0,0,0,0|1,0,1]=4 2405 B5R0.5 CC(C(=O)N)Cl Amb1151918 [2,0,0,0,0,0|1,0,1]=4 2406 B5R0.5 CC(C(=O)O)F Amb10605770 [2,0,0,0,0,0|1,0,0]=3 2407 B5R0.5 CC(C(N)C)Cl Amb17593116 [2,0,0,0,0,0|1,0,1]=4 2408 B5R0.5 CC(C(O)C)Br Amb17593818 [2,0,0,0,0,0|1,0,1]=4 2409 B5R0.5 CC(C)C(=O)Br Amb22731066 [2,0,0,0,0,0|2,0,0]=4 2410 B5R0.5 CC(C)C(=O)F Amb25848493 [2,0,0,0,0,0|2,0,0]=4 2411 B5R0.5 CC(C)C(O)O Amb25662421 [2,0,0,0,0,0|2,0,0]=4 2412 B5R0.5 CC(C)C([O-])=O Amb22045473 [2,0,0,0,0,0|1,0,1]=4 2413 B5R0.5 CC(C)C([O-])=O Amb22730398 [2,0,0,0,0,0|1,0,1]=4 2414 B5R0.5 CC(C)C([O-])=O Amb22734686 [2,0,0,0,0,0|1,0,1]=4 2415 B5R0.5 CC(C)S(N)=O Amb25675545 [2,0,0,0,0,0|2,0,0]=4 2416 B5R0.5 CC(Cl)C(=O)Br Amb24602442 [2,0,0,0,0,0|2,0,0]=4 2417 B5R0.5 CC(Cl)[C@H](C)O Amb24442994 [2,0,0,0,0,0|1,0,1]=4 2418 B5R0.5 CC(F)C(=O)Cl Amb24472500 [2,0,0,0,0,0|2,0,0]=4 2419 B5R0.5 CC(F)C(C)O Amb25278462 [2,0,0,0,0,0|1,0,1]=4 2420 B5R0.5 CC(F)[C@H](C)N Amb25810015 [2,0,0,0,0,0|1,0,1]=4 2421 B5R0.5 CC(I)C(=O)Cl Amb24559615 [2,0,0,0,0,0|2,0,0]=4 2422 B5R0.5 CC(I)C(N)=O Amb25684673 [2,0,0,0,0,0|1,0,1]=4 2423 B5R0.5 CC(N)B(O)O Amb25844423 [2,0,0,0,0,0|1,0,1]=4 2424 B5R0.5 CC(N)C(=O)Br Amb25184851 [2,0,0,0,0,0|1,0,0]=3 2425 B5R0.5 CC(N)C(C)=C Amb23536625 [2,0,0,0,0,0|2,0,0]=4 2426 B5R0.5 CC(N)C(C)=O Amb19148817 [2,0,0,0,0,0|1,0,0]=3 2427 B5R0.5 CC(N)C(C)N Amb22330596 [2,0,0,0,0,0|1,0,1]=4 2428 B5R0.5 CC(N)C(N)=N Amb25771576 [2,0,0,0,0,0|2,0,0]=4 2429 B5R0.5 CC(N)C(N)=O Amb21958673 [2,0,0,0,0,0|1,0,0]=3 2430 B5R0.5 CC(N)C(N)=S Amb19374914 [2,0,0,0,0,0|1,1,0]=4 2431 B5R0.5 CC(N)C(O)O Amb24369611 [2,0,0,0,0,0|0,0,2]=4 2432 B5R0.5 CC(N)P(O)=O Amb25147710 [2,0,0,0,0,0|1,0,0]=3 2433 B5R0.5 CC(N)S([O-])=O Amb25825173 [2,0,0,0,0,0|1,0,1]=4 2434 B5R0.5 CC(N)[13C](O)=O Amb22336671 [2,0,0,0,0,0|0,0,0]=2 2435 B5R0.5 CC(O)C(=C)F Amb25695653 [2,0,0,0,0,0|1,0,1]=4 2436 B5R0.5 CC(O)C(=C)I Amb24736518 [2,0,0,0,0,0|1,0,1]=4 2437 B5R0.5 CC(O)C(=O)Cl Amb25045690 [2,0,0,0,0,0|1,0,1]=4 2438 B5R0.5 CC(O)C(F)F Amb24428187 [2,0,0,0,0,0|2,0,0]=4 2439 B5R0.5 CC(O)C(N)=N Amb22587521 [2,0,0,0,0,0|1,0,1]=4 2440 B5R0.5 CC(O)C(N)=S Amb23449309 [2,0,0,0,0,0|0,1,1]=4 2441 B5R0.5 CC(O)C(O)=O Amb22350027 [2,0,0,0,0,0|1,0,0]=3 2442 B5R0.5 CC(O)C(O)Br Amb25274110 [2,0,0,0,0,0|1,0,0]=3 2443 B5R0.5 CC(O)C(O)Cl Amb25147284 [2,0,0,0,0,0|1,0,0]=3 2444 B5R0.5 CC(O)C(O)O Amb24531370 [2,0,0,0,0,0|1,0,0]=3 2445 B5R0.5 CC(O)C(S)Cl Amb24426141 [2,0,0,0,0,0|1,1,0]=4 2446 B5R0.5 CC(O)C([O-])=O Amb17942960 [2,0,0,0,0,0|1,0,1]=4 2447 B5R0.5 CC(O)C([O-])=O Amb17943079 [2,0,0,0,0,0|1,0,1]=4 2448 B5R0.5 CC(O)C([O-])=O Amb20246816 [2,0,0,0,0,0|1,0,1]=4 2449 B5R0.5 CC(O)C([O-])=O Amb21936112 [2,0,0,0,0,0|1,0,1]=4 2450 B5R0.5 CC(O)C([O-])=O Amb22002445 [2,0,0,0,0,0|1,0,1]=4 2451 B5R0.5 CC(O)C([O-])=O Amb22054134 [2,0,0,0,0,0|1,0,1]=4 2452 B5R0.5 CC(O)C([O-])=O Amb22055552 [2,0,0,0,0,0|1,0,1]=4 2453 B5R0.5 CC(O)C([O-])=O Amb22167842 [2,0,0,0,0,0|1,0,1]=4 2454 B5R0.5 CC(O)C([O-])=O Amb22350448 [2,0,0,0,0,0|1,0,1]=4 2455 B5R0.5 CC(O)C([O-])=O Amb22730128 [2,0,0,0,0,0|1,0,1]=4 2456 B5R0.5 CC(O)C([O-])=O Amb22730326 [2,0,0,0,0,0|1,0,1]=4 2457 B5R0.5 CC(O)C([O-])=O Amb22731947 [2,0,0,0,0,0|1,0,1]=4 2458 B5R0.5 CC(O)C([O-])=O Amb22732237 [2,0,0,0,0,0|1,0,1]=4 2459 B5R0.5 CC(O)C([O-])=O Amb22732420 [2,0,0,0,0,0|1,0,1]=4 2460 B5R0.5 CC(O)C([O-])=O Amb22732487 [2,0,0,0,0,0|1,0,1]=4 2461 B5R0.5 CC(O)C([O-])=O Amb22732889 [2,0,0,0,0,0|1,0,1]=4 2462 B5R0.5 CC(O)C([O-])=O Amb22733874 [2,0,0,0,0,0|1,0,1]=4 2463 B5R0.5 CC(O)C([O-])=O Amb22733995 [2,0,0,0,0,0|1,0,1]=4 2464 B5R0.5 CC(O)P(O)=O Amb24333635 [2,0,0,0,0,0|2,0,0]=4 2465 B5R0.5 CC(O)[14C]([O-])=O Amb22362798 [2,0,0,0,0,0|1,0,1]=4 2466 B5R0.5 CC(P)C(N)=O Amb24715877 [2,0,0,0,0,0|1,0,1]=4 2467 B5R0.5 CC([15NH2])C(O)=O Amb22353286 [2,0,0,0,0,0|0,0,0]=2 2468 B5R0.5 CC([C@@H](O)C)O Amb10068424 [2,0,0,0,0,0|1,0,0]=3 2469 B5R0.5 CC([C@H](O)C)O Amb10068423 [2,0,0,0,0,0|1,0,0]=3 2470 B5R0.5 CC([O-])C([O-])=O Amb22045882 [2,0,0,0,0,0|1,0,1]=4 2471 B5R0.5 CN(C)C(O)=O Amb22348477 [2,0,0,0,0,0|2,0,0]=4 2472 B5R0.5 CN(O)C(N)=O Amb22055740 [2,0,0,0,0,0|1,0,1]=4 2473 B5R0.5 C[13C@@H]([15NH2])C(O)=O Amb22363357 [2,0,0,0,0,0|0,0,0]=2 2474 B5R0.5 C[13CH](N)C(O)=O Amb22367246 [2,0,0,0,0,0|0,0,0]=2 2475 B5R0.5 C[C@@H](Cl)C(=O)F Amb25811184 [2,0,0,0,0,0|2,0,0]=4 2476 B5R0.5 C[C@@H](Cl)[C@@H](C)O Amb24478541 [2,0,0,0,0,0|1,0,1]=4 2477 B5R0.5 C[C@@H](Cl)[C@H](C)O Amb25295417 [2,0,0,0,0,0|1,0,1]=4 2478 B5R0.5 C[C@@H](F)C(O)=O Amb24376099 [2,0,0,0,0,0|1,0,0]=3 2479 B5R0.5 C[C@@H](F)[C@@H](C)O Amb25221029 [2,0,0,0,0,0|1,0,1]=4 2480 B5R0.5 C[C@@H](N)C(C)=O Amb22748924 [2,0,0,0,0,0|1,0,0]=3 2481 B5R0.5 C[C@@H](N)C(C)=O Amb22748925 [2,0,0,0,0,0|1,0,0]=3 2482 B5R0.5 C[C@@H](N)C(N)=O Amb22746786 [2,0,0,0,0,0|1,0,0]=3 2483 B5R0.5 C[C@@H](N)C(N)=S Amb24680806 [2,0,0,0,0,0|1,1,0]=4 2484 B5R0.5 C[C@@H](N)P(O)=O Amb24640370 [2,0,0,0,0,0|1,0,0]=3 2485 B5R0.5 C[C@@H](N)[C@@H](C)N Amb22800310 [2,0,0,0,0,0|1,0,1]=4 2486 B5R0.5 C[C@@H](O)C(C)=C Amb25834912 [2,0,0,0,0,0|1,0,1]=4 2487 B5R0.5 C[C@@H](O)C(C)=O Amb25120774 [2,0,0,0,0,0|1,0,1]=4 2488 B5R0.5 C[C@@H](O)C(Cl)Cl Amb24425559 [2,0,0,0,0,0|2,0,0]=4 2489 B5R0.5 C[C@@H](O)C(N)=N Amb22587056 [2,0,0,0,0,0|1,0,1]=4 2490 B5R0.5 C[C@@H](O)C(O)=O Amb22799466 [2,0,0,0,0,0|1,0,0]=3 2491 B5R0.5 C[C@@H](O)C([O-])=O Amb22350432 [2,0,0,0,0,0|1,0,1]=4 2492 B5R0.5 C[C@@H](O)C([O-])=O Amb22801669 [2,0,0,0,0,0|1,0,1]=4 2493 B5R0.5 C[C@@H](O)P(O)=O Amb25129822 [2,0,0,0,0,0|2,0,0]=4 2494 B5R0.5 C[C@@H](O)[C@H](C)N Amb25234072 [2,0,0,0,0,0|0,0,1]=3 2495 B5R0.5 C[C@@H](S)C(N)=O Amb25065854 [2,0,0,0,0,0|0,1,1]=4 2496 B5R0.5 C[C@@H](S)[C@H](C)O Amb22757247 [2,0,0,0,0,0|1,0,1]=4 2497 B5R0.5 C[C@@H]([15NH2])C(O)=O Amb22800337 [2,0,0,0,0,0|0,0,0]=2 2498 B5R0.5 C[C@H](Br)C(=O)Br Amb25780155 [2,0,0,0,0,0|2,0,0]=4 2499 B5R0.5 C[C@H](Br)C(=O)Cl Amb24449131 [2,0,0,0,0,0|2,0,0]=4 2500 B5R0.5 C[C@H](Br)[C@H](C)O Amb25772841 [2,0,0,0,0,0|1,0,1]=4 2501 B5R0.5 C[C@H](C(C)C)N Amb10844612 [2,0,0,0,0,0|1,0,1]=4 2502 B5R0.5 C[C@H](C(C)C)O Amb13952942 [2,0,0,0,0,0|1,0,1]=4 2503 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [2,0,0,0,0,0|2,0,0]=4 2504 B5R0.5 C[C@H](Cl)C(O)=O Amb17776586 [2,0,0,0,0,0|1,0,0]=3 2505 B5R0.5 C[C@H](Cl)[C@@H](C)O Amb24332606 [2,0,0,0,0,0|1,0,1]=4 2506 B5R0.5 C[C@H](Cl)[C@H](C)N Amb24409511 [2,0,0,0,0,0|1,0,1]=4 2507 B5R0.5 C[C@H](F)[C@@H](C)N Amb25062008 [2,0,0,0,0,0|1,0,1]=4 2508 B5R0.5 C[C@H](F)[C@H](C)N Amb25791579 [2,0,0,0,0,0|1,0,1]=4 2509 B5R0.5 C[C@H](I)C(O)=O Amb25724908 [2,0,0,0,0,0|1,0,0]=3 2510 B5R0.5 C[C@H](I)[C@H](C)O Amb24390416 [2,0,0,0,0,0|1,0,1]=4 2511 B5R0.5 C[C@H](N)C(=O)Cl Amb24333765 [2,0,0,0,0,0|1,0,0]=3 2512 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [2,0,0,0,0,0|1,0,0]=3 2513 B5R0.5 C[C@H](N)C(N)=S Amb24746259 [2,0,0,0,0,0|1,1,0]=4 2514 B5R0.5 C[C@H](N)P(O)=O Amb25101926 [2,0,0,0,0,0|1,0,0]=3 2515 B5R0.5 C[C@H](N)[C@@H](C)N Amb24460370 [2,0,0,0,0,0|1,0,1]=4 2516 B5R0.5 C[C@H](O)C(C)=C Amb25294556 [2,0,0,0,0,0|1,0,1]=4 2517 B5R0.5 C[C@H](O)C(C)=O Amb24625154 [2,0,0,0,0,0|1,0,1]=4 2518 B5R0.5 C[C@H](O)C(Cl)Cl Amb25765685 [2,0,0,0,0,0|2,0,0]=4 2519 B5R0.5 C[C@H](O)C(N)=N Amb22587541 [2,0,0,0,0,0|1,0,1]=4 2520 B5R0.5 C[C@H](O)C([O-])=O Amb17772234 [2,0,0,0,0,0|1,0,1]=4 2521 B5R0.5 C[C@H](O)C([O-])=O Amb22338062 [2,0,0,0,0,0|1,0,1]=4 2522 B5R0.5 C[C@H](O)C([O-])=O Amb22369005 [2,0,0,0,0,0|1,0,1]=4 2523 B5R0.5 C[C@H](O)[13C]([O-])=O Amb22353664 [2,0,0,0,0,0|1,0,1]=4 2524 B5R0.5 C[C@H](O)[C@@H](C)N Amb24683375 [2,0,0,0,0,0|0,0,1]=3 2525 B5R0.5 C[C@H](S)C(O)=O Amb25147510 [2,0,0,0,0,0|1,0,0]=3 2526 B5R0.5 C[C@H](S)[C@H](C)O Amb25145514 [2,0,0,0,0,0|1,0,1]=4 2527 B5R0.5 C[C@H]([15NH2])C(O)=O Amb22351686 [2,0,0,0,0,0|0,0,0]=2 2528 B5R0.5 FC(C(=O)O)F Amb1953492 [2,0,0,0,0,0|2,0,0]=4 2529 B5R0.5 IC(C(=O)O)I Amb17612865 [2,0,0,0,0,0|2,0,0]=4 2530 B5R0.5 NC(=N)C(=O)O Amb10549353 [2,0,0,0,0,0|1,0,1]=4 2531 B5R0.5 NC(=O)C(N)C Amb1156937 [2,0,0,0,0,0|1,0,0]=3 2532 B5R0.5 NC(=O)C(O)O Amb24680574 [2,0,0,0,0,0|1,0,1]=4 2533 B5R0.5 NC(=O)[C@@H](N)C Amb2371522 [2,0,0,0,0,0|1,0,0]=3 2534 B5R0.5 NC(=O)[C@H](N)C Amb2371905 [2,0,0,0,0,0|1,0,0]=3 2535 B5R0.5 NC(Br)C(O)=O Amb25724348 [2,0,0,0,0,0|1,0,0]=3 2536 B5R0.5 NC(O)C(Cl)Cl Amb25230609 [2,0,0,0,0,0|2,0,0]=4 2537 B5R0.5 NC(O)C(N)=O Amb24478450 [2,0,0,0,0,0|1,0,0]=3 2538 B5R0.5 NC(O)C(N)O Amb24680994 [2,0,0,0,0,0|1,0,0]=3 2539 B5R0.5 NC(O)C(O)=O Amb24663706 [2,0,0,0,0,0|0,0,0]=2 2540 B5R0.5 N[C@@H](O)C(N)=O Amb25338621 [2,0,0,0,0,0|1,0,0]=3 2541 B5R0.5 N[C@H](S)C(O)=O Amb25289119 [2,0,0,0,0,0|0,1,0]=3 2542 B5R0.5 OC(=O)C(=O)O Amb10608980 [2,0,0,0,0,0|1,0,1]=4 2543 B5R0.5 OC(=O)C(=O)O Amb19134307 [2,0,0,0,0,0|1,0,1]=4 2544 B5R0.5 OC(=O)C(Br)F Amb10841090 [2,0,0,0,0,0|2,0,0]=4 2545 B5R0.5 OC(=O)C(Cl)Br Amb22002468 [2,0,0,0,0,0|2,0,0]=4 2546 B5R0.5 OC(=O)C(Cl)Cl Amb22338543 [2,0,0,0,0,0|2,0,0]=4 2547 B5R0.5 OC(=O)C(Cl)F Amb10838714 [2,0,0,0,0,0|2,0,0]=4 2548 B5R0.5 OC(=O)C(F)S Amb25272480 [2,0,0,0,0,0|1,1,0]=4 2549 B5R0.5 OC(=O)C(I)Br Amb17610018 [2,0,0,0,0,0|2,0,0]=4 2550 B5R0.5 OC(=O)C(I)Cl Amb17610937 [2,0,0,0,0,0|2,0,0]=4 2551 B5R0.5 OC(=O)C(I)F Amb10838458 [2,0,0,0,0,0|2,0,0]=4 2552 B5R0.5 OC(=O)C(O)=O Amb19374136 [2,0,0,0,0,0|1,0,1]=4 2553 B5R0.5 OC(=O)C(O)=O Amb22002537 [2,0,0,0,0,0|1,0,1]=4 2554 B5R0.5 OC(=O)C(O)=O Amb22231343 [2,0,0,0,0,0|1,0,1]=4 2555 B5R0.5 OC(=O)C(O)=O Amb22352057 [2,0,0,0,0,0|1,0,1]=4 2556 B5R0.5 OC(=O)C(O)=O Amb22353291 [2,0,0,0,0,0|1,0,1]=4 2557 B5R0.5 OC(=O)C(O)=O Amb22360650 [2,0,0,0,0,0|1,0,1]=4 2558 B5R0.5 OC(=O)C(O)=O Amb22360667 [2,0,0,0,0,0|1,0,1]=4 2559 B5R0.5 OC(=O)C(O)=O Amb22363275 [2,0,0,0,0,0|1,0,1]=4 2560 B5R0.5 OC(=O)C(O)=O Amb22363302 [2,0,0,0,0,0|1,0,1]=4 2561 B5R0.5 OC(=O)C(O)=O Amb22394874 [2,0,0,0,0,0|1,0,1]=4 2562 B5R0.5 OC(=O)C(O)=O Amb22436461 [2,0,0,0,0,0|1,0,1]=4 2563 B5R0.5 OC(=O)C(O)=O Amb22731645 [2,0,0,0,0,0|1,0,1]=4 2564 B5R0.5 OC(=O)C(O)=O Amb22731888 [2,0,0,0,0,0|1,0,1]=4 2565 B5R0.5 OC(=O)C(O)=O Amb22897045 [2,0,0,0,0,0|1,0,1]=4 2566 B5R0.5 OC(=O)C(O)=O Amb23412252 [2,0,0,0,0,0|1,0,1]=4 2567 B5R0.5 OC(=O)[13CH](Cl)Cl Amb22336527 [2,0,0,0,0,0|2,0,0]=4 2568 B5R0.5 OC(=O)[C@@H](F)Br Amb25147695 [2,0,0,0,0,0|2,0,0]=4 2569 B5R0.5 OC(=O)[C@H](Cl)Br Amb25857711 [2,0,0,0,0,0|2,0,0]=4 2570 B5R0.5 OC(=O)[C@H](F)I Amb24561039 [2,0,0,0,0,0|2,0,0]=4 2571 B5R0.5 OC(Cl)C(=O)Cl Amb24470096 [2,0,0,0,0,0|2,0,0]=4 2572 B5R0.5 OC(O)C(O)O Amb25741488 [2,0,0,0,0,0|2,0,0]=4 2573 B5R0.5 OC(S)C(O)S Amb25792447 [2,0,0,0,0,0|2,0,0]=4 2574 B5R0.5 O[13C](=O)C(Br)Br Amb22367565 [2,0,0,0,0,0|2,0,0]=4 2575 B5R0.5 O[13C](=O)C(Cl)Br Amb22367326 [2,0,0,0,0,0|2,0,0]=4 2576 B5R0.5 O[13C](=O)[13C](O)=O Amb22369747 [2,0,0,0,0,0|1,0,1]=4 2577 B5R0.5 O[14C](=O)[14C](O)=O Amb22349945 [2,0,0,0,0,0|1,0,1]=4 2578 B5R0.5 O[C@H](S)[C@H](O)S Amb25792469 [2,0,0,0,0,0|2,0,0]=4 2579 B5R0.5 [12CH3][12C@H](N)[12C](O)=O Amb22367004 [2,0,0,0,0,0|0,0,0]=2 2580 B5R0.5 [13CH3]C(N)C(O)=O Amb22351250 [2,0,0,0,0,0|0,0,0]=2 2581 B5R0.5 [13CH3][13CH](N)C(O)=O Amb22338584 [2,0,0,0,0,0|0,0,0]=2 2582 B5R0.5 [13CH3][13CH](N)[13C](O)=O Amb22353501 [2,0,0,0,0,0|0,0,0]=2 2583 B5R0.5 [13CH3][C@@H](O)C([O-])=O Amb22350379 [2,0,0,0,0,0|1,0,1]=4 2584 B7R0.2 C#CC(N)CC(O)=O Amb24529562 [1,1,0,0,0,0|1,0,1]=4 2585 B7R0.2 C#CC(O)CC(O)=O Amb25737576 [1,1,0,0,0,0|0,0,1]=3 2586 B7R0.2 C=C(Br)C[C@H](O)CO Amb25369386 [1,1,0,0,0,0|2,0,0]=4 2587 B7R0.2 C=C(Cl)CC(O)CO Amb24482396 [1,1,0,0,0,0|2,0,0]=4 2588 B7R0.2 C=C(Cl)C[C@H](O)CO Amb24560451 [1,1,0,0,0,0|2,0,0]=4 2589 B7R0.2 C=CC(Br)CC(O)=O Amb18125534 [1,1,0,0,0,0|1,0,1]=4 2590 B7R0.2 C=CC(Cl)CC(O)=O Amb18124408 [1,1,0,0,0,0|1,0,1]=4 2591 B7R0.2 C=CC(F)CC(O)=O Amb25359137 [1,1,0,0,0,0|1,0,1]=4 2592 B7R0.2 C=CC(N)CC(O)=O Amb22641963 [1,1,0,0,0,0|1,0,1]=4 2593 B7R0.2 C=CC(O)CC(N)=O Amb25799663 [1,1,0,0,0,0|1,0,1]=4 2594 B7R0.2 C=CC(O)CC(O)=O Amb18641866 [1,1,0,0,0,0|0,0,1]=3 2595 B7R0.2 C=C[C@@H](O)CC(O)=O Amb25314661 [1,1,0,0,0,0|0,0,1]=3 2596 B7R0.2 C=C[C@H](O)CC(O)=O Amb25844309 [1,1,0,0,0,0|0,0,1]=3 2597 B7R0.2 CC(=C)CC(O)CCl Amb25322238 [1,1,0,0,0,0|2,0,0]=4 2598 B7R0.2 CC(=C)C[C@H](O)CO Amb25235652 [1,1,0,0,0,0|2,0,0]=4 2599 B7R0.2 CC(=CC(O)=O)OC Amb24699194 [1,1,0,0,0,0|0,0,2]=4 2600 B7R0.2 CC(=O)CC(=O)NO Amb24096625 [1,1,0,0,0,0|0,0,2]=4 2601 B7R0.2 CC(=O)CC(Cl)CCl Amb25335495 [1,1,0,0,0,0|2,0,0]=4 2602 B7R0.2 CC(=O)CC(O)C#C Amb24690832 [1,1,0,0,0,0|1,0,1]=4 2603 B7R0.2 CC(=O)CC(O)C=C Amb25103770 [1,1,0,0,0,0|1,0,1]=4 2604 B7R0.2 CC(=O)CC(O)C=O Amb24481554 [1,1,0,0,0,0|1,0,1]=4 2605 B7R0.2 CC(=O)CC(O)CO Amb25304727 [1,1,0,0,0,0|1,0,0]=3 2606 B7R0.2 CC(=O)C[C@@H](O)CO Amb24640954 [1,1,0,0,0,0|1,0,0]=3 2607 B7R0.2 CC(=O)C[C@H](O)C=C Amb25051451 [1,1,0,0,0,0|1,0,1]=4 2608 B7R0.2 CC(=O)C[C@H](O)CCl Amb25810138 [1,1,0,0,0,0|1,0,0]=3 2609 B7R0.2 CC(Br)CC(=O)CCl Amb24621526 [1,1,0,0,0,0|2,0,0]=4 2610 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [1,1,0,0,0,0|1,0,0]=3 2611 B7R0.2 CC(C)CC(=C)C=O Amb24481535 [1,1,0,0,0,0|2,0,0]=4 2612 B7R0.2 CC(C)CC(=O)C=O Amb25189904 [1,1,0,0,0,0|1,0,1]=4 2613 B7R0.2 CC(C)CC(=O)CBr Amb22396854 [1,1,0,0,0,0|2,0,0]=4 2614 B7R0.2 CC(C)CC(=O)CCl Amb20622841 [1,1,0,0,0,0|2,0,0]=4 2615 B7R0.2 CC(C)CC(=O)CF Amb23454719 [1,1,0,0,0,0|2,0,0]=4 2616 B7R0.2 CC(C)CC(=O)CN Amb18641847 [1,1,0,0,0,0|2,0,0]=4 2617 B7R0.2 CC(C)CC(=O)CO Amb18559774 [1,1,0,0,0,0|1,0,0]=3 2618 B7R0.2 CC(C)C[C@@H](O)C=O Amb25104909 [1,1,0,0,0,0|1,0,1]=4 2619 B7R0.2 CC(C)C\C(\C)=N\O Amb22729223 [1,1,0,0,0,0|2,0,0]=4 2620 B7R0.2 CC(CBr)CC(C)=O Amb24365894 [1,1,0,0,0,0|2,0,0]=4 2621 B7R0.2 CC(CC(=O)Cl)C=C Amb25278347 [1,1,0,0,0,0|2,0,0]=4 2622 B7R0.2 CC(CC(C)=O)C#C Amb24738456 [1,1,0,0,0,0|2,0,0]=4 2623 B7R0.2 CC(CC(C)=O)C#N Amb18124227 [1,1,0,0,0,0|2,0,0]=4 2624 B7R0.2 CC(CC(C)=O)C=O Amb18641789 [1,1,0,0,0,0|1,0,1]=4 2625 B7R0.2 CC(CC(C)O)OC Amb22757067 [1,1,0,0,0,0|1,0,1]=4 2626 B7R0.2 CC(CC(N)=O)CN Amb18641899 [1,1,0,0,0,0|2,0,0]=4 2627 B7R0.2 CC(CC(O)=O)=C=C Amb25265849 [1,1,0,0,0,0|1,0,1]=4 2628 B7R0.2 CC(CC(O)=O)=CCl Amb25802122 [1,1,0,0,0,0|1,0,1]=4 2629 B7R0.2 CC(CC(O)=O)C=C Amb18641774 [1,1,0,0,0,0|1,0,0]=3 2630 B7R0.2 CC(CC(O)=O)C=O Amb25836603 [1,1,0,0,0,0|0,0,1]=3 2631 B7R0.2 CC(CC(O)=O)CO Amb18198168 [1,1,0,0,0,0|0,0,0]=2 2632 B7R0.2 CC(CC(O)=O)SCl Amb24483173 [1,1,0,0,0,0|0,1,0]=3 2633 B7R0.2 CC(CC)CC(=O)Cl Amb10844649 [1,1,0,0,0,0|2,0,0]=4 2634 B7R0.2 CC(CN)CC(C)=O Amb18251072 [1,1,0,0,0,0|2,0,0]=4 2635 B7R0.2 CC(CN)CC(O)=O Amb18124263 [1,1,0,0,0,0|1,0,0]=3 2636 B7R0.2 CC(CN)CC(O)=O Amb20669501 [1,1,0,0,0,0|1,0,0]=3 2637 B7R0.2 CC(CN)CP(O)=O Amb25757942 [1,1,0,0,0,0|2,0,0]=4 2638 B7R0.2 CC(CO)=CC(O)=O Amb24689918 [1,1,0,0,0,0|0,0,2]=4 2639 B7R0.2 CC(CO)CC(C)=O Amb24606485 [1,1,0,0,0,0|1,0,0]=3 2640 B7R0.2 CC(CO)CC(N)=N Amb24579212 [1,1,0,0,0,0|2,0,0]=4 2641 B7R0.2 CC(CO)CC(N)=O Amb24452895 [1,1,0,0,0,0|1,0,0]=3 2642 B7R0.2 CC(CO)OC(C)=O Amb25144303 [1,1,0,0,0,0|2,0,0]=4 2643 B7R0.2 CC(CO)OP(O)=O Amb24643413 [1,1,0,0,0,0|2,0,0]=4 2644 B7R0.2 CC(NC)CC(=O)N Amb17231826 [1,1,0,0,0,0|2,0,0]=4 2645 B7R0.2 CC(O)CC(=C)C#N Amb18641647 [1,1,0,0,0,0|2,0,0]=4 2646 B7R0.2 CC(O)CC(=C)C=C Amb25369642 [1,1,0,0,0,0|2,0,0]=4 2647 B7R0.2 CC(O)CC(=O)C=O Amb24666713 [1,1,0,0,0,0|0,0,1]=3 2648 B7R0.2 CC(O)CC(=O)CO Amb25116562 [1,1,0,0,0,0|0,0,0]=2 2649 B7R0.2 CC(O)CC(=O)N[O-] Amb25345095 [1,1,0,0,0,0|0,0,1]=3 2650 B7R0.2 CC(O)CC(C)=NO Amb24475817 [1,1,0,0,0,0|1,0,0]=3 2651 B7R0.2 CC(O)CC(C)CO Amb25262806 [1,1,0,0,0,0|1,0,1]=4 2652 B7R0.2 CC(O)CC(N)CO Amb25828018 [1,1,0,0,0,0|1,0,1]=4 2653 B7R0.2 CC(O)CC(O)C=C Amb24397089 [1,1,0,0,0,0|1,0,1]=4 2654 B7R0.2 CC(O)CC(O)CCl Amb24663123 [1,1,0,0,0,0|1,0,1]=4 2655 B7R0.2 CC(O)C\C(\C)=C\Br Amb24415427 [1,1,0,0,0,0|2,0,0]=4 2656 B7R0.2 CC(O)NC(=O)C=C Amb25076501 [1,1,0,0,0,0|2,0,0]=4 2657 B7R0.2 CC(O)OC(=O)C=C Amb25266385 [1,1,0,0,0,0|2,0,0]=4 2658 B7R0.2 CC(O)OC(=O)CS Amb24698028 [1,1,0,0,0,0|1,1,0]=4 2659 B7R0.2 CCC(=C)CC(O)=O Amb18641782 [1,1,0,0,0,0|1,0,1]=4 2660 B7R0.2 CCC(=O)CC(C)Br Amb24483088 [1,1,0,0,0,0|2,0,0]=4 2661 B7R0.2 CCC(=O)CC(C)C Amb17138363 [1,1,0,0,0,0|2,0,0]=4 2662 B7R0.2 CCC(=O)CC(C)Cl Amb25275986 [1,1,0,0,0,0|2,0,0]=4 2663 B7R0.2 CCC(=O)CC(C)N Amb24679340 [1,1,0,0,0,0|2,0,0]=4 2664 B7R0.2 CCC(=O)CC(C)O Amb25113617 [1,1,0,0,0,0|1,0,0]=3 2665 B7R0.2 CCC(=O)CC(C)S Amb24647716 [1,1,0,0,0,0|1,1,0]=4 2666 B7R0.2 CCC(=O)CC(O)=O Amb18641869 [1,1,0,0,0,0|0,0,2]=4 2667 B7R0.2 CCC(=O)C[C@H](C)O Amb25746635 [1,1,0,0,0,0|1,0,0]=3 2668 B7R0.2 CCC(=O)OC(C)O Amb25234635 [1,1,0,0,0,0|2,0,0]=4 2669 B7R0.2 CCC(Br)CC(O)=O Amb24370499 [1,1,0,0,0,0|1,0,0]=3 2670 B7R0.2 CCC(C)CC(N)=O Amb25230669 [1,1,0,0,0,0|2,0,0]=4 2671 B7R0.2 CCC(CC(=O)C)C Amb10608208 [1,1,0,0,0,0|2,0,0]=4 2672 B7R0.2 CCC(CC(=O)O)N Amb1993862 [1,1,0,0,0,0|1,0,0]=3 2673 B7R0.2 CCC(CC(=O)O)O Amb10844270 [1,1,0,0,0,0|0,0,0]=2 2674 B7R0.2 CCC(Cl)CC(=O)Cl Amb24390220 [1,1,0,0,0,0|2,0,0]=4 2675 B7R0.2 CCC(N)CC(C)=O Amb18631696 [1,1,0,0,0,0|2,0,0]=4 2676 B7R0.2 CCC(N)CC(N)=O Amb25727686 [1,1,0,0,0,0|2,0,0]=4 2677 B7R0.2 CCC(O)=CC(C)O Amb24705890 [1,1,0,0,0,0|1,0,1]=4 2678 B7R0.2 CCC(O)CC(C)=C Amb24062975 [1,1,0,0,0,0|2,0,0]=4 2679 B7R0.2 CCC(O)CC(C)=O Amb25065181 [1,1,0,0,0,0|1,0,0]=3 2680 B7R0.2 CCC(O)CC(N)=O Amb24616660 [1,1,0,0,0,0|1,0,0]=3 2681 B7R0.2 CCC(O)CC(O)=O Amb22363067 [1,1,0,0,0,0|0,0,0]=2 2682 B7R0.2 CCC(O)C[N+]([O-])=O Amb25136685 [1,1,0,0,0,0|1,0,1]=4 2683 B7R0.2 CCC(S)CC(O)=O Amb18303084 [1,1,0,0,0,0|0,1,0]=3 2684 B7R0.2 CCN(N)CC(O)=O Amb25738005 [1,1,0,0,0,0|2,0,0]=4 2685 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [1,1,0,0,0,0|1,0,1]=4 2686 B7R0.2 CCS(=O)CC(C)O Amb25687853 [1,1,0,0,0,0|2,0,0]=4 2687 B7R0.2 CC[C@@H](Br)CC(O)=O Amb24467852 [1,1,0,0,0,0|1,0,0]=3 2688 B7R0.2 CC[C@@H](C)CC(=O)Cl Amb23425123 [1,1,0,0,0,0|2,0,0]=4 2689 B7R0.2 CC[C@@H](C)CC(N)=O Amb25310922 [1,1,0,0,0,0|2,0,0]=4 2690 B7R0.2 CC[C@@H](N)CC(O)=O Amb22225305 [1,1,0,0,0,0|1,0,0]=3 2691 B7R0.2 CC[C@@H](O)CC(C)=C Amb25136335 [1,1,0,0,0,0|2,0,0]=4 2692 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [1,1,0,0,0,0|1,0,0]=3 2693 B7R0.2 CC[C@@H](S)CC(O)=O Amb24481337 [1,1,0,0,0,0|0,1,0]=3 2694 B7R0.2 CC[C@H](C)CC(C)=O Amb24614519 [1,1,0,0,0,0|2,0,0]=4 2695 B7R0.2 CC[C@H](N)CC(O)=O Amb22226650 [1,1,0,0,0,0|1,0,0]=3 2696 B7R0.2 CC[C@H](O)C[N+]([O-])=O Amb25854053 [1,1,0,0,0,0|1,0,1]=4 2697 B7R0.2 CC[S+](C)CC(O)=O Amb24710040 [1,1,0,0,0,0|2,0,0]=4 2698 B7R0.2 CN(C)CC(=O)NO Amb25369208 [1,1,0,0,0,0|2,0,0]=4 2699 B7R0.2 CN(CC(O)=O)C#N Amb25195711 [1,1,0,0,0,0|2,0,0]=4 2700 B7R0.2 CN(CC(O)=O)C=O Amb18951578 [1,1,0,0,0,0|1,0,1]=4 2701 B7R0.2 CNC(=O)CC(C)Br Amb25724971 [1,1,0,0,0,0|2,0,0]=4 2702 B7R0.2 CNC(=O)CC(C)N Amb18949898 [1,1,0,0,0,0|2,0,0]=4 2703 B7R0.2 CNC(=O)CC(C)N Amb21959391 [1,1,0,0,0,0|2,0,0]=4 2704 B7R0.2 CNC(=O)CC(C)O Amb24525315 [1,1,0,0,0,0|1,0,0]=3 2705 B7R0.2 CNC(=O)C[C@@H](C)N Amb24428006 [1,1,0,0,0,0|2,0,0]=4 2706 B7R0.2 CNC(C)CC(N)=O Amb19960012 [1,1,0,0,0,0|2,0,0]=4 2707 B7R0.2 CNC(C)CC(O)=O Amb21959674 [1,1,0,0,0,0|1,0,0]=3 2708 B7R0.2 CN[C@@H](C)CC(O)=O Amb25255193 [1,1,0,0,0,0|1,0,0]=3 2709 B7R0.2 CN[C@H](C)CC(O)=O Amb25339129 [1,1,0,0,0,0|1,0,0]=3 2710 B7R0.2 COC(=O)CC(=O)O Amb16232032 [1,1,0,0,0,0|0,0,2]=4 2711 B7R0.2 COC(=O)CC(Br)C Amb10603675 [1,1,0,0,0,0|1,0,0]=3 2712 B7R0.2 COC(=O)CC(C)S Amb19515267 [1,1,0,0,0,0|0,1,0]=3 2713 B7R0.2 COC(=O)CC(Cl)Cl Amb25227821 [1,1,0,0,0,0|2,0,0]=4 2714 B7R0.2 COC(=O)CC(N)C Amb2371489 [1,1,0,0,0,0|1,0,0]=3 2715 B7R0.2 COC(=O)CC(N)F Amb25267953 [1,1,0,0,0,0|2,0,0]=4 2716 B7R0.2 COC(=O)CN(C)C Amb22167138 [1,1,0,0,0,0|2,0,0]=4 2717 B7R0.2 COC(=O)CS(C)=O Amb20626166 [1,1,0,0,0,0|1,0,1]=4 2718 B7R0.2 COC(=O)C[C@@H](C)N Amb22898912 [1,1,0,0,0,0|1,0,0]=3 2719 B7R0.2 COC(=O)C[C@H](C)N Amb25789928 [1,1,0,0,0,0|1,0,0]=3 2720 B7R0.2 COC(=O)NC(C)C Amb17861698 [1,1,0,0,0,0|2,0,0]=4 2721 B7R0.2 COC(=O)NC(C)O Amb25705192 [1,1,0,0,0,0|1,0,0]=3 2722 B7R0.2 COC(=O)OC(C)C Amb22049510 [1,1,0,0,0,0|2,0,0]=4 2723 B7R0.2 COC(C)=CC(C)O Amb25769416 [1,1,0,0,0,0|1,0,1]=4 2724 B7R0.2 COC(C)CC(N)=S Amb25782261 [1,1,0,0,0,0|1,1,0]=4 2725 B7R0.2 COC(C)CS([O-])=O Amb25690482 [1,1,0,0,0,0|1,0,1]=4 2726 B7R0.2 CON(C)CC(C)O Amb25285671 [1,1,0,0,0,0|2,0,0]=4 2727 B7R0.2 CON(C)CC(N)=O Amb24447118 [1,1,0,0,0,0|2,0,0]=4 2728 B7R0.2 CO[C@@H](C)CC(O)=O Amb24481367 [1,1,0,0,0,0|0,0,0]=2 2729 B7R0.2 CO[C@@H](O)CC(C)=O Amb24450127 [1,1,0,0,0,0|1,0,0]=3 2730 B7R0.2 CS(=O)CC(O)CN Amb24482487 [1,1,0,0,0,0|2,0,0]=4 2731 B7R0.2 CS(=O)C[C@@H](O)CN Amb25284334 [1,1,0,0,0,0|2,0,0]=4 2732 B7R0.2 CS(=O)C[C@H](O)CN Amb25811520 [1,1,0,0,0,0|2,0,0]=4 2733 B7R0.2 CSC(=O)CC(C)C Amb22168305 [1,1,0,0,0,0|1,1,0]=4 2734 B7R0.2 CSC(C)CC(C)=O Amb25714199 [1,1,0,0,0,0|1,1,0]=4 2735 B7R0.2 CSC(C)CC(O)=O Amb18967824 [1,1,0,0,0,0|0,1,0]=3 2736 B7R0.2 C[C@@H](CC(C)=O)C#C Amb25721483 [1,1,0,0,0,0|2,0,0]=4 2737 B7R0.2 C[C@@H](CC(C)=O)C=O Amb24379584 [1,1,0,0,0,0|1,0,1]=4 2738 B7R0.2 C[C@@H](CC(O)=O)ON Amb25189045 [1,1,0,0,0,0|0,0,0]=2 2739 B7R0.2 C[C@@H](CO)CC(C)=C Amb25845281 [1,1,0,0,0,0|2,0,0]=4 2740 B7R0.2 C[C@@H](CO)CC(C)=O Amb25072788 [1,1,0,0,0,0|1,0,0]=3 2741 B7R0.2 C[C@@H](CO)NC(N)=O Amb25315937 [1,1,0,0,0,0|2,0,0]=4 2742 B7R0.2 C[C@@H](CO)OC(C)=O Amb25681753 [1,1,0,0,0,0|2,0,0]=4 2743 B7R0.2 C[C@@H](O)CC(O)C=C Amb25207943 [1,1,0,0,0,0|1,0,1]=4 2744 B7R0.2 C[C@@H](O)C[C@H](C)CO Amb24642405 [1,1,0,0,0,0|1,0,1]=4 2745 B7R0.2 C[C@@H](O)C[C@H](O)C=C Amb25381234 [1,1,0,0,0,0|1,0,1]=4 2746 B7R0.2 C[C@@H](O)\C=C(/C)\C=O Amb25827172 [1,1,0,0,0,0|1,0,1]=4 2747 B7R0.2 C[C@H](CC(O)=O)C=C Amb25791667 [1,1,0,0,0,0|1,0,0]=3 2748 B7R0.2 C[C@H](CO)NC(C)=O Amb24426644 [1,1,0,0,0,0|2,0,0]=4 2749 B7R0.2 C[C@H](CO)NC(N)=O Amb24682644 [1,1,0,0,0,0|2,0,0]=4 2750 B7R0.2 C[C@H](C[C@H](C)O)OC Amb24733201 [1,1,0,0,0,0|1,0,1]=4 2751 B7R0.2 C[C@H](O)CC(C)=C=C Amb25346210 [1,1,0,0,0,0|2,0,0]=4 2752 B7R0.2 C[C@H](O)C[C@@H](C)CO Amb25845280 [1,1,0,0,0,0|1,0,1]=4 2753 B7R0.2 C[C@H](O)C[C@@H](N)CO Amb25105060 [1,1,0,0,0,0|1,0,1]=4 2754 B7R0.2 C[C@H](O)\C=C(\C)/CO Amb24372060 [1,1,0,0,0,0|1,0,1]=4 2755 B7R0.2 C\C(\CC(C)=O)=N\O Amb24457353 [1,1,0,0,0,0|1,0,1]=4 2756 B7R0.2 C\C(\CC(O)=O)=C\C Amb24481339 [1,1,0,0,0,0|1,0,1]=4 2757 B7R0.2 C\C(\CC(O)=O)=N/O Amb25064289 [1,1,0,0,0,0|0,0,1]=3 2758 B7R0.2 C\C(\CO)=C/C(O)=O Amb18641871 [1,1,0,0,0,0|0,0,2]=4 2759 B7R0.2 C\C=C(\Cl)/CC(O)=O Amb25174797 [1,1,0,0,0,0|1,0,1]=4 2760 B7R0.2 NC(=N)C[C@@H](O)CCl Amb24387966 [1,1,0,0,0,0|2,0,0]=4 2761 B7R0.2 NC(=O)CC(O)CO Amb25662216 [1,1,0,0,0,0|1,0,0]=3 2762 B7R0.2 NC(=O)C[C@H](O)CCl Amb25791271 [1,1,0,0,0,0|1,0,0]=3 2763 B7R0.2 NC(CF)CC(O)=O Amb24428065 [1,1,0,0,0,0|1,0,0]=3 2764 B7R0.2 NC(CO)CC(N)=O Amb24384089 [1,1,0,0,0,0|2,0,0]=4 2765 B7R0.2 NC(CS)CC(O)=O Amb25090412 [1,1,0,0,0,0|1,0,0]=3 2766 B7R0.2 NCC(F)CC(O)=O Amb24550169 [1,1,0,0,0,0|1,0,0]=3 2767 B7R0.2 NCC(N)CC(O)=O Amb19515145 [1,1,0,0,0,0|1,0,0]=3 2768 B7R0.2 NCC(N)CC(O)=O Amb21858324 [1,1,0,0,0,0|1,0,0]=3 2769 B7R0.2 NCC(N)CC(O)=O Amb22751661 [1,1,0,0,0,0|1,0,0]=3 2770 B7R0.2 NCC(O)CC(N)=O Amb18641952 [1,1,0,0,0,0|1,0,0]=3 2771 B7R0.2 NCC(O)CP(=O)=O Amb24648320 [1,1,0,0,0,0|1,0,1]=4 2772 B7R0.2 NCC(O)CP(O)=O Amb24714285 [1,1,0,0,0,0|1,0,0]=3 2773 B7R0.2 NC[C@@H](F)CP(O)=O Amb24481490 [1,1,0,0,0,0|2,0,0]=4 2774 B7R0.2 NC[C@@H](N)CC(O)=O Amb22751651 [1,1,0,0,0,0|1,0,0]=3 2775 B7R0.2 NC[C@@H](N)CC(O)=O Amb25829509 [1,1,0,0,0,0|1,0,0]=3 2776 B7R0.2 NC[C@H](CC(=O)O)N Amb10603267 [1,1,0,0,0,0|1,0,0]=3 2777 B7R0.2 NC[C@H](F)CS(O)=O Amb25068064 [1,1,0,0,0,0|2,0,0]=4 2778 B7R0.2 NC[C@H](N)CC(O)=O Amb25378712 [1,1,0,0,0,0|1,0,0]=3 2779 B7R0.2 NC[C@H](O)CP(O)=O Amb25324060 [1,1,0,0,0,0|1,0,0]=3 2780 B7R0.2 NNC(=O)CC(C)C Amb1154207 [1,1,0,0,0,0|2,0,0]=4 2781 B7R0.2 N[C@@H](CC(O)=O)C#N Amb25757887 [1,1,0,0,0,0|1,0,1]=4 2782 B7R0.2 N[C@@H](CO)CC(N)=O Amb24704927 [1,1,0,0,0,0|2,0,0]=4 2783 B7R0.2 N[C@H](CC(O)=O)C=O Amb24643781 [1,1,0,0,0,0|1,0,1]=4 2784 B7R0.2 N[C@H](CC(O)=O)CO Amb22388520 [1,1,0,0,0,0|1,0,0]=3 2785 B7R0.2 N[C@H](CO)CC(N)=O Amb24599306 [1,1,0,0,0,0|2,0,0]=4 2786 B7R0.2 O=C(Cl)CC(Cl)CCl Amb25138703 [1,1,0,0,0,0|2,0,0]=4 2787 B7R0.2 O=NN(CC(=O)O)C Amb17618622 [1,1,0,0,0,0|1,0,1]=4 2788 B7R0.2 OC(=O)CC(=O)CCl Amb18124484 [1,1,0,0,0,0|0,0,2]=4 2789 B7R0.2 OC(=O)CC(=O)NO Amb24444078 [1,1,0,0,0,0|1,0,1]=4 2790 B7R0.2 OC(=O)CC(Br)CCl Amb25834578 [1,1,0,0,0,0|1,0,0]=3 2791 B7R0.2 OC(=O)CC(Cl)CCl Amb25335414 [1,1,0,0,0,0|1,0,0]=3 2792 B7R0.2 OC(=O)CC(F)C=O Amb25114270 [1,1,0,0,0,0|1,0,1]=4 2793 B7R0.2 OC(=O)CN(O)C=O Amb25367291 [1,1,0,0,0,0|1,0,1]=4 2794 B7R0.2 OC(=O)CN(O)N=O Amb25041862 [1,1,0,0,0,0|2,0,0]=4 2795 B7R0.2 OC(CC(=O)Cl)CCl Amb25806118 [1,1,0,0,0,0|1,0,0]=3 2796 B7R0.2 OC(CCl)CC(O)=O Amb18643354 [1,1,0,0,0,0|0,0,0]=2 2797 B7R0.2 OCC(O)CP(O)=O Amb25316128 [1,1,0,0,0,0|1,0,0]=3 2798 B7R0.2 OC[C@@H](CC(=O)O)N Amb16184020 [1,1,0,0,0,0|1,0,0]=3 2799 B7R0.2 OC[C@H](O)CC(O)=O Amb25326979 [1,1,0,0,0,0|0,0,0]=2 2800 B7R0.2 O[C@H](CBr)CC(O)=O Amb22265826 [1,1,0,0,0,0|0,0,0]=2 2801 B7R0.2 [O-]C(=O)CC(O)C=O Amb22733997 [1,1,0,0,0,0|0,0,2]=4 2802 B7R0.2 [O-]C(=O)CC(O)CO Amb24117078 [1,1,0,0,0,0|0,0,1]=3 2803 B7R0.9 CC(=C)CC(C)(C)O Amb22052674 [1,1,0,0,0,0|2,0,0]=4 2804 B7R0.9 CC(=O)CC(C)(C)F Amb25758912 [1,1,0,0,0,0|2,0,0]=4 2805 B7R0.9 CC(=O)CC(C)(F)F Amb21951914 [1,1,0,0,0,0|2,0,0]=4 2806 B7R0.9 CC(=O)CC(C)(S)S Amb25767704 [1,1,0,0,0,0|1,1,0]=4 2807 B7R0.9 CC(=O)CC(S)(C)C Amb17593394 [1,1,0,0,0,0|1,1,0]=4 2808 B7R0.9 CC(C)(C)CS(O)=O Amb24614665 [1,1,0,0,0,0|2,0,0]=4 2809 B7R0.9 CC(C)(N)CC(N)=O Amb23402094 [1,1,0,0,0,0|2,0,0]=4 2810 B7R0.9 CC(C)(N)CC(N)=O Amb24271090 [1,1,0,0,0,0|2,0,0]=4 2811 B7R0.9 CC(C)(N)CC(O)=O Amb19267108 [1,1,0,0,0,0|1,0,0]=3 2812 B7R0.9 CC(C)(O)CC(N)=S Amb24711517 [1,1,0,0,0,0|1,1,0]=4 2813 B7R0.9 CC(C)(O)CC(O)O Amb25115429 [1,1,0,0,0,0|0,0,2]=4 2814 B7R0.9 CC(C)(O)CC([O-])=O Amb17678748 [1,1,0,0,0,0|0,0,1]=3 2815 B7R0.9 CC(C)(O)CC([O-])=O Amb22729769 [1,1,0,0,0,0|0,0,1]=3 2816 B7R0.9 CC(CS(=O)(=O)O)O Amb17593541 [1,1,0,0,0,0|1,0,0]=3 2817 B7R0.9 CC(Cl)CP(O)(O)=O Amb25169519 [1,1,0,0,0,0|2,0,0]=4 2818 B7R0.9 CC(N)CP(C)(O)=O Amb24482995 [1,1,0,0,0,0|2,0,0]=4 2819 B7R0.9 CC(O)CS(=O)(=O)Cl Amb25032356 [1,1,0,0,0,0|1,0,1]=4 2820 B7R0.9 CC(O)CS(C)(=O)=O Amb21988449 [1,1,0,0,0,0|1,0,1]=4 2821 B7R0.9 CC(S)CS(O)(=O)=O Amb24543740 [1,1,0,0,0,0|1,1,0]=4 2822 B7R0.9 CN(C)(C)CC(O)=O Amb22343422 [1,1,0,0,0,0|2,0,0]=4 2823 B7R0.9 CP(C)(=O)CC(O)=O Amb25197683 [1,1,0,0,0,0|1,0,1]=4 2824 B7R0.9 CS(C)(Br)CC(O)=O Amb25829058 [1,1,0,0,0,0|2,0,0]=4 2825 B7R0.9 C[C@@H](N)CP(C)(O)=O Amb24460368 [1,1,0,0,0,0|2,0,0]=4 2826 B7R0.9 C[C@@H](N)CP(O)(O)=O Amb25338674 [1,1,0,0,0,0|2,0,0]=4 2827 B7R0.9 C[C@@H](N)CS(O)(=O)=O Amb24670475 [1,1,0,0,0,0|2,0,0]=4 2828 B7R0.9 C[C@@H](O)CP(O)(O)=O Amb24334038 [1,1,0,0,0,0|1,0,0]=3 2829 B7R0.9 C[C@H](CC(O)(C)C)O Amb10606102 [1,1,0,0,0,0|1,0,1]=4 2830 B7R0.9 C[C@H](N)CS(O)(=O)=O Amb25760668 [1,1,0,0,0,0|2,0,0]=4 2831 B7R0.9 C[C@H](O)CC(C)(C)O Amb20669803 [1,1,0,0,0,0|1,0,1]=4 2832 B7R0.9 C[C@H](O)CP(O)(O)=O Amb25715996 [1,1,0,0,0,0|1,0,0]=3 2833 B7R0.9 C[N+](C)(C)CC(O)=O Amb22734051 [1,1,0,0,0,0|2,0,0]=4 2834 B7R0.9 C[P+](C)(C)CC(O)=O Amb24753800 [1,1,0,0,0,0|2,0,0]=4 2835 B7R0.9 C[Si](C)(C)CC(O)=O Amb19894126 [1,1,0,0,0,0|1,1,0]=4 2836 B7R0.9 OC(=O)CC(F)(F)Br Amb24373833 [1,1,0,0,0,0|2,0,0]=4 2837 B7R0.9 OC(=O)CC(O)(C)C Amb10605560 [1,1,0,0,0,0|0,0,0]=2 2838 B7R0.9 OC(=O)CS(=O)(=O)O Amb16232248 [1,1,0,0,0,0|2,0,0]=4 2839 B7R0.9 OC(=O)C[As+](C)(C)C Amb17608518 [1,1,0,0,0,0|2,0,0]=4 2840 B7R0.9 [2H]C([2H])([2H])CC(O)=O Amb22338080 [1,1,0,0,0,0|2,0,0]=4 2841 B7R0.5 C#CCC(N)C(N)=O Amb22059485 [1,1,0,0,0,0|1,0,1]=4 2842 B7R0.5 C#CCC(N)C(O)=O Amb19944472 [1,1,0,0,0,0|0,0,1]=3 2843 B7R0.5 C#CC[C@@H](N)C(O)=O Amb22748688 [1,1,0,0,0,0|0,0,1]=3 2844 B7R0.5 C#CC[C@@H](O)C(O)=O Amb25189884 [1,1,0,0,0,0|1,0,1]=4 2845 B7R0.5 C=C(CON)C(O)=O Amb25778441 [1,1,0,0,0,0|1,0,1]=4 2846 B7R0.5 C=CCC(Br)C(O)=O Amb18648213 [1,1,0,0,0,0|1,0,1]=4 2847 B7R0.5 C=CCC(Cl)C(O)=O Amb25056173 [1,1,0,0,0,0|1,0,1]=4 2848 B7R0.5 C=CCC(N)C(O)=O Amb21856826 [1,1,0,0,0,0|0,0,1]=3 2849 B7R0.5 C=CCC(N)P(O)=O Amb24377187 [1,1,0,0,0,0|1,0,1]=4 2850 B7R0.5 C=CC[C@@H](F)C(O)=O Amb24481338 [1,1,0,0,0,0|1,0,1]=4 2851 B7R0.5 C=CC[C@@H](N)C(O)=O Amb22745310 [1,1,0,0,0,0|0,0,1]=3 2852 B7R0.5 C=CC[C@@H](O)C(O)=O Amb24548731 [1,1,0,0,0,0|1,0,1]=4 2853 B7R0.5 CC#CC(C)C(O)=O Amb22748425 [1,1,0,0,0,0|1,0,1]=4 2854 B7R0.5 CC(=CCO)C(O)=O Amb24730294 [1,1,0,0,0,0|1,0,1]=4 2855 B7R0.5 CC(=O)C(Cl)CCCl Amb20671951 [1,1,0,0,0,0|2,0,0]=4 2856 B7R0.5 CC(=O)C(N)CCO Amb25087112 [1,1,0,0,0,0|1,0,0]=3 2857 B7R0.5 CC(=O)C(O)CCS Amb24516694 [1,1,0,0,0,0|2,0,0]=4 2858 B7R0.5 CC(=O)C(S)CCO Amb25831127 [1,1,0,0,0,0|2,0,0]=4 2859 B7R0.5 CC(=O)N(N)CCO Amb18641953 [1,1,0,0,0,0|2,0,0]=4 2860 B7R0.5 CC(C(=O)C)CCO Amb13881368 [1,1,0,0,0,0|2,0,0]=4 2861 B7R0.5 CC(C(=O)O)CC#N Amb17334056 [1,1,0,0,0,0|1,0,1]=4 2862 B7R0.5 CC(C(=O)O)CNC Amb13952364 [1,1,0,0,0,0|1,0,0]=3 2863 B7R0.5 CC(C)C(C)CC=O Amb18641816 [1,1,0,0,0,0|2,0,0]=4 2864 B7R0.5 CC(C)C(C)NC=O Amb24631907 [1,1,0,0,0,0|2,0,0]=4 2865 B7R0.5 CC(C)C(Cl)OC=O Amb24533537 [1,1,0,0,0,0|2,0,0]=4 2866 B7R0.5 CC(C)C(N)C=CC Amb23536816 [1,1,0,0,0,0|2,0,0]=4 2867 B7R0.5 CC(C)C(N)CC=C Amb18292096 [1,1,0,0,0,0|2,0,0]=4 2868 B7R0.5 CC(C)C(N)COC Amb18202679 [1,1,0,0,0,0|1,0,1]=4 2869 B7R0.5 CC(C)C(N)COC Amb21954041 [1,1,0,0,0,0|1,0,1]=4 2870 B7R0.5 CC(C)C(N)NC=O Amb25804048 [1,1,0,0,0,0|1,0,0]=3 2871 B7R0.5 CC(C)C(N)\C=C\C Amb24473868 [1,1,0,0,0,0|2,0,0]=4 2872 B7R0.5 CC(C)C(N)\C=C\I Amb25731035 [1,1,0,0,0,0|2,0,0]=4 2873 B7R0.5 CC(C)C(O)CC=O Amb24584440 [1,1,0,0,0,0|2,0,0]=4 2874 B7R0.5 CC(C)[C@@H](N)CC=C Amb22831776 [1,1,0,0,0,0|2,0,0]=4 2875 B7R0.5 CC(C)[C@@H](N)COC Amb18016631 [1,1,0,0,0,0|1,0,1]=4 2876 B7R0.5 CC(C)[C@H](C)CC=O Amb25253560 [1,1,0,0,0,0|2,0,0]=4 2877 B7R0.5 CC(C)[C@H](N)C=C=C Amb25184830 [1,1,0,0,0,0|2,0,0]=4 2878 B7R0.5 CC(C)[C@H](N)\C=C\I Amb25821343 [1,1,0,0,0,0|2,0,0]=4 2879 B7R0.5 CC(C)[C@H](O)CC=O Amb24481570 [1,1,0,0,0,0|2,0,0]=4 2880 B7R0.5 CC(C=NO)C(O)=O Amb24616398 [1,1,0,0,0,0|1,0,1]=4 2881 B7R0.5 CC(CC#C)C(O)=O Amb18633959 [1,1,0,0,0,0|1,0,1]=4 2882 B7R0.5 CC(CCBr)C(=O)Cl Amb25798925 [1,1,0,0,0,0|2,0,0]=4 2883 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [1,1,0,0,0,0|2,0,0]=4 2884 B7R0.5 CC(CCCl)C(=O)F Amb25839945 [1,1,0,0,0,0|2,0,0]=4 2885 B7R0.5 CC(CCF)C(O)=O Amb24678386 [1,1,0,0,0,0|1,0,0]=3 2886 B7R0.5 CC(CCN)C(C)=O Amb18251071 [1,1,0,0,0,0|2,0,0]=4 2887 B7R0.5 CC(CCN)C(N)=O Amb18641900 [1,1,0,0,0,0|2,0,0]=4 2888 B7R0.5 CC(CCN)C(O)=O Amb20667970 [1,1,0,0,0,0|1,0,0]=3 2889 B7R0.5 CC(CCO)C(O)=O Amb18641949 [1,1,0,0,0,0|1,0,0]=3 2890 B7R0.5 CC(CCS)C(O)=O Amb25133689 [1,1,0,0,0,0|1,0,0]=3 2891 B7R0.5 CC(COC)C(C)O Amb24746662 [1,1,0,0,0,0|1,0,1]=4 2892 B7R0.5 CC(NC=O)C(C)O Amb25347778 [1,1,0,0,0,0|1,0,0]=3 2893 B7R0.5 CC(NOC)C(C)O Amb25832401 [1,1,0,0,0,0|2,0,0]=4 2894 B7R0.5 CC(O)C(C)=CCO Amb25144974 [1,1,0,0,0,0|1,0,1]=4 2895 B7R0.5 CC(O)C(Cl)CC=C Amb25109284 [1,1,0,0,0,0|2,0,0]=4 2896 B7R0.5 CC(O)C(N)CCC Amb24656798 [1,1,0,0,0,0|1,0,1]=4 2897 B7R0.5 CC(O)C(N)COC Amb18124266 [1,1,0,0,0,0|0,0,1]=3 2898 B7R0.5 CC(O)C(O)CC=C Amb24734248 [1,1,0,0,0,0|2,0,0]=4 2899 B7R0.5 CC(O)C(O)CC=O Amb25745503 [1,1,0,0,0,0|1,0,0]=3 2900 B7R0.5 CC(O)C(O)CCO Amb25851421 [1,1,0,0,0,0|1,0,1]=4 2901 B7R0.5 CC(O)C(O)COC Amb24414234 [1,1,0,0,0,0|1,0,1]=4 2902 B7R0.5 CC(O)[C@@H](C)CCO Amb24431016 [1,1,0,0,0,0|1,0,1]=4 2903 B7R0.5 CC(O)[C@@H](N)CC=C Amb24367846 [1,1,0,0,0,0|1,0,0]=3 2904 B7R0.5 CC(O)[C@H](N)CC=C Amb25336245 [1,1,0,0,0,0|1,0,0]=3 2905 B7R0.5 CC(SC=C)C(C)O Amb25676605 [1,1,0,0,0,0|2,0,0]=4 2906 B7R0.5 CC(\C=C\Cl)C(C)O Amb25101501 [1,1,0,0,0,0|2,0,0]=4 2907 B7R0.5 CCCC(=C)C(O)=O Amb18641779 [1,1,0,0,0,0|1,0,1]=4 2908 B7R0.5 CCCC(=O)C(O)=O Amb22347924 [1,1,0,0,0,0|1,0,1]=4 2909 B7R0.5 CCCC(=O)C(O)=O Amb22733540 [1,1,0,0,0,0|1,0,1]=4 2910 B7R0.5 CCCC(Br)C(=O)Br Amb24369503 [1,1,0,0,0,0|2,0,0]=4 2911 B7R0.5 CCCC(C(=O)Cl)Br Amb17569837 [1,1,0,0,0,0|2,0,0]=4 2912 B7R0.5 CCCC(C(=O)O)Cl Amb17593470 [1,1,0,0,0,0|1,0,0]=3 2913 B7R0.5 CCCC(C(=O)O)O Amb2582532 [1,1,0,0,0,0|1,0,0]=3 2914 B7R0.5 CCCC(Cl)C(N)=O Amb25024550 [1,1,0,0,0,0|2,0,0]=4 2915 B7R0.5 CCCC(F)C(O)=O Amb25842008 [1,1,0,0,0,0|1,0,0]=3 2916 B7R0.5 CCCC(N)C(=O)S Amb25378817 [1,1,0,0,0,0|0,1,0]=3 2917 B7R0.5 CCCC(N)C(C)=C Amb24643425 [1,1,0,0,0,0|2,0,0]=4 2918 B7R0.5 CCCC(N)C(N)=O Amb22284825 [1,1,0,0,0,0|1,0,0]=3 2919 B7R0.5 CCCC(N)P(O)O Amb24401110 [1,1,0,0,0,0|1,0,1]=4 2920 B7R0.5 CCCC(O)C(C)=O Amb22495823 [1,1,0,0,0,0|2,0,0]=4 2921 B7R0.5 CCCC(O)C(N)=O Amb24116553 [1,1,0,0,0,0|2,0,0]=4 2922 B7R0.5 CCCC(O)C([O-])=O Amb22731263 [1,1,0,0,0,0|1,0,1]=4 2923 B7R0.5 CCCC(O)P(O)=O Amb25143218 [1,1,0,0,0,0|2,0,0]=4 2924 B7R0.5 CCCC(S)C(C)=O Amb24689502 [1,1,0,0,0,0|2,0,0]=4 2925 B7R0.5 CCCC(S)C(O)=O Amb18124440 [1,1,0,0,0,0|1,0,0]=3 2926 B7R0.5 CCC[C@@H](C)C(C)=O Amb24631887 [1,1,0,0,0,0|2,0,0]=4 2927 B7R0.5 CCC[C@@H](C)C(N)=O Amb25257881 [1,1,0,0,0,0|2,0,0]=4 2928 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [1,1,0,0,0,0|1,0,0]=3 2929 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [1,1,0,0,0,0|1,0,0]=3 2930 B7R0.5 CCC[C@@H](O)C(C)=O Amb24432580 [1,1,0,0,0,0|2,0,0]=4 2931 B7R0.5 CCC[C@@H](O)C(O)=O Amb22746731 [1,1,0,0,0,0|1,0,0]=3 2932 B7R0.5 CCC[C@H](C)C(N)=O Amb25305606 [1,1,0,0,0,0|2,0,0]=4 2933 B7R0.5 CCC[C@H](F)C(O)=O Amb24657412 [1,1,0,0,0,0|1,0,0]=3 2934 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [1,1,0,0,0,0|2,0,0]=4 2935 B7R0.5 CCC[C@H](O)C(N)=O Amb25082239 [1,1,0,0,0,0|2,0,0]=4 2936 B7R0.5 CCC[C@H](O)C(O)=O Amb22226514 [1,1,0,0,0,0|1,0,0]=3 2937 B7R0.5 CCNC(=N)C(O)=O Amb18641879 [1,1,0,0,0,0|0,0,2]=4 2938 B7R0.5 CCNC(C)C(N)=O Amb21959648 [1,1,0,0,0,0|2,0,0]=4 2939 B7R0.5 CCN[C@H](C)C(O)=O Amb24351099 [1,1,0,0,0,0|1,0,0]=3 2940 B7R0.5 CCOC(=C)C(O)=O Amb18641872 [1,1,0,0,0,0|1,0,1]=4 2941 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [1,1,0,0,0,0|1,0,1]=4 2942 B7R0.5 CCOC(C)C(N)=O Amb19960053 [1,1,0,0,0,0|2,0,0]=4 2943 B7R0.5 CCOC(O)C(C)=O Amb25189063 [1,1,0,0,0,0|2,0,0]=4 2944 B7R0.5 CCOC(O)C(O)=O Amb24680848 [1,1,0,0,0,0|1,0,0]=3 2945 B7R0.5 CCO[C@@H](O)C(C)=O Amb25092956 [1,1,0,0,0,0|2,0,0]=4 2946 B7R0.5 CCO[C@H](C)C(O)=O Amb24660035 [1,1,0,0,0,0|1,0,0]=3 2947 B7R0.5 CCSC(=S)C(O)=O Amb25210892 [1,1,0,0,0,0|1,0,1]=4 2948 B7R0.5 CCSC(O)C(O)=O Amb24444218 [1,1,0,0,0,0|1,0,0]=3 2949 B7R0.5 CCS[C@@H](C)C(O)=O Amb25083211 [1,1,0,0,0,0|1,0,0]=3 2950 B7R0.5 CCS[C@H](C)C(O)=O Amb25259517 [1,1,0,0,0,0|1,0,0]=3 2951 B7R0.5 CC\C=C(/N)\C(N)=O Amb25858729 [1,1,0,0,0,0|1,0,1]=4 2952 B7R0.5 CC\C=C(\Br)/C(O)=O Amb18125610 [1,1,0,0,0,0|1,0,1]=4 2953 B7R0.5 CC\C=C(\F)/C(O)=O Amb25326985 [1,1,0,0,0,0|1,0,1]=4 2954 B7R0.5 CC\C=C(\N)/C(N)=O Amb24515060 [1,1,0,0,0,0|1,0,1]=4 2955 B7R0.5 CC\C=C(\N)/C(O)=O Amb24349496 [1,1,0,0,0,0|0,0,1]=3 2956 B7R0.5 CNCC(=C)C(O)=O Amb24561619 [1,1,0,0,0,0|1,0,1]=4 2957 B7R0.5 CNCC(C(=O)O)N Amb10071505 [1,1,0,0,0,0|0,0,0]=2 2958 B7R0.5 CNCC(C(=O)O)N Amb10845350 [1,1,0,0,0,0|0,0,0]=2 2959 B7R0.5 CNCC(C)C(C)=O Amb25340555 [1,1,0,0,0,0|2,0,0]=4 2960 B7R0.5 CNCC(F)C(O)=O Amb24666017 [1,1,0,0,0,0|1,0,0]=3 2961 B7R0.5 CNCC(N)C(N)=O Amb25316352 [1,1,0,0,0,0|1,0,0]=3 2962 B7R0.5 CNC[C@@H](C(=O)O)N Amb17617148 [1,1,0,0,0,0|0,0,0]=2 2963 B7R0.5 CNC[C@@H](N)C(O)=O Amb19133072 [1,1,0,0,0,0|0,0,0]=2 2964 B7R0.5 CNC[C@@H](N)C(O)=O Amb22746009 [1,1,0,0,0,0|0,0,0]=2 2965 B7R0.5 CNC[C@@H](N)C(O)=O Amb22748835 [1,1,0,0,0,0|0,0,0]=2 2966 B7R0.5 CNC[C@H](N)C(O)=O Amb19892230 [1,1,0,0,0,0|0,0,0]=2 2967 B7R0.5 CNC[C@H](O)C(O)=O Amb25689188 [1,1,0,0,0,0|1,0,0]=3 2968 B7R0.5 CNN=C(N)C(O)=O Amb25684306 [1,1,0,0,0,0|1,0,1]=4 2969 B7R0.5 CNNC(C)C(O)=O Amb24070183 [1,1,0,0,0,0|2,0,0]=4 2970 B7R0.5 COCC(=O)C(O)=O Amb25304863 [1,1,0,0,0,0|1,0,1]=4 2971 B7R0.5 COCC(Br)C(C)=O Amb24483184 [1,1,0,0,0,0|2,0,0]=4 2972 B7R0.5 COCC(Br)C(N)=O Amb24740751 [1,1,0,0,0,0|2,0,0]=4 2973 B7R0.5 COCC(C(=O)O)Br Amb17594709 [1,1,0,0,0,0|1,0,0]=3 2974 B7R0.5 COCC(C(=O)O)Cl Amb10068384 [1,1,0,0,0,0|1,0,0]=3 2975 B7R0.5 COCC(C)C(C)=O Amb24683449 [1,1,0,0,0,0|2,0,0]=4 2976 B7R0.5 COCC(C)S(O)=O Amb25280974 [1,1,0,0,0,0|2,0,0]=4 2977 B7R0.5 COCC(Cl)C(C)=O Amb25073897 [1,1,0,0,0,0|2,0,0]=4 2978 B7R0.5 COCC(F)C(O)=O Amb24526772 [1,1,0,0,0,0|1,0,0]=3 2979 B7R0.5 COCC(N)C(N)=O Amb18984372 [1,1,0,0,0,0|1,0,0]=3 2980 B7R0.5 COCC(O)C(C)=O Amb25072841 [1,1,0,0,0,0|2,0,0]=4 2981 B7R0.5 COCC(O)C(O)=O Amb18124273 [1,1,0,0,0,0|1,0,0]=3 2982 B7R0.5 COC[C@@H](N)C(N)=O Amb25211762 [1,1,0,0,0,0|1,0,0]=3 2983 B7R0.5 COC[C@@H](N)C(O)=O Amb22744762 [1,1,0,0,0,0|0,0,0]=2 2984 B7R0.5 COC[C@@H](O)C(O)=O Amb25829059 [1,1,0,0,0,0|1,0,0]=3 2985 B7R0.5 COC[C@H](C(=O)O)N Amb10604051 [1,1,0,0,0,0|0,0,0]=2 2986 B7R0.5 COC[C@H](C(C)C)N Amb17061638 [1,1,0,0,0,0|1,0,1]=4 2987 B7R0.5 CSCC(C)C(=O)Cl Amb20247150 [1,1,0,0,0,0|2,0,0]=4 2988 B7R0.5 CSCC(C)C(C)=O Amb25268934 [1,1,0,0,0,0|2,0,0]=4 2989 B7R0.5 CSCC(C)C(N)=O Amb24475326 [1,1,0,0,0,0|2,0,0]=4 2990 B7R0.5 CSCC(C)C(O)=O Amb18967825 [1,1,0,0,0,0|1,0,0]=3 2991 B7R0.5 CSCC(N)C(C)=C Amb25142968 [1,1,0,0,0,0|2,0,0]=4 2992 B7R0.5 CSCC(N)C(N)=O Amb18294390 [1,1,0,0,0,0|1,0,0]=3 2993 B7R0.5 CSCC(O)C(O)=O Amb25131873 [1,1,0,0,0,0|1,0,0]=3 2994 B7R0.5 CSC[C@H](O)C(O)=O Amb24435256 [1,1,0,0,0,0|1,0,0]=3 2995 B7R0.5 CSSC(C)C(O)=O Amb25701741 [1,1,0,0,0,0|2,0,0]=4 2996 B7R0.5 C[C@@H](C(=O)O)CC#C Amb10844029 [1,1,0,0,0,0|1,0,1]=4 2997 B7R0.5 C[C@@H](C(=O)O)CC=C Amb10844040 [1,1,0,0,0,0|1,0,1]=4 2998 B7R0.5 C[C@@H](C(=O)O)CCC Amb10844028 [1,1,0,0,0,0|1,0,0]=3 2999 B7R0.5 C[C@@H](CCS)C(O)=O Amb25786376 [1,1,0,0,0,0|1,0,0]=3 3000 B7R0.5 C[C@@H](NON)C(O)=O Amb24409085 [1,1,0,0,0,0|2,0,0]=4 3001 B7R0.5 C[C@@H](O)C(N)CC=C Amb24332662 [1,1,0,0,0,0|1,0,0]=3 3002 B7R0.5 C[C@@H](O)C(O)CC=C Amb25344994 [1,1,0,0,0,0|2,0,0]=4 3003 B7R0.5 C[C@@H](O)[C@@H](C)CCO Amb24475865 [1,1,0,0,0,0|1,0,1]=4 3004 B7R0.5 C[C@@H](O)[C@@H](O)C=C=C Amb24457432 [1,1,0,0,0,0|2,0,0]=4 3005 B7R0.5 C[C@@H](O)[C@H](C)CCO Amb25206314 [1,1,0,0,0,0|1,0,1]=4 3006 B7R0.5 C[C@@H](O)[C@H](F)CC=C Amb24420825 [1,1,0,0,0,0|2,0,0]=4 3007 B7R0.5 C[C@@H](O)[C@H](N)CCC Amb25328641 [1,1,0,0,0,0|1,0,1]=4 3008 B7R0.5 C[C@@H](O)[C@H](N)COC Amb25304782 [1,1,0,0,0,0|0,0,1]=3 3009 B7R0.5 C[C@@H](O)[C@H](O)CC=C Amb25106054 [1,1,0,0,0,0|2,0,0]=4 3010 B7R0.5 C[C@@H](O)[C@H](O)\C=C\C Amb25083940 [1,1,0,0,0,0|2,0,0]=4 3011 B7R0.5 C[C@@H](OC=O)[C@H](C)Br Amb25701559 [1,1,0,0,0,0|2,0,0]=4 3012 B7R0.5 C[C@@H](\C=C/Cl)[C@@H](C)O Amb24483187 [1,1,0,0,0,0|2,0,0]=4 3013 B7R0.5 C[C@H](C(=O)O)CC#C Amb10844036 [1,1,0,0,0,0|1,0,1]=4 3014 B7R0.5 C[C@H](C(=O)O)CC=C Amb10844033 [1,1,0,0,0,0|1,0,1]=4 3015 B7R0.5 C[C@H](C(=O)O)CCC Amb10844037 [1,1,0,0,0,0|1,0,0]=3 3016 B7R0.5 C[C@H](C(=O)O)CCN Amb10844043 [1,1,0,0,0,0|1,0,0]=3 3017 B7R0.5 C[C@H](C(=O)O)COC Amb10844266 [1,1,0,0,0,0|1,0,0]=3 3018 B7R0.5 C[C@H](CC#N)C(O)=O Amb24725603 [1,1,0,0,0,0|1,0,1]=4 3019 B7R0.5 C[C@H](CC=C)[C@@H](C)O Amb25072004 [1,1,0,0,0,0|2,0,0]=4 3020 B7R0.5 C[C@H](CC=C)[C@H](C)O Amb24717463 [1,1,0,0,0,0|2,0,0]=4 3021 B7R0.5 C[C@H](CCO)C(O)=O Amb24483065 [1,1,0,0,0,0|1,0,0]=3 3022 B7R0.5 C[C@H](NCO)C(O)=O Amb24401217 [1,1,0,0,0,0|1,0,0]=3 3023 B7R0.5 C[C@H](O)[C@@H](N)CC=C Amb25264318 [1,1,0,0,0,0|1,0,0]=3 3024 B7R0.5 C[C@H](O)[C@@H](N)COC Amb25169361 [1,1,0,0,0,0|0,0,1]=3 3025 B7R0.5 C[C@H](O)[C@@H](O)C=C=C Amb25722136 [1,1,0,0,0,0|2,0,0]=4 3026 B7R0.5 C[C@H](O)[C@H](C)CCO Amb25143027 [1,1,0,0,0,0|1,0,1]=4 3027 B7R0.5 C[C@H](O)[C@H](N)CC=C Amb24454742 [1,1,0,0,0,0|1,0,0]=3 3028 B7R0.5 C[C@H](O)[C@H](N)CCC Amb24604367 [1,1,0,0,0,0|1,0,1]=4 3029 B7R0.5 C[C@H](OC=O)[C@H](C)Br Amb25061373 [1,1,0,0,0,0|2,0,0]=4 3030 B7R0.5 C[C@H](\C=C/Cl)[C@@H](C)O Amb24526763 [1,1,0,0,0,0|2,0,0]=4 3031 B7R0.5 C[C@H](\C=C/Cl)[C@H](C)O Amb25331248 [1,1,0,0,0,0|2,0,0]=4 3032 B7R0.5 C[Se]CC(=O)C(=O)O Amb17617778 [1,1,0,0,0,0|1,0,1]=4 3033 B7R0.5 C[Se]C[C@@H](C(=O)O)N Amb10601626 [1,1,0,0,0,0|0,0,0]=2 3034 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22350259 [1,1,0,0,0,0|0,0,0]=2 3035 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22745692 [1,1,0,0,0,0|0,0,0]=2 3036 B7R0.5 C\C(=C/CO)\C(O)=O Amb18641873 [1,1,0,0,0,0|1,0,1]=4 3037 B7R0.5 C\C=C/C(N)C(N)=O Amb24679364 [1,1,0,0,0,0|1,0,1]=4 3038 B7R0.5 C\C=C\C(C)C(O)=O Amb18641786 [1,1,0,0,0,0|1,0,1]=4 3039 B7R0.5 C\C=C\C(N)C(N)=O Amb24515058 [1,1,0,0,0,0|1,0,1]=4 3040 B7R0.5 C\C=C\C(N)C(O)=O Amb24481451 [1,1,0,0,0,0|0,0,1]=3 3041 B7R0.5 C\C=C\C(O)C(O)=O Amb24481382 [1,1,0,0,0,0|1,0,1]=4 3042 B7R0.5 C\C=C\[C@@H](C)C(O)=O Amb25719907 [1,1,0,0,0,0|1,0,1]=4 3043 B7R0.5 C\C=C\[C@@H](C)[C@H](C)O Amb25056250 [1,1,0,0,0,0|2,0,0]=4 3044 B7R0.5 C\C=C\[C@H](C)C(O)=O Amb24481336 [1,1,0,0,0,0|1,0,1]=4 3045 B7R0.5 N#CCC(O)C(O)=O Amb25678609 [1,1,0,0,0,0|1,0,1]=4 3046 B7R0.5 NC(=O)C(Br)CCBr Amb25174083 [1,1,0,0,0,0|2,0,0]=4 3047 B7R0.5 NC(=O)C(O)CCO Amb25703294 [1,1,0,0,0,0|2,0,0]=4 3048 B7R0.5 NC(=O)C(S)CCO Amb24525295 [1,1,0,0,0,0|2,0,0]=4 3049 B7R0.5 NC(=O)N(N)CCO Amb18641972 [1,1,0,0,0,0|2,0,0]=4 3050 B7R0.5 NC(C(=O)O)CCBr Amb10576584 [1,1,0,0,0,0|0,0,0]=2 3051 B7R0.5 NC(CC#N)C(O)=O Amb18641766 [1,1,0,0,0,0|0,0,1]=3 3052 B7R0.5 NC(CCBr)C(O)=O Amb21858417 [1,1,0,0,0,0|0,0,0]=2 3053 B7R0.5 NC(CCF)C(N)=O Amb24391278 [1,1,0,0,0,0|1,0,0]=3 3054 B7R0.5 NC(CCI)C(O)=O Amb25339674 [1,1,0,0,0,0|0,0,0]=2 3055 B7R0.5 NC(CCO)C(N)=O Amb24481392 [1,1,0,0,0,0|1,0,0]=3 3056 B7R0.5 NC(CCS)C(N)=O Amb24599383 [1,1,0,0,0,0|1,0,0]=3 3057 B7R0.5 NC(CCS)C(O)=O Amb19267093 [1,1,0,0,0,0|0,0,0]=2 3058 B7R0.5 NC(CS=O)C(O)=O Amb24557184 [1,1,0,0,0,0|0,0,1]=3 3059 B7R0.5 NC(CSCl)C(O)=O Amb24482298 [1,1,0,0,0,0|0,1,0]=3 3060 B7R0.5 NC(CSO)C(O)=O Amb24746797 [1,1,0,0,0,0|0,0,0]=2 3061 B7R0.5 NC(CSS)C(O)=O Amb24614616 [1,1,0,0,0,0|0,1,0]=3 3062 B7R0.5 NC(\C=C\Cl)C(O)=O Amb24483058 [1,1,0,0,0,0|0,0,2]=4 3063 B7R0.5 NCCC(=O)C(O)=O Amb25724685 [1,1,0,0,0,0|1,0,1]=4 3064 B7R0.5 NCCC(C(=O)O)F Amb10838221 [1,1,0,0,0,0|1,0,0]=3 3065 B7R0.5 NCCC(C(=O)O)O Amb16232090 [1,1,0,0,0,0|1,0,0]=3 3066 B7R0.5 NCCC(Cl)C(O)=O Amb18124502 [1,1,0,0,0,0|1,0,0]=3 3067 B7R0.5 NCCC(F)C(O)=O Amb22229524 [1,1,0,0,0,0|1,0,0]=3 3068 B7R0.5 NCCC(N)C(N)=O Amb24634873 [1,1,0,0,0,0|1,0,0]=3 3069 B7R0.5 NCCC(N)C(O)=O Amb17678762 [1,1,0,0,0,0|0,0,0]=2 3070 B7R0.5 NCCC(N)C(O)=O Amb22348212 [1,1,0,0,0,0|0,0,0]=2 3071 B7R0.5 NCCC(S)C(O)=O Amb25083375 [1,1,0,0,0,0|1,0,0]=3 3072 B7R0.5 NCC[C@@H](Cl)C(O)=O Amb24481492 [1,1,0,0,0,0|1,0,0]=3 3073 B7R0.5 NCC[C@@H](F)C(O)=O Amb24055858 [1,1,0,0,0,0|1,0,0]=3 3074 B7R0.5 NCC[C@@H](N)C(O)=O Amb22750574 [1,1,0,0,0,0|0,0,0]=2 3075 B7R0.5 NCC[C@@H](N)C(O)=O Amb23438994 [1,1,0,0,0,0|0,0,0]=2 3076 B7R0.5 NCC[C@@H](O)C(O)=O Amb22225364 [1,1,0,0,0,0|1,0,0]=3 3077 B7R0.5 NCC[C@@H](O)C(O)=O Amb22748225 [1,1,0,0,0,0|1,0,0]=3 3078 B7R0.5 NCC[C@H](F)C(O)=O Amb24055857 [1,1,0,0,0,0|1,0,0]=3 3079 B7R0.5 NCC[C@H](N)C(O)=O Amb22886961 [1,1,0,0,0,0|0,0,0]=2 3080 B7R0.5 NOCC(N)C(N)=O Amb24388788 [1,1,0,0,0,0|1,0,0]=3 3081 B7R0.5 NOCC(N)C(O)=O Amb24184086 [1,1,0,0,0,0|0,0,0]=2 3082 B7R0.5 NOC[C@@H](N)C(O)=O Amb25791301 [1,1,0,0,0,0|0,0,0]=2 3083 B7R0.5 NOC[C@H](N)C(O)=O Amb24548229 [1,1,0,0,0,0|0,0,0]=2 3084 B7R0.5 N[C@@H](C(=O)O)CC#C Amb16183954 [1,1,0,0,0,0|0,0,1]=3 3085 B7R0.5 N[C@@H](C(=O)O)CCN Amb16183852 [1,1,0,0,0,0|0,0,0]=2 3086 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22746780 [1,1,0,0,0,0|0,0,1]=3 3087 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22748768 [1,1,0,0,0,0|0,0,1]=3 3088 B7R0.5 N[C@@H](CCBr)C(O)=O Amb22748283 [1,1,0,0,0,0|0,0,0]=2 3089 B7R0.5 N[C@@H](CCO)C(O)=O Amb20242705 [1,1,0,0,0,0|0,0,0]=2 3090 B7R0.5 N[C@@H](CCS)P(O)=O Amb24594746 [1,1,0,0,0,0|1,0,0]=3 3091 B7R0.5 N[C@@H](CCS)S(O)=O Amb25784628 [1,1,0,0,0,0|1,0,0]=3 3092 B7R0.5 N[C@@H](CNO)C(O)=O Amb24481412 [1,1,0,0,0,0|0,0,0]=2 3093 B7R0.5 N[C@@H](CO[SiH3])C(O)=O Amb24526864 [1,1,0,0,0,0|0,0,0]=2 3094 B7R0.5 N[C@@H](CSCl)C(O)=O Amb25055747 [1,1,0,0,0,0|0,1,0]=3 3095 B7R0.5 N[C@@H](CSO)C(O)=O Amb24481432 [1,1,0,0,0,0|0,0,0]=2 3096 B7R0.5 N[C@H](C(=O)O)CC#N Amb16183916 [1,1,0,0,0,0|0,0,1]=3 3097 B7R0.5 N[C@H](C(=O)O)CC=C Amb10982568 [1,1,0,0,0,0|0,0,1]=3 3098 B7R0.5 N[C@H](C(=O)O)CCN Amb16183862 [1,1,0,0,0,0|0,0,0]=2 3099 B7R0.5 N[C@H](CCS)C(O)=O Amb22230515 [1,1,0,0,0,0|0,0,0]=2 3100 B7R0.5 N[C@H](CNO)C(O)=O Amb24745929 [1,1,0,0,0,0|0,0,0]=2 3101 B7R0.5 N[C@H](\C=C\Cl)C(O)=O Amb25230190 [1,1,0,0,0,0|0,0,2]=4 3102 B7R0.5 O=C(Br)C(Br)CCBr Amb22234970 [1,1,0,0,0,0|2,0,0]=4 3103 B7R0.5 O=C(Cl)C(Br)CCBr Amb19930045 [1,1,0,0,0,0|2,0,0]=4 3104 B7R0.5 O=C(Cl)C(Cl)CCCl Amb24423919 [1,1,0,0,0,0|2,0,0]=4 3105 B7R0.5 O=CCC(C(=O)O)N Amb16232081 [1,1,0,0,0,0|0,0,1]=3 3106 B7R0.5 OC(=O)C(=O)CCCl Amb24592167 [1,1,0,0,0,0|1,0,1]=4 3107 B7R0.5 OC(=O)C(=O)CCO Amb25677024 [1,1,0,0,0,0|1,0,1]=4 3108 B7R0.5 OC(=O)C(Br)CCBr Amb19889695 [1,1,0,0,0,0|1,0,0]=3 3109 B7R0.5 OC(=O)C(Br)CCF Amb25073798 [1,1,0,0,0,0|1,0,0]=3 3110 B7R0.5 OC(=O)C(Cl)CCCl Amb18126030 [1,1,0,0,0,0|1,0,0]=3 3111 B7R0.5 OC(=O)[C@H](S)CCS Amb24483251 [1,1,0,0,0,0|1,0,0]=3 3112 B7R0.5 OC(=O)\C(\Br)=C/CO Amb24692651 [1,1,0,0,0,0|1,0,1]=4 3113 B7R0.5 OC(=O)\C(\Cl)=C/CO Amb24598039 [1,1,0,0,0,0|1,0,1]=4 3114 B7R0.5 OC(=O)\C(\F)=C/CO Amb25737076 [1,1,0,0,0,0|1,0,1]=4 3115 B7R0.5 OC(CC=O)C(O)=O Amb25225249 [1,1,0,0,0,0|1,0,1]=4 3116 B7R0.5 OC(CCS)C(O)=O Amb24586206 [1,1,0,0,0,0|1,0,0]=3 3117 B7R0.5 OCCC(C(C)C)N Amb1993950 [1,1,0,0,0,0|1,0,1]=4 3118 B7R0.5 OCCC(O)C(O)=O Amb24689942 [1,1,0,0,0,0|1,0,0]=3 3119 B7R0.5 O[15NH]CC(C(=O)O)N Amb17608097 [1,1,0,0,0,0|0,0,0]=2 3120 B7R0.5 O[C@@H](CCF)C(O)=O Amb24481351 [1,1,0,0,0,0|1,0,0]=3 3121 B7R0.10 C#CC(O)[C@H](N)CO Amb24436532 [1,1,0,0,0,0|0,0,2]=4 3122 B7R0.10 C=CC(=O)C(N)CS Amb25082980 [1,1,0,0,0,0|1,1,0]=4 3123 B7R0.10 C=CC(Cl)C(O)CO Amb24443794 [1,1,0,0,0,0|2,0,0]=4 3124 B7R0.10 C=CC(N)C(O)C=C Amb24440897 [1,1,0,0,0,0|1,0,1]=4 3125 B7R0.10 C=CC(N)C(O)CO Amb18641922 [1,1,0,0,0,0|1,0,0]=3 3126 B7R0.10 C=CC(O)C(O)C=O Amb25318889 [1,1,0,0,0,0|1,0,1]=4 3127 B7R0.10 C=CC(O)C(O)CN Amb18641921 [1,1,0,0,0,0|2,0,0]=4 3128 B7R0.10 C=CC(O)C(O)CO Amb25082759 [1,1,0,0,0,0|2,0,0]=4 3129 B7R0.10 C=CC(O)[C@H](O)CO Amb25716025 [1,1,0,0,0,0|2,0,0]=4 3130 B7R0.10 C=C[C@@H](N)[C@@H](O)CO Amb24655125 [1,1,0,0,0,0|1,0,0]=3 3131 B7R0.10 C=C[C@@H](N)[C@H](O)C=C Amb25703149 [1,1,0,0,0,0|1,0,1]=4 3132 B7R0.10 C=C[C@@H](O)[C@@H](N)CO Amb24120616 [1,1,0,0,0,0|0,0,2]=4 3133 B7R0.10 C=C[C@@H](O)[C@@H](O)C=O Amb24383182 [1,1,0,0,0,0|1,0,1]=4 3134 B7R0.10 C=C[C@@H](O)[C@H](O)C=O Amb24444427 [1,1,0,0,0,0|1,0,1]=4 3135 B7R0.10 C=C[C@@H](O)[C@H](O)CN Amb24563564 [1,1,0,0,0,0|2,0,0]=4 3136 B7R0.10 C=C[C@H](F)[C@@H](O)CO Amb25317504 [1,1,0,0,0,0|2,0,0]=4 3137 B7R0.10 C=C[C@H](N)[C@@H](O)CO Amb25727169 [1,1,0,0,0,0|1,0,0]=3 3138 B7R0.10 C=C[C@H](O)[C@@H](O)C=O Amb25733477 [1,1,0,0,0,0|1,0,1]=4 3139 B7R0.10 C=C[C@H](O)[C@@H](O)CO Amb25280157 [1,1,0,0,0,0|2,0,0]=4 3140 B7R0.10 C=C[C@H](O)[C@H](O)CCl Amb24360256 [1,1,0,0,0,0|2,0,0]=4 3141 B7R0.10 C=C[C@H](O)[C@H](O)CN Amb25083127 [1,1,0,0,0,0|2,0,0]=4 3142 B7R0.10 CC(C#N)C(N)CO Amb25731562 [1,1,0,0,0,0|1,0,1]=4 3143 B7R0.10 CC(C(=O)NN)CC Amb1124144 [1,1,0,0,0,0|2,0,0]=4 3144 B7R0.10 CC(C(=O)OC)CN Amb13952562 [1,1,0,0,0,0|2,0,0]=4 3145 B7R0.10 CC(C=C)C(O)CCl Amb25062901 [1,1,0,0,0,0|2,0,0]=4 3146 B7R0.10 CC(C=C)C(O)CO Amb24749640 [1,1,0,0,0,0|2,0,0]=4 3147 B7R0.10 CC(C=C)[C@H](O)CC Amb24506540 [1,1,0,0,0,0|2,0,0]=4 3148 B7R0.10 CC(C=O)C(C)C=O Amb18641795 [1,1,0,0,0,0|1,0,1]=4 3149 B7R0.10 CC(C=O)C(O)C=C Amb24481507 [1,1,0,0,0,0|1,0,1]=4 3150 B7R0.10 CC(C=O)C(S)CC Amb22229341 [1,1,0,0,0,0|1,1,0]=4 3151 B7R0.10 CC(C=O)[C@H](O)CC Amb25827452 [1,1,0,0,0,0|1,0,0]=3 3152 B7R0.10 CC(CC)C(=O)CC Amb22229845 [1,1,0,0,0,0|2,0,0]=4 3153 B7R0.10 CC(CC)C(Cl)C=O Amb25274320 [1,1,0,0,0,0|2,0,0]=4 3154 B7R0.10 CC(CC)C(F)C=O Amb24334085 [1,1,0,0,0,0|2,0,0]=4 3155 B7R0.10 CC(CC)C(N)CO Amb19267092 [1,1,0,0,0,0|1,0,1]=4 3156 B7R0.10 CC(CC)[C@@H](N)CO Amb18015117 [1,1,0,0,0,0|1,0,1]=4 3157 B7R0.10 CC(CC)[C@@H](N)CO Amb22800764 [1,1,0,0,0,0|1,0,1]=4 3158 B7R0.10 CC(CCl)C(=O)NO Amb24659587 [1,1,0,0,0,0|2,0,0]=4 3159 B7R0.10 CC(CO)C(=C)CO Amb25832740 [1,1,0,0,0,0|2,0,0]=4 3160 B7R0.10 CC(CO)C(=O)C=C Amb25370664 [1,1,0,0,0,0|2,0,0]=4 3161 B7R0.10 CC(CO)C(N)C=C Amb24482467 [1,1,0,0,0,0|1,0,0]=3 3162 B7R0.10 CC(CO)C(O)CC Amb24461954 [1,1,0,0,0,0|1,0,1]=4 3163 B7R0.10 CC(CO)C(O)CCl Amb25783961 [1,1,0,0,0,0|1,0,1]=4 3164 B7R0.10 CC(CO)N(C)C=O Amb25803142 [1,1,0,0,0,0|2,0,0]=4 3165 B7R0.10 CC(CO)N(O)N=O Amb24367422 [1,1,0,0,0,0|2,0,0]=4 3166 B7R0.10 CC(NO)C(O)CC Amb25859360 [1,1,0,0,0,0|2,0,0]=4 3167 B7R0.10 CC(OC)C(C)C=O Amb18641882 [1,1,0,0,0,0|1,0,0]=3 3168 B7R0.10 CC(OC)C(N)C#C Amb24332078 [1,1,0,0,0,0|1,0,1]=4 3169 B7R0.10 CC(OC)C(N)CO Amb24693968 [1,1,0,0,0,0|0,0,1]=3 3170 B7R0.10 CC(OC)C(O)C=C Amb25077372 [1,1,0,0,0,0|2,0,0]=4 3171 B7R0.10 CC(OC)C(O)CO Amb25769768 [1,1,0,0,0,0|1,0,1]=4 3172 B7R0.10 CC(SC)C(C)C=O Amb24706814 [1,1,0,0,0,0|1,1,0]=4 3173 B7R0.10 CCC(=C)C(=O)OC Amb24469857 [1,1,0,0,0,0|1,0,1]=4 3174 B7R0.10 CCC(=O)C(=O)NO Amb25304726 [1,1,0,0,0,0|1,0,1]=4 3175 B7R0.10 CCC(=O)C(=O)OC Amb17935757 [1,1,0,0,0,0|1,0,1]=4 3176 B7R0.10 CCC(=O)C(C)CO Amb25371915 [1,1,0,0,0,0|2,0,0]=4 3177 B7R0.10 CCC(=O)C(CC)Cl Amb17593422 [1,1,0,0,0,0|2,0,0]=4 3178 B7R0.10 CCC(=O)C(N)CC Amb18203255 [1,1,0,0,0,0|1,0,0]=3 3179 B7R0.10 CCC(=O)C(S)CC Amb25801155 [1,1,0,0,0,0|2,0,0]=4 3180 B7R0.10 CCC(=O)[C@@H](O)CC Amb24724312 [1,1,0,0,0,0|2,0,0]=4 3181 B7R0.10 CCC(=O)[C@@H](O)CO Amb25346866 [1,1,0,0,0,0|2,0,0]=4 3182 B7R0.10 CCC(=O)[C@H](O)CC Amb24333825 [1,1,0,0,0,0|2,0,0]=4 3183 B7R0.10 CCC(=O)[C@H](O)CO Amb24364207 [1,1,0,0,0,0|2,0,0]=4 3184 B7R0.10 CCC(Br)C(=O)C#N Amb24390870 [1,1,0,0,0,0|2,0,0]=4 3185 B7R0.10 CCC(Br)C(=O)CCl Amb24483130 [1,1,0,0,0,0|2,0,0]=4 3186 B7R0.10 CCC(Br)C(=O)NC Amb18181033 [1,1,0,0,0,0|2,0,0]=4 3187 B7R0.10 CCC(Br)C(=O)SC Amb24692936 [1,1,0,0,0,0|1,1,0]=4 3188 B7R0.10 CCC(C(=O)OC)Br Amb1157544 [1,1,0,0,0,0|1,0,0]=3 3189 B7R0.10 CCC(C(=O)OC)N Amb17601372 [1,1,0,0,0,0|0,0,0]=2 3190 B7R0.10 CCC(C(C=O)C)O Amb17593201 [1,1,0,0,0,0|1,0,0]=3 3191 B7R0.10 CCC(C(OC)C)N Amb1128200 [1,1,0,0,0,0|1,0,1]=4 3192 B7R0.10 CCC(C)C(=C)C=O Amb18641701 [1,1,0,0,0,0|2,0,0]=4 3193 B7R0.10 CCC(C)C(=N)OC Amb20623203 [1,1,0,0,0,0|2,0,0]=4 3194 B7R0.10 CCC(C)C(=O)C#C Amb25745951 [1,1,0,0,0,0|2,0,0]=4 3195 B7R0.10 CCC(C)C(=O)C=O Amb24481549 [1,1,0,0,0,0|1,0,1]=4 3196 B7R0.10 CCC(C)C(=O)CBr Amb24483169 [1,1,0,0,0,0|2,0,0]=4 3197 B7R0.10 CCC(C)C(=O)CCl Amb20667851 [1,1,0,0,0,0|2,0,0]=4 3198 B7R0.10 CCC(C)C(=O)CF Amb25736326 [1,1,0,0,0,0|2,0,0]=4 3199 B7R0.10 CCC(C)C(=O)CO Amb24680373 [1,1,0,0,0,0|1,0,0]=3 3200 B7R0.10 CCC(C)C(=O)SC Amb22168284 [1,1,0,0,0,0|1,1,0]=4 3201 B7R0.10 CCC(C)C(C)C=O Amb18641810 [1,1,0,0,0,0|2,0,0]=4 3202 B7R0.10 CCC(C)\C(\N)=N\O Amb19516921 [1,1,0,0,0,0|2,0,0]=4 3203 B7R0.10 CCC(C)\C(\N)=N\O Amb22586630 [1,1,0,0,0,0|2,0,0]=4 3204 B7R0.10 CCC(Cl)C(=O)CBr Amb24577526 [1,1,0,0,0,0|2,0,0]=4 3205 B7R0.10 CCC(Cl)C(=O)CCl Amb25265568 [1,1,0,0,0,0|2,0,0]=4 3206 B7R0.10 CCC(Cl)C(=O)NCl Amb24449533 [1,1,0,0,0,0|2,0,0]=4 3207 B7R0.10 CCC(Cl)C(=O)OC Amb21618748 [1,1,0,0,0,0|1,0,0]=3 3208 B7R0.10 CCC(Cl)C(=O)OF Amb24483107 [1,1,0,0,0,0|1,0,0]=3 3209 B7R0.10 CCC(Cl)C(C)=NO Amb24661921 [1,1,0,0,0,0|2,0,0]=4 3210 B7R0.10 CCC(F)C(=O)CBr Amb25359543 [1,1,0,0,0,0|2,0,0]=4 3211 B7R0.10 CCC(N)C(=O)NC Amb22587219 [1,1,0,0,0,0|1,0,0]=3 3212 B7R0.10 CCC(N)C(=O)NN Amb18061942 [1,1,0,0,0,0|1,0,0]=3 3213 B7R0.10 CCC(N)C(=O)NO Amb21922881 [1,1,0,0,0,0|0,0,0]=2 3214 B7R0.10 CCC(N)C(=O)OC Amb22349873 [1,1,0,0,0,0|0,0,0]=2 3215 B7R0.10 CCC(N)C(O)CC Amb18641928 [1,1,0,0,0,0|1,0,1]=4 3216 B7R0.10 CCC(N)C(O)CF Amb25727496 [1,1,0,0,0,0|1,0,1]=4 3217 B7R0.10 CCC(O)C(=C)CO Amb25369426 [1,1,0,0,0,0|2,0,0]=4 3218 B7R0.10 CCC(O)C(=N)OC Amb24617831 [1,1,0,0,0,0|2,0,0]=4 3219 B7R0.10 CCC(O)C(=O)C#C Amb25050768 [1,1,0,0,0,0|2,0,0]=4 3220 B7R0.10 CCC(O)C(=O)C=O Amb24722957 [1,1,0,0,0,0|1,0,1]=4 3221 B7R0.10 CCC(O)C(=O)SC Amb25257037 [1,1,0,0,0,0|1,1,0]=4 3222 B7R0.10 CCC(O)C(O)CO Amb24642404 [1,1,0,0,0,0|1,0,1]=4 3223 B7R0.10 CCC(O)[C@H](O)CO Amb24352310 [1,1,0,0,0,0|1,0,1]=4 3224 B7R0.10 CCC(S)C(=O)NN Amb25189705 [1,1,0,0,0,0|2,0,0]=4 3225 B7R0.10 CC[C@@H](C)C(=O)OC Amb24549105 [1,1,0,0,0,0|1,0,0]=3 3226 B7R0.10 CC[C@@H](C)[C@@H](N)CO Amb17678825 [1,1,0,0,0,0|1,0,1]=4 3227 B7R0.10 CC[C@@H](C)[C@H](C)C=O Amb25062588 [1,1,0,0,0,0|2,0,0]=4 3228 B7R0.10 CC[C@@H](N)C(=O)NN Amb24483099 [1,1,0,0,0,0|1,0,0]=3 3229 B7R0.10 CC[C@@H](N)C(=O)OC Amb19944650 [1,1,0,0,0,0|0,0,0]=2 3230 B7R0.10 CC[C@@H](N)C(=O)OC Amb22057548 [1,1,0,0,0,0|0,0,0]=2 3231 B7R0.10 CC[C@@H](N)[C@@H](O)CC Amb25835253 [1,1,0,0,0,0|1,0,1]=4 3232 B7R0.10 CC[C@@H](O)C(=O)OC Amb22746930 [1,1,0,0,0,0|1,0,0]=3 3233 B7R0.10 CC[C@@H](O)[C@@H](Cl)C=C Amb24693772 [1,1,0,0,0,0|2,0,0]=4 3234 B7R0.10 CC[C@@H](O)[C@@H](N)CO Amb25131931 [1,1,0,0,0,0|0,0,1]=3 3235 B7R0.10 CC[C@@H](O)[C@@H](O)C=C Amb25141223 [1,1,0,0,0,0|2,0,0]=4 3236 B7R0.10 CC[C@@H](O)[C@@H](O)CO Amb24354362 [1,1,0,0,0,0|1,0,1]=4 3237 B7R0.10 CC[C@H](C)C(=C)CO Amb25270604 [1,1,0,0,0,0|2,0,0]=4 3238 B7R0.10 CC[C@H](C)C(=O)C#C Amb25830032 [1,1,0,0,0,0|2,0,0]=4 3239 B7R0.10 CC[C@H](C)C(=O)C=C Amb25052297 [1,1,0,0,0,0|2,0,0]=4 3240 B7R0.10 CC[C@H](C)C(=O)CCl Amb24578496 [1,1,0,0,0,0|2,0,0]=4 3241 B7R0.10 CC[C@H](C)C(=O)NN Amb24423489 [1,1,0,0,0,0|2,0,0]=4 3242 B7R0.10 CC[C@H](F)[C@H](N)CO Amb25197755 [1,1,0,0,0,0|1,0,1]=4 3243 B7R0.10 CC[C@H](N)C(=O)NC Amb25259660 [1,1,0,0,0,0|1,0,0]=3 3244 B7R0.10 CC[C@H](N)C(=O)OC Amb22167154 [1,1,0,0,0,0|0,0,0]=2 3245 B7R0.10 CC[C@H](N)C(O)CC Amb24683759 [1,1,0,0,0,0|1,0,1]=4 3246 B7R0.10 CC[C@H](N)[C@@H](O)CC Amb24453099 [1,1,0,0,0,0|1,0,1]=4 3247 B7R0.10 CC[C@H](N)[C@H](O)CC Amb25378124 [1,1,0,0,0,0|1,0,1]=4 3248 B7R0.10 CC[C@H](O)[C@@H](N)CO Amb25722027 [1,1,0,0,0,0|0,0,1]=3 3249 B7R0.10 CC[C@H](O)[C@@H](O)C=C Amb25092001 [1,1,0,0,0,0|2,0,0]=4 3250 B7R0.10 CC[C@H](O)[C@@H](O)CO Amb25024752 [1,1,0,0,0,0|1,0,1]=4 3251 B7R0.10 CC[C@H](O)[C@H](N)C=C Amb25259236 [1,1,0,0,0,0|1,0,0]=3 3252 B7R0.10 CC[C@H](O)[C@H](O)C=C Amb24588296 [1,1,0,0,0,0|2,0,0]=4 3253 B7R0.10 CNC(=O)C(N)CO Amb18641958 [1,1,0,0,0,0|1,0,0]=3 3254 B7R0.10 CNC(=O)C(N)CS Amb24729394 [1,1,0,0,0,0|1,1,0]=4 3255 B7R0.10 CNC(=O)[C@@H](N)CO Amb22899002 [1,1,0,0,0,0|1,0,0]=3 3256 B7R0.10 CNC(=O)[C@@H](N)CO Amb24120441 [1,1,0,0,0,0|1,0,0]=3 3257 B7R0.10 CNC(=O)[C@@H](N)CS Amb24524250 [1,1,0,0,0,0|1,1,0]=4 3258 B7R0.10 CNC(C)C(=O)OC Amb18299580 [1,1,0,0,0,0|2,0,0]=4 3259 B7R0.10 CNC(C)C(=O)OC Amb21961535 [1,1,0,0,0,0|2,0,0]=4 3260 B7R0.10 CN[C@@H](C)C(=O)OC Amb22587553 [1,1,0,0,0,0|2,0,0]=4 3261 B7R0.10 CN[C@@H](C)C(=O)OC Amb22745401 [1,1,0,0,0,0|2,0,0]=4 3262 B7R0.10 CN[C@H](C)C(=O)OC Amb22587562 [1,1,0,0,0,0|2,0,0]=4 3263 B7R0.10 COC(=N)C(N)C=O Amb25340734 [1,1,0,0,0,0|1,0,1]=4 3264 B7R0.10 COC(=O)C(=C)CO Amb17933844 [1,1,0,0,0,0|1,0,1]=4 3265 B7R0.10 COC(=O)C(Br)CO Amb22491520 [1,1,0,0,0,0|1,0,0]=3 3266 B7R0.10 COC(=O)C(Br)CS Amb25831266 [1,1,0,0,0,0|1,1,0]=4 3267 B7R0.10 COC(=O)C(Br)OC Amb21964964 [1,1,0,0,0,0|2,0,0]=4 3268 B7R0.10 COC(=O)C(C)CBr Amb23440928 [1,1,0,0,0,0|2,0,0]=4 3269 B7R0.10 COC(=O)C(C)CI Amb25114121 [1,1,0,0,0,0|2,0,0]=4 3270 B7R0.10 COC(=O)C(C)CS Amb17673607 [1,1,0,0,0,0|1,1,0]=4 3271 B7R0.10 COC(=O)C(C)SC Amb22043309 [1,1,0,0,0,0|2,0,0]=4 3272 B7R0.10 COC(=O)C(CCl)N Amb1019565 [1,1,0,0,0,0|1,0,0]=3 3273 B7R0.10 COC(=O)C(CCl)N Amb10601654 [1,1,0,0,0,0|1,0,0]=3 3274 B7R0.10 COC(=O)C(CF)Br Amb10605572 [1,1,0,0,0,0|2,0,0]=4 3275 B7R0.10 COC(=O)C(CO)Cl Amb10605503 [1,1,0,0,0,0|1,0,0]=3 3276 B7R0.10 COC(=O)C(Cl)OC Amb22388783 [1,1,0,0,0,0|2,0,0]=4 3277 B7R0.10 COC(=O)C(F)CCl Amb22735421 [1,1,0,0,0,0|2,0,0]=4 3278 B7R0.10 COC(=O)C(F)CF Amb25246790 [1,1,0,0,0,0|2,0,0]=4 3279 B7R0.10 COC(=O)C(F)CN Amb25241379 [1,1,0,0,0,0|2,0,0]=4 3280 B7R0.10 COC(=O)C(F)CO Amb22235114 [1,1,0,0,0,0|1,0,0]=3 3281 B7R0.10 COC(=O)C(I)CN Amb25189042 [1,1,0,0,0,0|2,0,0]=4 3282 B7R0.10 COC(=O)C(N)C#N Amb23400152 [1,1,0,0,0,0|1,0,1]=4 3283 B7R0.10 COC(=O)C(N)C#N Amb23402903 [1,1,0,0,0,0|1,0,1]=4 3284 B7R0.10 COC(=O)C(N)C#N Amb23437075 [1,1,0,0,0,0|1,0,1]=4 3285 B7R0.10 COC(=O)C(N)C=C Amb24427259 [1,1,0,0,0,0|0,0,2]=4 3286 B7R0.10 COC(=O)C(N)CBr Amb25701710 [1,1,0,0,0,0|1,0,0]=3 3287 B7R0.10 COC(=O)C(N)CF Amb24482199 [1,1,0,0,0,0|1,0,0]=3 3288 B7R0.10 COC(=O)C(N)CN Amb18641956 [1,1,0,0,0,0|1,0,0]=3 3289 B7R0.10 COC(=O)C(N)CO Amb22489451 [1,1,0,0,0,0|0,0,0]=2 3290 B7R0.10 COC(=O)C(N)OC Amb24401525 [1,1,0,0,0,0|1,0,0]=3 3291 B7R0.10 COC(=O)C(O)CBr Amb25757463 [1,1,0,0,0,0|2,0,0]=4 3292 B7R0.10 COC(=O)C(O)CCl Amb22261563 [1,1,0,0,0,0|2,0,0]=4 3293 B7R0.10 COC(=O)C(O)CF Amb25734186 [1,1,0,0,0,0|2,0,0]=4 3294 B7R0.10 COC(=O)C(O)CN Amb22058759 [1,1,0,0,0,0|2,0,0]=4 3295 B7R0.10 COC(=O)C(O)SC Amb24362213 [1,1,0,0,0,0|2,0,0]=4 3296 B7R0.10 COC(=O)C(OC)O Amb17593224 [1,1,0,0,0,0|2,0,0]=4 3297 B7R0.10 COC(=O)C(S)CCl Amb24469139 [1,1,0,0,0,0|2,0,0]=4 3298 B7R0.10 COC(=O)C(S)CN Amb25271434 [1,1,0,0,0,0|2,0,0]=4 3299 B7R0.10 COC(=O)[C@@H](C)CBr Amb22225306 [1,1,0,0,0,0|2,0,0]=4 3300 B7R0.10 COC(=O)[C@@H](C)CI Amb23437667 [1,1,0,0,0,0|2,0,0]=4 3301 B7R0.10 COC(=O)[C@@H](CCl)N Amb10601655 [1,1,0,0,0,0|1,0,0]=3 3302 B7R0.10 COC(=O)[C@@H](Cl)CO Amb24739681 [1,1,0,0,0,0|1,0,0]=3 3303 B7R0.10 COC(=O)[C@@H](F)CN Amb24505312 [1,1,0,0,0,0|2,0,0]=4 3304 B7R0.10 COC(=O)[C@@H](N)C=C Amb25127988 [1,1,0,0,0,0|0,0,2]=4 3305 B7R0.10 COC(=O)[C@@H](N)CCl Amb24099304 [1,1,0,0,0,0|1,0,0]=3 3306 B7R0.10 COC(=O)[C@@H](N)CF Amb24600133 [1,1,0,0,0,0|1,0,0]=3 3307 B7R0.10 COC(=O)[C@@H](O)CBr Amb24529091 [1,1,0,0,0,0|2,0,0]=4 3308 B7R0.10 COC(=O)[C@@H](O)CN Amb24670217 [1,1,0,0,0,0|2,0,0]=4 3309 B7R0.10 COC(=O)[C@@H](O)CO Amb22226736 [1,1,0,0,0,0|1,0,0]=3 3310 B7R0.10 COC(=O)[C@H](C)CN Amb25317379 [1,1,0,0,0,0|2,0,0]=4 3311 B7R0.10 COC(=O)[C@H](CCl)N Amb10608842 [1,1,0,0,0,0|1,0,0]=3 3312 B7R0.10 COC(=O)[C@H](N)C=C Amb24376395 [1,1,0,0,0,0|0,0,2]=4 3313 B7R0.10 COC(=O)[C@H](N)CCl Amb25261480 [1,1,0,0,0,0|1,0,0]=3 3314 B7R0.10 COC(=O)[C@H](N)CF Amb24351631 [1,1,0,0,0,0|1,0,0]=3 3315 B7R0.10 COC(=O)[C@H](O)CBr Amb25783921 [1,1,0,0,0,0|2,0,0]=4 3316 B7R0.10 COC(=O)[C@H](O)CN Amb24073731 [1,1,0,0,0,0|2,0,0]=4 3317 B7R0.10 COC(=O)[C@H](O)CS Amb25098943 [1,1,0,0,0,0|1,1,0]=4 3318 B7R0.10 COC(=O)\C(\N)=N\O Amb22741276 [1,1,0,0,0,0|1,0,1]=4 3319 B7R0.10 COC(C)\C(\N)=N\O Amb19650787 [1,1,0,0,0,0|1,0,1]=4 3320 B7R0.10 COC(O)C(O)CO Amb24474148 [1,1,0,0,0,0|1,0,1]=4 3321 B7R0.10 CO[C@@H](C)C(N)=NO Amb24681093 [1,1,0,0,0,0|1,0,1]=4 3322 B7R0.10 CSC(=O)C(O)CO Amb25051310 [1,1,0,0,0,0|1,1,0]=4 3323 B7R0.10 C[C@@H](C(=O)OC)CBr Amb10844721 [1,1,0,0,0,0|2,0,0]=4 3324 B7R0.10 C[C@@H](C(=O)OC)CO Amb17615446 [1,1,0,0,0,0|1,0,0]=3 3325 B7R0.10 C[C@@H](C=C)[C@H](C)CO Amb24733215 [1,1,0,0,0,0|2,0,0]=4 3326 B7R0.10 C[C@@H](C=C)[C@H](O)CO Amb25045441 [1,1,0,0,0,0|2,0,0]=4 3327 B7R0.10 C[C@@H](C=O)[C@@H](C)C=O Amb25827162 [1,1,0,0,0,0|1,0,1]=4 3328 B7R0.10 C[C@@H](C=O)[C@H](O)CC Amb25223087 [1,1,0,0,0,0|1,0,0]=3 3329 B7R0.10 C[C@@H](CC)C(=O)CC Amb25735825 [1,1,0,0,0,0|2,0,0]=4 3330 B7R0.10 C[C@@H](CC)[C@H](Cl)C=O Amb24533977 [1,1,0,0,0,0|2,0,0]=4 3331 B7R0.10 C[C@@H](CO)[C@H](O)CC Amb24361979 [1,1,0,0,0,0|1,0,1]=4 3332 B7R0.10 C[C@@H](OC)[C@@H](C)C=O Amb25372033 [1,1,0,0,0,0|1,0,0]=3 3333 B7R0.10 C[C@@H](OC)[C@H](N)CO Amb25221786 [1,1,0,0,0,0|0,0,1]=3 3334 B7R0.10 C[C@H](C(=O)OC)CO Amb17615445 [1,1,0,0,0,0|1,0,0]=3 3335 B7R0.10 C[C@H](C=C)[C@H](O)CO Amb25802112 [1,1,0,0,0,0|2,0,0]=4 3336 B7R0.10 C[C@H](C=O)C(O)CC Amb25294541 [1,1,0,0,0,0|1,0,0]=3 3337 B7R0.10 C[C@H](C=O)[C@@H](C)C=O Amb25827161 [1,1,0,0,0,0|1,0,1]=4 3338 B7R0.10 C[C@H](C=O)[C@@H](C)CO Amb24418439 [1,1,0,0,0,0|1,0,0]=3 3339 B7R0.10 C[C@H](C=O)[C@@H](O)C=O Amb24502787 [1,1,0,0,0,0|1,0,1]=4 3340 B7R0.10 C[C@H](C=O)[C@H](C)C=O Amb24482506 [1,1,0,0,0,0|1,0,1]=4 3341 B7R0.10 C[C@H](C=O)[C@H](O)CC Amb25780605 [1,1,0,0,0,0|1,0,0]=3 3342 B7R0.10 C[C@H](CC)[C@@H](N)C=O Amb24731395 [1,1,0,0,0,0|1,0,0]=3 3343 B7R0.10 C[C@H](CC)[C@H](N)CO Amb25081749 [1,1,0,0,0,0|1,0,1]=4 3344 B7R0.10 C[C@H](CO)[C@@H](O)C=C Amb25801976 [1,1,0,0,0,0|2,0,0]=4 3345 B7R0.10 C[C@H](CO)[C@H](O)CC Amb24398245 [1,1,0,0,0,0|1,0,1]=4 3346 B7R0.10 C[C@H](CO)[C@H](O)CO Amb25357327 [1,1,0,0,0,0|1,0,1]=4 3347 B7R0.10 C[C@H](OC)[C@@H](C)C=O Amb24741787 [1,1,0,0,0,0|1,0,0]=3 3348 B7R0.10 C[C@H](OC)[C@H](C)C=O Amb24759162 [1,1,0,0,0,0|1,0,0]=3 3349 B7R0.10 C\C=C(/N)\C(=O)OC Amb25684543 [1,1,0,0,0,0|0,0,2]=4 3350 B7R0.10 N=C(NO)C(O)CO Amb25090215 [1,1,0,0,0,0|2,0,0]=4 3351 B7R0.10 NC(CO)C(=O)NO Amb22352399 [1,1,0,0,0,0|0,0,0]=2 3352 B7R0.10 NC(CO)C(=O)OBr Amb25102550 [1,1,0,0,0,0|0,0,0]=2 3353 B7R0.10 NC(CO)C(N)CO Amb24743310 [1,1,0,0,0,0|1,0,1]=4 3354 B7R0.10 NC(CO)C(O)CI Amb25680864 [1,1,0,0,0,0|0,0,1]=3 3355 B7R0.10 NC(CO)C(O)CO Amb18641994 [1,1,0,0,0,0|0,0,1]=3 3356 B7R0.10 NCC(O)C(O)CO Amb25775606 [1,1,0,0,0,0|1,0,1]=4 3357 B7R0.10 N[C@@H](CCl)C(=O)NO Amb22747830 [1,1,0,0,0,0|1,0,0]=3 3358 B7R0.10 N[C@@H](CO)C(=O)OBr Amb24665775 [1,1,0,0,0,0|0,0,0]=2 3359 B7R0.10 N[C@@H](CO)[C@@H](O)CO Amb25772184 [1,1,0,0,0,0|0,0,1]=3 3360 B7R0.10 N[C@H](C(=O)NN)CS Amb16231457 [1,1,0,0,0,0|1,1,0]=4 3361 B7R0.10 N[C@H](CO)C(=O)NO Amb24555900 [1,1,0,0,0,0|0,0,0]=2 3362 B7R0.10 N[C@H](CO)[C@H](O)CI Amb24476586 [1,1,0,0,0,0|0,0,1]=3 3363 B7R0.10 N[C@H](CO)[C@H](O)CO Amb25809433 [1,1,0,0,0,0|0,0,1]=3 3364 B7R0.10 OC(CCl)C(Cl)C=O Amb24575269 [1,1,0,0,0,0|1,0,0]=3 3365 B7R0.10 OC(CO)C(Br)CO Amb25376569 [1,1,0,0,0,0|1,0,1]=4 3366 B7R0.10 OCC(C(CO)C)C Amb17593215 [1,1,0,0,0,0|1,0,1]=4 3367 B7R0.10 OCC(O)C(O)=NO Amb25687962 [1,1,0,0,0,0|1,0,1]=4 3368 B7R0.10 OCC(O)C(O)CCl Amb25683508 [1,1,0,0,0,0|1,0,1]=4 3369 B7R0.10 OCC(O)[C@H](O)C=O Amb25733091 [1,1,0,0,0,0|1,0,0]=3 3370 B7R0.10 OC[C@@H](O)C(O)C=O Amb24481538 [1,1,0,0,0,0|1,0,0]=3 3371 B7R0.10 OC[C@@H](O)[C@H](O)C=O Amb22746428 [1,1,0,0,0,0|1,0,0]=3 3372 B7R0.10 OC[C@H](O)[C@@H](O)C=O Amb24481533 [1,1,0,0,0,0|1,0,0]=3 3373 B7R0.10 OC[C@H](O)[C@H](O)C=O Amb25839823 [1,1,0,0,0,0|1,0,0]=3 3374 B7R0.10 ONC(=O)C(Cl)CCl Amb24618974 [1,1,0,0,0,0|2,0,0]=4 3375 B7R0.10 O[C@@H](C=O)[C@@H](O)C=O Amb25309636 [1,1,0,0,0,0|1,0,1]=4 3376 B7R0.10 O[C@@H](CO)C(=O)CO Amb22337027 [1,1,0,0,0,0|1,0,0]=3 3377 B7R0.10 O[C@@H](CO)C(O)CO Amb25682221 [1,1,0,0,0,0|1,0,1]=4 3378 B7R0.10 O[C@@H](CO)[C@H](Br)CO Amb25359607 [1,1,0,0,0,0|1,0,1]=4 3379 B7R0.10 O[C@H](C=O)[C@@H](O)C=O Amb25046496 [1,1,0,0,0,0|1,0,1]=4 3380 B7R0.10 O[C@H](C=O)[C@H](O)C=O Amb24482037 [1,1,0,0,0,0|1,0,1]=4 3381 B7R0.10 O[C@H](CO)C(=O)CO Amb24628483 [1,1,0,0,0,0|1,0,0]=3 3382 B7R0.10 O[C@H](CO)[C@@H](S)CO Amb24407455 [1,1,0,0,0,0|1,0,1]=4 3383 B7R0.10 O[C@H](CO)[C@H](O)CO Amb20242423 [1,1,0,0,0,0|1,0,1]=4 3384 B7R0.13 C([2H])(C(C)C)(C=O)[2H] Amb10072161 [1,1,0,0,0,0|2,0,0]=4 3385 B7R0.13 CC(=O)C(C)(C)CO Amb24691506 [1,1,0,0,0,0|2,0,0]=4 3386 B7R0.13 CC(=O)C(C)(Cl)CO Amb24752373 [1,1,0,0,0,0|2,0,0]=4 3387 B7R0.13 CC(=O)C(C)(N)CO Amb25765120 [1,1,0,0,0,0|1,0,0]=3 3388 B7R0.13 CC(=O)C(Cl)(Cl)CO Amb24601361 [1,1,0,0,0,0|2,0,0]=4 3389 B7R0.13 CC(=O)C(F)(F)CO Amb25724409 [1,1,0,0,0,0|2,0,0]=4 3390 B7R0.13 CC(C(=O)N)(CC)N Amb13952193 [1,1,0,0,0,0|1,0,0]=3 3391 B7R0.13 CC(C(=O)O)(CC)N Amb2235200 [1,1,0,0,0,0|0,0,0]=2 3392 B7R0.13 CC(C)(CF)C(O)=O Amb22000679 [1,1,0,0,0,0|2,0,0]=4 3393 B7R0.13 CC(C)(CN)C(O)=O Amb22371031 [1,1,0,0,0,0|2,0,0]=4 3394 B7R0.13 CC(C)(NO)C(O)=O Amb24407386 [1,1,0,0,0,0|2,0,0]=4 3395 B7R0.13 CC(C)C(C)(C)C=O Amb18641812 [1,1,0,0,0,0|2,0,0]=4 3396 B7R0.13 CC(C)C(C)(N)C=C Amb24332394 [1,1,0,0,0,0|2,0,0]=4 3397 B7R0.13 CC(C)C(C)(N)CO Amb18286211 [1,1,0,0,0,0|1,0,1]=4 3398 B7R0.13 CC(C)C(C)(O)C=O Amb24383654 [1,1,0,0,0,0|2,0,0]=4 3399 B7R0.13 CC(C)C(Cl)(Cl)C=O Amb25063159 [1,1,0,0,0,0|2,0,0]=4 3400 B7R0.13 CC(C)C(F)(F)C=O Amb24664529 [1,1,0,0,0,0|2,0,0]=4 3401 B7R0.13 CC(C)[C@@](C)(N)CO Amb22503794 [1,1,0,0,0,0|1,0,1]=4 3402 B7R0.13 CC(C)[C@](C)(N)CO Amb22503795 [1,1,0,0,0,0|1,0,1]=4 3403 B7R0.13 CC(F)(CF)C(O)=O Amb24545976 [1,1,0,0,0,0|2,0,0]=4 3404 B7R0.13 CC(N)(C#C)C(O)=O Amb23504061 [1,1,0,0,0,0|0,0,2]=4 3405 B7R0.13 CC(N)(C=C)C(O)=O Amb18641826 [1,1,0,0,0,0|0,0,2]=4 3406 B7R0.13 CC(N)(CN)C(O)=O Amb25310586 [1,1,0,0,0,0|1,0,0]=3 3407 B7R0.13 CC(N)(CS)C(O)=O Amb18124446 [1,1,0,0,0,0|0,1,0]=3 3408 B7R0.13 CC(N)(CS)C(O)=O Amb24480151 [1,1,0,0,0,0|0,1,0]=3 3409 B7R0.13 CC(O)(CBr)C(O)=O Amb18522184 [1,1,0,0,0,0|2,0,0]=4 3410 B7R0.13 CC(O)(CN)C(O)=O Amb25378699 [1,1,0,0,0,0|2,0,0]=4 3411 B7R0.13 CC(O)(CO)C(O)=O Amb22270195 [1,1,0,0,0,0|1,0,0]=3 3412 B7R0.13 CC(O)(NO)C(O)=O Amb24482657 [1,1,0,0,0,0|2,0,0]=4 3413 B7R0.13 CC(O)C(C)(C)C=O Amb18641889 [1,1,0,0,0,0|1,0,0]=3 3414 B7R0.13 CC(O)C(C)(C)NO Amb25119921 [1,1,0,0,0,0|2,0,0]=4 3415 B7R0.13 CC(O)C(C)(F)CO Amb25745843 [1,1,0,0,0,0|1,0,1]=4 3416 B7R0.13 CC(O)C(C)(N)CO Amb24483101 [1,1,0,0,0,0|0,0,1]=3 3417 B7R0.13 CC(O)C(C)(O)CO Amb24642681 [1,1,0,0,0,0|1,0,1]=4 3418 B7R0.13 CC(O)C(C)(O)NO Amb24332280 [1,1,0,0,0,0|2,0,0]=4 3419 B7R0.13 CC(O)C(Cl)(Cl)C=C Amb24397493 [1,1,0,0,0,0|2,0,0]=4 3420 B7R0.13 CCC(C(=O)C)(O)C Amb17593200 [1,1,0,0,0,0|2,0,0]=4 3421 B7R0.13 CCC(C(=O)O)(F)F Amb10982488 [1,1,0,0,0,0|1,0,0]=3 3422 B7R0.13 CCC(C)(Br)C(=O)Br Amb24061144 [1,1,0,0,0,0|2,0,0]=4 3423 B7R0.13 CCC(C)(Br)C(=O)Cl Amb25127778 [1,1,0,0,0,0|2,0,0]=4 3424 B7R0.13 CCC(C)(Br)C(C)=O Amb24570848 [1,1,0,0,0,0|2,0,0]=4 3425 B7R0.13 CCC(C)(Br)C(N)=O Amb25111192 [1,1,0,0,0,0|2,0,0]=4 3426 B7R0.13 CCC(C)(Br)C(O)=O Amb22228657 [1,1,0,0,0,0|1,0,0]=3 3427 B7R0.13 CCC(C)(C)C(=O)S Amb22734427 [1,1,0,0,0,0|1,1,0]=4 3428 B7R0.13 CCC(C)(Cl)C(C)=O Amb24434571 [1,1,0,0,0,0|2,0,0]=4 3429 B7R0.13 CCC(C)(Cl)C(O)=O Amb25730682 [1,1,0,0,0,0|1,0,0]=3 3430 B7R0.13 CCC(C)(F)C(O)=O Amb24481385 [1,1,0,0,0,0|1,0,0]=3 3431 B7R0.13 CCC(C)(N)C(C)=O Amb25857157 [1,1,0,0,0,0|1,0,0]=3 3432 B7R0.13 CCC(C)(N)C(N)=N Amb25835758 [1,1,0,0,0,0|2,0,0]=4 3433 B7R0.13 CCC(C)(N)C(N)=O Amb18949646 [1,1,0,0,0,0|1,0,0]=3 3434 B7R0.13 CCC(C)(N)C(N)=S Amb24387902 [1,1,0,0,0,0|1,1,0]=4 3435 B7R0.13 CCC(C)(N)P(O)=O Amb24505272 [1,1,0,0,0,0|1,0,0]=3 3436 B7R0.13 CCC(C)(O)C(N)=O Amb24116738 [1,1,0,0,0,0|2,0,0]=4 3437 B7R0.13 CCC(Cl)(Cl)C(C)=O Amb25714198 [1,1,0,0,0,0|2,0,0]=4 3438 B7R0.13 CCC(Cl)(Cl)C(O)=O Amb25274946 [1,1,0,0,0,0|1,0,0]=3 3439 B7R0.13 CCC(F)(Cl)C(C)=O Amb24575964 [1,1,0,0,0,0|2,0,0]=4 3440 B7R0.13 CCC(F)(F)C(N)=O Amb24054261 [1,1,0,0,0,0|2,0,0]=4 3441 B7R0.13 CCC(F)(F)C([O-])=O Amb19889420 [1,1,0,0,0,0|1,0,1]=4 3442 B7R0.13 CCC(O)(O)C(N)=O Amb24419277 [1,1,0,0,0,0|2,0,0]=4 3443 B7R0.13 CC[C@@](C)(N)C(O)=O Amb19929605 [1,1,0,0,0,0|0,0,0]=2 3444 B7R0.13 CC[C@@](C)(O)C(C)=O Amb24481445 [1,1,0,0,0,0|2,0,0]=4 3445 B7R0.13 CC[C@@](C)(O)C(N)=O Amb24668764 [1,1,0,0,0,0|2,0,0]=4 3446 B7R0.13 CC[C@@](C)(O)C([O-])=O Amb17772231 [1,1,0,0,0,0|1,0,1]=4 3447 B7R0.13 CC[C@](C)(Cl)C(O)=O Amb24402244 [1,1,0,0,0,0|1,0,0]=3 3448 B7R0.13 CNC(C)(F)C(O)=O Amb25225635 [1,1,0,0,0,0|2,0,0]=4 3449 B7R0.13 CN[C@@](C)(F)C(O)=O Amb25697457 [1,1,0,0,0,0|2,0,0]=4 3450 B7R0.13 CN[C@](C)(F)C(O)=O Amb25085415 [1,1,0,0,0,0|2,0,0]=4 3451 B7R0.13 COC(C)(N)C(C)=O Amb24608852 [1,1,0,0,0,0|2,0,0]=4 3452 B7R0.13 COC(C)(S)C(O)=O Amb25201636 [1,1,0,0,0,0|2,0,0]=4 3453 B7R0.13 CSC(C(=O)O)(C)C Amb17501488 [1,1,0,0,0,0|2,0,0]=4 3454 B7R0.13 CSC(F)(F)C(O)=O Amb23586472 [1,1,0,0,0,0|2,0,0]=4 3455 B7R0.13 C[C@@H](O)C(C)(C)C=C Amb25711646 [1,1,0,0,0,0|2,0,0]=4 3456 B7R0.13 C[C@@](C(=O)O)(CC)N Amb16183896 [1,1,0,0,0,0|0,0,0]=2 3457 B7R0.13 C[C@@](C(=O)O)(CC)O Amb10067076 [1,1,0,0,0,0|1,0,0]=3 3458 B7R0.13 C[C@@](N)(CF)C(O)=O Amb25169596 [1,1,0,0,0,0|1,0,0]=3 3459 B7R0.13 C[C@@](N)(CS)C(O)=O Amb22757501 [1,1,0,0,0,0|0,1,0]=3 3460 B7R0.13 C[C@@](O)(CN)C(O)=O Amb24698181 [1,1,0,0,0,0|2,0,0]=4 3461 B7R0.13 C[C@H](O)C(C)(C)C=C Amb25206471 [1,1,0,0,0,0|2,0,0]=4 3462 B7R0.13 C[C@H](O)[C@@](C)(O)CO Amb24333575 [1,1,0,0,0,0|1,0,1]=4 3463 B7R0.13 C[C@H](O)[C@](C)(F)CO Amb24474590 [1,1,0,0,0,0|1,0,1]=4 3464 B7R0.13 C[C@H](O)[C@](C)(O)CO Amb25832648 [1,1,0,0,0,0|1,0,1]=4 3465 B7R0.13 C[C@](C(=O)O)(CBr)O Amb17610012 [1,1,0,0,0,0|2,0,0]=4 3466 B7R0.13 C[C@](C(=O)O)(CC)O Amb10067075 [1,1,0,0,0,0|1,0,0]=3 3467 B7R0.13 C[C@](C(=O)O)(CS)N Amb16183893 [1,1,0,0,0,0|0,1,0]=3 3468 B7R0.13 C[C@](F)(CN)C(O)=O Amb25110675 [1,1,0,0,0,0|2,0,0]=4 3469 B7R0.13 C[C@](N)(C#C)C(O)=O Amb24406693 [1,1,0,0,0,0|0,0,2]=4 3470 B7R0.13 C[C@](N)(C=C)C(O)=O Amb24481465 [1,1,0,0,0,0|0,0,2]=4 3471 B7R0.13 C[C@](N)(CF)C(O)=O Amb25775618 [1,1,0,0,0,0|1,0,0]=3 3472 B7R0.13 C[C@](N)(CN)C(O)=O Amb25690446 [1,1,0,0,0,0|1,0,0]=3 3473 B7R0.13 C[C@](N)(CS)C(O)=O Amb22388665 [1,1,0,0,0,0|0,1,0]=3 3474 B7R0.13 C[C@](N)(CS)C(O)=O Amb24053489 [1,1,0,0,0,0|0,1,0]=3 3475 B7R0.13 C[C@](O)(CBr)C(O)=O Amb22224875 [1,1,0,0,0,0|2,0,0]=4 3476 B7R0.13 C[C@](O)(CO)C(O)=O Amb25173833 [1,1,0,0,0,0|1,0,0]=3 3477 B7R0.13 C[C@](O)(NO)C(O)=O Amb24412529 [1,1,0,0,0,0|2,0,0]=4 3478 B7R0.13 NC(=O)C(F)(F)CO Amb25378711 [1,1,0,0,0,0|2,0,0]=4 3479 B7R0.13 NC(N)(CS)C(O)=O Amb24746383 [1,1,0,0,0,0|0,1,0]=3 3480 B7R0.13 NC(O)(CS)C(O)=O Amb25211789 [1,1,0,0,0,0|0,1,0]=3 3481 B7R0.13 NCC(F)(F)C(O)=O Amb19888004 [1,1,0,0,0,0|2,0,0]=4 3482 B7R0.13 O=CC(C(Cl)C)(Cl)Cl Amb16233584 [1,1,0,0,0,0|2,0,0]=4 3483 B7R0.13 OC(=O)C(Cl)(Cl)CCl Amb22731239 [1,1,0,0,0,0|2,0,0]=4 3484 B7R0.13 OC(=O)C(F)(Cl)CCl Amb25189030 [1,1,0,0,0,0|2,0,0]=4 3485 B7R0.13 OC(=O)C(F)(F)CF Amb25711017 [1,1,0,0,0,0|2,0,0]=4 3486 B7R0.13 OCC(C(=O)O)(F)F Amb17593305 [1,1,0,0,0,0|1,0,0]=3 3487 B7R0.14 CC(C)(C)C(Br)C=O Amb18127551 [1,1,0,0,0,0|2,0,0]=4 3488 B7R0.14 CC(C)(C)C(F)C=O Amb25189018 [1,1,0,0,0,0|2,0,0]=4 3489 B7R0.14 CC(C)(C)C(N)CO Amb19338133 [1,1,0,0,0,0|1,0,1]=4 3490 B7R0.14 CC(C)(C)C(O)C=O Amb18641888 [1,1,0,0,0,0|2,0,0]=4 3491 B7R0.14 CC(C)(C)[C@H](Br)C=O Amb24483298 [1,1,0,0,0,0|2,0,0]=4 3492 B7R0.14 CC(C)(C)[C@H](N)CO Amb22349422 [1,1,0,0,0,0|1,0,1]=4 3493 B7R0.14 CC(C)(C)[C@H](O)C=O Amb25093762 [1,1,0,0,0,0|2,0,0]=4 3494 B7R0.14 CC(C)(F)C(N)CO Amb25075200 [1,1,0,0,0,0|1,0,1]=4 3495 B7R0.14 CC(C)(O)C(=C)C=O Amb18641797 [1,1,0,0,0,0|1,0,1]=4 3496 B7R0.14 CC(C)(O)C(=O)C=O Amb24640374 [1,1,0,0,0,0|1,0,1]=4 3497 B7R0.14 CC(C)(O)C(Br)CO Amb25201013 [1,1,0,0,0,0|1,0,1]=4 3498 B7R0.14 CC(C)(O)C(Cl)CO Amb20620744 [1,1,0,0,0,0|1,0,1]=4 3499 B7R0.14 CC(C)(O)C(N)C=C Amb25104795 [1,1,0,0,0,0|1,0,0]=3 3500 B7R0.14 CC(C)(O)C(O)C=C Amb25332376 [1,1,0,0,0,0|2,0,0]=4 3501 B7R0.14 CC(C)(O)C(O)C=O Amb25313089 [1,1,0,0,0,0|1,0,0]=3 3502 B7R0.14 CC(C)(O)C(O)CO Amb24404708 [1,1,0,0,0,0|1,0,1]=4 3503 B7R0.14 CC(C)(O)[C@@H](O)CO Amb24733946 [1,1,0,0,0,0|1,0,1]=4 3504 B7R0.14 CC(C)(O)[C@H](N)CO Amb25132177 [1,1,0,0,0,0|0,0,1]=3 3505 B7R0.14 CC(C=O)C(C)(C)F Amb24694360 [1,1,0,0,0,0|2,0,0]=4 3506 B7R0.14 CC(C=O)C(C)(F)F Amb25026843 [1,1,0,0,0,0|2,0,0]=4 3507 B7R0.14 CC(CO)P(O)(O)=O Amb25135495 [1,1,0,0,0,0|2,0,0]=4 3508 B7R0.14 CC(CO)S(O)(=O)=O Amb25285698 [1,1,0,0,0,0|2,0,0]=4 3509 B7R0.14 CC(F)(F)C(N)C=C Amb25339149 [1,1,0,0,0,0|2,0,0]=4 3510 B7R0.14 CC(F)(F)C(N)CO Amb25207871 [1,1,0,0,0,0|1,0,1]=4 3511 B7R0.14 CCC(C)S(O)(=O)=O Amb22372234 [1,1,0,0,0,0|2,0,0]=4 3512 B7R0.14 CCC(Cl)S(O)(=O)=O Amb24627108 [1,1,0,0,0,0|2,0,0]=4 3513 B7R0.14 CCC(N)C(C)(C)O Amb18198391 [1,1,0,0,0,0|1,0,1]=4 3514 B7R0.14 CCC(N)C(N)(O)O Amb25810948 [1,1,0,0,0,0|0,0,2]=4 3515 B7R0.14 CCC(N)S(O)(=O)=O Amb24558367 [1,1,0,0,0,0|1,0,0]=3 3516 B7R0.14 CCC(O)P(O)(O)=O Amb24354457 [1,1,0,0,0,0|2,0,0]=4 3517 B7R0.14 CCC(P(=O)(O)O)C Amb10560197 [1,1,0,0,0,0|2,0,0]=4 3518 B7R0.14 CC[C@@H](Cl)P(O)(O)=O Amb24332616 [1,1,0,0,0,0|2,0,0]=4 3519 B7R0.14 CC[C@@H](N)C(C)(C)O Amb25800412 [1,1,0,0,0,0|1,0,1]=4 3520 B7R0.14 CC[C@H](N)C(C)(C)O Amb25131729 [1,1,0,0,0,0|1,0,1]=4 3521 B7R0.14 CP(O)(=O)C(N)CO Amb25809584 [1,1,0,0,0,0|1,0,0]=3 3522 B7R0.14 C[C@@H](C=O)C(C)(C)O Amb24690253 [1,1,0,0,0,0|1,0,0]=3 3523 B7R0.14 C[C@@H](CO)C(C)(C)O Amb22737257 [1,1,0,0,0,0|1,0,1]=4 3524 B7R0.14 C[C@H](C=O)C(C)(C)C Amb25690808 [1,1,0,0,0,0|2,0,0]=4 3525 B7R0.14 NC(CBr)P(O)(O)=O Amb24374007 [1,1,0,0,0,0|2,0,0]=4 3526 B7R0.14 NC(CF)P(O)(O)=O Amb25117594 [1,1,0,0,0,0|2,0,0]=4 3527 B7R0.14 NC(CS)P(O)(O)=O Amb24740823 [1,1,0,0,0,0|1,1,0]=4 3528 B7R0.14 N[C@@H](CO)P(O)(O)=O Amb25211599 [1,1,0,0,0,0|1,0,0]=3 3529 B7R0.14 O=CC(C(C)(C)C)C Amb10558535 [1,1,0,0,0,0|2,0,0]=4 3530 B7R0.14 O=CC(C(C)(C)C)Cl Amb17593424 [1,1,0,0,0,0|2,0,0]=4 3531 B7R0.14 OCC(Cl)S(O)(=O)=O Amb24613047 [1,1,0,0,0,0|2,0,0]=4 3532 B7R0.15 CC(=O)C(CC)=NN Amb25373336 [1,1,0,0,0,0|1,0,1]=4 3533 B7R0.15 CC(=O)C(CO)CO Amb22904340 [1,1,0,0,0,0|2,0,0]=4 3534 B7R0.15 CC(C)C(C=O)NC Amb18641852 [1,1,0,0,0,0|1,0,0]=3 3535 B7R0.15 CC(C)C(C=O)OC Amb18641891 [1,1,0,0,0,0|2,0,0]=4 3536 B7R0.15 CC(C)C(C=O)SC Amb18641605 [1,1,0,0,0,0|2,0,0]=4 3537 B7R0.15 CC(C)C(CN)CO Amb22304811 [1,1,0,0,0,0|1,0,1]=4 3538 B7R0.15 CC(C)C(CO)C=O Amb25277235 [1,1,0,0,0,0|2,0,0]=4 3539 B7R0.15 CC(C)C(CO)NC Amb18291223 [1,1,0,0,0,0|1,0,1]=4 3540 B7R0.15 CC(C)C(CO)NO Amb24432794 [1,1,0,0,0,0|1,0,1]=4 3541 B7R0.15 CC(C)C(CO)ON Amb25175780 [1,1,0,0,0,0|1,0,1]=4 3542 B7R0.15 CC(C)[C@@H](C=O)SC Amb24481557 [1,1,0,0,0,0|2,0,0]=4 3543 B7R0.15 CC(C)[C@@H](CC)C=O Amb24483063 [1,1,0,0,0,0|2,0,0]=4 3544 B7R0.15 CC(C)[C@@H](CN)CO Amb25075276 [1,1,0,0,0,0|1,0,1]=4 3545 B7R0.15 CC(C)[C@@H](CO)C=O Amb25093763 [1,1,0,0,0,0|2,0,0]=4 3546 B7R0.15 CC(C)[C@H](CC)C=O Amb24524270 [1,1,0,0,0,0|2,0,0]=4 3547 B7R0.15 CC(C)[C@H](CN)CO Amb25224738 [1,1,0,0,0,0|1,0,1]=4 3548 B7R0.15 CC(C)\C(=C/N)\C=O Amb24483050 [1,1,0,0,0,0|1,0,1]=4 3549 B7R0.15 CC(C)\C(=C\N)\C=O Amb25338102 [1,1,0,0,0,0|1,0,1]=4 3550 B7R0.15 CC(O)=C(CO)NC Amb25210013 [1,1,0,0,0,0|1,0,1]=4 3551 B7R0.15 CC(O)C(C=C)C#C Amb24622708 [1,1,0,0,0,0|2,0,0]=4 3552 B7R0.15 CC(O)C(C=C)NC Amb25367280 [1,1,0,0,0,0|1,0,0]=3 3553 B7R0.15 CC(O)C(C=C)OC Amb25287051 [1,1,0,0,0,0|2,0,0]=4 3554 B7R0.15 CC(O)C(CO)C=C Amb25787350 [1,1,0,0,0,0|1,0,1]=4 3555 B7R0.15 CCC(=C=C)C(O)=O Amb25246162 [1,1,0,0,0,0|1,0,1]=4 3556 B7R0.15 CCC(=CC)C(O)=O Amb25781700 [1,1,0,0,0,0|1,0,1]=4 3557 B7R0.15 CCC(C#C)C(C)=O Amb25128229 [1,1,0,0,0,0|2,0,0]=4 3558 B7R0.15 CCC(C#C)C(O)=O Amb25777159 [1,1,0,0,0,0|1,0,0]=3 3559 B7R0.15 CCC(C(=O)N)NC Amb15701261 [1,1,0,0,0,0|1,0,0]=3 3560 B7R0.15 CCC(C(=O)N)OC Amb2027289 [1,1,0,0,0,0|2,0,0]=4 3561 B7R0.15 CCC(C(=O)O)C#N Amb17210513 [1,1,0,0,0,0|0,0,1]=3 3562 B7R0.15 CCC(C(=O)O)NC Amb10610245 [1,1,0,0,0,0|0,0,0]=2 3563 B7R0.15 CCC(C(=O)O)SC Amb17501348 [1,1,0,0,0,0|1,0,0]=3 3564 B7R0.15 CCC(C(=O)[O-])CCl Amb10604125 [1,1,0,0,0,0|1,0,1]=4 3565 B7R0.15 CCC(CBr)C(O)=O Amb25173840 [1,1,0,0,0,0|1,0,0]=3 3566 B7R0.15 CCC(CC)C(=O)Br Amb25280424 [1,1,0,0,0,0|2,0,0]=4 3567 B7R0.15 CCC(CC)C([O-])=O Amb22585838 [1,1,0,0,0,0|1,0,1]=4 3568 B7R0.15 CCC(CN)B(O)O Amb25075896 [1,1,0,0,0,0|1,0,1]=4 3569 B7R0.15 CCC(CN)C(C)=O Amb24548156 [1,1,0,0,0,0|1,0,0]=3 3570 B7R0.15 CCC(CN)C(N)=O Amb18294192 [1,1,0,0,0,0|1,0,0]=3 3571 B7R0.15 CCC(CN)C(O)=O Amb18987934 [1,1,0,0,0,0|0,0,0]=2 3572 B7R0.15 CCC(CN)C(O)=O Amb19514932 [1,1,0,0,0,0|0,0,0]=2 3573 B7R0.15 CCC(CN)S(C)=O Amb25106958 [1,1,0,0,0,0|2,0,0]=4 3574 B7R0.15 CCC(CO)C(C)=O Amb24709237 [1,1,0,0,0,0|2,0,0]=4 3575 B7R0.15 CCC(CO)C(O)=O Amb18641947 [1,1,0,0,0,0|1,0,0]=3 3576 B7R0.15 CCC(CS)C(O)=O Amb24435402 [1,1,0,0,0,0|1,0,0]=3 3577 B7R0.15 CCC(N=C)C(N)=O Amb25811618 [1,1,0,0,0,0|1,0,1]=4 3578 B7R0.15 CCC(NN)C(O)=O Amb18641955 [1,1,0,0,0,0|0,0,0]=2 3579 B7R0.15 CCC(ON)C(N)=O Amb24483121 [1,1,0,0,0,0|1,0,0]=3 3580 B7R0.15 CCC(ON)C(O)=O Amb25697895 [1,1,0,0,0,0|0,0,0]=2 3581 B7R0.15 CC[C@@H](C(=O)O)CO Amb16232065 [1,1,0,0,0,0|1,0,0]=3 3582 B7R0.15 CC[C@@H](CO)C(O)=O Amb22745321 [1,1,0,0,0,0|1,0,0]=3 3583 B7R0.15 CC[C@@H](CS)C(O)=O Amb24429203 [1,1,0,0,0,0|1,0,0]=3 3584 B7R0.15 CC[C@@H](NN)C(O)=O Amb25746090 [1,1,0,0,0,0|0,0,0]=2 3585 B7R0.15 CC[C@H](C=C)C(O)=O Amb24524256 [1,1,0,0,0,0|1,0,0]=3 3586 B7R0.15 CC[C@H](CN)C(O)=O Amb25790771 [1,1,0,0,0,0|0,0,0]=2 3587 B7R0.15 CC[C@H](CS)C(O)=O Amb25131908 [1,1,0,0,0,0|1,0,0]=3 3588 B7R0.15 CC[C@H](N=C)C(N)=O Amb25738279 [1,1,0,0,0,0|1,0,1]=4 3589 B7R0.15 CC[C@H](NC)C(N)=O Amb25745002 [1,1,0,0,0,0|1,0,0]=3 3590 B7R0.15 CC[C@H](NC)C(O)=O Amb24505225 [1,1,0,0,0,0|0,0,0]=2 3591 B7R0.15 CC\C(=C/C)\C(O)=O Amb18641780 [1,1,0,0,0,0|1,0,1]=4 3592 B7R0.15 CC\C(=N/O)\C(O)=O Amb25378085 [1,1,0,0,0,0|0,0,2]=4 3593 B7R0.15 CNC(C=C)C(O)=O Amb25847721 [1,1,0,0,0,0|0,0,2]=4 3594 B7R0.15 CNC(CF)C(O)=O Amb25695388 [1,1,0,0,0,0|1,0,0]=3 3595 B7R0.15 CNC(CN)C(O)=O Amb23515020 [1,1,0,0,0,0|1,0,0]=3 3596 B7R0.15 CNC(CO)C(N)=O Amb18641957 [1,1,0,0,0,0|1,0,0]=3 3597 B7R0.15 CNC(SC)C(O)=O Amb25745282 [1,1,0,0,0,0|1,0,0]=3 3598 B7R0.15 CN[C@@H](CF)C(O)=O Amb25367323 [1,1,0,0,0,0|1,0,0]=3 3599 B7R0.15 CN[C@@H](CN)C(O)=O Amb24397074 [1,1,0,0,0,0|1,0,0]=3 3600 B7R0.15 CN[C@@H](CO)C(N)=O Amb25025437 [1,1,0,0,0,0|1,0,0]=3 3601 B7R0.15 CN[C@H](C(=O)O)CO Amb16183860 [1,1,0,0,0,0|0,0,0]=2 3602 B7R0.15 CN[C@H](CF)C(O)=O Amb25367324 [1,1,0,0,0,0|1,0,0]=3 3603 B7R0.15 COC(C=C)C(O)=O Amb18641874 [1,1,0,0,0,0|2,0,0]=4 3604 B7R0.15 COC(CCl)C(O)=O Amb18643355 [1,1,0,0,0,0|2,0,0]=4 3605 B7R0.15 COC(CN)C(N)=O Amb24719552 [1,1,0,0,0,0|2,0,0]=4 3606 B7R0.15 COC(CN)C(O)=O Amb22059584 [1,1,0,0,0,0|1,0,0]=3 3607 B7R0.15 COC(CN)C(O)=O Amb24271092 [1,1,0,0,0,0|1,0,0]=3 3608 B7R0.15 COC(CO)C(O)=O Amb24482992 [1,1,0,0,0,0|1,0,0]=3 3609 B7R0.15 COC(CS)C(O)=O Amb25305649 [1,1,0,0,0,0|1,1,0]=4 3610 B7R0.15 CO[C@H](CO)C(N)=O Amb25755894 [1,1,0,0,0,0|2,0,0]=4 3611 B7R0.15 CSC(CCl)C(O)=O Amb24526774 [1,1,0,0,0,0|2,0,0]=4 3612 B7R0.15 CSC(CO)C(C)=O Amb25746293 [1,1,0,0,0,0|2,0,0]=4 3613 B7R0.15 CSC(CO)C(N)=O Amb25849170 [1,1,0,0,0,0|2,0,0]=4 3614 B7R0.15 C[C@@H](O)[C@@H](C=C)OC Amb24363678 [1,1,0,0,0,0|2,0,0]=4 3615 B7R0.15 C[C@@H](O)[C@H](C=C)OC Amb24412954 [1,1,0,0,0,0|2,0,0]=4 3616 B7R0.15 C\C(\O)=C(\CO)/NC Amb25759923 [1,1,0,0,0,0|1,0,1]=4 3617 B7R0.15 C\C=C(\CO)/C(O)=O Amb25306747 [1,1,0,0,0,0|1,0,1]=4 3618 B7R0.15 NCC(C(=O)O)C#N Amb10842157 [1,1,0,0,0,0|1,0,1]=4 3619 B7R0.15 NCC(CN)C(O)=O Amb25335570 [1,1,0,0,0,0|1,0,0]=3 3620 B7R0.15 NC[C@@H](CO)C(O)=O Amb22756739 [1,1,0,0,0,0|0,0,0]=2 3621 B7R0.15 NNC(CS)C(O)=O Amb24117863 [1,1,0,0,0,0|0,1,0]=3 3622 B7R0.15 NN[C@@H](CO)C(O)=O Amb24384871 [1,1,0,0,0,0|0,0,0]=2 3623 B7R0.15 NOC(ON)C(O)=O Amb24642031 [1,1,0,0,0,0|2,0,0]=4 3624 B7R0.15 OC(=O)C(CI)CI Amb17779784 [1,1,0,0,0,0|2,0,0]=4 3625 B7R0.15 OC(=O)C(CO)CO Amb18124271 [1,1,0,0,0,0|1,0,0]=3 3626 B7R0.15 OC(=O)C(CS)NS Amb25286626 [1,1,0,0,0,0|0,1,0]=3 3627 B7R0.15 OCC(NO)C(O)=O Amb24719766 [1,1,0,0,0,0|0,0,0]=2 3628 B7R0.15 [C-]#[N+]C(CC)C(O)=O Amb24432856 [1,1,0,0,0,0|0,0,1]=3 3629 B9R0.10 CC(=O)CC(N)C(C)(C)C Amb24465193 [0,1,0,0,0,1|2,0,0]=4 3630 B9R0.10 CC(C)(C)C(Br)CC(O)=O Amb25075478 [0,1,0,0,0,1|2,0,0]=4 3631 B9R0.10 CC(C)(C)C(F)CC(O)=O Amb25282886 [0,1,0,0,0,1|2,0,0]=4 3632 B9R0.10 CC(C)(C)C(N)CC(N)=O Amb25304992 [0,1,0,0,0,1|2,0,0]=4 3633 B9R0.10 CC(C)(C)[C@@H](N)CC(O)=O Amb19888358 [0,1,0,0,0,1|1,0,0]=3 3634 B9R0.10 CC(C)(C)[C@@H](O)CC(O)=O Amb24505172 [0,1,0,0,0,1|2,0,0]=4 3635 B9R0.10 CC(C)(C)[C@H](N)CC(N)=O Amb24541681 [0,1,0,0,0,1|2,0,0]=4 3636 B9R0.10 CC(C)(C)[C@H](N)CC(O)=O Amb19887644 [0,1,0,0,0,1|1,0,0]=3 3637 B9R0.10 CC(C)(O)C(O)=CC(O)=O Amb25225351 [0,1,0,0,0,1|1,0,1]=4 3638 B9R0.10 CC(C)(O)C(O)CC(O)=O Amb25808868 [0,1,0,0,0,1|1,0,0]=3 3639 B9R0.10 CC(C)CC(N)S(O)(=O)=O Amb24390196 [0,1,0,0,0,1|2,0,0]=4 3640 B9R0.10 CC(CC(O)=O)C(C)(C)N Amb19651352 [0,1,0,0,0,1|2,0,0]=4 3641 B9R0.10 CC(CC(O)=O)C(C)(C)N Amb21961488 [0,1,0,0,0,1|2,0,0]=4 3642 B9R0.10 CC(CC(O)=O)C(C)(F)F Amb25241872 [0,1,0,0,0,1|2,0,0]=4 3643 B9R0.10 CC(CC(O)=O)P(C)(O)=O Amb25059136 [0,1,0,0,0,1|2,0,0]=4 3644 B9R0.10 CC(NC(N)=O)C(C)(C)O Amb25120603 [0,1,0,0,0,1|2,0,0]=4 3645 B9R0.10 CC(O)CC(C)S(O)(=O)=O Amb24509369 [0,1,0,0,0,1|2,0,0]=4 3646 B9R0.10 CC(O)CC(N)P(O)(O)=O Amb25844516 [0,1,0,0,0,1|1,0,0]=3 3647 B9R0.10 C[C@H](CC(O)=O)C(C)(C)C Amb24409482 [0,1,0,0,0,1|2,0,0]=4 3648 B9R0.10 NC(C(F)(F)F)CC(=O)O Amb1091770 [0,1,0,0,0,1|2,0,0]=4 3649 B9R0.10 NC(C(F)(F)F)CC(=O)O Amb1146904 [0,1,0,0,0,1|2,0,0]=4 3650 B9R0.10 N[C@@H](CC(O)=O)C(F)(F)F Amb22388421 [0,1,0,0,0,1|2,0,0]=4 3651 B9R0.10 N[C@@H](CC(O)=O)P(O)(O)=O Amb25322981 [0,1,0,0,0,1|2,0,0]=4 3652 B9R0.10 N[C@H](CC(O)=O)C(F)(F)F Amb20670844 [0,1,0,0,0,1|2,0,0]=4 3653 B9R0.10 N[C@H](CC(O)=O)C(F)(F)F Amb22738680 [0,1,0,0,0,1|2,0,0]=4 3654 B9R0.10 OC(C(C)(C)C)CC(=O)O Amb17232006 [0,1,0,0,0,1|2,0,0]=4 3655 B9R0.11 CC(=C)C(C)(N)CC(O)=O Amb22641962 [0,1,0,0,0,1|1,0,1]=4 3656 B9R0.11 CC(C)C(C)(C)CC(O)=O Amb18124695 [0,1,0,0,0,1|2,0,0]=4 3657 B9R0.11 CC(C)C(C)(F)CC(O)=O Amb24665956 [0,1,0,0,0,1|2,0,0]=4 3658 B9R0.11 CC(C)C(C)(O)CC(O)=O Amb18991699 [0,1,0,0,0,1|2,0,0]=4 3659 B9R0.11 CC(C)CC(C)(N)C(N)=O Amb18288986 [0,1,0,0,0,1|2,0,0]=4 3660 B9R0.11 CC(C)CC(C)(O)C(O)=O Amb18523766 [0,1,0,0,0,1|2,0,0]=4 3661 B9R0.11 CC(C)CC(F)(F)C(O)=O Amb25773701 [0,1,0,0,0,1|2,0,0]=4 3662 B9R0.11 CC(C)C[C@@](C)(O)C(O)=O Amb25744207 [0,1,0,0,0,1|2,0,0]=4 3663 B9R0.11 CC(C)C[C@](C)(O)C(O)=O Amb24763710 [0,1,0,0,0,1|2,0,0]=4 3664 B9R0.11 CC(C)OC(C)(C)C(O)=O Amb18976739 [0,1,0,0,0,1|2,0,0]=4 3665 B9R0.11 CC(C)OC(F)(F)C(O)=O Amb18987261 [0,1,0,0,0,1|2,0,0]=4 3666 B9R0.11 CC(C)SC(F)(F)C(O)=O Amb23586507 [0,1,0,0,0,1|2,0,0]=4 3667 B9R0.11 CC(C)[C@@](C)(N)CC(O)=O Amb19929555 [0,1,0,0,0,1|1,0,0]=3 3668 B9R0.11 CC(C)[C@](C)(N)CC(O)=O Amb19929556 [0,1,0,0,0,1|1,0,0]=3 3669 B9R0.11 CC(CC(C(=O)O)(C)C)C Amb10843993 [0,1,0,0,0,1|2,0,0]=4 3670 B9R0.11 CC(C[C@@](C(=O)O)(N)C)C Amb10066904 [0,1,0,0,0,1|1,0,0]=3 3671 B9R0.11 CC(N)(CC(O)=O)C(O)=O Amb22800383 [0,1,0,0,0,1|1,0,1]=4 3672 B9R0.11 CC(N)(CC(O)=O)P(O)=O Amb25701546 [0,1,0,0,0,1|2,0,0]=4 3673 B9R0.11 CC(O)C(C)(C)NC(C)=O Amb24425580 [0,1,0,0,0,1|2,0,0]=4 3674 B9R0.11 CC(O)C(C)(C)NC(N)=O Amb25274592 [0,1,0,0,0,1|2,0,0]=4 3675 B9R0.11 CC(O)CC(C)(C)C(O)=O Amb25230577 [0,1,0,0,0,1|1,0,0]=3 3676 B9R0.11 CC(O)CC(C)(O)C(O)=O Amb25265252 [0,1,0,0,0,1|1,0,0]=3 3677 B9R0.11 CC(SC(C(=O)O)(C)C)C Amb17501486 [0,1,0,0,0,1|2,0,0]=4 3678 B9R0.11 CN(C)CC(C)(N)C(O)=O Amb18294465 [0,1,0,0,0,1|2,0,0]=4 3679 B9R0.11 NC(N)(CC(O)=O)C(O)=O Amb24460545 [0,1,0,0,0,1|1,0,1]=4 3680 B9R0.11 OC(=O)CC(C(=O)O)(N)C Amb10807406 [0,1,0,0,0,1|1,0,1]=4 3681 B9R0.11 OC(=O)C[C@@](C(=O)O)(N)C Amb10601663 [0,1,0,0,0,1|1,0,1]=4 3682 B9R0.11 OC(=O)C[C@](C(=O)O)(N)C Amb10601664 [0,1,0,0,0,1|1,0,1]=4 3683 B9R0.11 OC(=O)C[C@](C(=O)O)(N)C Amb17608152 [0,1,0,0,0,1|1,0,1]=4 3684 B9R0.23 CC(=C)C[C@H](N)C(=O)OC Amb25200054 [0,1,0,0,0,1|1,0,1]=4 3685 B9R0.23 CC(=CC(O)=O)C(C)OC Amb25045184 [0,1,0,0,0,1|1,0,1]=4 3686 B9R0.23 CC(=O)CC(N)C(=O)OC Amb25367296 [0,1,0,0,0,1|0,0,2]=4 3687 B9R0.23 CC(=O)CC(O)C(O)CO Amb24737444 [0,1,0,0,0,1|2,0,0]=4 3688 B9R0.23 CC(=O)C[C@@H](O)[C@@H](O)CO Amb25767917 [0,1,0,0,0,1|2,0,0]=4 3689 B9R0.23 CC(C(CC(=O)O)N)CC Amb2438880 [0,1,0,0,0,1|1,0,0]=3 3690 B9R0.23 CC(C)CC(Br)C(=O)OC Amb22490955 [0,1,0,0,0,1|2,0,0]=4 3691 B9R0.23 CC(C)CC(Cl)C(=O)OC Amb18800856 [0,1,0,0,0,1|2,0,0]=4 3692 B9R0.23 CC(C)CC(F)C(=O)OC Amb24405963 [0,1,0,0,0,1|2,0,0]=4 3693 B9R0.23 CC(C)CC(N)C(=O)CC Amb18202462 [0,1,0,0,0,1|2,0,0]=4 3694 B9R0.23 CC(C)CC(N)C(=O)NN Amb18559331 [0,1,0,0,0,1|2,0,0]=4 3695 B9R0.23 CC(C)CC(N)C(=O)OC Amb22489476 [0,1,0,0,0,1|1,0,0]=3 3696 B9R0.23 CC(C)CC(N)C(=O)SC Amb25774431 [0,1,0,0,0,1|1,1,0]=4 3697 B9R0.23 CC(C)CC(O)C(=O)OC Amb19306745 [0,1,0,0,0,1|2,0,0]=4 3698 B9R0.23 CC(C)C[C@@H](N)C(=O)CCl Amb22750583 [0,1,0,0,0,1|2,0,0]=4 3699 B9R0.23 CC(C)C[C@@H](N)C(=O)CCl Amb25200016 [0,1,0,0,0,1|2,0,0]=4 3700 B9R0.23 CC(C)C[C@@H](N)C(=O)NC Amb18035928 [0,1,0,0,0,1|2,0,0]=4 3701 B9R0.23 CC(C)C[C@@H](N)C(=O)NN Amb22800071 [0,1,0,0,0,1|2,0,0]=4 3702 B9R0.23 CC(C)C[C@@H](N)C(=O)NO Amb22800473 [0,1,0,0,0,1|1,0,0]=3 3703 B9R0.23 CC(C)C[C@H](Cl)C(=O)OC Amb25101463 [0,1,0,0,0,1|2,0,0]=4 3704 B9R0.23 CC(C)C[C@H](N)C(=O)CC Amb25791564 [0,1,0,0,0,1|2,0,0]=4 3705 B9R0.23 CC(C)C[C@H](N)C(=O)NN Amb25146434 [0,1,0,0,0,1|2,0,0]=4 3706 B9R0.23 CC(C)C[C@H](N)C(=O)NO Amb24440728 [0,1,0,0,0,1|1,0,0]=3 3707 B9R0.23 CC(C)C[C@H](O)C(=O)OC Amb25299357 [0,1,0,0,0,1|2,0,0]=4 3708 B9R0.23 CC(C)NC(C)C(=O)OC Amb19003119 [0,1,0,0,0,1|2,0,0]=4 3709 B9R0.23 CC(C)OC(C)C(=O)OC Amb24621367 [0,1,0,0,0,1|2,0,0]=4 3710 B9R0.23 CC(C)O[C@@H](C)C(=O)OC Amb25831283 [0,1,0,0,0,1|2,0,0]=4 3711 B9R0.23 CC(C)SC(C)C(=O)OC Amb18798145 [0,1,0,0,0,1|2,0,0]=4 3712 B9R0.23 CC(C=C)C(C)CC(O)=O Amb18643924 [0,1,0,0,0,1|2,0,0]=4 3713 B9R0.23 CC(CC(C)O)C(=O)OC Amb25781081 [0,1,0,0,0,1|1,0,0]=3 3714 B9R0.23 CC(CC(O)=O)C(N)CC Amb25820735 [0,1,0,0,0,1|2,0,0]=4 3715 B9R0.23 CC(CC)C(N)CC(N)=O Amb25312995 [0,1,0,0,0,1|2,0,0]=4 3716 B9R0.23 CC(CC)C(O)CC(O)=O Amb18310690 [0,1,0,0,0,1|2,0,0]=4 3717 B9R0.23 CC(CC)[C@@H](N)CC(N)=O Amb25823252 [0,1,0,0,0,1|2,0,0]=4 3718 B9R0.23 CC(CC)[C@H](N)CC(O)=O Amb25117039 [0,1,0,0,0,1|1,0,0]=3 3719 B9R0.23 CC(CO)N(C)CC(O)=O Amb24419908 [0,1,0,0,0,1|2,0,0]=4 3720 B9R0.23 CC(Cl)CC(Cl)C(=O)OC Amb25724873 [0,1,0,0,0,1|2,0,0]=4 3721 B9R0.23 CC(N)CC(O)C(=O)NO Amb25276417 [0,1,0,0,0,1|2,0,0]=4 3722 B9R0.23 CC(N)CC(O)C(=O)OC Amb24587361 [0,1,0,0,0,1|2,0,0]=4 3723 B9R0.23 CC(NC(N)=O)C(O)CC Amb24584317 [0,1,0,0,0,1|2,0,0]=4 3724 B9R0.23 CC(O)CC(O)C(O)C=O Amb25713186 [0,1,0,0,0,1|1,0,1]=4 3725 B9R0.23 CC(O)C[C@H](O)C(=O)CO Amb25146805 [0,1,0,0,0,1|1,0,0]=3 3726 B9R0.23 CC(OC(C)=O)C(O)CC Amb25225668 [0,1,0,0,0,1|2,0,0]=4 3727 B9R0.23 CC(OC(C)=O)C(O)CCl Amb25367346 [0,1,0,0,0,1|2,0,0]=4 3728 B9R0.23 CC(OC(C)=O)C(O)OC Amb24481205 [0,1,0,0,0,1|2,0,0]=4 3729 B9R0.23 CC(OC)C(C)CC(O)=O Amb18202340 [0,1,0,0,0,1|1,0,0]=3 3730 B9R0.23 CC(OC)C(N)C=C(C)C Amb24467730 [0,1,0,0,0,1|2,0,0]=4 3731 B9R0.23 CC(OC)C(N)CC(C)=C Amb24745048 [0,1,0,0,0,1|2,0,0]=4 3732 B9R0.23 CC(OC)[C@@H](C)NC(N)=O Amb25271787 [0,1,0,0,0,1|2,0,0]=4 3733 B9R0.23 CC(OC)[C@H](C)NC(N)=O Amb24676126 [0,1,0,0,0,1|2,0,0]=4 3734 B9R0.23 CCC(=C)C(N)CC(O)=O Amb25068441 [0,1,0,0,0,1|1,0,1]=4 3735 B9R0.23 CCC(C)C(C)CC(O)=O Amb18304200 [0,1,0,0,0,1|2,0,0]=4 3736 B9R0.23 CCC(Cl)C(O)CC(O)=O Amb25111208 [0,1,0,0,0,1|2,0,0]=4 3737 B9R0.23 CCC(O)C(O)CC(O)=O Amb25132101 [0,1,0,0,0,1|1,0,0]=3 3738 B9R0.23 CCN(O)C(C)CC(O)=O Amb25379050 [0,1,0,0,0,1|2,0,0]=4 3739 B9R0.23 CC[C@@H](C)[C@H](C)CC(O)=O Amb24715562 [0,1,0,0,0,1|2,0,0]=4 3740 B9R0.23 CC[C@H](O)[C@H](N)CC(O)=O Amb25204323 [0,1,0,0,0,1|0,0,0]=2 3741 B9R0.23 CNC(=O)C(N)CC(O)=O Amb18862479 [0,1,0,0,0,1|0,0,2]=4 3742 B9R0.23 CNC(=O)N(N)CC(C)O Amb24478891 [0,1,0,0,0,1|2,0,0]=4 3743 B9R0.23 CNC(=O)[C@@H](N)CC(O)=O Amb25694374 [0,1,0,0,0,1|0,0,2]=4 3744 B9R0.23 CNC(=O)[C@H](CC(C)C)N Amb17231992 [0,1,0,0,0,1|2,0,0]=4 3745 B9R0.23 COC(=O)C(CC(C)C)N Amb1152419 [0,1,0,0,0,1|1,0,0]=3 3746 B9R0.23 COC(=O)C(N)CC(F)F Amb22059458 [0,1,0,0,0,1|2,0,0]=4 3747 B9R0.23 COC(=O)C(N)CC(O)=O Amb18644309 [0,1,0,0,0,1|0,0,2]=4 3748 B9R0.23 COC(=O)C(N)CN(C)C Amb24715537 [0,1,0,0,0,1|2,0,0]=4 3749 B9R0.23 COC(=O)C(O)CN(C)O Amb24713209 [0,1,0,0,0,1|2,0,0]=4 3750 B9R0.23 COC(=O)[C@@H](N)CC(O)=O Amb22746069 [0,1,0,0,0,1|0,0,2]=4 3751 B9R0.23 COC(=O)[C@@H](N)CS(O)=O Amb24592787 [0,1,0,0,0,1|2,0,0]=4 3752 B9R0.23 COC(=O)[C@H](N)CC(O)=O Amb19944281 [0,1,0,0,0,1|0,0,2]=4 3753 B9R0.23 COC(O)C(O)CC(O)=O Amb24650997 [0,1,0,0,0,1|1,0,0]=3 3754 B9R0.23 C[C@@H](C=C)[C@H](C)CC(O)=O Amb25843885 [0,1,0,0,0,1|2,0,0]=4 3755 B9R0.23 C[C@@H](CC([O-])=O)C(O)CO Amb24334935 [0,1,0,0,0,1|1,0,1]=4 3756 B9R0.23 C[C@@H](CC)[C@@H](O)CC(O)=O Amb25068472 [0,1,0,0,0,1|2,0,0]=4 3757 B9R0.23 C[C@@H](CC)[C@H](N)CC(O)=O Amb19944304 [0,1,0,0,0,1|1,0,0]=3 3758 B9R0.23 C[C@@H](CC)[C@H](N)CC(O)=O Amb25068405 [0,1,0,0,0,1|1,0,0]=3 3759 B9R0.23 C[C@@H](CC)[C@H](O)CC(O)=O Amb24409363 [0,1,0,0,0,1|2,0,0]=4 3760 B9R0.23 C[C@@H]([C@@H](CC(=O)O)N)CC Amb16184028 [0,1,0,0,0,1|1,0,0]=3 3761 B9R0.23 C[C@H](CC(O)=O)[C@H](O)CN Amb25131743 [0,1,0,0,0,1|1,0,0]=3 3762 B9R0.23 C[C@H](CC)[C@@H](N)CC(O)=O Amb25689818 [0,1,0,0,0,1|1,0,0]=3 3763 B9R0.23 C[C@H](NC(C)=O)[C@@H](O)CC Amb25730625 [0,1,0,0,0,1|2,0,0]=4 3764 B9R0.23 C[C@H](NC(C)=O)[C@H](O)CC Amb24427505 [0,1,0,0,0,1|2,0,0]=4 3765 B9R0.23 C[C@H]([C@H](CC(=O)O)N)CC Amb16184016 [0,1,0,0,0,1|1,0,0]=3 3766 B9R0.23 C\C(=C/C)\C(N)CC(O)=O Amb24377592 [0,1,0,0,0,1|1,0,1]=4 3767 B9R0.23 C\C(=C/N)\C(N)CC(O)=O Amb25761855 [0,1,0,0,0,1|1,0,1]=4 3768 B9R0.23 NC(=O)CC(O)C(O)CO Amb25139467 [0,1,0,0,0,1|2,0,0]=4 3769 B9R0.23 NC(CC(N)=O)C(O)CO Amb24460353 [0,1,0,0,0,1|1,0,0]=3 3770 B9R0.23 NC(CC(O)=O)C(=O)O[Na] Amb22352689 [0,1,0,0,0,1|1,0,1]=4 3771 B9R0.23 NCC(=O)C(N)CC(O)=O Amb24745663 [0,1,0,0,0,1|0,0,2]=4 3772 B9R0.23 N[C@@H](CC(O)=O)C(=O)NO Amb25762946 [0,1,0,0,0,1|1,0,1]=4 3773 B9R0.23 N[C@@H](CC(O)=O)[C@@H](N)CO Amb25788533 [0,1,0,0,0,1|1,0,0]=3 3774 B9R0.23 OC[C@@H](O)[C@@H](O)CC(O)=O Amb24509722 [0,1,0,0,0,1|1,0,0]=3 3775 B9R0.23 OC[C@@H](O)[C@H](O)CC(O)=O Amb25258026 [0,1,0,0,0,1|1,0,0]=3 3776 B9R0.23 OC[C@H](O)[C@H](O)CC(O)=O Amb24726353 [0,1,0,0,0,1|1,0,0]=3 3777 B9R0.39 CC(=O)C(CC(O)=O)NC Amb18611382 [0,1,0,0,0,1|0,0,2]=4 3778 B9R0.39 CC(=O)CC(NC)C(O)=O Amb25690263 [0,1,0,0,0,1|0,0,2]=4 3779 B9R0.39 CC(=O)N[C@@H](CN)C(O)=O Amb24479068 [0,1,0,0,0,1|0,0,2]=4 3780 B9R0.39 CC(=O)OC(CN)C(O)=O Amb25082692 [0,1,0,0,0,1|0,0,2]=4 3781 B9R0.39 CC(Br)=CC(ON)C(O)=O Amb25218261 [0,1,0,0,0,1|1,0,1]=4 3782 B9R0.39 CC(C)C(CC(N)=O)CN Amb25177753 [0,1,0,0,0,1|2,0,0]=4 3783 B9R0.39 CC(C)C(CC(N)=O)NC Amb25738895 [0,1,0,0,0,1|2,0,0]=4 3784 B9R0.39 CC(C)C(CC(O)=O)C#N Amb25818234 [0,1,0,0,0,1|1,0,1]=4 3785 B9R0.39 CC(C)C(CC(O)=O)C=C Amb18643903 [0,1,0,0,0,1|2,0,0]=4 3786 B9R0.39 CC(C)C(CC(O)=O)CC Amb18304202 [0,1,0,0,0,1|2,0,0]=4 3787 B9R0.39 CC(C)C(CC(O)=O)SC Amb25858344 [0,1,0,0,0,1|2,0,0]=4 3788 B9R0.39 CC(C)C(CN)NC(C)=O Amb18251274 [0,1,0,0,0,1|2,0,0]=4 3789 B9R0.39 CC(C)C(CN)NC(N)=O Amb18251283 [0,1,0,0,0,1|2,0,0]=4 3790 B9R0.39 CC(C)CC(C#N)C(O)=O Amb23558965 [0,1,0,0,0,1|1,0,1]=4 3791 B9R0.39 CC(C)CC(CC)C(O)=O Amb19014184 [0,1,0,0,0,1|2,0,0]=4 3792 B9R0.39 CC(C)CC(CF)C(O)=O Amb24596212 [0,1,0,0,0,1|2,0,0]=4 3793 B9R0.39 CC(C)CC(CN)C(N)=O Amb24333087 [0,1,0,0,0,1|2,0,0]=4 3794 B9R0.39 CC(C)CC(CN)C(O)=O Amb19021764 [0,1,0,0,0,1|1,0,0]=3 3795 B9R0.39 CC(C)CC(CO)C(O)=O Amb18124780 [0,1,0,0,0,1|2,0,0]=4 3796 B9R0.39 CC(C)CC(NC)C(N)=O Amb19006600 [0,1,0,0,0,1|2,0,0]=4 3797 B9R0.39 CC(C)CC(NC)C(O)=O Amb22274694 [0,1,0,0,0,1|1,0,0]=3 3798 B9R0.39 CC(C)CC(NN)C(O)=O Amb18644273 [0,1,0,0,0,1|1,0,0]=3 3799 B9R0.39 CC(C)CC(NO)C(N)=O Amb25294339 [0,1,0,0,0,1|2,0,0]=4 3800 B9R0.39 CC(C)CC(ON)C(O)=O Amb18644321 [0,1,0,0,0,1|1,0,0]=3 3801 B9R0.39 CC(C)C[C@@H](CN)C(O)=O Amb22756732 [0,1,0,0,0,1|1,0,0]=3 3802 B9R0.39 CC(C)C[C@@H](CN)C(O)=O Amb22756740 [0,1,0,0,0,1|1,0,0]=3 3803 B9R0.39 CC(C)C[C@@H](NC)C(O)=O Amb22745995 [0,1,0,0,0,1|1,0,0]=3 3804 B9R0.39 CC(C)C[C@H](CO)C(O)=O Amb25214140 [0,1,0,0,0,1|2,0,0]=4 3805 B9R0.39 CC(C)C[C@H](NC)C(N)=O Amb24550819 [0,1,0,0,0,1|2,0,0]=4 3806 B9R0.39 CC(C)C[C@H](NCl)C(O)=O Amb24563420 [0,1,0,0,0,1|1,0,0]=3 3807 B9R0.39 CC(C)C[C@H](ON)C(O)=O Amb24505012 [0,1,0,0,0,1|1,0,0]=3 3808 B9R0.39 CC(C)NC(C=C)C(O)=O Amb24481162 [0,1,0,0,0,1|2,0,0]=4 3809 B9R0.39 CC(C)N[C@@H](CO)C(O)=O Amb24587694 [0,1,0,0,0,1|2,0,0]=4 3810 B9R0.39 CC(C)N[C@@H](CS)C(O)=O Amb25299344 [0,1,0,0,0,1|2,0,0]=4 3811 B9R0.39 CC(C)N[C@H](CO)C(O)=O Amb25099258 [0,1,0,0,0,1|2,0,0]=4 3812 B9R0.39 CC(C)N[C@H](CS)C(O)=O Amb25851404 [0,1,0,0,0,1|2,0,0]=4 3813 B9R0.39 CC(C)OC(C=C)C(O)=O Amb18644139 [0,1,0,0,0,1|2,0,0]=4 3814 B9R0.39 CC(C)OC(CC)C(O)=O Amb25723566 [0,1,0,0,0,1|2,0,0]=4 3815 B9R0.39 CC(C)SC(CO)C(O)=O Amb25172117 [0,1,0,0,0,1|2,0,0]=4 3816 B9R0.39 CC(N)C(CC(O)=O)CC Amb23536772 [0,1,0,0,0,1|2,0,0]=4 3817 B9R0.39 CC(N)NC(CO)C(O)=O Amb25367822 [0,1,0,0,0,1|2,0,0]=4 3818 B9R0.39 CC(O)C(C=C)OC(C)=O Amb24463562 [0,1,0,0,0,1|2,0,0]=4 3819 B9R0.39 CC(O)C(CC(O)=O)CC Amb18831453 [0,1,0,0,0,1|1,0,0]=3 3820 B9R0.39 CC(O)C(CC(O)=O)NC Amb24400678 [0,1,0,0,0,1|0,0,0]=2 3821 B9R0.39 CC(O)C(CC)OC(C)=O Amb25769425 [0,1,0,0,0,1|2,0,0]=4 3822 B9R0.39 CC(O)C(CC)OC(N)=O Amb25339455 [0,1,0,0,0,1|2,0,0]=4 3823 B9R0.39 CCC(=CC(O)=O)C(C)O Amb24568884 [0,1,0,0,0,1|1,0,1]=4 3824 B9R0.39 CCC(C(=O)O)SC(C)C Amb17501347 [0,1,0,0,0,1|2,0,0]=4 3825 B9R0.39 CC\C(=C\C(O)=O)\C(C)O Amb24654751 [0,1,0,0,0,1|1,0,1]=4 3826 B9R0.39 CNC(C(=O)O)CC(=O)O Amb1905634 [0,1,0,0,0,1|1,0,1]=4 3827 B9R0.39 CNC(CS(O)=O)C(O)=O Amb25765774 [0,1,0,0,0,1|2,0,0]=4 3828 B9R0.39 CN[C@@H](C(=O)O)CC(C)C Amb10842218 [0,1,0,0,0,1|1,0,0]=3 3829 B9R0.39 CN[C@@H](CC(O)=O)C(O)=O Amb22748003 [0,1,0,0,0,1|1,0,1]=4 3830 B9R0.39 CN[C@@H](CS(O)=O)C(O)=O Amb24482415 [0,1,0,0,0,1|2,0,0]=4 3831 B9R0.39 CN[C@H](C(=O)O)CC(C)C Amb16183858 [0,1,0,0,0,1|1,0,0]=3 3832 B9R0.39 C[C@@H](O)[C@@H](C=C)OC(C)=O Amb25741754 [0,1,0,0,0,1|2,0,0]=4 3833 B9R0.39 C[C@@H](O)[C@@H](CO)NC(C)=O Amb25232080 [0,1,0,0,0,1|2,0,0]=4 3834 B9R0.39 C[C@@H](O)[C@H](CO)NC(C)=O Amb24479138 [0,1,0,0,0,1|2,0,0]=4 3835 B9R0.39 C[C@H](O)[C@@H](CC(O)=O)NC Amb24460369 [0,1,0,0,0,1|0,0,0]=2 3836 B9R0.39 C[C@H](O)[C@H](C=O)NC(C)=O Amb25323139 [0,1,0,0,0,1|2,0,0]=4 3837 B9R0.39 C\C(\Cl)=C/C(ON)C(O)=O Amb24390358 [0,1,0,0,0,1|1,0,1]=4 3838 B9R0.39 NCC(CC(O)=O)C(O)=O Amb22546423 [0,1,0,0,0,1|1,0,1]=4 3839 B9R0.39 NCC(CC(O)=O)C(O)=O Amb24538047 [0,1,0,0,0,1|1,0,1]=4 3840 B9R0.39 NC[C@H](CC(O)=O)C(O)=O Amb25147272 [0,1,0,0,0,1|1,0,1]=4 3841 B9R0.39 NN[C@@H](CC(O)=O)C(O)=O Amb24117193 [0,1,0,0,0,1|1,0,1]=4 3842 B9R0.39 OC(=O)C(CC(O)=O)NO Amb24685872 [0,1,0,0,0,1|1,0,1]=4 3843 B9R0.39 OC(=O)C(CC(O)=O)NS Amb25808901 [0,1,0,0,0,1|1,0,1]=4 3844 B9R0.39 OC(=O)[C@H](CC(O)=O)NO Amb24117497 [0,1,0,0,0,1|1,0,1]=4 3845 B9R0.39 OC(=O)[C@H](CC(O)=O)NO Amb24630025 [0,1,0,0,0,1|1,0,1]=4 3846 B9R0.42 CC(=O)C(N)CC(=O)OC Amb24529258 [0,1,0,0,0,1|0,0,2]=4 3847 B9R0.42 CC(C)C(C)CC(=O)OC Amb24482543 [0,1,0,0,0,1|2,0,0]=4 3848 B9R0.42 CC(C)C(C)NC(=O)NO Amb24478867 [0,1,0,0,0,1|2,0,0]=4 3849 B9R0.42 CC(C)C(C)OC(=O)CO Amb25209163 [0,1,0,0,0,1|2,0,0]=4 3850 B9R0.42 CC(C)C(N)CC(=O)C=C Amb25231795 [0,1,0,0,0,1|2,0,0]=4 3851 B9R0.42 CC(C)C(N)CC(=O)CC Amb25783213 [0,1,0,0,0,1|2,0,0]=4 3852 B9R0.42 CC(C)C(N)CC(=O)NO Amb24502300 [0,1,0,0,0,1|1,0,0]=3 3853 B9R0.42 CC(C)C(N)CC(=O)OC Amb22168224 [0,1,0,0,0,1|1,0,0]=3 3854 B9R0.42 CC(C)C(O)CC(=O)OC Amb24423234 [0,1,0,0,0,1|2,0,0]=4 3855 B9R0.42 CC(C)[C@@H](N)CC(=O)OC Amb23401522 [0,1,0,0,0,1|1,0,0]=3 3856 B9R0.42 CC(C)[C@H](N)\C=C(/C)\CO Amb24716799 [0,1,0,0,0,1|2,0,0]=4 3857 B9R0.42 CC(C)[C@H](O)CC(=O)OC Amb25847717 [0,1,0,0,0,1|2,0,0]=4 3858 B9R0.42 CC(CC(=O)NN)C(C)O Amb24412186 [0,1,0,0,0,1|2,0,0]=4 3859 B9R0.42 CC(CC(=O)OC)C(C)N Amb25296644 [0,1,0,0,0,1|2,0,0]=4 3860 B9R0.42 CC(CC(=O)OC)C(C)O Amb25260435 [0,1,0,0,0,1|1,0,0]=3 3861 B9R0.42 CC(CC(Br)C(O)=O)CN Amb24478240 [0,1,0,0,0,1|2,0,0]=4 3862 B9R0.42 CC(CC(C)C#N)C(O)=O Amb25694006 [0,1,0,0,0,1|2,0,0]=4 3863 B9R0.42 CC(CC(C)C=C)C(O)=O Amb18643935 [0,1,0,0,0,1|2,0,0]=4 3864 B9R0.42 CC(CC(C)C=O)C(O)=O Amb18644134 [0,1,0,0,0,1|1,0,1]=4 3865 B9R0.42 CC(CC(F)C(O)=O)CN Amb25265347 [0,1,0,0,0,1|2,0,0]=4 3866 B9R0.42 CC(CC(F)C(O)=O)OC Amb25298262 [0,1,0,0,0,1|1,0,0]=3 3867 B9R0.42 CC(CC(N)C(C)=C)OC Amb25851059 [0,1,0,0,0,1|2,0,0]=4 3868 B9R0.42 CC(CC(N)C(C)=O)CC Amb25747386 [0,1,0,0,0,1|2,0,0]=4 3869 B9R0.42 CC(CC(N)C(N)=O)OC Amb25349298 [0,1,0,0,0,1|1,0,0]=3 3870 B9R0.42 CC(CC(N)C(O)=O)=C=C Amb24409576 [0,1,0,0,0,1|1,0,1]=4 3871 B9R0.42 CC(CC(N)C(O)=O)C#C Amb25067277 [0,1,0,0,0,1|1,0,0]=3 3872 B9R0.42 CC(CC(N)C(O)=O)C#N Amb25262927 [0,1,0,0,0,1|1,0,0]=3 3873 B9R0.42 CC(CC(N)C(O)=O)C=C Amb25778211 [0,1,0,0,0,1|1,0,0]=3 3874 B9R0.42 CC(CC(N)C(O)=O)CC Amb18313985 [0,1,0,0,0,1|1,0,0]=3 3875 B9R0.42 CC(CC(N)C(O)=O)CC Amb20667726 [0,1,0,0,0,1|1,0,0]=3 3876 B9R0.42 CC(CC(N)C(O)=O)CCl Amb24480574 [0,1,0,0,0,1|1,0,0]=3 3877 B9R0.42 CC(CC(N)C(O)=O)CO Amb25147300 [0,1,0,0,0,1|0,0,0]=2 3878 B9R0.42 CC(CC(N)C(O)=O)NC Amb24711878 [0,1,0,0,0,1|1,0,0]=3 3879 B9R0.42 CC(CC(N)C(O)=O)OC Amb25147752 [0,1,0,0,0,1|0,0,0]=2 3880 B9R0.42 CC(CC(N)C(O)=O)SC Amb24365891 [0,1,0,0,0,1|0,1,0]=3 3881 B9R0.42 CC(CC(O)C(O)=O)=NO Amb25291967 [0,1,0,0,0,1|1,0,1]=4 3882 B9R0.42 CC(CC(O)C(O)=O)CC Amb25849308 [0,1,0,0,0,1|2,0,0]=4 3883 B9R0.42 CC(CC(O)CN)C(O)=O Amb25375725 [0,1,0,0,0,1|1,0,0]=3 3884 B9R0.42 CC(CC(S)C(O)=O)CC Amb18798152 [0,1,0,0,0,1|2,0,0]=4 3885 B9R0.42 CC(CC(S)C(O)=O)OC Amb24641528 [0,1,0,0,0,1|1,0,0]=3 3886 B9R0.42 CC(CC)OC(F)C(O)=O Amb25043871 [0,1,0,0,0,1|2,0,0]=4 3887 B9R0.42 CC(CN)CC(C)C(O)=O Amb24717285 [0,1,0,0,0,1|2,0,0]=4 3888 B9R0.42 CC(CO)NC(=O)C(O)=O Amb25106609 [0,1,0,0,0,1|1,0,1]=4 3889 B9R0.42 CC(C[C@@H](N)C(O)=O)CC Amb25127143 [0,1,0,0,0,1|1,0,0]=3 3890 B9R0.42 CC(C[C@@H](N)C(O)=O)OC Amb24412403 [0,1,0,0,0,1|0,0,0]=2 3891 B9R0.42 CC(C[C@@H](N)C(O)=O)SC Amb24692660 [0,1,0,0,0,1|0,1,0]=3 3892 B9R0.42 CC(C[C@H](N)C(O)=O)C#C Amb25214668 [0,1,0,0,0,1|1,0,0]=3 3893 B9R0.42 CC(C[C@H](N)C(O)=O)CCl Amb24479195 [0,1,0,0,0,1|1,0,0]=3 3894 B9R0.42 CC(Cl)C(Cl)CC(=O)OC Amb24613883 [0,1,0,0,0,1|2,0,0]=4 3895 B9R0.42 CC(NC(=O)CCl)C(C)O Amb24446559 [0,1,0,0,0,1|2,0,0]=4 3896 B9R0.42 CC(NC(C)C#C)C(O)=O Amb25088637 [0,1,0,0,0,1|2,0,0]=4 3897 B9R0.42 CC(NC(C)C=C)C(O)=O Amb18310595 [0,1,0,0,0,1|2,0,0]=4 3898 B9R0.42 CC(NC(C)CO)C(O)=O Amb18315378 [0,1,0,0,0,1|1,0,0]=3 3899 B9R0.42 CC(O)C(C)\C=C(\C)/CO Amb25215302 [0,1,0,0,0,1|2,0,0]=4 3900 B9R0.42 CC(O)C(N)CC(=O)OC Amb24466348 [0,1,0,0,0,1|0,0,0]=2 3901 B9R0.42 CC(O)C(O)CC(O)C=O Amb25729199 [0,1,0,0,0,1|1,0,1]=4 3902 B9R0.42 CC(O)[C@@H](N)CC(=O)OC Amb25315361 [0,1,0,0,0,1|0,0,0]=2 3903 B9R0.42 CC(OC(=O)C=C)C(C)O Amb25831948 [0,1,0,0,0,1|2,0,0]=4 3904 B9R0.42 CC(OC(=O)CC)C(C)O Amb25320390 [0,1,0,0,0,1|2,0,0]=4 3905 B9R0.42 CC(OC(C)C#N)C(O)=O Amb25185255 [0,1,0,0,0,1|2,0,0]=4 3906 B9R0.42 CC(OC(C)CN)C(O)=O Amb18110542 [0,1,0,0,0,1|2,0,0]=4 3907 B9R0.42 CC(SC(C)C#N)C(O)=O Amb18292357 [0,1,0,0,0,1|2,0,0]=4 3908 B9R0.42 CC(SC(C)C=C)C(O)=O Amb18310581 [0,1,0,0,0,1|2,0,0]=4 3909 B9R0.42 CC(SC(C)CN)C(O)=O Amb25096975 [0,1,0,0,0,1|2,0,0]=4 3910 B9R0.42 CC(SC(C)CO)C(O)=O Amb24687156 [0,1,0,0,0,1|1,0,0]=3 3911 B9R0.42 CCC(=C)C[C@H](N)C(O)=O Amb25694434 [0,1,0,0,0,1|1,0,1]=4 3912 B9R0.42 CCC(=O)CC(C)C(C)O Amb25298744 [0,1,0,0,0,1|2,0,0]=4 3913 B9R0.42 CCC(=O)CC(N)C(O)=O Amb22546324 [0,1,0,0,0,1|0,0,2]=4 3914 B9R0.42 CCC(=O)CC(N)C(O)=O Amb24479073 [0,1,0,0,0,1|0,0,2]=4 3915 B9R0.42 CCC(=O)C[C@H](N)C(O)=O Amb24479266 [0,1,0,0,0,1|0,0,2]=4 3916 B9R0.42 CCC(C)CC(C)C(O)=O Amb22228338 [0,1,0,0,0,1|2,0,0]=4 3917 B9R0.42 CCC(C)N[C@@H](C)C(O)=O Amb25691180 [0,1,0,0,0,1|2,0,0]=4 3918 B9R0.42 CCC(C)N[C@H](C)C(O)=O Amb24375136 [0,1,0,0,0,1|2,0,0]=4 3919 B9R0.42 CCC(C)OC(C)C(O)=O Amb25357779 [0,1,0,0,0,1|2,0,0]=4 3920 B9R0.42 CCC(Cl)CC(N)C(O)=O Amb24374416 [0,1,0,0,0,1|1,0,0]=3 3921 B9R0.42 CCC(O)CC(N)C(O)=O Amb24117068 [0,1,0,0,0,1|0,0,0]=2 3922 B9R0.42 CCC(O)C[C@H](N)C(O)=O Amb24759913 [0,1,0,0,0,1|0,0,0]=2 3923 B9R0.42 CCN(O)CC(O)C(O)=O Amb24699297 [0,1,0,0,0,1|2,0,0]=4 3924 B9R0.42 CCS(=N)CC(N)C(O)=O Amb25046702 [0,1,0,0,0,1|2,0,0]=4 3925 B9R0.42 CCS(=N)C[C@H](N)C(O)=O Amb24502175 [0,1,0,0,0,1|2,0,0]=4 3926 B9R0.42 CC[C@@H](C)C[C@H](C)C(O)=O Amb24426532 [0,1,0,0,0,1|2,0,0]=4 3927 B9R0.42 CC[C@@H](F)C[C@H](N)C(O)=O Amb25147291 [0,1,0,0,0,1|1,0,0]=3 3928 B9R0.42 CC[C@H](C)C[C@@H](C)C(O)=O Amb24480420 [0,1,0,0,0,1|2,0,0]=4 3929 B9R0.42 CNC(=O)C[C@@H](N)C(O)=O Amb20240891 [0,1,0,0,0,1|0,0,2]=4 3930 B9R0.42 CNC(=O)C[C@H](N)C(O)=O Amb20242140 [0,1,0,0,0,1|0,0,2]=4 3931 B9R0.42 CNC(=O)NC(C)C(C)O Amb24408107 [0,1,0,0,0,1|2,0,0]=4 3932 B9R0.42 CNC(C)CC(C)C(O)=O Amb25291515 [0,1,0,0,0,1|2,0,0]=4 3933 B9R0.42 COC(=O)CC(N)C(O)=O Amb22489498 [0,1,0,0,0,1|0,0,2]=4 3934 B9R0.42 COC(=O)C[C@@H](C(=O)O)N Amb13884879 [0,1,0,0,0,1|0,0,2]=4 3935 B9R0.42 COC(=O)C[C@@H](N)C(O)=O Amb22745861 [0,1,0,0,0,1|0,0,2]=4 3936 B9R0.42 COC(=O)NC(C(C)C)C Amb10568210 [0,1,0,0,0,1|2,0,0]=4 3937 B9R0.42 COC(=O)\C=C(/N)\C(C)C Amb21858861 [0,1,0,0,0,1|1,0,1]=4 3938 B9R0.42 COC(=O)\C=C(\N)/C(C)C Amb25135602 [0,1,0,0,0,1|1,0,1]=4 3939 B9R0.42 COC(=O)\N=C(/N)\C(C)C Amb25147336 [0,1,0,0,0,1|1,0,1]=4 3940 B9R0.42 COC(C)\C=C(\F)/C(O)=O Amb25263824 [0,1,0,0,0,1|1,0,1]=4 3941 B9R0.42 CO[C@@H](C)C[C@H](C)C(O)=O Amb24691586 [0,1,0,0,0,1|1,0,0]=3 3942 B9R0.42 C[C@@H](CC(=O)OC)[C@H](C)O Amb25206323 [0,1,0,0,0,1|1,0,0]=3 3943 B9R0.42 C[C@@H](C[C@@H](C)C=C)C(O)=O Amb25756960 [0,1,0,0,0,1|2,0,0]=4 3944 B9R0.42 C[C@@H](C[C@@H](N)C(O)=O)CC Amb25844637 [0,1,0,0,0,1|1,0,0]=3 3945 B9R0.42 C[C@@H](C[C@H](C)C=C)C(O)=O Amb25757917 [0,1,0,0,0,1|2,0,0]=4 3946 B9R0.42 C[C@@H](C[C@H](N)C(O)=O)C=C Amb25727679 [0,1,0,0,0,1|1,0,0]=3 3947 B9R0.42 C[C@@H](C[C@H](N)C(O)=O)CC Amb24619367 [0,1,0,0,0,1|1,0,0]=3 3948 B9R0.42 C[C@@H](C[C@H](N)C(O)=O)CF Amb25147611 [0,1,0,0,0,1|1,0,0]=3 3949 B9R0.42 C[C@@H](C[C@H](O)CN)C(O)=O Amb24447195 [0,1,0,0,0,1|1,0,0]=3 3950 B9R0.42 C[C@@H](NC(C)CN)C(O)=O Amb25291159 [0,1,0,0,0,1|2,0,0]=4 3951 B9R0.42 C[C@@H](N[C@@H](C)C#N)C(O)=O Amb24479136 [0,1,0,0,0,1|2,0,0]=4 3952 B9R0.42 C[C@@H](O)[C@@H](O)C[C@@H](O)C=O Amb24524335 [0,1,0,0,0,1|1,0,1]=4 3953 B9R0.42 C[C@@H](O)[C@H](C)\C=C(\C)/CO Amb24352405 [0,1,0,0,0,1|2,0,0]=4 3954 B9R0.42 C[C@@H](O)[C@H](O)C[C@@H](O)C=O Amb25277248 [0,1,0,0,0,1|1,0,1]=4 3955 B9R0.42 C[C@H](C[C@@H](N)C(O)=O)CC Amb25738618 [0,1,0,0,0,1|1,0,0]=3 3956 B9R0.42 C[C@H](C[C@H](C)C=C)C(O)=O Amb24352097 [0,1,0,0,0,1|2,0,0]=4 3957 B9R0.42 C[C@H](C[C@H](C)CO)C(O)=O Amb24480419 [0,1,0,0,0,1|1,0,0]=3 3958 B9R0.42 C[C@H](C[C@H](N)C(O)=O)C#N Amb24529159 [0,1,0,0,0,1|1,0,0]=3 3959 B9R0.42 C[C@H](C[C@H](N)C(O)=O)C=C Amb24561660 [0,1,0,0,0,1|1,0,0]=3 3960 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CC Amb25662528 [0,1,0,0,0,1|1,0,0]=3 3961 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CF Amb25378691 [0,1,0,0,0,1|1,0,0]=3 3962 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CO Amb25378739 [0,1,0,0,0,1|0,0,0]=2 3963 B9R0.42 C[C@H](C[C@H](N)C(O)=O)SC Amb25848560 [0,1,0,0,0,1|0,1,0]=3 3964 B9R0.42 C[C@H](C[C@H](O)C(O)=O)CC Amb24446982 [0,1,0,0,0,1|2,0,0]=4 3965 B9R0.42 C[C@H](O)[C@@H](O)C[C@H](O)C=O Amb25131111 [0,1,0,0,0,1|1,0,1]=4 3966 B9R0.42 C[C@H](O)[C@H](O)CC(=O)C=O Amb25313074 [0,1,0,0,0,1|1,0,1]=4 3967 B9R0.42 C[C@H](OC(C)C#N)C(O)=O Amb25265720 [0,1,0,0,0,1|2,0,0]=4 3968 B9R0.42 C[C@H](OC(C)C=C)C(O)=O Amb25185256 [0,1,0,0,0,1|2,0,0]=4 3969 B9R0.42 C[C@H](\C=C(/C)\C=O)[C@@H](C)O Amb24452145 [0,1,0,0,0,1|2,0,0]=4 3970 B9R0.42 C\C(=C\C(=O)OC)\C(C)O Amb25823878 [0,1,0,0,0,1|1,0,1]=4 3971 B9R0.42 C\C(\CC(N)C(O)=O)=C/C Amb24587021 [0,1,0,0,0,1|1,0,1]=4 3972 B9R0.42 C\C(\C[C@H](N)C(O)=O)=C\C Amb24746992 [0,1,0,0,0,1|1,0,1]=4 3973 B9R0.42 NC(CC(=O)CBr)C(O)=O Amb24477386 [0,1,0,0,0,1|0,0,2]=4 3974 B9R0.42 NC(CC(=O)CCl)C(O)=O Amb24061070 [0,1,0,0,0,1|0,0,2]=4 3975 B9R0.42 NC(CC(=O)CO)C(O)=O Amb18644310 [0,1,0,0,0,1|0,0,2]=4 3976 B9R0.42 NC(CC(=O)NO)C(O)=O Amb22349932 [0,1,0,0,0,1|1,0,1]=4 3977 B9R0.42 NC(CC(F)CN)C(O)=O Amb24709973 [0,1,0,0,0,1|1,0,0]=3 3978 B9R0.42 NC(CC(O)CCl)C(O)=O Amb20179638 [0,1,0,0,0,1|0,0,0]=2 3979 B9R0.42 NC(CC(O)CO)C(O)=O Amb18644388 [0,1,0,0,0,1|0,0,0]=2 3980 B9R0.42 NC(CC(O)CO)C(O)=O Amb24117285 [0,1,0,0,0,1|0,0,0]=2 3981 B9R0.42 NCC(=O)CC(N)C(O)=O Amb24462002 [0,1,0,0,0,1|0,0,2]=4 3982 B9R0.42 NCC(=O)C[C@H](N)C(O)=O Amb25757838 [0,1,0,0,0,1|0,0,2]=4 3983 B9R0.42 NC[C@H](O)C[C@H](O)C(O)=O Amb24383534 [0,1,0,0,0,1|1,0,0]=3 3984 B9R0.42 N[C@@H](CC(=O)CBr)C(O)=O Amb24477399 [0,1,0,0,0,1|0,0,2]=4 3985 B9R0.42 N[C@@H](CC(F)CO)C(O)=O Amb24079182 [0,1,0,0,0,1|1,0,0]=3 3986 B9R0.42 N[C@@H](CC(O)CN)C(O)=O Amb24455060 [0,1,0,0,0,1|0,0,0]=2 3987 B9R0.42 N[C@@H](C[C@@H](O)C=O)C(O)=O Amb25367252 [0,1,0,0,0,1|0,0,1]=3 3988 B9R0.42 N[C@@H](C[C@@H](O)CN)C(O)=O Amb25320209 [0,1,0,0,0,1|0,0,0]=2 3989 B9R0.42 N[C@@H](C[C@@H](O)CO)C(O)=O Amb24680903 [0,1,0,0,0,1|0,0,0]=2 3990 B9R0.42 N[C@@H](C[C@H](O)CCl)C(O)=O Amb25265266 [0,1,0,0,0,1|0,0,0]=2 3991 B9R0.42 N[C@@H](C[C@H](O)CN)C(O)=O Amb24446199 [0,1,0,0,0,1|0,0,0]=2 3992 B9R0.42 N[C@H](CC(=O)NO)C(O)=O Amb24451287 [0,1,0,0,0,1|1,0,1]=4 3993 B9R0.42 N[C@H](C[C@@H](O)CN)C(O)=O Amb24480730 [0,1,0,0,0,1|0,0,0]=2 3994 B9R0.42 N[C@H](C[C@H](O)CN)C(O)=O Amb25147418 [0,1,0,0,0,1|0,0,0]=2 3995 B9R0.42 O=NN(CC(C(=O)O)N)O Amb17607757 [0,1,0,0,0,1|2,0,0]=4 3996 B9R0.42 O=NN(C[C@@H](C(=O)O)N)O Amb17607759 [0,1,0,0,0,1|2,0,0]=4 3997 B9R0.42 O=[15N][15N](CC(C(=O)O)N)O Amb17607758 [0,1,0,0,0,1|2,0,0]=4 3998 B9R0.42 OC(=O)C(=O)CC(O)CO Amb25733244 [0,1,0,0,0,1|1,0,1]=4 3999 B9R0.42 OCC(O)CC(O)C(O)=O Amb18644410 [0,1,0,0,0,1|1,0,0]=3 4000 B9R0.42 OC[C@@H](O)C[C@@H](O)C(O)=O Amb25227512 [0,1,0,0,0,1|1,0,0]=3 4001 B9R0.42 OC[C@@H](O)C[C@H](O)C(O)=O Amb25336564 [0,1,0,0,0,1|1,0,0]=3 4002 B9R0.42 OC[C@H](O)C[C@@H](O)C(O)=O Amb25774509 [0,1,0,0,0,1|1,0,0]=3 4003 B9R0.57 C([2H])(CC(C(=O)O)N)([2H])[2H] Amb17607913 [0,1,0,0,0,1|2,0,0]=4 4004 B9R0.57 CC(=O)C(N)OC(C)(C)C Amb24718655 [0,1,0,0,0,1|2,0,0]=4 4005 B9R0.57 CC(=O)[C@H](N)OC(C)(C)C Amb25042352 [0,1,0,0,0,1|2,0,0]=4 4006 B9R0.57 CC(C(=O)O)NC(C)(C)C Amb17399895 [0,1,0,0,0,1|2,0,0]=4 4007 B9R0.57 CC(C)(C)CC(Br)C(O)=O Amb25324184 [0,1,0,0,0,1|2,0,0]=4 4008 B9R0.57 CC(C)(C)CC(Cl)C(O)=O Amb25281140 [0,1,0,0,0,1|2,0,0]=4 4009 B9R0.57 CC(C)(C)CC(F)C(O)=O Amb25107249 [0,1,0,0,0,1|2,0,0]=4 4010 B9R0.57 CC(C)(C)CC(N)C(N)=O Amb19000296 [0,1,0,0,0,1|2,0,0]=4 4011 B9R0.57 CC(C)(C)CC(N)P(O)=O Amb24695250 [0,1,0,0,0,1|2,0,0]=4 4012 B9R0.57 CC(C)(C)CC(O)C(O)=O Amb18302187 [0,1,0,0,0,1|2,0,0]=4 4013 B9R0.57 CC(C)(C)C[C@@H](N)C(N)=O Amb24457334 [0,1,0,0,0,1|2,0,0]=4 4014 B9R0.57 CC(C)(C)C[C@@H](O)C(O)=O Amb22057813 [0,1,0,0,0,1|2,0,0]=4 4015 B9R0.57 CC(C)(C)C[C@H](O)C(O)=O Amb25727583 [0,1,0,0,0,1|2,0,0]=4 4016 B9R0.57 CC(C)(C)NC(O)C(O)=O Amb24641288 [0,1,0,0,0,1|2,0,0]=4 4017 B9R0.57 CC(C)(Cl)C[C@H](N)C(O)=O Amb24711368 [0,1,0,0,0,1|1,0,0]=3 4018 B9R0.57 CC(C)(F)C[C@@H](N)C(O)=O Amb24055873 [0,1,0,0,0,1|1,0,0]=3 4019 B9R0.57 CC(C)(N)CC(N)C(O)=O Amb25195464 [0,1,0,0,0,1|1,0,0]=3 4020 B9R0.57 CC(C)(O)CC(N)C(O)=O Amb18644326 [0,1,0,0,0,1|0,0,0]=2 4021 B9R0.57 CC(C)(O)C[C@@H](N)C(O)=O Amb24479570 [0,1,0,0,0,1|0,0,0]=2 4022 B9R0.57 CC(C)C(N)CP(C)(O)=O Amb24663118 [0,1,0,0,0,1|2,0,0]=4 4023 B9R0.57 CC(C)[C@@H](N)CP(O)(O)=O Amb24626120 [0,1,0,0,0,1|2,0,0]=4 4024 B9R0.57 CC(C)[C@@H](N)CS(O)(=O)=O Amb24509501 [0,1,0,0,0,1|2,0,0]=4 4025 B9R0.57 CC(C)[C@H](N)CS(O)(=O)=O Amb24529309 [0,1,0,0,0,1|2,0,0]=4 4026 B9R0.57 CC(CC(C)(C)C)C(O)=O Amb18124693 [0,1,0,0,0,1|2,0,0]=4 4027 B9R0.57 CC(CC(C)(C)N)C(O)=O Amb22364426 [0,1,0,0,0,1|2,0,0]=4 4028 B9R0.57 CC(CC(C)(C)O)C(C)=O Amb25141586 [0,1,0,0,0,1|2,0,0]=4 4029 B9R0.57 CC(CC(C)(C)O)C(O)=O Amb24529313 [0,1,0,0,0,1|1,0,0]=3 4030 B9R0.57 CC(F)(F)CC(S)C(O)=O Amb24677777 [0,1,0,0,0,1|2,0,0]=4 4031 B9R0.57 CC(O)C(C)OP(O)(O)=O Amb25332491 [0,1,0,0,0,1|2,0,0]=4 4032 B9R0.57 CC(SC(C)(C)C)C(O)=O Amb25341387 [0,1,0,0,0,1|2,0,0]=4 4033 B9R0.57 CS(=N)(=O)CC(N)C(O)=O Amb24732321 [0,1,0,0,0,1|1,0,1]=4 4034 B9R0.57 C[C@@H](OC(C)(C)C)C(O)=O Amb25700452 [0,1,0,0,0,1|2,0,0]=4 4035 B9R0.57 C[C@H](OC(C)(C)C)C(O)=O Amb25111514 [0,1,0,0,0,1|2,0,0]=4 4036 B9R0.57 C[C@H](SC(C)(C)C)C(O)=O Amb25074461 [0,1,0,0,0,1|2,0,0]=4 4037 B9R0.57 C[S@](=N)(=O)C[C@H](N)C(O)=O Amb25749061 [0,1,0,0,0,1|1,0,1]=4 4038 B9R0.57 C[Si](C)(C)C[C@H](N)C(O)=O Amb24482244 [0,1,0,0,0,1|1,1,0]=4 4039 B9R0.57 C[Si](C)(O)CC(N)C(O)=O Amb25060652 [0,1,0,0,0,1|0,1,0]=3 4040 B9R0.57 NC(C(=O)O)CC(F)(F)F Amb10603542 [0,1,0,0,0,1|2,0,0]=4 4041 B9R0.57 NC(CC(Cl)(Cl)Cl)C(O)=O Amb24399501 [0,1,0,0,0,1|2,0,0]=4 4042 B9R0.57 NC(CS(O)(=O)=O)C(O)=O Amb21929317 [0,1,0,0,0,1|2,0,0]=4 4043 B9R0.57 N[C@@H](C(=O)O)CC(C)(C)C Amb16184025 [0,1,0,0,0,1|1,0,0]=3 4044 B9R0.57 N[C@@H](CC(F)(F)F)C(O)=O Amb19889287 [0,1,0,0,0,1|2,0,0]=4 4045 B9R0.57 N[C@@H](CS(O)(=O)=O)C(O)=O Amb17942867 [0,1,0,0,0,1|2,0,0]=4 4046 B9R0.57 N[C@H](CC(F)(F)F)C(O)=O Amb19889286 [0,1,0,0,0,1|2,0,0]=4 4047 B9R0.57 OC(=O)[C@H](C[C](=O)(O)C)N Amb10604178 [0,1,0,0,0,1|0,0,1]=3 4048 B9R0.57 [2H]C([2H])([2H])C[C@@H](N)C(O)=O Amb19130400 [0,1,0,0,0,1|2,0,0]=4 4049 B9R0.79 C=C(C(N)C(O)=O)C(O)=O Amb18644186 [0,1,0,0,0,1|1,0,1]=4 4050 B9R0.79 CC(=O)C(=C)[C@H](O)[C@@H](C)O Amb25051798 [0,1,0,0,0,1|2,0,0]=4 4051 B9R0.79 CC(=O)C(=O)[C@@H](O)[C@@H](C)O Amb25187316 [0,1,0,0,0,1|2,0,0]=4 4052 B9R0.79 CC(=O)C(=O)[C@H](O)[C@@H](C)O Amb25066378 [0,1,0,0,0,1|2,0,0]=4 4053 B9R0.79 CC(=O)C(C)C(N)C(O)=O Amb18202116 [0,1,0,0,0,1|0,0,2]=4 4054 B9R0.79 CC(=O)[C@@H](C)[C@H](N)C(O)=O Amb25703453 [0,1,0,0,0,1|0,0,2]=4 4055 B9R0.79 CC(C(C)O)C(=O)C(O)=O Amb24454984 [0,1,0,0,0,1|1,0,0]=3 4056 B9R0.79 CC(C(N)C(O)=O)C(Cl)Cl Amb24412209 [0,1,0,0,0,1|2,0,0]=4 4057 B9R0.79 CC(C)C(=C)C(C)C(O)=O Amb24581229 [0,1,0,0,0,1|2,0,0]=4 4058 B9R0.79 CC(C)C(Br)C(=O)C(O)=O Amb18131027 [0,1,0,0,0,1|2,0,0]=4 4059 B9R0.79 CC(C)C(C)C(C)C(O)=O Amb18124692 [0,1,0,0,0,1|2,0,0]=4 4060 B9R0.79 CC(C)C(C)C(F)C(O)=O Amb25853148 [0,1,0,0,0,1|2,0,0]=4 4061 B9R0.79 CC(C)C(Cl)C(=O)C(O)=O Amb18646182 [0,1,0,0,0,1|2,0,0]=4 4062 B9R0.79 CC(C)C(Cl)C(N)C(O)=O Amb25779528 [0,1,0,0,0,1|1,0,0]=3 4063 B9R0.79 CC(C)C(O)C(Br)C(O)=O Amb25313138 [0,1,0,0,0,1|2,0,0]=4 4064 B9R0.79 CC(C)C(O)C(C)C(O)=O Amb18990636 [0,1,0,0,0,1|2,0,0]=4 4065 B9R0.79 CC(C)C(O)C(Cl)C(O)=O Amb25275308 [0,1,0,0,0,1|2,0,0]=4 4066 B9R0.79 CC(C)C(O)C(N)C(O)=O Amb23399656 [0,1,0,0,0,1|1,0,0]=3 4067 B9R0.79 CC(C)C(O)[C@@H](N)C(O)=O Amb19130451 [0,1,0,0,0,1|1,0,0]=3 4068 B9R0.79 CC(C)C(O)[C@H](N)C(O)=O Amb24509492 [0,1,0,0,0,1|1,0,0]=3 4069 B9R0.79 CC(C)S(=O)C(C)C(O)=O Amb18289811 [0,1,0,0,0,1|2,0,0]=4 4070 B9R0.79 CC(C)[C@@H](C)[C@@H](N)C(O)=O Amb24670804 [0,1,0,0,0,1|1,0,0]=3 4071 B9R0.79 CC(C)[C@@H](C)[C@H](N)C(O)=O Amb25061907 [0,1,0,0,0,1|1,0,0]=3 4072 B9R0.79 CC(C)[C@@H](C)[C@H](O)C(O)=O Amb24447350 [0,1,0,0,0,1|2,0,0]=4 4073 B9R0.79 CC(C)[C@@H](F)[C@@H](N)C(O)=O Amb22802115 [0,1,0,0,0,1|1,0,0]=3 4074 B9R0.79 CC(C)[C@@H](N)C(O)C(O)=O Amb25258947 [0,1,0,0,0,1|1,0,0]=3 4075 B9R0.79 CC(C)[C@@H](O)[C@@H](N)C(O)=O Amb22224932 [0,1,0,0,0,1|1,0,0]=3 4076 B9R0.79 CC(C)[C@@H](O)[C@@H](O)C(O)=O Amb25222321 [0,1,0,0,0,1|2,0,0]=4 4077 B9R0.79 CC(C)[C@@H](O)[C@H](O)C(O)=O Amb24550312 [0,1,0,0,0,1|2,0,0]=4 4078 B9R0.79 CC(C)[C@@H](S)[C@H](N)C(O)=O Amb25302326 [0,1,0,0,0,1|1,0,0]=3 4079 B9R0.79 CC(C)[C@H](C)[C@@H](N)C(O)=O Amb25147401 [0,1,0,0,0,1|1,0,0]=3 4080 B9R0.79 CC(C)[C@H](C)[C@H](O)C(O)=O Amb24548143 [0,1,0,0,0,1|2,0,0]=4 4081 B9R0.79 CC(C)[C@H](N)C(O)C(O)=O Amb24744520 [0,1,0,0,0,1|1,0,0]=3 4082 B9R0.79 CC(C)[C@H](N)[C@@H](F)C(O)=O Amb24629885 [0,1,0,0,0,1|1,0,0]=3 4083 B9R0.79 CC(C)[C@H](N)[C@@H](O)C(O)=O Amb24428177 [0,1,0,0,0,1|1,0,0]=3 4084 B9R0.79 CC(C)[C@H](N)[C@H](O)C(O)=O Amb25147282 [0,1,0,0,0,1|1,0,0]=3 4085 B9R0.79 CC(C)[C@H](O)[C@@H](Br)C(O)=O Amb24598278 [0,1,0,0,0,1|2,0,0]=4 4086 B9R0.79 CC(N)C(C)C(C)C(O)=O Amb25828384 [0,1,0,0,0,1|2,0,0]=4 4087 B9R0.79 CC(O)C(C)C(N)C(O)=O Amb21953714 [0,1,0,0,0,1|0,0,0]=2 4088 B9R0.79 CC(O)C(C)[C@@H](N)C(O)=O Amb22800202 [0,1,0,0,0,1|0,0,0]=2 4089 B9R0.79 CC(O)C(O)C(O)C(C)=O Amb25145498 [0,1,0,0,0,1|2,0,0]=4 4090 B9R0.79 CC(O)[C@@H](C)[C@@H](N)C(O)=O Amb24052812 [0,1,0,0,0,1|0,0,0]=2 4091 B9R0.79 CC([C@@H](N)C(O)=O)C(O)=O Amb22745450 [0,1,0,0,0,1|1,0,1]=4 4092 B9R0.79 CC([C@@H]([C@@H](C(=O)O)N)C)O Amb10603785 [0,1,0,0,0,1|0,0,0]=2 4093 B9R0.79 CC([C@@H]([C@H](C(=O)O)C)O)C Amb10844253 [0,1,0,0,0,1|2,0,0]=4 4094 B9R0.79 CC([C@@H]([C@H](C(=O)O)N)O)C Amb10807407 [0,1,0,0,0,1|1,0,0]=3 4095 B9R0.79 CN(O)C(C)C(C)C(O)=O Amb24540667 [0,1,0,0,0,1|2,0,0]=4 4096 B9R0.79 C[C@@H](O)C(O)[C@H](N)C(O)=O Amb24435507 [0,1,0,0,0,1|0,0,0]=2 4097 B9R0.79 C[C@@H](O)[C@@H](C)[C@@H](N)C(O)=O Amb25693814 [0,1,0,0,0,1|0,0,0]=2 4098 B9R0.79 C[C@@H](O)[C@@H](C)[C@H](N)C(O)=O Amb24340188 [0,1,0,0,0,1|0,0,0]=2 4099 B9R0.79 C[C@@H](O)[C@@H](O)[C@@H](O)C(C)=O Amb24661092 [0,1,0,0,0,1|2,0,0]=4 4100 B9R0.79 C[C@@H](O)[C@H](O)[C@@H](O)C(O)=O Amb24482345 [0,1,0,0,0,1|1,0,0]=3 4101 B9R0.79 C[C@@H](O)[C@H](O)[C@H](O)C(O)=O Amb24711187 [0,1,0,0,0,1|1,0,0]=3 4102 B9R0.79 C[C@@H]([C@H](N)C(O)=O)C(O)=O Amb22756698 [0,1,0,0,0,1|1,0,1]=4 4103 B9R0.79 C[C@@H]([C@H](O)[C@H](C)N)C(O)=O Amb24563136 [0,1,0,0,0,1|2,0,0]=4 4104 B9R0.79 C[C@H](O)C(C)[C@H](N)C(O)=O Amb22735316 [0,1,0,0,0,1|0,0,0]=2 4105 B9R0.79 C[C@H](O)[C@@H](O)[C@@H](O)C(N)=O Amb24712923 [0,1,0,0,0,1|2,0,0]=4 4106 B9R0.79 C[C@H](O)[C@@H](O)[C@@H](O)C(O)=O Amb25374422 [0,1,0,0,0,1|1,0,0]=3 4107 B9R0.79 C[C@H]([C@@H]([C@@H](C(=O)O)N)C)O Amb17615448 [0,1,0,0,0,1|0,0,0]=2 4108 B9R0.79 C[C@H]([C@H](N)C(O)=O)C(C)Cl Amb25363328 [0,1,0,0,0,1|1,0,0]=3 4109 B9R0.79 C[C@H]([C@H](N)C(O)=O)C(O)=O Amb25324829 [0,1,0,0,0,1|1,0,1]=4 4110 B9R0.79 NC(C(Br)C(O)=O)C(O)=O Amb18657078 [0,1,0,0,0,1|1,0,1]=4 4111 B9R0.79 NC(C(Cl)C(Cl)Cl)C(O)=O Amb24375729 [0,1,0,0,0,1|2,0,0]=4 4112 B9R0.79 NC(C(Cl)C(O)=O)C(O)=O Amb18126453 [0,1,0,0,0,1|1,0,1]=4 4113 B9R0.79 NC(C(F)C(O)=O)C(F)F Amb24482391 [0,1,0,0,0,1|2,0,0]=4 4114 B9R0.79 NC(C(F)C(O)=O)C(O)=O Amb24061061 [0,1,0,0,0,1|1,0,1]=4 4115 B9R0.79 NC(C(N)C(O)=O)C(O)=O Amb18124865 [0,1,0,0,0,1|1,0,1]=4 4116 B9R0.79 NC(C(N)C(O)=O)C(O)=O Amb24117894 [0,1,0,0,0,1|1,0,1]=4 4117 B9R0.79 NC(C(O)C(F)F)C(O)=O Amb19148422 [0,1,0,0,0,1|2,0,0]=4 4118 B9R0.79 NC([C@H](O)C(O)=O)C(O)=O Amb24513602 [0,1,0,0,0,1|1,0,1]=4 4119 B9R0.79 N[C@@H](C(O)C(O)=O)C(O)=O Amb22229324 [0,1,0,0,0,1|1,0,1]=4 4120 B9R0.79 N[C@@H]([C@@H](O)C(O)=O)C(O)=O Amb24087715 [0,1,0,0,0,1|1,0,1]=4 4121 B9R0.79 N[C@@H]([C@@H](O)C(O)=O)C(O)=O Amb24117974 [0,1,0,0,0,1|1,0,1]=4 4122 B9R0.79 N[C@H]([C@@H](C(=O)O)N)C(=O)O Amb10072362 [0,1,0,0,0,1|1,0,1]=4 4123 B9R0.79 N[C@H]([C@@H](F)C(O)=O)C(O)=O Amb22229006 [0,1,0,0,0,1|1,0,1]=4 4124 B9R0.79 N[C@H]([C@@H](N)C(O)=O)C(O)=O Amb22802394 [0,1,0,0,0,1|1,0,1]=4 4125 B9R0.79 N[C@H]([C@@H](O)C(O)=O)C(O)=O Amb17942870 [0,1,0,0,0,1|1,0,1]=4 4126 B9R0.79 N[C@H]([C@H](F)C(O)=O)C(O)=O Amb24634454 [0,1,0,0,0,1|1,0,1]=4 4127 B9R0.79 OC(=O)C(C(C(=O)O)C)N Amb2099482 [0,1,0,0,0,1|1,0,1]=4 4128 B9R0.79 OC(=O)[C@H](C(C(=O)O)C)N Amb16232531 [0,1,0,0,0,1|1,0,1]=4 4129 B9R0.79 OC(=O)[C@H]([C@@H](C(=O)O)N)O Amb17615140 [0,1,0,0,0,1|1,0,1]=4 4130 B9R0.6 C=CCC(N)C(O)C(O)=O Amb25147612 [0,2,0,0,0,0|2,0,0]=4 4131 B9R0.6 C=CC[C@@H](O)[C@H](N)C(O)=O Amb24459826 [0,2,0,0,0,0|0,0,0]=2 4132 B9R0.6 CC#C[C@H](O)[C@H](N)C(O)=O Amb25313389 [0,2,0,0,0,0|0,0,0]=2 4133 B9R0.6 CC(=O)C(N)C(=O)OCC Amb18124722 [0,2,0,0,0,0|0,0,2]=4 4134 B9R0.6 CC(=O)C(O)C(O)CCO Amb24458926 [0,2,0,0,0,0|2,0,0]=4 4135 B9R0.6 CC(=O)[C@@H](O)[C@H](O)CCO Amb24409676 [0,2,0,0,0,0|2,0,0]=4 4136 B9R0.6 CC(Br)C(O)C(=O)OCC Amb24382954 [0,2,0,0,0,0|2,0,0]=4 4137 B9R0.6 CC(C(C)CC=C)C(O)=O Amb18643938 [0,2,0,0,0,0|2,0,0]=4 4138 B9R0.6 CC(C(C)CC=O)C(O)=O Amb18644133 [0,2,0,0,0,0|1,0,1]=4 4139 B9R0.6 CC(C(C)CNC)C(O)=O Amb25379230 [0,2,0,0,0,0|2,0,0]=4 4140 B9R0.6 CC(C(C)COC)C(C)=O Amb24701910 [0,2,0,0,0,0|2,0,0]=4 4141 B9R0.6 CC(C(C)COC)C(N)=O Amb25682872 [0,2,0,0,0,0|2,0,0]=4 4142 B9R0.6 CC(C(C)N)C(=O)COC Amb24417315 [0,2,0,0,0,0|2,0,0]=4 4143 B9R0.6 CC(C(C)N)C(=O)OCC Amb25759658 [0,2,0,0,0,0|2,0,0]=4 4144 B9R0.6 CC(C(C)NC=O)C(O)=O Amb24543868 [0,2,0,0,0,0|1,0,1]=4 4145 B9R0.6 CC(C(C)NOC)C(O)=O Amb24465798 [0,2,0,0,0,0|1,0,0]=3 4146 B9R0.6 CC(C(N)CCC)C(O)=O Amb24763852 [0,2,0,0,0,0|2,0,0]=4 4147 B9R0.6 CC(C(O)CCC)C(O)=O Amb18310700 [0,2,0,0,0,0|1,0,0]=3 4148 B9R0.6 CC(C(O)\C=C\C)C(C)=O Amb24380970 [0,2,0,0,0,0|2,0,0]=4 4149 B9R0.6 CC(C(O)\C=C\C)C(O)=O Amb18644138 [0,2,0,0,0,0|1,0,0]=3 4150 B9R0.6 CC(C)C(C)C(=O)COC Amb25769374 [0,2,0,0,0,0|2,0,0]=4 4151 B9R0.6 CC(C)C(Cl)C(=O)OCC Amb18800861 [0,2,0,0,0,0|2,0,0]=4 4152 B9R0.6 CC(C)C(Cl)C(=O)OCCl Amb25264431 [0,2,0,0,0,0|2,0,0]=4 4153 B9R0.6 CC(C)C(F)C(=O)NOC Amb25220815 [0,2,0,0,0,0|2,0,0]=4 4154 B9R0.6 CC(C)C(F)C(=O)OCC Amb24554825 [0,2,0,0,0,0|2,0,0]=4 4155 B9R0.6 CC(C)C(N)C(=C)COC Amb24589438 [0,2,0,0,0,0|2,0,0]=4 4156 B9R0.6 CC(C)C(N)C(=O)CC=C Amb25118255 [0,2,0,0,0,0|2,0,0]=4 4157 B9R0.6 CC(C)C(N)C(=O)NCC Amb21956643 [0,2,0,0,0,0|2,0,0]=4 4158 B9R0.6 CC(C)C(O)C(=O)COC Amb24454492 [0,2,0,0,0,0|2,0,0]=4 4159 B9R0.6 CC(C)C(O)C(=O)OCC Amb25787483 [0,2,0,0,0,0|2,0,0]=4 4160 B9R0.6 CC(C)[C@@H](N)C(=O)NCC Amb18538480 [0,2,0,0,0,0|2,0,0]=4 4161 B9R0.6 CC(C)[C@@H](N)C(=O)OCC Amb22801934 [0,2,0,0,0,0|1,0,0]=3 4162 B9R0.6 CC(C)[C@@H](O)C(=O)OCC Amb20241602 [0,2,0,0,0,0|2,0,0]=4 4163 B9R0.6 CC(C)[C@H](N)C(=O)NOC Amb25104774 [0,2,0,0,0,0|1,0,0]=3 4164 B9R0.6 CC(C)[C@H](O)C(=O)OCC Amb25079854 [0,2,0,0,0,0|2,0,0]=4 4165 B9R0.6 CC(C=C=C)C(N)C(O)=O Amb25785751 [0,2,0,0,0,0|1,0,0]=3 4166 B9R0.6 CC(CCC)C(N)C(O)=O Amb20622789 [0,2,0,0,0,0|1,0,0]=3 4167 B9R0.6 CC(CCC)C(S)C(O)=O Amb24438702 [0,2,0,0,0,0|2,0,0]=4 4168 B9R0.6 CC(CCCl)C(N)C(O)=O Amb25803640 [0,2,0,0,0,0|1,0,0]=3 4169 B9R0.6 CC(CCN)C(N)C(O)=O Amb25309114 [0,2,0,0,0,0|1,0,0]=3 4170 B9R0.6 CC(CCO)C(N)C(O)=O Amb25054791 [0,2,0,0,0,0|0,0,0]=2 4171 B9R0.6 CC(CCO)C(O)C(O)=O Amb24392760 [0,2,0,0,0,0|1,0,0]=3 4172 B9R0.6 CC(CCO)[C@H](N)C(O)=O Amb24744497 [0,2,0,0,0,0|0,0,0]=2 4173 B9R0.6 CC(COC)C(N)C(N)=O Amb24468545 [0,2,0,0,0,0|1,0,0]=3 4174 B9R0.6 CC(COC)C(N)C(O)=O Amb24116980 [0,2,0,0,0,0|0,0,0]=2 4175 B9R0.6 CC(COC)[C@H](N)C(O)=O Amb25729786 [0,2,0,0,0,0|0,0,0]=2 4176 B9R0.6 CC(CSC)[C@@H](N)C(O)=O Amb24482316 [0,2,0,0,0,0|0,1,0]=3 4177 B9R0.6 CC(Cl)C(Cl)C(=O)OCC Amb25374725 [0,2,0,0,0,0|2,0,0]=4 4178 B9R0.6 CC(F)C(O)C(=O)OCC Amb24403866 [0,2,0,0,0,0|2,0,0]=4 4179 B9R0.6 CC(N)C(O)C(=O)OCC Amb25048818 [0,2,0,0,0,0|2,0,0]=4 4180 B9R0.6 CC(N=[N+]=[N-])C(N)C(O)=O Amb24477179 [0,2,0,0,0,0|1,0,0]=3 4181 B9R0.6 CC(NCC)C(O)C(O)=O Amb25679409 [0,2,0,0,0,0|2,0,0]=4 4182 B9R0.6 CC(O)C(Cl)C(=O)OCC Amb25240641 [0,2,0,0,0,0|1,0,0]=3 4183 B9R0.6 CC(O)C(N)C(=O)CCN Amb25799652 [0,2,0,0,0,0|1,0,0]=3 4184 B9R0.6 CC(O)C(O)C(=C)COC Amb24606718 [0,2,0,0,0,0|2,0,0]=4 4185 B9R0.6 CC(O)C(O)C(=O)\C=C\O Amb25143412 [0,2,0,0,0,0|1,0,0]=3 4186 B9R0.6 CC(OCC)C(Br)C(O)=O Amb24416715 [0,2,0,0,0,0|1,0,0]=3 4187 B9R0.6 CC(OCC)[C@H](S)C(O)=O Amb25053429 [0,2,0,0,0,0|1,0,0]=3 4188 B9R0.6 CC(OCO)C(N)C(O)=O Amb24567906 [0,2,0,0,0,0|0,0,0]=2 4189 B9R0.6 CC([C@@H](C)O)C(=O)OCC Amb25316250 [0,2,0,0,0,0|1,0,0]=3 4190 B9R0.6 CC([C@H](N)CCC)C(O)=O Amb25238448 [0,2,0,0,0,0|2,0,0]=4 4191 B9R0.6 CC(\C=C\C)C(Br)C(O)=O Amb25703798 [0,2,0,0,0,0|2,0,0]=4 4192 B9R0.6 CC(\C=C\C)C(F)C(O)=O Amb24595961 [0,2,0,0,0,0|2,0,0]=4 4193 B9R0.6 CC(\C=C\C)C(O)C(O)=O Amb18644120 [0,2,0,0,0,0|2,0,0]=4 4194 B9R0.6 CCCC(Br)C(O)C(O)=O Amb25229083 [0,2,0,0,0,0|2,0,0]=4 4195 B9R0.6 CCCC(C(C(=O)C)C)O Amb17593628 [0,2,0,0,0,0|2,0,0]=4 4196 B9R0.6 CCCC(C(C(=O)O)N)F Amb10839857 [0,2,0,0,0,0|1,0,0]=3 4197 B9R0.6 CCCC(N)C(O)C(O)=O Amb20242874 [0,2,0,0,0,0|2,0,0]=4 4198 B9R0.6 CCCC(O)C(=C)C(O)=O Amb25131217 [0,2,0,0,0,0|1,0,1]=4 4199 B9R0.6 CCCC(O)C(Br)C(O)=O Amb24633342 [0,2,0,0,0,0|1,0,0]=3 4200 B9R0.6 CCCC(O)C(N)C(N)=O Amb25375285 [0,2,0,0,0,0|1,0,0]=3 4201 B9R0.6 CCCC(O)C(N)C(O)=O Amb18124815 [0,2,0,0,0,0|0,0,0]=2 4202 B9R0.6 CCCC(O)[C@@H](N)C(O)=O Amb25268432 [0,2,0,0,0,0|0,0,0]=2 4203 B9R0.6 CCCC(S)[C@H](N)C(O)=O Amb24359854 [0,2,0,0,0,0|0,1,0]=3 4204 B9R0.6 CCC[C@@H](N)[C@@H](O)C(O)=O Amb22747816 [0,2,0,0,0,0|2,0,0]=4 4205 B9R0.6 CCC[C@@H](N)[C@H](O)C(O)=O Amb22747809 [0,2,0,0,0,0|2,0,0]=4 4206 B9R0.6 CCC[C@@H](O)[C@@H](N)C(O)=O Amb25367288 [0,2,0,0,0,0|0,0,0]=2 4207 B9R0.6 CCC[C@@H](O)[C@H](N)C(O)=O Amb24715802 [0,2,0,0,0,0|0,0,0]=2 4208 B9R0.6 CCC[C@@H](O)[C@H](O)C(C)=O Amb25282703 [0,2,0,0,0,0|2,0,0]=4 4209 B9R0.6 CCC[C@@H](O)[C@H](O)C(O)=O Amb24480722 [0,2,0,0,0,0|1,0,0]=3 4210 B9R0.6 CCC[C@H](N)[C@H](O)C(O)=O Amb25084552 [0,2,0,0,0,0|2,0,0]=4 4211 B9R0.6 CCC[C@H](O)[C@@H](Br)C(O)=O Amb25309541 [0,2,0,0,0,0|1,0,0]=3 4212 B9R0.6 CCC[C@H](O)[C@H](Br)C(O)=O Amb24727027 [0,2,0,0,0,0|1,0,0]=3 4213 B9R0.6 CCC[C@H](O)[C@H](N)C(O)=O Amb25113866 [0,2,0,0,0,0|0,0,0]=2 4214 B9R0.6 CCNC(=O)[C@H](C(C)C)N Amb17231989 [0,2,0,0,0,0|2,0,0]=4 4215 B9R0.6 CCOC(=O)C(=O)C(C)O Amb25146496 [0,2,0,0,0,0|1,0,1]=4 4216 B9R0.6 CCOC(=O)C(C(C)C)N Amb17621190 [0,2,0,0,0,0|1,0,0]=3 4217 B9R0.6 CCOC(=O)C(C(O)C)C Amb17615516 [0,2,0,0,0,0|1,0,0]=3 4218 B9R0.6 CCOC(=O)C(C(O)C)O Amb17593683 [0,2,0,0,0,0|1,0,0]=3 4219 B9R0.6 CCOC(=O)C(N)C(F)F Amb25795018 [0,2,0,0,0,0|2,0,0]=4 4220 B9R0.6 CCOC(=O)[C@@H](C(C)C)N Amb10069732 [0,2,0,0,0,0|1,0,0]=3 4221 B9R0.6 CCOC(=O)[C@@H](N)C(F)F Amb24117985 [0,2,0,0,0,0|2,0,0]=4 4222 B9R0.6 CCOC(=O)[C@@H](O)[C@@H](C)O Amb17666646 [0,2,0,0,0,0|1,0,0]=3 4223 B9R0.6 COCC(O)=C(N)C(O)=O Amb25340695 [0,2,0,0,0,0|0,0,2]=4 4224 B9R0.6 COCC(O)C(N)C(O)=O Amb25147551 [0,2,0,0,0,0|0,0,0]=2 4225 B9R0.6 CSCC(O)C(N)C(O)=O Amb18646340 [0,2,0,0,0,0|0,0,0]=2 4226 B9R0.6 C[C@@H](CCC)[C@H](O)C(O)=O Amb25368297 [0,2,0,0,0,0|2,0,0]=4 4227 B9R0.6 C[C@@H](CCF)[C@H](N)C(O)=O Amb25147533 [0,2,0,0,0,0|1,0,0]=3 4228 B9R0.6 C[C@@H](CCO)[C@H](N)C(O)=O Amb25709206 [0,2,0,0,0,0|0,0,0]=2 4229 B9R0.6 C[C@@H](F)[C@@H](N)C(=O)OCC Amb25727320 [0,2,0,0,0,0|1,0,0]=3 4230 B9R0.6 C[C@@H](O)[C@@H](Cl)C(=O)OCC Amb25273933 [0,2,0,0,0,0|1,0,0]=3 4231 B9R0.6 C[C@@H](O)[C@@H](F)C(=O)OCC Amb24450415 [0,2,0,0,0,0|1,0,0]=3 4232 B9R0.6 C[C@@H](O)[C@@H](S)C(=O)OCC Amb24448070 [0,2,0,0,0,0|1,0,0]=3 4233 B9R0.6 C[C@@H](O)[C@H](N)C(=O)OCC Amb22745461 [0,2,0,0,0,0|0,0,0]=2 4234 B9R0.6 C[C@@H](O)[C@H](O)[C@@H](O)CC=O Amb24711764 [0,2,0,0,0,0|1,0,1]=4 4235 B9R0.6 C[C@@H](O)[C@H](O)[C@H](O)CC=O Amb25253399 [0,2,0,0,0,0|1,0,1]=4 4236 B9R0.6 C[C@@H](OCC)[C@@H](N)C(O)=O Amb22747686 [0,2,0,0,0,0|0,0,0]=2 4237 B9R0.6 C[C@@H]([C@@H](C(=O)O)N)OCC Amb10807408 [0,2,0,0,0,0|0,0,0]=2 4238 B9R0.6 C[C@@H]([C@@H](O)CCC)C(O)=O Amb24445556 [0,2,0,0,0,0|1,0,0]=3 4239 B9R0.6 C[C@@H]([C@H](C)O)C(=O)SCC Amb25357495 [0,2,0,0,0,0|1,1,0]=4 4240 B9R0.6 C[C@@H]([C@H](O)CCC)C(O)=O Amb24529277 [0,2,0,0,0,0|1,0,0]=3 4241 B9R0.6 C[C@@H]([C@H](O)\C=C\C)C(O)=O Amb25340404 [0,2,0,0,0,0|1,0,0]=3 4242 B9R0.6 C[C@@H](\C=C\C)[C@@H](O)C(O)=O Amb24480683 [0,2,0,0,0,0|2,0,0]=4 4243 B9R0.6 C[C@@H](\C=C\C)[C@H](Br)C(O)=O Amb25309543 [0,2,0,0,0,0|2,0,0]=4 4244 B9R0.6 C[C@H](C(O)CCC)C(O)=O Amb25096562 [0,2,0,0,0,0|1,0,0]=3 4245 B9R0.6 C[C@H](CC=C)[C@H](N)C(O)=O Amb25347201 [0,2,0,0,0,0|1,0,0]=3 4246 B9R0.6 C[C@H](CCC)[C@H](N)C(O)=O Amb25062732 [0,2,0,0,0,0|1,0,0]=3 4247 B9R0.6 C[C@H](CCC)[C@H](O)C(O)=O Amb25786123 [0,2,0,0,0,0|2,0,0]=4 4248 B9R0.6 C[C@H](CCF)[C@H](N)C(O)=O Amb25132099 [0,2,0,0,0,0|1,0,0]=3 4249 B9R0.6 C[C@H](CCO)[C@H](N)C(O)=O Amb25111969 [0,2,0,0,0,0|0,0,0]=2 4250 B9R0.6 C[C@H](CCO)[C@H](O)C(O)=O Amb25122108 [0,2,0,0,0,0|1,0,0]=3 4251 B9R0.6 C[C@H](CSC)[C@@H](N)C(O)=O Amb24642749 [0,2,0,0,0,0|0,1,0]=3 4252 B9R0.6 C[C@H](CSC)[C@H](N)C(O)=O Amb25851133 [0,2,0,0,0,0|0,1,0]=3 4253 B9R0.6 C[C@H](F)[C@@H](N)C(=O)OCC Amb25703513 [0,2,0,0,0,0|1,0,0]=3 4254 B9R0.6 C[C@H](O)[C@@H](Cl)C(=O)OCC Amb25210526 [0,2,0,0,0,0|1,0,0]=3 4255 B9R0.6 C[C@H](O)[C@@H](N)C(=O)OCC Amb24587729 [0,2,0,0,0,0|0,0,0]=2 4256 B9R0.6 C[C@H](O)[C@@H](O)C(=O)OCC Amb25714491 [0,2,0,0,0,0|1,0,0]=3 4257 B9R0.6 C[C@H](O)[C@@H](O)[C@@H](O)CC=O Amb25679039 [0,2,0,0,0,0|1,0,1]=4 4258 B9R0.6 C[C@H](O)[C@H](F)C(=O)OCC Amb25831910 [0,2,0,0,0,0|1,0,0]=3 4259 B9R0.6 C[C@H](O)[C@H](N)[C@@H](O)CC=C Amb25068386 [0,2,0,0,0,0|1,0,1]=4 4260 B9R0.6 C[C@H](O)[C@H](O)[C@@H](O)CC=O Amb24477017 [0,2,0,0,0,0|1,0,1]=4 4261 B9R0.6 C[C@H](O)[C@H](O)[C@H](O)CC=O Amb25773334 [0,2,0,0,0,0|1,0,1]=4 4262 B9R0.6 C[C@H]([C@@H](O)CCC)C(C)=O Amb25145582 [0,2,0,0,0,0|2,0,0]=4 4263 B9R0.6 C[C@H]([C@@H](O)CCC)C(O)=O Amb25789993 [0,2,0,0,0,0|1,0,0]=3 4264 B9R0.6 C[C@H]([C@@H](O)\C=C\C)C(O)=O Amb24359088 [0,2,0,0,0,0|1,0,0]=3 4265 B9R0.6 C[C@H]([C@H](C)NOC)C(O)=O Amb24451571 [0,2,0,0,0,0|1,0,0]=3 4266 B9R0.6 C[C@H]([C@H](C)O)C(=O)OCC Amb25191994 [0,2,0,0,0,0|1,0,0]=3 4267 B9R0.6 C[C@H]([C@H](C)OC=O)C(O)=O Amb24479221 [0,2,0,0,0,0|1,0,0]=3 4268 B9R0.6 C[C@H]([C@H](O)CCC)C(C)=O Amb25128812 [0,2,0,0,0,0|2,0,0]=4 4269 B9R0.6 C[C@H]([C@H](O)\C=C\C)C(O)=O Amb25378724 [0,2,0,0,0,0|1,0,0]=3 4270 B9R0.6 C[C@H](\C=C\C)[C@H](F)C(O)=O Amb25727302 [0,2,0,0,0,0|2,0,0]=4 4271 B9R0.6 NC(C(S)CCO)C(O)=O Amb24724703 [0,2,0,0,0,0|0,1,0]=3 4272 B9R0.6 N[C@@H](C(S)CCO)C(O)=O Amb25320812 [0,2,0,0,0,0|0,1,0]=3 4273 B9R0.6 OCCC(O)C(O)C(O)=O Amb24482452 [0,2,0,0,0,0|1,0,0]=3 4274 B9R0.25 CC(C(=O)CO)C(C)(C)O Amb25792770 [0,2,0,0,0,0|1,0,0]=3 4275 B9R0.25 CC(C(=O)NN)C(C)(C)O Amb25276755 [0,2,0,0,0,0|2,0,0]=4 4276 B9R0.25 CC(C(=O)NO)C(C)(F)F Amb24454573 [0,2,0,0,0,0|2,0,0]=4 4277 B9R0.25 CC(C)(C)C(N)C(=O)CO Amb25198426 [0,2,0,0,0,0|1,0,0]=3 4278 B9R0.25 CC(C)(C)C(N)C(=O)NO Amb24760873 [0,2,0,0,0,0|1,0,0]=3 4279 B9R0.25 CC(C)(C)[C@@H](N)C(=O)NN Amb25708969 [0,2,0,0,0,0|2,0,0]=4 4280 B9R0.25 CC(C)(C)[C@H](N)C(=O)NN Amb24713714 [0,2,0,0,0,0|2,0,0]=4 4281 B9R0.25 CC(C)(C)[C@H](N)C(=O)NO Amb25117334 [0,2,0,0,0,0|1,0,0]=3 4282 B9R0.25 CC(CC)[C@H](N)P(O)(O)=O Amb24742149 [0,2,0,0,0,0|2,0,0]=4 4283 B9R0.25 CCC(=O)C(Br)C(C)(C)O Amb25218246 [0,2,0,0,0,0|2,0,0]=4 4284 B9R0.25 CCC(=O)C(C)C(C)(C)O Amb25340911 [0,2,0,0,0,0|2,0,0]=4 4285 B9R0.25 CCC(O)C(N)P(O)(O)=O Amb25109911 [0,2,0,0,0,0|1,0,0]=3 4286 B9R0.25 CNC(=O)C(N)C(C)(C)C Amb18523738 [0,2,0,0,0,0|2,0,0]=4 4287 B9R0.25 CNC(=O)[C@@H](N)C(C)(C)C Amb22801719 [0,2,0,0,0,0|2,0,0]=4 4288 B9R0.25 CNC(=O)[C@H](N)C(C)(C)C Amb24479552 [0,2,0,0,0,0|2,0,0]=4 4289 B9R0.25 COC(=O)C(=O)C(C)(C)O Amb24116918 [0,2,0,0,0,0|1,0,1]=4 4290 B9R0.25 COC(=O)C(C(C)(C)C)C Amb10558498 [0,2,0,0,0,0|2,0,0]=4 4291 B9R0.25 COC(=O)C(C(C)(C)C)N Amb2425516 [0,2,0,0,0,0|1,0,0]=3 4292 B9R0.25 COC(=O)C(C(F)(F)F)N Amb10840309 [0,2,0,0,0,0|2,0,0]=4 4293 B9R0.25 COC(=O)C(C)C(C)(C)N Amb24640984 [0,2,0,0,0,0|2,0,0]=4 4294 B9R0.25 COC(=O)C(Cl)C(C)(C)C Amb18800858 [0,2,0,0,0,0|2,0,0]=4 4295 B9R0.25 COC(=O)C(N)C(C)(C)F Amb25662650 [0,2,0,0,0,0|1,0,0]=3 4296 B9R0.25 COC(=O)C(N)C(C)(C)O Amb23399555 [0,2,0,0,0,0|0,0,0]=2 4297 B9R0.25 COC(=O)C(N)C(C)(C)S Amb18126363 [0,2,0,0,0,0|0,1,0]=3 4298 B9R0.25 COC(=O)C(O)C(C)(C)N Amb25683764 [0,2,0,0,0,0|2,0,0]=4 4299 B9R0.25 COC(=O)[C@@H](Cl)C(C)(C)C Amb24740807 [0,2,0,0,0,0|2,0,0]=4 4300 B9R0.25 COC(=O)[C@@H](N)C(C)(C)C Amb19374784 [0,2,0,0,0,0|1,0,0]=3 4301 B9R0.25 COC(=O)[C@@H](N)C(C)(C)S Amb24482143 [0,2,0,0,0,0|0,1,0]=3 4302 B9R0.25 COC(=O)[C@@H](N)C(C)(F)F Amb25055714 [0,2,0,0,0,0|1,0,0]=3 4303 B9R0.25 COC(=O)[C@@H](N)C(F)(F)F Amb22274753 [0,2,0,0,0,0|2,0,0]=4 4304 B9R0.25 COC(=O)[C@@H](O)C(C)(C)O Amb24449797 [0,2,0,0,0,0|1,0,0]=3 4305 B9R0.25 COC(=O)[C@H](N)C(C)(C)O Amb24480720 [0,2,0,0,0,0|0,0,0]=2 4306 B9R0.25 COC(=O)[C@H](N)C(C)(F)F Amb24709361 [0,2,0,0,0,0|1,0,0]=3 4307 B9R0.25 COC(=O)[C@H](O)C(C)(C)C Amb25045311 [0,2,0,0,0,0|2,0,0]=4 4308 B9R0.25 C[C@@H](CC)[C@H](N)P(O)(O)=O Amb25853637 [0,2,0,0,0,0|2,0,0]=4 4309 B9R0.25 NCC(O)C(O)P(O)(O)=O Amb24477262 [0,2,0,0,0,0|2,0,0]=4 4310 B9R0.25 NC[C@H](O)[C@@H](O)P(O)(O)=O Amb25311984 [0,2,0,0,0,0|2,0,0]=4 4311 B9R0.25 OC[C@@H](O)[C@@H](O)P(O)(O)=O Amb25806053 [0,2,0,0,0,0|2,0,0]=4 4312 B9R0.25 OC[C@@H](O)[C@H](O)P(O)(O)=O Amb25044300 [0,2,0,0,0,0|2,0,0]=4 4313 B9R0.27 C=CC(O)C(O)C(=O)CO Amb25723933 [0,2,0,0,0,0|1,0,1]=4 4314 B9R0.27 C=C[C@@H](O)[C@H](O)C(=O)CO Amb25282755 [0,2,0,0,0,0|1,0,1]=4 4315 B9R0.27 CC(C(=O)OC)N(C)OC Amb24482762 [0,2,0,0,0,0|2,0,0]=4 4316 B9R0.27 CC(C(C)C=C)C(=O)OC Amb24607215 [0,2,0,0,0,0|2,0,0]=4 4317 B9R0.27 CC(C(C)C=O)C(=O)OC Amb25828591 [0,2,0,0,0,0|1,0,1]=4 4318 B9R0.27 CC(C(O)CC)C(=O)OC Amb24731247 [0,2,0,0,0,0|1,0,0]=3 4319 B9R0.27 CC(C(O)OC)C(=O)OC Amb25049424 [0,2,0,0,0,0|1,0,0]=3 4320 B9R0.27 CC(C=C)C(N)C(=O)OC Amb18644005 [0,2,0,0,0,0|1,0,0]=3 4321 B9R0.27 CC(C=C)C(N)C(=O)OC Amb24271135 [0,2,0,0,0,0|1,0,0]=3 4322 B9R0.27 CC(C=C)C(O)C(=O)OC Amb25125510 [0,2,0,0,0,0|2,0,0]=4 4323 B9R0.27 CC(C=C)[C@@H](O)C(=O)OC Amb24422774 [0,2,0,0,0,0|2,0,0]=4 4324 B9R0.27 CC(C=C)[C@H](O)C(=O)OC Amb25107561 [0,2,0,0,0,0|2,0,0]=4 4325 B9R0.27 CC(C=O)C(Br)C(=O)OC Amb24640254 [0,2,0,0,0,0|1,0,1]=4 4326 B9R0.27 CC(CC)C(Cl)C(=O)OC Amb18800857 [0,2,0,0,0,0|2,0,0]=4 4327 B9R0.27 CC(CC)C(N)C(=O)CBr Amb24740869 [0,2,0,0,0,0|2,0,0]=4 4328 B9R0.27 CC(CC)C(N)C(=O)CCl Amb25779268 [0,2,0,0,0,0|2,0,0]=4 4329 B9R0.27 CC(CC)C(N)C(=O)NN Amb25146438 [0,2,0,0,0,0|2,0,0]=4 4330 B9R0.27 CC(CC)C(N)C(=O)NO Amb24572995 [0,2,0,0,0,0|1,0,0]=3 4331 B9R0.27 CC(CC)C(O)C(=O)OC Amb23596600 [0,2,0,0,0,0|2,0,0]=4 4332 B9R0.27 CC(CC)[C@@H](N)C(=O)NO Amb22800472 [0,2,0,0,0,0|1,0,0]=3 4333 B9R0.27 CC(CC)[C@@H](N)C(=O)OC Amb25111579 [0,2,0,0,0,0|1,0,0]=3 4334 B9R0.27 CC(CC)[C@H](N)C(=O)NN Amb25279310 [0,2,0,0,0,0|2,0,0]=4 4335 B9R0.27 CC(CC)[C@H](O)C(=O)OC Amb25136173 [0,2,0,0,0,0|2,0,0]=4 4336 B9R0.27 CC(NC)C(Cl)C(=O)OC Amb25139466 [0,2,0,0,0,0|2,0,0]=4 4337 B9R0.27 CC(OC)C(Cl)C(=O)NC Amb24588762 [0,2,0,0,0,0|2,0,0]=4 4338 B9R0.27 CC(OC)C(Cl)C(=O)OC Amb24373136 [0,2,0,0,0,0|1,0,0]=3 4339 B9R0.27 CC(OC)C(N)C(=O)OC Amb25111509 [0,2,0,0,0,0|0,0,0]=2 4340 B9R0.27 CC(OC)C(O)C(=O)OC Amb25234709 [0,2,0,0,0,0|1,0,0]=3 4341 B9R0.27 CC(ON)C(N)C(=O)OC Amb25075953 [0,2,0,0,0,0|0,0,0]=2 4342 B9R0.27 CC([C@@H](O)CC)C(=O)OC Amb25740781 [0,2,0,0,0,0|1,0,0]=3 4343 B9R0.27 CCC(=O)C(C)C(C)OC Amb25374408 [0,2,0,0,0,0|2,0,0]=4 4344 B9R0.27 CCC(=O)C(N)C(=O)OC Amb18124723 [0,2,0,0,0,0|0,0,2]=4 4345 B9R0.27 CCC(=O)C(O)C(O)CCl Amb25772863 [0,2,0,0,0,0|2,0,0]=4 4346 B9R0.27 CCC(=O)[C@@H](O)[C@H](O)CBr Amb24712478 [0,2,0,0,0,0|2,0,0]=4 4347 B9R0.27 CCC(=O)[C@@H](O)[C@H](O)CCl Amb25082011 [0,2,0,0,0,0|2,0,0]=4 4348 B9R0.27 CCC(=O)[C@H](O)[C@H](O)CO Amb24647600 [0,2,0,0,0,0|2,0,0]=4 4349 B9R0.27 CCC(C(C(=O)OC)N)C Amb1154182 [0,2,0,0,0,0|1,0,0]=3 4350 B9R0.27 CCC(C)C(C)C(=O)NO Amb25761241 [0,2,0,0,0,0|2,0,0]=4 4351 B9R0.27 CCC(Cl)C(Cl)C(=O)OC Amb24675863 [0,2,0,0,0,0|2,0,0]=4 4352 B9R0.27 CCC(N)C(O)C(=O)OC Amb24459819 [0,2,0,0,0,0|2,0,0]=4 4353 B9R0.27 CCC(O)C(Cl)C(=O)OC Amb24400655 [0,2,0,0,0,0|1,0,0]=3 4354 B9R0.27 CCC(O)C(N)C(=O)OC Amb18644322 [0,2,0,0,0,0|0,0,0]=2 4355 B9R0.27 CCC(O)C(N)C(O)CC Amb25249699 [0,2,0,0,0,0|1,0,1]=4 4356 B9R0.27 CCC(O)C(O)C(=O)CO Amb25146801 [0,2,0,0,0,0|1,0,0]=3 4357 B9R0.27 CCC(O)C(O)C(=O)OC Amb24457791 [0,2,0,0,0,0|1,0,0]=3 4358 B9R0.27 CCC(O)C(O)C(O)C=O Amb25833335 [0,2,0,0,0,0|1,0,1]=4 4359 B9R0.27 CCC([C@@H](C(=O)NC)N)C Amb17231991 [0,2,0,0,0,0|2,0,0]=4 4360 B9R0.27 CCC([C@@H](C(=O)OC)N)C Amb10807496 [0,2,0,0,0,0|1,0,0]=3 4361 B9R0.27 CC[C@@H](O)C(N)[C@H](O)CC Amb24726612 [0,2,0,0,0,0|1,0,1]=4 4362 B9R0.27 CC[C@@H](O)[C@@H](O)C(=O)CO Amb25663072 [0,2,0,0,0,0|1,0,0]=3 4363 B9R0.27 CC[C@H](O)C(N)[C@@H](O)CC Amb25216235 [0,2,0,0,0,0|1,0,1]=4 4364 B9R0.27 CC[C@H](O)[C@@H](O)C(=O)CO Amb25370711 [0,2,0,0,0,0|1,0,0]=3 4365 B9R0.27 CC[C@H](O)[C@H](N)[C@H](O)CC Amb25147408 [0,2,0,0,0,0|1,0,1]=4 4366 B9R0.27 CC[C@H](O)[C@H](O)C(=O)CO Amb24478272 [0,2,0,0,0,0|1,0,0]=3 4367 B9R0.27 CC[C@H]([C@@H](C(=O)OC)N)C Amb10844606 [0,2,0,0,0,0|1,0,0]=3 4368 B9R0.27 COC(=O)C(=C)C(C)CO Amb25335437 [0,2,0,0,0,0|1,0,1]=4 4369 B9R0.27 COC(=O)C(Br)C(Br)CBr Amb20241612 [0,2,0,0,0,0|2,0,0]=4 4370 B9R0.27 COC(=O)C(Br)C(O)CBr Amb25293763 [0,2,0,0,0,0|1,0,0]=3 4371 B9R0.27 COC(=O)C(C)C(C)SC Amb25851772 [0,2,0,0,0,0|1,1,0]=4 4372 B9R0.27 COC(=O)C(F)C(O)CO Amb25120052 [0,2,0,0,0,0|1,0,0]=3 4373 B9R0.27 COC(=O)C(O)C(F)CBr Amb24477361 [0,2,0,0,0,0|2,0,0]=4 4374 B9R0.27 COC(=O)C(O)C(F)CO Amb25097732 [0,2,0,0,0,0|2,0,0]=4 4375 B9R0.27 COC(=O)C(O)C(N)CO Amb25288549 [0,2,0,0,0,0|2,0,0]=4 4376 B9R0.27 COC(=O)N(C)[C@@H](C)CO Amb24482597 [0,2,0,0,0,0|2,0,0]=4 4377 B9R0.27 COC(=O)N(C)[C@H](C)CO Amb24573876 [0,2,0,0,0,0|2,0,0]=4 4378 B9R0.27 COC(=O)[C@@H](Br)[C@H](O)CO Amb25288997 [0,2,0,0,0,0|1,0,0]=3 4379 B9R0.27 COC(=O)[C@@H](F)[C@@H](O)CO Amb24353362 [0,2,0,0,0,0|1,0,0]=3 4380 B9R0.27 COC(=O)[C@@H](O)[C@@H](F)CBr Amb24477336 [0,2,0,0,0,0|2,0,0]=4 4381 B9R0.27 COC(=O)[C@@H](O)[C@@H](F)CO Amb24524431 [0,2,0,0,0,0|2,0,0]=4 4382 B9R0.27 COC(=O)[C@@H](O)[C@H](F)CO Amb25712976 [0,2,0,0,0,0|2,0,0]=4 4383 B9R0.27 COC(=O)[C@@H](O)[C@H](N)CO Amb25265465 [0,2,0,0,0,0|2,0,0]=4 4384 B9R0.27 COC(=O)[C@H](O)[C@@H](O)CCl Amb24480650 [0,2,0,0,0,0|1,0,0]=3 4385 B9R0.27 COC(=O)[C@H](O)[C@H](O)CBr Amb25311327 [0,2,0,0,0,0|1,0,0]=3 4386 B9R0.27 COC(C)N(C)C(=O)CO Amb24474156 [0,2,0,0,0,0|2,0,0]=4 4387 B9R0.27 C[C@@H](C(O)CC)C(=O)CC Amb25735211 [0,2,0,0,0,0|2,0,0]=4 4388 B9R0.27 C[C@@H](CC)C(O)C(=O)OC Amb25077852 [0,2,0,0,0,0|2,0,0]=4 4389 B9R0.27 C[C@@H](CC)[C@@H](N)C(=O)OC Amb22747221 [0,2,0,0,0,0|1,0,0]=3 4390 B9R0.27 C[C@@H](CC)[C@@H](O)C(=O)OC Amb25320601 [0,2,0,0,0,0|2,0,0]=4 4391 B9R0.27 C[C@@H](CC)[C@H](N)C(=O)CC Amb25790371 [0,2,0,0,0,0|2,0,0]=4 4392 B9R0.27 C[C@@H](CC)[C@H](N)C(=O)NC Amb24478007 [0,2,0,0,0,0|2,0,0]=4 4393 B9R0.27 C[C@@H](CC)[C@H](N)C(=O)NN Amb25146437 [0,2,0,0,0,0|2,0,0]=4 4394 B9R0.27 C[C@@H](CC)[C@H](N)C(=O)NO Amb25146430 [0,2,0,0,0,0|1,0,0]=3 4395 B9R0.27 C[C@@H](NC)[C@H](Cl)C(=O)OC Amb24482166 [0,2,0,0,0,0|2,0,0]=4 4396 B9R0.27 C[C@@H](OC)C(=O)C(=O)OC Amb25146480 [0,2,0,0,0,0|1,0,1]=4 4397 B9R0.27 C[C@@H](ON)[C@H](N)C(=O)OC Amb25378740 [0,2,0,0,0,0|0,0,0]=2 4398 B9R0.27 C[C@@H](SC)[C@H](Cl)C(=O)OC Amb24470163 [0,2,0,0,0,0|1,1,0]=4 4399 B9R0.27 C[C@@H]([C@@H](C)C=O)C(=O)OC Amb25142663 [0,2,0,0,0,0|1,0,1]=4 4400 B9R0.27 C[C@@H]([C@@H](C)CO)C(=O)OC Amb25279746 [0,2,0,0,0,0|1,0,0]=3 4401 B9R0.27 C[C@@H]([C@@H](O)CC)C(=O)CC Amb25266330 [0,2,0,0,0,0|2,0,0]=4 4402 B9R0.27 C[C@@H]([C@@H](O)CC)C(=O)NO Amb25058433 [0,2,0,0,0,0|1,0,0]=3 4403 B9R0.27 C[C@@H]([C@@H](O)CC)C(=O)OC Amb25769352 [0,2,0,0,0,0|1,0,0]=3 4404 B9R0.27 C[C@@H]([C@H](C)C=C)C(=O)OC Amb25780851 [0,2,0,0,0,0|2,0,0]=4 4405 B9R0.27 C[C@@H]([C@H](O)C=C)C(=O)OC Amb24429580 [0,2,0,0,0,0|1,0,1]=4 4406 B9R0.27 C[C@@H]([C@H](O)CC)C(=O)CC Amb25146623 [0,2,0,0,0,0|2,0,0]=4 4407 B9R0.27 C[C@@H]([C@H](O)CC)C(=O)OC Amb24556034 [0,2,0,0,0,0|1,0,0]=3 4408 B9R0.27 C[C@H](C=C)[C@@H](O)C(=O)OC Amb25097689 [0,2,0,0,0,0|2,0,0]=4 4409 B9R0.27 C[C@H](CO)N(C)C(=O)CO Amb24749523 [0,2,0,0,0,0|2,0,0]=4 4410 B9R0.27 C[C@H](NC)[C@H](Cl)C(=O)OC Amb24482167 [0,2,0,0,0,0|2,0,0]=4 4411 B9R0.27 C[C@H](OC)[C@H](Br)C(=O)OC Amb24502160 [0,2,0,0,0,0|1,0,0]=3 4412 B9R0.27 C[C@H](SC)[C@H](Cl)C(=O)OC Amb25684816 [0,2,0,0,0,0|1,1,0]=4 4413 B9R0.27 C[C@H]([C@@H](O)C=C)C(=O)OC Amb25215424 [0,2,0,0,0,0|1,0,1]=4 4414 B9R0.27 C[C@H]([C@@H](O)CC)C(=O)CC Amb25853384 [0,2,0,0,0,0|2,0,0]=4 4415 B9R0.27 C[C@H]([C@H](O)C=C)C(=O)OC Amb25706084 [0,2,0,0,0,0|1,0,1]=4 4416 B9R0.27 C[C@H]([C@H](O)CC)C(=O)OC Amb25045706 [0,2,0,0,0,0|1,0,0]=3 4417 B9R0.27 C\C(=C\C)\[C@@H](N)C(=O)OC Amb25367761 [0,2,0,0,0,0|1,0,1]=4 4418 B9R0.27 NC(CO)C(N)C(O)CO Amb25349717 [0,2,0,0,0,0|1,0,1]=4 4419 B9R0.27 NCC(=O)C(O)C(O)CO Amb25095234 [0,2,0,0,0,0|2,0,0]=4 4420 B9R0.27 NCC(O)C(O)C(O)C=O Amb24419787 [0,2,0,0,0,0|1,0,1]=4 4421 B9R0.27 NC[C@@H](O)[C@H](O)[C@@H](O)C=O Amb24683002 [0,2,0,0,0,0|1,0,1]=4 4422 B9R0.27 NNC(=O)C(O)C(O)CO Amb25739705 [0,2,0,0,0,0|2,0,0]=4 4423 B9R0.27 NNC(=O)[C@H](O)[C@H](O)CO Amb25332394 [0,2,0,0,0,0|2,0,0]=4 4424 B9R0.27 OC(C(O)CBr)C(O)C=O Amb25799010 [0,2,0,0,0,0|1,0,1]=4 4425 B9R0.27 OC(C(O)CF)C(O)C=O Amb25066224 [0,2,0,0,0,0|1,0,1]=4 4426 B9R0.27 OC(CO)C(O)C(=O)CO Amb25099014 [0,2,0,0,0,0|1,0,0]=3 4427 B9R0.27 OC(CO)[C@H](O)C(=O)CO Amb25146835 [0,2,0,0,0,0|1,0,0]=3 4428 B9R0.27 OCC(=O)C(O)C(O)CF Amb25830531 [0,2,0,0,0,0|1,0,0]=3 4429 B9R0.27 OCC(=O)[C@@H](O)C(O)CF Amb25146806 [0,2,0,0,0,0|1,0,0]=3 4430 B9R0.27 OCC(=O)[C@@H](O)[C@H](O)CBr Amb24477214 [0,2,0,0,0,0|1,0,0]=3 4431 B9R0.27 OCC(=O)[C@@H](O)[C@H](O)CCl Amb24562237 [0,2,0,0,0,0|1,0,0]=3 4432 B9R0.27 OCC(=O)[C@@H](O)[C@H](O)CS Amb25839360 [0,2,0,0,0,0|1,0,0]=3 4433 B9R0.27 OCC(O)C(O)C(=O)C=O Amb25370795 [0,2,0,0,0,0|1,0,1]=4 4434 B9R0.27 OCC(O)C(O)C(=O)NO Amb25676772 [0,2,0,0,0,0|1,0,0]=3 4435 B9R0.27 OCC(O)[C@@H](O)[C@@H](O)C=O Amb25205443 [0,2,0,0,0,0|1,0,1]=4 4436 B9R0.27 OCC(O)[C@H](O)[C@@H](O)C=O Amb25797947 [0,2,0,0,0,0|1,0,1]=4 4437 B9R0.27 OC[C@@H](O)C(O)[C@@H](O)C=O Amb24413837 [0,2,0,0,0,0|1,0,1]=4 4438 B9R0.27 OC[C@@H](O)[C@@H](F)[C@H](O)C=O Amb25129381 [0,2,0,0,0,0|1,0,1]=4 4439 B9R0.27 OC[C@@H](O)[C@H](O)C(=O)NO Amb25057744 [0,2,0,0,0,0|1,0,0]=3 4440 B9R0.27 OC[C@H](O)[C@@H](O)[C@@H](O)C=O Amb25146279 [0,2,0,0,0,0|1,0,1]=4 4441 B9R0.27 OC[C@H](O)\C(\O)=C(/O)\C=O Amb25269544 [0,2,0,0,0,0|1,0,1]=4 4442 B9R0.27 OC[C@H]([C@@H]([C@@H](C=O)O)O)O Amb10807416 [0,2,0,0,0,0|1,0,1]=4 4443 B9R0.27 OC[C@H]([C@@H]([C@H](C=O)O)O)O Amb10843531 [0,2,0,0,0,0|1,0,1]=4 4444 B9R0.27 O[C@@H](CO)[C@@H](O)C(=O)CO Amb22800928 [0,2,0,0,0,0|1,0,0]=3 4445 B9R0.27 O[C@@H](CO)[C@H](O)C(=O)CO Amb22352819 [0,2,0,0,0,0|1,0,0]=3 4446 B9R0.27 O[C@H](CO)[C@@H](O)C(=O)CO Amb22230606 [0,2,0,0,0,0|1,0,0]=3 4447 B9R0.27 O[C@H]([C@H](O)CF)[C@@H](O)C=O Amb25858526 [0,2,0,0,0,0|1,0,1]=4 4448 B9R0.28 CC(=C)C(C)(N)C(=O)OC Amb18124642 [0,2,0,0,0,0|1,0,1]=4 4449 B9R0.28 CC(=O)C(O)(O)C(O)CO Amb24722053 [0,2,0,0,0,0|2,0,0]=4 4450 B9R0.28 CC(C#C)C(C)(N)C(O)=O Amb25061187 [0,2,0,0,0,0|1,0,0]=3 4451 B9R0.28 CC(C)(C(O)C=C)C(O)=O Amb24568657 [0,2,0,0,0,0|1,0,1]=4 4452 B9R0.28 CC(C)([C@H](N)CO)C(O)=O Amb25245841 [0,2,0,0,0,0|2,0,0]=4 4453 B9R0.28 CC(C)C(C)(C)C(=O)NO Amb24482877 [0,2,0,0,0,0|2,0,0]=4 4454 B9R0.28 CC(C=C)C(C)(C)C(O)=O Amb25073155 [0,2,0,0,0,0|2,0,0]=4 4455 B9R0.28 CC(C=C)C(C)(F)C(O)=O Amb24617972 [0,2,0,0,0,0|2,0,0]=4 4456 B9R0.28 CC(C=C)C(C)(N)C(N)=O Amb24523164 [0,2,0,0,0,0|2,0,0]=4 4457 B9R0.28 CC(C=C)C(C)(N)C(O)=O Amb25147471 [0,2,0,0,0,0|1,0,0]=3 4458 B9R0.28 CC(C=C)C(C)(O)C(O)=O Amb18644094 [0,2,0,0,0,0|2,0,0]=4 4459 B9R0.28 CC(C=C)C(F)(Cl)C(O)=O Amb25124094 [0,2,0,0,0,0|2,0,0]=4 4460 B9R0.28 CC(C=C)C(F)(F)C(O)=O Amb25100968 [0,2,0,0,0,0|2,0,0]=4 4461 B9R0.28 CC(C=O)C(C)(C)C(O)=O Amb25063874 [0,2,0,0,0,0|1,0,1]=4 4462 B9R0.28 CC(CN)C(C)(O)C(O)=O Amb24700228 [0,2,0,0,0,0|2,0,0]=4 4463 B9R0.28 CC(O)([C@H](O)CO)C(O)=O Amb24524547 [0,2,0,0,0,0|1,0,0]=3 4464 B9R0.28 CCC(=O)C(C)(C)C(C)O Amb24589253 [0,2,0,0,0,0|2,0,0]=4 4465 B9R0.28 CCC(=O)C(C)(O)C(C)O Amb24642295 [0,2,0,0,0,0|2,0,0]=4 4466 B9R0.28 CCC(=O)[C@](C)(O)[C@H](C)O Amb25088915 [0,2,0,0,0,0|2,0,0]=4 4467 B9R0.28 CCC(Br)C(C)(O)C(O)=O Amb24478191 [0,2,0,0,0,0|2,0,0]=4 4468 B9R0.28 CCC(C)C(C)(N)C(N)=O Amb18289874 [0,2,0,0,0,0|2,0,0]=4 4469 B9R0.28 CCC(C)C(N)(O)C(O)=O Amb25147278 [0,2,0,0,0,0|1,0,0]=3 4470 B9R0.28 CCC(O)C(C)(O)C(O)=O Amb18644353 [0,2,0,0,0,0|1,0,0]=3 4471 B9R0.28 CCC(O)C(F)(F)C(O)=O Amb18796752 [0,2,0,0,0,0|1,0,0]=3 4472 B9R0.28 CC[C@@H](C)C(N)(N)C(O)=O Amb25147542 [0,2,0,0,0,0|1,0,0]=3 4473 B9R0.28 CC[C@@H](O)[C@](C)(O)C(C)=O Amb25373304 [0,2,0,0,0,0|2,0,0]=4 4474 B9R0.28 CC[C@@H](O)[C@](C)(O)C(O)=O Amb25111955 [0,2,0,0,0,0|1,0,0]=3 4475 B9R0.28 CC[C@H](C)C(C)(C)C(O)=O Amb24480772 [0,2,0,0,0,0|2,0,0]=4 4476 B9R0.28 CC[C@H](C)[C@](C)(N)C(O)=O Amb24538030 [0,2,0,0,0,0|1,0,0]=3 4477 B9R0.28 CC[C@H](O)[C@](C)(O)C(C)=O Amb25735127 [0,2,0,0,0,0|2,0,0]=4 4478 B9R0.28 CC[C@H](O)[C@](C)(O)C(O)=O Amb24624659 [0,2,0,0,0,0|1,0,0]=3 4479 B9R0.28 CNC(=O)C(C)(N)C(C)O Amb24595887 [0,2,0,0,0,0|1,0,0]=3 4480 B9R0.28 CNC(=O)[C@@](C)(N)C(C)C Amb24763792 [0,2,0,0,0,0|2,0,0]=4 4481 B9R0.28 CNC(=O)[C@](C)(N)[C@@H](C)O Amb25327485 [0,2,0,0,0,0|1,0,0]=3 4482 B9R0.28 COC(=O)C(C)(C)C(C)C Amb23589746 [0,2,0,0,0,0|2,0,0]=4 4483 B9R0.28 COC(=O)C(C)(C)C(C)N Amb18124747 [0,2,0,0,0,0|2,0,0]=4 4484 B9R0.28 COC(=O)C(C)(C)[C@@H](C)N Amb25367310 [0,2,0,0,0,0|2,0,0]=4 4485 B9R0.28 COC(=O)C(C)(C)[C@@H](C)O Amb25381341 [0,2,0,0,0,0|1,0,0]=3 4486 B9R0.28 COC(=O)C(C)(C)[C@H](C)N Amb24746730 [0,2,0,0,0,0|2,0,0]=4 4487 B9R0.28 COC(=O)C(C)(N)C(C)C Amb18989923 [0,2,0,0,0,0|1,0,0]=3 4488 B9R0.28 COC(=O)C(C)(N)C(C)O Amb18644324 [0,2,0,0,0,0|0,0,0]=2 4489 B9R0.28 COC(=O)C(C)(N)C(O)=O Amb24585696 [0,2,0,0,0,0|0,0,2]=4 4490 B9R0.28 COC(=O)C(Cl)(Cl)C(C)Cl Amb24741770 [0,2,0,0,0,0|2,0,0]=4 4491 B9R0.28 COC(=O)C(F)(F)C(C)F Amb24514263 [0,2,0,0,0,0|2,0,0]=4 4492 B9R0.28 COC(=O)C(F)(F)C(C)N Amb24564743 [0,2,0,0,0,0|2,0,0]=4 4493 B9R0.28 COC(=O)[C@@](C)(N)C(C)C Amb24456742 [0,2,0,0,0,0|1,0,0]=3 4494 B9R0.28 COC(=O)[C@@](C)(O)[C@H](C)O Amb25296400 [0,2,0,0,0,0|1,0,0]=3 4495 B9R0.28 COC(=O)[C@](C)(N)[C@@H](C)O Amb24554415 [0,2,0,0,0,0|0,0,0]=2 4496 B9R0.28 COC(=O)[C@](C)(O)[C@@H](C)O Amb25356388 [0,2,0,0,0,0|1,0,0]=3 4497 B9R0.28 COC(C)C(C)(C)C(O)=O Amb25211514 [0,2,0,0,0,0|1,0,0]=3 4498 B9R0.28 COC(C)C(C)(N)C(N)=O Amb25361711 [0,2,0,0,0,0|1,0,0]=3 4499 B9R0.28 COC(C)C(C)(N)C(O)=O Amb25336838 [0,2,0,0,0,0|0,0,0]=2 4500 B9R0.28 COC(C)C(C)(O)C(C)=O Amb24722344 [0,2,0,0,0,0|2,0,0]=4 4501 B9R0.28 COC(C)C(C)(O)C(N)=O Amb24722981 [0,2,0,0,0,0|2,0,0]=4 4502 B9R0.28 C[C@@H](C#C)[C@](C)(O)C(O)=O Amb24480794 [0,2,0,0,0,0|2,0,0]=4 4503 B9R0.28 C[C@@H](C=C)[C@](C)(N)C(N)=O Amb25068283 [0,2,0,0,0,0|2,0,0]=4 4504 B9R0.28 C[C@@H](C=C)[C@](C)(N)C(O)=O Amb24573053 [0,2,0,0,0,0|1,0,0]=3 4505 B9R0.28 C[C@@H](C=C)[C@](C)(O)C(O)=O Amb24683050 [0,2,0,0,0,0|2,0,0]=4 4506 B9R0.28 C[C@@H](CN)[C@](C)(O)C(O)=O Amb25366576 [0,2,0,0,0,0|2,0,0]=4 4507 B9R0.28 C[C@@](O)([C@H](O)CO)C(O)=O Amb24687216 [0,2,0,0,0,0|1,0,0]=3 4508 B9R0.28 C[C@H](C#C)[C@](C)(O)C(O)=O Amb24480793 [0,2,0,0,0,0|2,0,0]=4 4509 B9R0.28 C[C@H](C=C)[C@](C)(N)C(N)=O Amb25789456 [0,2,0,0,0,0|2,0,0]=4 4510 B9R0.28 C[C@H](C=C)[C@](C)(N)C(O)=O Amb25757514 [0,2,0,0,0,0|1,0,0]=3 4511 B9R0.28 C\C(=N/O)\C(C)(C)C(O)=O Amb24480723 [0,2,0,0,0,0|1,0,1]=4 4512 B9R0.28 N[C@@H](CO)C(F)(F)C(O)=O Amb24479410 [0,2,0,0,0,0|2,0,0]=4 4513 B9R0.28 OC(=O)C(F)(Cl)C(Cl)CCl Amb24477396 [0,2,0,0,0,0|2,0,0]=4 4514 B9R0.29 CC(=C)C(NC)C(O)CC Amb24694147 [0,2,0,0,0,0|2,0,0]=4 4515 B9R0.29 CC(=C)[C@@H](NC)[C@@H](O)CC Amb24679918 [0,2,0,0,0,0|2,0,0]=4 4516 B9R0.29 CC(=O)C(NO)C(=O)OC Amb24708176 [0,2,0,0,0,0|0,0,2]=4 4517 B9R0.29 CC(C)C(C#N)C(=O)OC Amb18643719 [0,2,0,0,0,0|1,0,1]=4 4518 B9R0.29 CC(C)C(C=O)C(=O)OC Amb18644091 [0,2,0,0,0,0|2,0,0]=4 4519 B9R0.29 CC(C)C(CC)C(=O)OC Amb25080099 [0,2,0,0,0,0|2,0,0]=4 4520 B9R0.29 CC(C)C(CN)C(=O)C=C Amb24680496 [0,2,0,0,0,0|2,0,0]=4 4521 B9R0.29 CC(C)C(CN)C(=O)CC Amb24715583 [0,2,0,0,0,0|2,0,0]=4 4522 B9R0.29 CC(C)C(CN)C(=O)NC Amb18294178 [0,2,0,0,0,0|2,0,0]=4 4523 B9R0.29 CC(C)C(CN)C(=O)NO Amb24407675 [0,2,0,0,0,0|1,0,0]=3 4524 B9R0.29 CC(C)C(CN)C(=O)OC Amb25744585 [0,2,0,0,0,0|1,0,0]=3 4525 B9R0.29 CC(C)C(CN)C(N)=NO Amb24585463 [0,2,0,0,0,0|2,0,0]=4 4526 B9R0.29 CC(C)C(NC)C(=O)NO Amb24356003 [0,2,0,0,0,0|1,0,0]=3 4527 B9R0.29 CC(C)C(NO)C(=O)NC Amb25776957 [0,2,0,0,0,0|2,0,0]=4 4528 B9R0.29 CC(C)[C@@H](C=O)C(=O)OC Amb25278229 [0,2,0,0,0,0|2,0,0]=4 4529 B9R0.29 CC(C)[C@@H](CO)C(=O)OC Amb24748552 [0,2,0,0,0,0|2,0,0]=4 4530 B9R0.29 CC(C)[C@@H](NC)C(=O)OC Amb22745354 [0,2,0,0,0,0|1,0,0]=3 4531 B9R0.29 CC(C)[C@H](CN)C(=O)OC Amb24761504 [0,2,0,0,0,0|1,0,0]=3 4532 B9R0.29 CC(C)[C@H](NN)C(=O)OC Amb25090398 [0,2,0,0,0,0|1,0,0]=3 4533 B9R0.29 CC(C=C)C(CC)C(O)=O Amb18643888 [0,2,0,0,0,0|2,0,0]=4 4534 B9R0.29 CC(CC)C(C=C)C(O)=O Amb25076396 [0,2,0,0,0,0|2,0,0]=4 4535 B9R0.29 CC(CC)C(NBr)C(O)=O Amb25125862 [0,2,0,0,0,0|1,0,0]=3 4536 B9R0.29 CC(CC)C(NC)C(N)=O Amb18304752 [0,2,0,0,0,0|2,0,0]=4 4537 B9R0.29 CC(CC)C(NCl)C(O)=O Amb25279236 [0,2,0,0,0,0|1,0,0]=3 4538 B9R0.29 CC(CC)C(NN)C(N)=O Amb24479121 [0,2,0,0,0,0|2,0,0]=4 4539 B9R0.29 CC(CC)C(NN)C(O)=O Amb24398974 [0,2,0,0,0,0|1,0,0]=3 4540 B9R0.29 CC(CC)C(NO)C(O)=O Amb25378713 [0,2,0,0,0,0|1,0,0]=3 4541 B9R0.29 CC(CC)C(OC)C(O)=O Amb24563898 [0,2,0,0,0,0|2,0,0]=4 4542 B9R0.29 CC(CC)C(SC)C(O)=O Amb25076827 [0,2,0,0,0,0|2,0,0]=4 4543 B9R0.29 CC(CO)C(NC)C(O)=O Amb18644323 [0,2,0,0,0,0|0,0,0]=2 4544 B9R0.29 CC(Cl)C(OC)C(=O)OC Amb24482257 [0,2,0,0,0,0|2,0,0]=4 4545 B9R0.29 CC(O)C(CC)C(=O)NC Amb24482968 [0,2,0,0,0,0|2,0,0]=4 4546 B9R0.29 CC(O)C(CC)C(=O)OC Amb25325694 [0,2,0,0,0,0|1,0,0]=3 4547 B9R0.29 CC(O)C(OC)C(=O)OC Amb24454859 [0,2,0,0,0,0|1,0,0]=3 4548 B9R0.29 CC(O)C(SC)C(=O)OC Amb25056674 [0,2,0,0,0,0|1,0,0]=3 4549 B9R0.29 CC(O)[C@@H](NC)C(=O)OC Amb23603655 [0,2,0,0,0,0|0,0,0]=2 4550 B9R0.29 CC(OC)C(CC)C(O)=O Amb24597787 [0,2,0,0,0,0|1,0,0]=3 4551 B9R0.29 CC(OC)C(NC)C(O)=O Amb24117895 [0,2,0,0,0,0|0,0,0]=2 4552 B9R0.29 CC(OC)C(NC)C(O)=O Amb24596308 [0,2,0,0,0,0|0,0,0]=2 4553 B9R0.29 CC=C(C(C)O)C(=O)OC Amb25204660 [0,2,0,0,0,0|1,0,1]=4 4554 B9R0.29 CC=C(C(C)OC)C(O)=O Amb24574145 [0,2,0,0,0,0|1,0,1]=4 4555 B9R0.29 CC=C([C@H](C)O)C(=O)OC Amb24474212 [0,2,0,0,0,0|1,0,1]=4 4556 B9R0.29 CCC(O)C(=CC)C(O)=O Amb24622470 [0,2,0,0,0,0|1,0,1]=4 4557 B9R0.29 CCC(O)C(C=C)C(O)=O Amb18644141 [0,2,0,0,0,0|1,0,0]=3 4558 B9R0.29 CCC(O)C(NC)C(O)=O Amb25046706 [0,2,0,0,0,0|0,0,0]=2 4559 B9R0.29 CCC(O)C(OC)C(O)=O Amb18644355 [0,2,0,0,0,0|1,0,0]=3 4560 B9R0.29 CCC(O)\C(=C/C)\C(O)=O Amb18644125 [0,2,0,0,0,0|1,0,1]=4 4561 B9R0.29 CCN(C)C(CN)C(O)=O Amb24697507 [0,2,0,0,0,0|2,0,0]=4 4562 B9R0.29 CCN(O)C(CN)C(O)=O Amb24548240 [0,2,0,0,0,0|1,0,0]=3 4563 B9R0.29 CC[C@@H](O)[C@H](C=C)C(O)=O Amb24480681 [0,2,0,0,0,0|1,0,0]=3 4564 B9R0.29 CC[C@@H]([C@@H](C(=O)O)NC)C Amb16183967 [0,2,0,0,0,0|1,0,0]=3 4565 B9R0.29 CC[C@H](N)[C@H](CC)C(O)=O Amb24505157 [0,2,0,0,0,0|2,0,0]=4 4566 B9R0.29 CC[C@H](O)[C@H](NC)C(O)=O Amb24446992 [0,2,0,0,0,0|0,0,0]=2 4567 B9R0.29 CN(N=O)C(CN)C(O)=O Amb24349972 [0,2,0,0,0,0|1,0,1]=4 4568 B9R0.29 CN[C@@H](C(=O)OC)C(C)C Amb16183832 [0,2,0,0,0,0|1,0,0]=3 4569 B9R0.29 CN[C@H](C(=O)OC)C(C)C Amb16183826 [0,2,0,0,0,0|1,0,0]=3 4570 B9R0.29 COC(=O)C(CN)S(C)=O Amb24481157 [0,2,0,0,0,0|1,0,1]=4 4571 B9R0.29 CO[C@@H]([C@H](O)CO)C(N)=O Amb24427631 [0,2,0,0,0,0|2,0,0]=4 4572 B9R0.29 CO[C@H]([C@@H](O)CO)C(O)=O Amb25065328 [0,2,0,0,0,0|1,0,0]=3 4573 B9R0.29 CO[C@H]([C@H](O)CO)C(O)=O Amb25053877 [0,2,0,0,0,0|1,0,0]=3 4574 B9R0.29 C[C@@H](C#C)[C@@H](CC)C(O)=O Amb24716321 [0,2,0,0,0,0|2,0,0]=4 4575 B9R0.29 C[C@@H](C=C)[C@H](CC)C(O)=O Amb25064183 [0,2,0,0,0,0|2,0,0]=4 4576 B9R0.29 C[C@@H](C=C)[C@H](OC)C(O)=O Amb25824161 [0,2,0,0,0,0|2,0,0]=4 4577 B9R0.29 C[C@@H](CC)[C@@H](CC)C(O)=O Amb24713592 [0,2,0,0,0,0|2,0,0]=4 4578 B9R0.29 C[C@@H](CC)[C@@H](CN)C(O)=O Amb25147293 [0,2,0,0,0,0|1,0,0]=3 4579 B9R0.29 C[C@@H](CC)[C@@H](NC)C(O)=O Amb25132156 [0,2,0,0,0,0|1,0,0]=3 4580 B9R0.29 C[C@@H](CC)[C@H](CN)C(O)=O Amb25791124 [0,2,0,0,0,0|1,0,0]=3 4581 B9R0.29 C[C@@H](CC)[C@H](NBr)C(O)=O Amb24640231 [0,2,0,0,0,0|1,0,0]=3 4582 B9R0.29 C[C@@H](CC)[C@H](NC)C(O)=O Amb22747123 [0,2,0,0,0,0|1,0,0]=3 4583 B9R0.29 C[C@@H](CC)[C@H](NN)C(O)=O Amb25102747 [0,2,0,0,0,0|1,0,0]=3 4584 B9R0.29 C[C@@H](O)C(CO)C(=O)OC Amb25235714 [0,2,0,0,0,0|1,0,0]=3 4585 B9R0.29 C[C@@H](O)[C@@H](C=C)C(=O)OC Amb24386866 [0,2,0,0,0,0|1,0,0]=3 4586 B9R0.29 C[C@@H](O)[C@H](C=C)C(=O)OC Amb25731832 [0,2,0,0,0,0|1,0,0]=3 4587 B9R0.29 C[C@@H](O)[C@H](OC)[C@@H](O)C=O Amb25732574 [0,2,0,0,0,0|1,0,1]=4 4588 B9R0.29 C[C@@H](OC)[C@H](NC)C(O)=O Amb25340790 [0,2,0,0,0,0|0,0,0]=2 4589 B9R0.29 C[C@@H](OC)[C@H](OC)C(O)=O Amb25677780 [0,2,0,0,0,0|1,0,0]=3 4590 B9R0.29 C[C@H](C=C)[C@@H](CC)C(O)=O Amb25339204 [0,2,0,0,0,0|2,0,0]=4 4591 B9R0.29 C[C@H](CC)[C@H](C=C)C(O)=O Amb24561616 [0,2,0,0,0,0|2,0,0]=4 4592 B9R0.29 C[C@H](CC)[C@H](NC)C(O)=O Amb24544666 [0,2,0,0,0,0|1,0,0]=3 4593 B9R0.29 C[C@H](Cl)[C@@H](OC)C(=O)OC Amb25765234 [0,2,0,0,0,0|2,0,0]=4 4594 B9R0.29 C[C@H](N)[C@@H](CC)C(=O)OC Amb25117462 [0,2,0,0,0,0|2,0,0]=4 4595 B9R0.29 C[C@H](O)[C@@H](CC)C(=O)OC Amb24371110 [0,2,0,0,0,0|1,0,0]=3 4596 B9R0.29 C[C@H](O)[C@@H](SC)C(=O)OC Amb25169364 [0,2,0,0,0,0|1,0,0]=3 4597 B9R0.29 C[C@H](O)[C@H](CC)C(=O)OC Amb24733645 [0,2,0,0,0,0|1,0,0]=3 4598 B9R0.29 C[C@H](OC)[C@H](NC)C(O)=O Amb24478844 [0,2,0,0,0,0|0,0,0]=2 4599 B9R0.29 NC[C@@H]([C@H](O)CF)C(O)=O Amb25102471 [0,2,0,0,0,0|0,0,0]=2 4600 B9R0.32 CC(C(O)=O)C(C)(C)C=C Amb18643892 [0,2,0,0,0,0|2,0,0]=4 4601 B9R0.32 CC(C(O)=O)C(C)(O)C#N Amb25367972 [0,2,0,0,0,0|1,0,0]=3 4602 B9R0.32 CC(C)(C=C)C(N)C(O)=O Amb25703173 [0,2,0,0,0,0|1,0,0]=3 4603 B9R0.32 CC(C)(C=C)C(O)C(O)=O Amb25789992 [0,2,0,0,0,0|2,0,0]=4 4604 B9R0.32 CC(C)(C=O)C(O)C(O)=O Amb25118019 [0,2,0,0,0,0|1,0,1]=4 4605 B9R0.32 CC(C)(CCl)C(N)C(O)=O Amb24558312 [0,2,0,0,0,0|1,0,0]=3 4606 B9R0.32 CC(C)(CN)[C@@H](O)C(O)=O Amb25757349 [0,2,0,0,0,0|2,0,0]=4 4607 B9R0.32 CC(C)(CO)C(O)C(=O)Cl Amb24480409 [0,2,0,0,0,0|2,0,0]=4 4608 B9R0.32 CC(C)(CO)C(O)C(O)=O Amb18644357 [0,2,0,0,0,0|1,0,0]=3 4609 B9R0.32 CC(C)(CO)C(O)C([O-])=O Amb24118017 [0,2,0,0,0,0|1,0,1]=4 4610 B9R0.32 CC(C)(CO)[C@H](N)C(O)=O Amb25265734 [0,2,0,0,0,0|0,0,0]=2 4611 B9R0.32 CC(C)(CO)[C@H](O)C(N)=O Amb25858946 [0,2,0,0,0,0|2,0,0]=4 4612 B9R0.32 CC(C)(SS)C(N)C(O)=O Amb25282986 [0,2,0,0,0,0|0,1,0]=3 4613 B9R0.32 CC(O)(CF)C(O)C(O)=O Amb24440807 [0,2,0,0,0,0|1,0,0]=3 4614 B9R0.32 CC(O)C(O)C(C)(O)C=O Amb25145537 [0,2,0,0,0,0|1,0,1]=4 4615 B9R0.32 CCC(C)(C)C(N)C(N)=O Amb24565547 [0,2,0,0,0,0|2,0,0]=4 4616 B9R0.32 CCC(C)(C)[C@H](N)C(O)=O Amb24699415 [0,2,0,0,0,0|1,0,0]=3 4617 B9R0.32 CCC(C)(Cl)[C@H](N)C(O)=O Amb25701696 [0,2,0,0,0,0|1,0,0]=3 4618 B9R0.32 CCC(C)(O)C(=O)C(O)=O Amb22731859 [0,2,0,0,0,0|1,0,1]=4 4619 B9R0.32 CCC(C)(O)C(C)C(O)=O Amb18990593 [0,2,0,0,0,0|1,0,0]=3 4620 B9R0.32 CCC(C)(O)[C@@H](N)C(O)=O Amb25147507 [0,2,0,0,0,0|0,0,0]=2 4621 B9R0.32 CC[C@@](C)(O)[C@H](O)C(O)=O Amb25825540 [0,2,0,0,0,0|1,0,0]=3 4622 B9R0.32 CC[C@@](C)(S)[C@@H](N)C(O)=O Amb24482392 [0,2,0,0,0,0|0,1,0]=3 4623 B9R0.32 CC[C@](C)(O)[C@H](C)C(O)=O Amb24480440 [0,2,0,0,0,0|1,0,0]=3 4624 B9R0.32 COC(C(C(=O)O)Br)(C)C Amb10070092 [0,2,0,0,0,0|1,0,0]=3 4625 B9R0.32 COC(C(C(=O)O)N)(C)C Amb10070091 [0,2,0,0,0,0|0,0,0]=2 4626 B9R0.32 COC(C)(C)C(Br)C(C)=O Amb24505279 [0,2,0,0,0,0|2,0,0]=4 4627 B9R0.32 COC(C)(C)C(C)C(C)=O Amb24524649 [0,2,0,0,0,0|2,0,0]=4 4628 B9R0.32 COC(C)(C)C(N)C(C)=C Amb24412396 [0,2,0,0,0,0|2,0,0]=4 4629 B9R0.32 COC(C)(C)[C@H](N)C(O)=O Amb22229351 [0,2,0,0,0,0|0,0,0]=2 4630 B9R0.32 CSC(C)(C)[C@@H](N)C(O)=O Amb24482204 [0,2,0,0,0,0|0,1,0]=3 4631 B9R0.32 CSC(C)(C)[C@H](N)C(O)=O Amb24355892 [0,2,0,0,0,0|0,1,0]=3 4632 B9R0.32 C[C@@H](O)[C@H](N)C(C)(C)OC Amb25199177 [0,2,0,0,0,0|1,0,1]=4 4633 B9R0.32 C[C@@](O)(CF)[C@@H](N)C(O)=O Amb24627279 [0,2,0,0,0,0|0,0,0]=2 4634 B9R0.32 C[C@@](O)(CO)[C@H](N)C(O)=O Amb25251068 [0,2,0,0,0,0|0,0,0]=2 4635 B9R0.32 C[C@](O)(CN)[C@@H](O)C(O)=O Amb25727684 [0,2,0,0,0,0|1,0,0]=3 4636 B9R0.32 C[C@](O)(CN)[C@H](O)C(O)=O Amb25701236 [0,2,0,0,0,0|1,0,0]=3 4637 B9R0.32 NC(C(O)=O)C(F)(F)CS Amb25351360 [0,2,0,0,0,0|1,0,0]=3 4638 B9R0.32 OCC(C(C(=O)O)N)(C)C Amb17593671 [0,2,0,0,0,0|0,0,0]=2 4639 B9R0.32 OCP(O)(=O)C(O)C(O)=O Amb24462681 [0,2,0,0,0,0|2,0,0]=4 4640 B9R0.41 CC(=O)C(Br)C(CC)OC Amb24666723 [0,2,0,0,0,0|2,0,0]=4 4641 B9R0.41 CC(=O)C(O)C(OC)OC Amb24364071 [0,2,0,0,0,0|2,0,0]=4 4642 B9R0.41 CC(C(C=C)OC)C(O)=O Amb25340446 [0,2,0,0,0,0|1,0,1]=4 4643 B9R0.41 CC(C(CC)CC)C(O)=O Amb18831490 [0,2,0,0,0,0|2,0,0]=4 4644 B9R0.41 CC(C(CCl)CCl)C(O)=O Amb25800661 [0,2,0,0,0,0|2,0,0]=4 4645 B9R0.41 CC(C(OC)OC)C(C)=O Amb19650817 [0,2,0,0,0,0|2,0,0]=4 4646 B9R0.41 CC(C(OC)OC)C(O)=O Amb24401121 [0,2,0,0,0,0|1,0,0]=3 4647 B9R0.41 CCC(=CC)C(N)C(O)=O Amb25701826 [0,2,0,0,0,0|1,0,1]=4 4648 B9R0.41 CCC(=CC)[C@@H](N)C(O)=O Amb24616440 [0,2,0,0,0,0|1,0,1]=4 4649 B9R0.41 CCC(C#N)C(O)C(O)=O Amb24386131 [0,2,0,0,0,0|2,0,0]=4 4650 B9R0.41 CCC(CC)C(Br)C(O)=O Amb24574692 [0,2,0,0,0,0|2,0,0]=4 4651 B9R0.41 CCC(CC)C(F)C(O)=O Amb25823402 [0,2,0,0,0,0|2,0,0]=4 4652 B9R0.41 CCC(CC)C(N)C(N)=O Amb18307119 [0,2,0,0,0,0|2,0,0]=4 4653 B9R0.41 CCC(CC)C(N)C(O)=O Amb19375421 [0,2,0,0,0,0|1,0,0]=3 4654 B9R0.41 CCC(CC)C(O)C(O)=O Amb19013419 [0,2,0,0,0,0|2,0,0]=4 4655 B9R0.41 CCC(CCl)C(N)C(O)=O Amb25104857 [0,2,0,0,0,0|1,0,0]=3 4656 B9R0.41 CCC(CN)C(O)C(O)=O Amb24700895 [0,2,0,0,0,0|2,0,0]=4 4657 B9R0.41 CCC(OC)C(=C)C(O)=O Amb25757932 [0,2,0,0,0,0|1,0,1]=4 4658 B9R0.41 CCC(OC)C(Br)C(O)=O Amb25224428 [0,2,0,0,0,0|1,0,0]=3 4659 B9R0.41 CCC(OC)C(N)C(O)=O Amb24381341 [0,2,0,0,0,0|0,0,0]=2 4660 B9R0.41 CCC(OC)C(O)C(N)=O Amb25348258 [0,2,0,0,0,0|2,0,0]=4 4661 B9R0.41 CCC(OC)C(O)C(O)=O Amb25695288 [0,2,0,0,0,0|1,0,0]=3 4662 B9R0.41 CCC([C@@H](C(=O)O)N)CC Amb17612761 [0,2,0,0,0,0|1,0,0]=3 4663 B9R0.41 CCC([C@H](C(=O)O)N)CC Amb17612760 [0,2,0,0,0,0|1,0,0]=3 4664 B9R0.41 CC[C@@H](OC)[C@H](N)C(O)=O Amb24745671 [0,2,0,0,0,0|0,0,0]=2 4665 B9R0.41 CC\C(=C\C)\[C@@H](N)C(O)=O Amb25147301 [0,2,0,0,0,0|1,0,1]=4 4666 B9R0.41 COC(C(C(=O)C)Cl)OC Amb17594151 [0,2,0,0,0,0|2,0,0]=4 4667 B9R0.41 COC(OC)C(Cl)C(O)=O Amb25349475 [0,2,0,0,0,0|1,0,0]=3 4668 B9R0.41 COC(OC)[C@@H](N)C(O)=O Amb24120392 [0,2,0,0,0,0|0,0,0]=2 4669 B9R0.41 COC(OC)[C@H](N)C(O)=O Amb24658204 [0,2,0,0,0,0|0,0,0]=2 4670 B9R0.41 CO[C@@H](CO)[C@@H](O)C(N)=O Amb25147298 [0,2,0,0,0,0|2,0,0]=4 4671 B9R0.41 C[C@@H](C(CC)CC)C(O)=O Amb25255941 [0,2,0,0,0,0|2,0,0]=4 4672 B9R0.41 C[C@@H](C(OC)OC)C(O)=O Amb25694344 [0,2,0,0,0,0|1,0,0]=3 4673 B9R0.41 C[C@@H]([C@@H](C=C)OC)C(O)=O Amb25840435 [0,2,0,0,0,0|1,0,1]=4 4674 B9R0.41 C[C@@H]([C@@H](CC)C=C)C(O)=O Amb24479222 [0,2,0,0,0,0|2,0,0]=4 4675 B9R0.41 C[C@@H]([C@H](CC)C#C)C(O)=O Amb24402902 [0,2,0,0,0,0|2,0,0]=4 4676 B9R0.41 C[C@H]([C@@H](CC)C#C)C(O)=O Amb24671284 [0,2,0,0,0,0|2,0,0]=4 4677 B9R0.41 C[C@H]([C@H](CC)C=C)C(O)=O Amb25703518 [0,2,0,0,0,0|2,0,0]=4 4678 B9R0.41 C\C=C(/C=O)\C(N)C(O)=O Amb24756701 [0,2,0,0,0,0|0,0,2]=4 4679 B9R0.41 NC(C(CF)CF)C(O)=O Amb25088384 [0,2,0,0,0,0|1,0,0]=3 4680 B9R0.41 NC(C(CO)CO)C(O)=O Amb24436950 [0,2,0,0,0,0|0,0,0]=2 4681 B9R0.41 N[C@H](C(CO)CO)C(O)=O Amb25757902 [0,2,0,0,0,0|0,0,0]=2 4682 B9R0.33 CC(C)C(CC#C)C(O)=O Amb25259400 [0,2,0,0,0,0|2,0,0]=4 4683 B9R0.33 CC(C)C(CC=C)C(O)=O Amb18643926 [0,2,0,0,0,0|2,0,0]=4 4684 B9R0.33 CC(C)C(CC=O)C(O)=O Amb18831504 [0,2,0,0,0,0|2,0,0]=4 4685 B9R0.33 CC(C)C(CCN)C(O)=O Amb22371125 [0,2,0,0,0,0|1,0,0]=3 4686 B9R0.33 CC(C)C(CCN)C(O)=O Amb24426418 [0,2,0,0,0,0|1,0,0]=3 4687 B9R0.33 CC(C)C(N=CC)C(O)=O Amb25275310 [0,2,0,0,0,0|1,0,1]=4 4688 B9R0.33 CC(C)C(NC=O)C(N)=O Amb25706327 [0,2,0,0,0,0|2,0,0]=4 4689 B9R0.33 CC(C)C(NCC)C(N)=O Amb19012660 [0,2,0,0,0,0|2,0,0]=4 4690 B9R0.33 CC(C)C(NCC)C(O)=O Amb19514760 [0,2,0,0,0,0|1,0,0]=3 4691 B9R0.33 CC(C)C(NOC)C(O)=O Amb24398888 [0,2,0,0,0,0|1,0,0]=3 4692 B9R0.33 CC(C)C(SSC)C(O)=O Amb25307678 [0,2,0,0,0,0|2,0,0]=4 4693 B9R0.33 CC(C)C(\C=C\C)C(O)=O Amb18643944 [0,2,0,0,0,0|2,0,0]=4 4694 B9R0.33 CC(C)[C@@H](CCC)C(O)=O Amb24376843 [0,2,0,0,0,0|2,0,0]=4 4695 B9R0.33 CC(C)[C@@H](N=[N+]=[N-])C(O)=O Amb24468176 [0,2,0,0,0,0|1,0,1]=4 4696 B9R0.33 CC(C)[C@@H](NC=O)C(O)=O Amb22745192 [0,2,0,0,0,0|1,0,0]=3 4697 B9R0.33 CC(C)[C@H](CC=C)C(O)=O Amb25790140 [0,2,0,0,0,0|2,0,0]=4 4698 B9R0.33 CC(C)[C@H](CC=O)C(O)=O Amb25068059 [0,2,0,0,0,0|2,0,0]=4 4699 B9R0.33 CC(C)[C@H](N=[N+]=[N-])C(O)=O Amb24477170 [0,2,0,0,0,0|1,0,1]=4 4700 B9R0.33 CC(C)[C@H](NCC)C(O)=O Amb25230589 [0,2,0,0,0,0|1,0,0]=3 4701 B9R0.33 CC(Cl)C(SCC)C(O)=O Amb24433994 [0,2,0,0,0,0|2,0,0]=4 4702 B9R0.33 CC(O)C(N=C=O)C(O)=O Amb24705699 [0,2,0,0,0,0|0,0,1]=3 4703 B9R0.33 CC(O)C(N=[N+]=[N-])C(O)=O Amb24460917 [0,2,0,0,0,0|0,0,1]=3 4704 B9R0.33 CC(O)C(NC=O)C(O)=O Amb18290433 [0,2,0,0,0,0|0,0,0]=2 4705 B9R0.33 CC(O)C(NCC)C(O)=O Amb25702357 [0,2,0,0,0,0|0,0,0]=2 4706 B9R0.33 CCCC(C(=O)O)C(C)C Amb17616275 [0,2,0,0,0,0|2,0,0]=4 4707 B9R0.33 CN(C)[C@@H](CCN)C(O)=O Amb25147640 [0,2,0,0,0,0|2,0,0]=4 4708 B9R0.33 C[C@@H](N)[C@@H](CC=C)C(O)=O Amb25825013 [0,2,0,0,0,0|2,0,0]=4 4709 B9R0.33 C[C@@H](O)[C@@H](CC#C)C(O)=O Amb24745676 [0,2,0,0,0,0|1,0,0]=3 4710 B9R0.33 C[C@@H](O)[C@@H](CC=C)C(C)=O Amb25059737 [0,2,0,0,0,0|2,0,0]=4 4711 B9R0.33 C[C@@H](O)[C@@H](CCC)C(C)=O Amb24614825 [0,2,0,0,0,0|2,0,0]=4 4712 B9R0.33 C[C@@H](O)[C@H](CCC)C(C)=O Amb24424917 [0,2,0,0,0,0|2,0,0]=4 4713 B9R0.33 C[C@@H](O)[C@H](N=C=O)C(O)=O Amb25071598 [0,2,0,0,0,0|0,0,1]=3 4714 B9R0.33 C[C@@H](O)[C@H](NC=O)C(O)=O Amb24478847 [0,2,0,0,0,0|0,0,0]=2 4715 B9R0.33 C[C@H](O)[C@@H](CC=C)C(C)=O Amb24686538 [0,2,0,0,0,0|2,0,0]=4 4716 B9R0.33 C[C@H](O)[C@H](CC=C)C(O)=O Amb24672255 [0,2,0,0,0,0|1,0,0]=3 4717 B9R0.33 OC(=O)C(NC=O)C(O)=O Amb25118158 [0,2,0,0,0,0|1,0,1]=4 4718 B9R0.54 CC(=C)C(C(C)C)C(O)=O Amb18643917 [0,2,0,0,0,0|2,0,0]=4 4719 B9R0.54 CC(=C)[C@H](C(C)C)C(O)=O Amb24680337 [0,2,0,0,0,0|2,0,0]=4 4720 B9R0.54 CC(C(C(=O)O)C(C)C)C Amb17593626 [0,2,0,0,0,0|2,0,0]=4 4721 B9R0.54 CC(C)C(C(C)N)C(O)=O Amb24420001 [0,2,0,0,0,0|1,0,0]=3 4722 B9R0.54 CC(C)C(C(N)=O)C(N)=S Amb18800422 [0,2,0,0,0,0|2,0,0]=4 4723 B9R0.54 CC(C)C(C(N)=O)N(C)C Amb25147485 [0,2,0,0,0,0|2,0,0]=4 4724 B9R0.54 CC(C)C(C(N)=O)N(C)N Amb18644210 [0,2,0,0,0,0|2,0,0]=4 4725 B9R0.54 CC(C)C(C(O)=O)N(C)C Amb19343274 [0,2,0,0,0,0|1,0,0]=3 4726 B9R0.54 CC(C)C(C(O)=O)N(C)C Amb21961533 [0,2,0,0,0,0|1,0,0]=3 4727 B9R0.54 CC(C)C(C(O)=O)N(C)N Amb22234256 [0,2,0,0,0,0|1,0,0]=3 4728 B9R0.54 CC(C)C(C(O)=O)N(C)O Amb25024913 [0,2,0,0,0,0|1,0,0]=3 4729 B9R0.54 CC(C)C(C(O)=O)N(Cl)Cl Amb25723154 [0,2,0,0,0,0|1,0,0]=3 4730 B9R0.54 CC(C)C(C(O)=O)S(C)=O Amb18290928 [0,2,0,0,0,0|2,0,0]=4 4731 B9R0.54 CC(C)[C@@H](C(N)=O)N(C)C Amb24746633 [0,2,0,0,0,0|2,0,0]=4 4732 B9R0.54 CC(C)[C@H](C(N)=O)N(C)C Amb24592374 [0,2,0,0,0,0|2,0,0]=4 4733 B9R0.54 CC(C)[C@H](C(O)=O)N(C)C Amb24053107 [0,2,0,0,0,0|1,0,0]=3 4734 B9R0.54 CC(C)[C@H]([C@@H](C)N)C(O)=O Amb25703405 [0,2,0,0,0,0|1,0,0]=3 4735 B9R0.54 CC(Cl)C(C(C)Cl)C(O)=O Amb24710937 [0,2,0,0,0,0|2,0,0]=4 4736 B9R0.54 CC(F)C(C(O)=O)N(C)C Amb25848152 [0,2,0,0,0,0|1,0,0]=3 4737 B9R0.54 CC(N)C(C(O)=O)P(O)=O Amb24373175 [0,2,0,0,0,0|1,1,0]=4 4738 B9R0.54 CC(O)C(C(N)O)[N+]([O-])=O Amb24634657 [0,2,0,0,0,0|1,0,1]=4 4739 B9R0.54 CC(O)C(C(O)=O)C(O)=O Amb24480725 [0,2,0,0,0,0|1,0,0]=3 4740 B9R0.54 CC(O)[C@@H](C(O)=O)N(C)C Amb24698989 [0,2,0,0,0,0|0,0,0]=2 4741 B9R0.54 CC(S)C(C(C)S)C(O)=O Amb24725889 [0,2,0,0,0,0|1,1,0]=4 4742 B9R0.54 C[C@@H](O)[C@@H]([C@H](C)N)C(O)=O Amb25789955 [0,2,0,0,0,0|0,0,0]=2 4743 B9R0.54 C[C@H](O)[C@@H](C(O)=O)N(C)C Amb25316187 [0,2,0,0,0,0|0,0,0]=2 4744 B9R0.54 C[C@H](O)[C@@H]([C@@H](C)N)C(O)=O Amb25340296 [0,2,0,0,0,0|0,0,0]=2 4745 B9R0.72 CC(C)(C)C(=NN)C(O)=O Amb24350605 [0,2,0,0,0,0|1,0,1]=4 4746 B9R0.72 CC(C)(C)C(C#N)C(O)=O Amb18643723 [0,2,0,0,0,0|1,0,1]=4 4747 B9R0.72 CC(C)(C)C(CN)C(O)=O Amb22745168 [0,2,0,0,0,0|1,0,0]=3 4748 B9R0.72 CC(C)(C)C(NBr)C(O)=O Amb25825138 [0,2,0,0,0,0|1,0,0]=3 4749 B9R0.72 CC(C)(C)C(NN)C(N)=O Amb18124760 [0,2,0,0,0,0|2,0,0]=4 4750 B9R0.72 CC(C)(C)[C@@H](CN)C(O)=O Amb22744975 [0,2,0,0,0,0|1,0,0]=3 4751 B9R0.72 CC(C)(C)[C@@H](CO)C(O)=O Amb24502322 [0,2,0,0,0,0|2,0,0]=4 4752 B9R0.72 CC(C)(C)[C@H](NBr)C(O)=O Amb25131170 [0,2,0,0,0,0|1,0,0]=3 4753 B9R0.72 CC(C)(C)[C@H](ON)C(O)=O Amb24538052 [0,2,0,0,0,0|1,0,0]=3 4754 B9R0.72 CC(C)(O)C(C=C)C(O)=O Amb18644112 [0,2,0,0,0,0|1,0,0]=3 4755 B9R0.72 CC(C)C(CN)P(O)(O)=O Amb25295335 [0,2,0,0,0,0|2,0,0]=4 4756 B9R0.72 CCC(C(O)=O)C(C)(C)C Amb18124683 [0,2,0,0,0,0|2,0,0]=4 4757 B9R0.72 CCC(C(O)=O)C(C)(C)F Amb24756885 [0,2,0,0,0,0|2,0,0]=4 4758 B9R0.72 CNC(C(N)=O)C(C)(C)C Amb18975751 [0,2,0,0,0,0|2,0,0]=4 4759 B9R0.72 CNC(C(O)=O)C(C)(C)C Amb18975753 [0,2,0,0,0,0|1,0,0]=3 4760 B9R0.72 CNC(C(O)=O)C(C)(C)O Amb18644319 [0,2,0,0,0,0|0,0,0]=2 4761 B9R0.72 CN[C@@H](C(N)=O)C(C)(C)C Amb24117093 [0,2,0,0,0,0|2,0,0]=4 4762 B9R0.72 CN[C@@H](C(O)=O)C(C)(C)C Amb24117092 [0,2,0,0,0,0|1,0,0]=3 4763 B9R0.72 CN[C@H](C(N)=O)C(C)(C)C Amb24470493 [0,2,0,0,0,0|2,0,0]=4 4764 B9R0.72 COC(C(O)=O)C(C)(C)C Amb24382480 [0,2,0,0,0,0|2,0,0]=4 4765 B9R0.72 CSC(C(O)=O)C(C)(C)Cl Amb18648723 [0,2,0,0,0,0|2,0,0]=4 4766 B9R0.72 CSC(C(O)=O)C(C)(C)N Amb25101572 [0,2,0,0,0,0|2,0,0]=4 4767 B9R0.72 NCC(C(F)(F)F)C(=O)O Amb10841964 [0,2,0,0,0,0|2,0,0]=4 4768 B9R0.72 NCC(C(O)=O)S(O)(=O)=O Amb21982536 [0,2,0,0,0,0|2,0,0]=4 4769 B9R0.76 C=CC(N)(C(O)=O)C(O)=O Amb24479037 [0,2,0,0,0,0|1,0,1]=4 4770 B9R0.76 CC(C)C(C)(C#N)C(O)=O Amb24695128 [0,2,0,0,0,0|1,0,1]=4 4771 B9R0.76 CC(C)C(C)(CN)C(O)=O Amb24452860 [0,2,0,0,0,0|1,0,0]=3 4772 B9R0.76 CC(C)C(Cl)(C#N)C(O)=O Amb25684746 [0,2,0,0,0,0|1,0,1]=4 4773 B9R0.76 CC(C)C(F)(CN)C(O)=O Amb25135307 [0,2,0,0,0,0|1,0,0]=3 4774 B9R0.76 CC(C)C(N)(C=C)C(O)=O Amb25703547 [0,2,0,0,0,0|1,0,0]=3 4775 B9R0.76 CC(C)[C@](N)(CO)C(O)=O Amb25103828 [0,2,0,0,0,0|1,0,0]=3 4776 B9R0.76 CC(O)C(C)(C=C)C(O)=O Amb18644147 [0,2,0,0,0,0|1,0,0]=3 4777 B9R0.76 CC(O)C(N)(CO)C(O)=O Amb25147371 [0,2,0,0,0,0|0,0,0]=2 4778 B9R0.76 CCC(Br)(C(C)C)C(O)=O Amb25119235 [0,2,0,0,0,0|2,0,0]=4 4779 B9R0.76 CCC(C)(C(C)C)C(O)=O Amb18644163 [0,2,0,0,0,0|2,0,0]=4 4780 B9R0.76 CCC(C)(C(C)O)C(C)=O Amb25145647 [0,2,0,0,0,0|2,0,0]=4 4781 B9R0.76 CCC(C)(C(C)O)C(O)=O Amb25826200 [0,2,0,0,0,0|1,0,0]=3 4782 B9R0.76 CCC(N)(C(C)C)C(N)=O Amb18289873 [0,2,0,0,0,0|2,0,0]=4 4783 B9R0.76 CCC(N)(C(C)C)C(O)=O Amb24460296 [0,2,0,0,0,0|1,0,0]=3 4784 B9R0.76 CCC(O)(C(C)C)C(O)=O Amb24459544 [0,2,0,0,0,0|2,0,0]=4 4785 B9R0.76 CC[C@@](C)([C@@H](C)O)C(C)=O Amb25298569 [0,2,0,0,0,0|2,0,0]=4 4786 B9R0.76 CC[C@@](N)([C@@H](C)O)C(O)=O Amb25082905 [0,2,0,0,0,0|0,0,0]=2 4787 B9R0.76 CC[C@@](O)([C@@H](C)O)C(O)=O Amb25214139 [0,2,0,0,0,0|1,0,0]=3 4788 B9R0.76 CNC(C)(C(C)C)C(N)=O Amb18289562 [0,2,0,0,0,0|2,0,0]=4 4789 B9R0.76 CNC(C)(C(C)C)C(O)=O Amb18298758 [0,2,0,0,0,0|1,0,0]=3 4790 B9R0.76 CN[C@](C)(C(C)C)C(N)=O Amb24567659 [0,2,0,0,0,0|2,0,0]=4 4791 B9R0.76 COC(C)(C(C)C)C(O)=O Amb24616993 [0,2,0,0,0,0|2,0,0]=4 4792 B9R0.76 NC(CO)(C(O)=O)C(O)=O Amb25339816 [0,2,0,0,0,0|1,0,1]=4 4793 B9R0.76 N[C@](CO)(C(F)F)C(O)=O Amb24649833 [0,2,0,0,0,0|2,0,0]=4 4794 B9R0.49 CC(C)(S)C(N)P(C)(O)=O Amb25257380 [0,2,0,0,0,0|1,1,0]=4 4795 B9R0.49 NC(P(=O)(O)O)C(C)(C)C Amb1150406 [0,2,0,0,0,0|2,0,0]=4 4796 B9R0.80 CC(C)(C(O)=O)C(C)(C)N Amb19283404 [0,2,0,0,0,0|2,0,0]=4 4797 B9R0.80 CC(C)(C)C(C)(C)C(O)=O Amb18124686 [0,2,0,0,0,0|2,0,0]=4 4798 B9R0.80 CC(C)(C)C(C)(Cl)C(O)=O Amb25101678 [0,2,0,0,0,0|2,0,0]=4 4799 B9R0.80 CC(C)(C)C(C)(N)C(C)=O Amb24480565 [0,2,0,0,0,0|2,0,0]=4 4800 B9R0.80 CC(C)(C)C(C)(N)C(N)=O Amb25843215 [0,2,0,0,0,0|2,0,0]=4 4801 B9R0.80 CC(C)(C)C(C)(O)C(O)=O Amb18644262 [0,2,0,0,0,0|2,0,0]=4 4802 B9R0.80 CC(C)(C)[C@@](C)(N)C(O)=O Amb19929646 [0,2,0,0,0,0|1,0,0]=3 4803 B9R0.80 CC(C)(C)[C@](C)(N)C(O)=O Amb24471265 [0,2,0,0,0,0|1,0,0]=3 4804 B9R0.80 CC(C)(O)C(C)(C)C(O)=O Amb18281599 [0,2,0,0,0,0|1,0,0]=3 4805 B9R0.80 CC(C)(O)C(C)(O)C(C)=O Amb25240479 [0,2,0,0,0,0|2,0,0]=4 4806 B9R0.80 CC(C)(O)C(C)(O)C(N)=O Amb24349415 [0,2,0,0,0,0|2,0,0]=4 4807 B9R0.80 CC(C)(O)C(F)(F)C(N)=O Amb25107467 [0,2,0,0,0,0|2,0,0]=4 4808 B9R0.80 CC(C)(O)C(F)(F)C(O)=O Amb18796751 [0,2,0,0,0,0|1,0,0]=3 4809 B9R0.80 CC(C)(O)[C@@](C)(N)C(O)=O Amb25117586 [0,2,0,0,0,0|0,0,0]=2 4810 B9R0.80 CC(C)(S)C(C)(N)C(O)=O Amb25088416 [0,2,0,0,0,0|0,1,0]=3 4811 B9R0.80 CC(F)(F)C(F)(F)C(O)=O Amb25772767 [0,2,0,0,0,0|2,0,0]=4 4812 B9R0.80 CC(N)(C(O)=O)C(F)(F)F Amb19330378 [0,2,0,0,0,0|2,0,0]=4 4813 B9R0.80 CC(O)C(F)(F)P(O)(O)=O Amb25687806 [0,2,0,0,0,0|2,0,0]=4 4814 B9R0.80 C[C@H](O)C(F)(F)P(O)(O)=O Amb25027608 [0,2,0,0,0,0|2,0,0]=4 4815 B9R0.80 C[C@](N)(C(O)=O)C(F)(F)Cl Amb25065332 [0,2,0,0,0,0|2,0,0]=4 4816 B9R0.80 C[C@](N)(C(O)=O)C(F)(F)F Amb25273871 [0,2,0,0,0,0|2,0,0]=4 4817 B9R0.80 OC(=O)C(C(F)(F)F)(N)C Amb1091768 [0,2,0,0,0,0|2,0,0]=4 4818 B9R0.80 [2H]C([2H])([2H])C([2H])(N)C(O)=O Amb22338710 [0,2,0,0,0,0|2,0,0]=4 4819 B9R0.80 [2H]C([2H])([2H])[C@@]([2H])(N)C(O)=O Amb22801648 [0,2,0,0,0,0|2,0,0]=4 4820 B7R1.2 C=C1CC(=O)OC1 Amb24589821 [1,0,0,1,0,0|1,0,1]=4 4821 B7R1.2 C=C1CC(O)CC1 Amb25246529 [1,0,0,1,0,0|2,0,0]=4 4822 B7R1.2 CC1CC(=O)CS1 Amb23598370 [1,0,0,1,0,0|1,1,0]=4 4823 B7R1.2 CC1CC(=O)NC1 Amb10608004 [1,0,0,1,0,0|2,0,0]=4 4824 B7R1.2 CC1COC(=O)C1 Amb22231914 [1,0,0,1,0,0|1,0,0]=3 4825 B7R1.2 CC1COC(=O)N1 Amb19517037 [1,0,0,1,0,0|2,0,0]=4 4826 B7R1.2 CC1CSC(=O)C1 Amb25136024 [1,0,0,1,0,0|1,1,0]=4 4827 B7R1.2 CC1NNC(=O)C1 Amb2371659 [1,0,0,1,0,0|2,0,0]=4 4828 B7R1.2 CC1[N-]OC(=O)N1 Amb24481515 [1,0,0,1,0,0|2,0,0]=4 4829 B7R1.2 CC=1CC(=O)ON1 Amb22274079 [1,0,0,1,0,0|1,0,1]=4 4830 B7R1.2 C[C@@H]1CC(=O)CC1 Amb22801305 [1,0,0,1,0,0|2,0,0]=4 4831 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [1,0,0,1,0,0|2,0,0]=4 4832 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [1,0,0,1,0,0|2,0,0]=4 4833 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [1,0,0,1,0,0|1,0,0]=3 4834 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [1,0,0,1,0,0|2,0,0]=4 4835 B7R1.2 C[C@H]1CC(=O)CN1 Amb25746539 [1,0,0,1,0,0|2,0,0]=4 4836 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [1,0,0,1,0,0|1,0,0]=3 4837 B7R1.2 C[C@H]1C[C@H](O)CO1 Amb25212245 [1,0,0,1,0,0|1,0,1]=4 4838 B7R1.2 ClC1COC(=O)O1 Amb10842117 [1,0,0,1,0,0|2,0,0]=4 4839 B7R1.2 FC1COC(=O)O1 Amb10841016 [1,0,0,1,0,0|2,0,0]=4 4840 B7R1.2 NC1CC(=O)CC1 Amb22236085 [1,0,0,1,0,0|2,0,0]=4 4841 B7R1.2 NC1CC(=O)CC1 Amb22494268 [1,0,0,1,0,0|2,0,0]=4 4842 B7R1.2 NC1CC(=O)NO1 Amb24640844 [1,0,0,1,0,0|2,0,0]=4 4843 B7R1.2 NC1CNC(=O)C1 Amb17760661 [1,0,0,1,0,0|2,0,0]=4 4844 B7R1.2 NC1COC(=O)N1 Amb23590649 [1,0,0,1,0,0|2,0,0]=4 4845 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [1,0,0,1,0,0|2,0,0]=4 4846 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [1,0,0,1,0,0|2,0,0]=4 4847 B7R1.2 N[C@@H]1COS(=O)C1 Amb24612429 [1,0,0,1,0,0|2,0,0]=4 4848 B7R1.2 N[C@H]1CC(=O)OC1 Amb16233747 [1,0,0,1,0,0|1,0,0]=3 4849 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [1,0,0,1,0,0|2,0,0]=4 4850 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [1,0,0,1,0,0|1,0,0]=3 4851 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [1,0,0,1,0,0|1,0,0]=3 4852 B7R1.2 O=C1CC(Br)CC1 Amb24334292 [1,0,0,1,0,0|2,0,0]=4 4853 B7R1.2 O=C1CC(Br)CO1 Amb25803413 [1,0,0,1,0,0|1,0,0]=3 4854 B7R1.2 O=C1CC(Cl)CO1 Amb24608923 [1,0,0,1,0,0|1,0,0]=3 4855 B7R1.2 O=C1CC(F)CC1 Amb21963553 [1,0,0,1,0,0|2,0,0]=4 4856 B7R1.2 O=C1CC(F)CO1 Amb24431109 [1,0,0,1,0,0|1,0,0]=3 4857 B7R1.2 O=C1CC(I)CC1 Amb22001809 [1,0,0,1,0,0|2,0,0]=4 4858 B7R1.2 O=C1CC(S)CN1 Amb25685875 [1,0,0,1,0,0|1,1,0]=4 4859 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [1,0,0,1,0,0|1,1,0]=4 4860 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [1,0,0,1,0,0|1,1,0]=4 4861 B7R1.2 O=C1OC=C(C1)O Amb17621628 [1,0,0,1,0,0|0,0,2]=4 4862 B7R1.2 O=C1OCC(I)O1 Amb25681787 [1,0,0,1,0,0|2,0,0]=4 4863 B7R1.2 OC1CC(=O)CC1 Amb22057378 [1,0,0,1,0,0|1,0,0]=3 4864 B7R1.2 OC1CC=C(Br)C1 Amb25662365 [1,0,0,1,0,0|2,0,0]=4 4865 B7R1.2 OC1CC=C(Cl)C1 Amb25215432 [1,0,0,1,0,0|2,0,0]=4 4866 B7R1.2 OC1CCC(=O)N1 Amb21963236 [1,0,0,1,0,0|2,0,0]=4 4867 B7R1.2 OC1CCC(=O)O1 Amb22740957 [1,0,0,1,0,0|2,0,0]=4 4868 B7R1.2 OC1CNC(=O)C1 Amb19958404 [1,0,0,1,0,0|1,0,0]=3 4869 B7R1.2 OC1COC(=O)N1 Amb24428770 [1,0,0,1,0,0|1,0,0]=3 4870 B7R1.2 OC1CSS(=O)C1 Amb25169570 [1,0,0,1,0,0|1,1,0]=4 4871 B7R1.2 O[C@@H]1CC(=O)NC1 Amb15691722 [1,0,0,1,0,0|1,0,0]=3 4872 B7R1.2 O[C@@H]1CN(O)CC1 Amb25025106 [1,0,0,1,0,0|2,0,0]=4 4873 B7R1.2 O[C@H]1CSS(=O)C1 Amb25317551 [1,0,0,1,0,0|1,1,0]=4 4874 B7R1.2 O[C@H]1C[C@H](O)CC1 Amb24519755 [1,0,0,1,0,0|1,0,1]=4 4875 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [1,0,0,1,0,0|2,0,0]=4 4876 B7R1.12 C=C1C[C@@H]1C(O)=O Amb24683036 [1,0,0,1,0,0|1,0,1]=4 4877 B7R1.12 C=C1C[C@H]1C(O)=O Amb24368112 [1,0,0,1,0,0|1,0,1]=4 4878 B7R1.12 CC(=O)C1CC1Br Amb24426068 [1,0,0,1,0,0|2,0,0]=4 4879 B7R1.12 CC(=O)C1CC1Cl Amb25321894 [1,0,0,1,0,0|2,0,0]=4 4880 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Br Amb25745820 [1,0,0,1,0,0|2,0,0]=4 4881 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Cl Amb24595358 [1,0,0,1,0,0|2,0,0]=4 4882 B7R1.12 CC(=O)[C@@H]1C[C@H]1Br Amb25110221 [1,0,0,1,0,0|2,0,0]=4 4883 B7R1.12 CC(=O)[C@@H]1C[C@H]1Cl Amb25179033 [1,0,0,1,0,0|2,0,0]=4 4884 B7R1.12 CC1CC1C(C)=O Amb25720437 [1,0,0,1,0,0|2,0,0]=4 4885 B7R1.12 CC1OC1C(=O)O Amb17593088 [1,0,0,1,0,0|0,0,0]=2 4886 B7R1.12 CC1OC1C(C)O Amb24687071 [1,0,0,1,0,0|1,0,1]=4 4887 B7R1.12 CC1OC1[C@H](C)O Amb24529514 [1,0,0,1,0,0|1,0,1]=4 4888 B7R1.12 CC1SC1C(C)=O Amb24333031 [1,0,0,1,0,0|1,1,0]=4 4889 B7R1.12 C[C@@H]1C[C@@H]1C(C)=O Amb24670522 [1,0,0,1,0,0|2,0,0]=4 4890 B7R1.12 C[C@@H]1C[C@@H]1C(N)=O Amb25745425 [1,0,0,1,0,0|2,0,0]=4 4891 B7R1.12 C[C@@H]1C[C@@H]1C(O)=O Amb25851678 [1,0,0,1,0,0|1,0,0]=3 4892 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [1,0,0,1,0,0|2,0,0]=4 4893 B7R1.12 C[C@@H]1C[C@H]1C(O)=O Amb22735875 [1,0,0,1,0,0|1,0,0]=3 4894 B7R1.12 C[C@@H]1N[C@H]1C(O)=O Amb24120621 [1,0,0,1,0,0|1,0,0]=3 4895 B7R1.12 C[C@@H]1O[C@@H]1[C@@H](C)O Amb24630796 [1,0,0,1,0,0|1,0,1]=4 4896 B7R1.12 C[C@@H]1O[C@@H]1[C@H](C)O Amb25176663 [1,0,0,1,0,0|1,0,1]=4 4897 B7R1.12 C[C@@H]1O[C@H]1C(O)=O Amb25738149 [1,0,0,1,0,0|0,0,0]=2 4898 B7R1.12 C[C@@H]1O[C@H]1[C@@H](C)O Amb24570001 [1,0,0,1,0,0|1,0,1]=4 4899 B7R1.12 C[C@@H]1S[C@H]1C(C)=O Amb24374150 [1,0,0,1,0,0|1,1,0]=4 4900 B7R1.12 C[C@H]1C[C@@H]1C(O)=O Amb22735974 [1,0,0,1,0,0|1,0,0]=3 4901 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [1,0,0,1,0,0|1,0,0]=3 4902 B7R1.12 C[C@H]1C[C@H]1C(C)=O Amb25236374 [1,0,0,1,0,0|2,0,0]=4 4903 B7R1.12 C[C@H]1O[C@@H]1C(C)O Amb25173891 [1,0,0,1,0,0|1,0,1]=4 4904 B7R1.12 C[C@H]1O[C@H]1C(C)O Amb24597224 [1,0,0,1,0,0|1,0,1]=4 4905 B7R1.12 C[C@H]1O[C@H]1[C@H](C)O Amb24671875 [1,0,0,1,0,0|1,0,1]=4 4906 B7R1.12 NC(=O)[C@@H]1C[C@@H]1Br Amb24519223 [1,0,0,1,0,0|2,0,0]=4 4907 B7R1.12 NC1CC1C(N)=O Amb18279694 [1,0,0,1,0,0|2,0,0]=4 4908 B7R1.12 N[C@@H]1C[C@@H]1C(O)=O Amb25708637 [1,0,0,1,0,0|1,0,0]=3 4909 B7R1.12 N[C@@H]1C[C@H]1C(=O)O Amb2372566 [1,0,0,1,0,0|1,0,0]=3 4910 B7R1.12 N[C@H]1C[C@@H]1C(O)=O Amb25204284 [1,0,0,1,0,0|1,0,0]=3 4911 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1Cl Amb25320863 [1,0,0,1,0,0|2,0,0]=4 4912 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1F Amb24403332 [1,0,0,1,0,0|2,0,0]=4 4913 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [1,0,0,1,0,0|2,0,0]=4 4914 B7R1.12 OC(=O)C1CC1F Amb22490547 [1,0,0,1,0,0|1,0,0]=3 4915 B7R1.12 OC(=O)C1CC1S Amb20246988 [1,0,0,1,0,0|0,1,0]=3 4916 B7R1.12 OC(=O)[C@@H]1C[C@@H]1Cl Amb25209184 [1,0,0,1,0,0|1,0,0]=3 4917 B7R1.12 OC(=O)[C@@H]1C[C@@H]1F Amb22737600 [1,0,0,1,0,0|1,0,0]=3 4918 B7R1.12 OC(=O)[C@@H]1C[C@@H]1I Amb22756600 [1,0,0,1,0,0|1,0,0]=3 4919 B7R1.12 OC(=O)[C@@H]1C[C@H]1Br Amb24570997 [1,0,0,1,0,0|1,0,0]=3 4920 B7R1.12 OC(=O)[C@@H]1C[C@H]1F Amb22737604 [1,0,0,1,0,0|1,0,0]=3 4921 B7R1.12 OC(=O)[C@H]1C[C@@H]1F Amb22736113 [1,0,0,1,0,0|1,0,0]=3 4922 B7R1.12 OC(=O)[C@H]1C[C@H]1F Amb22738580 [1,0,0,1,0,0|1,0,0]=3 4923 B7R1.12 OC(=O)[C@H]1C[C@H]1I Amb22736654 [1,0,0,1,0,0|1,0,0]=3 4924 B7R1.12 OC1CC1C(O)=O Amb24360896 [1,0,0,1,0,0|0,0,0]=2 4925 B7R1.16 CC1(C)CC(=O)C1 Amb24117921 [1,0,0,1,0,0|2,0,0]=4 4926 B7R1.16 CC1(C)CC(=O)N1 Amb19515692 [1,0,0,1,0,0|2,0,0]=4 4927 B7R1.16 CC1(C)CC(=O)O1 Amb17940813 [1,0,0,1,0,0|1,0,0]=3 4928 B7R1.16 OC1CP(O)(=O)C1 Amb25811046 [1,0,0,1,0,0|1,0,0]=3 4929 B7R1.16 OC1CS(=O)(=O)C1 Amb22229261 [1,0,0,1,0,0|1,0,1]=4 4930 B7R1.20 CC(=O)CC1CC1 Amb10603417 [1,0,0,1,0,0|2,0,0]=4 4931 B7R1.20 CC(=O)CC1CO1 Amb25718439 [1,0,0,1,0,0|1,0,0]=3 4932 B7R1.20 CC(=O)OC1CO1 Amb25261586 [1,0,0,1,0,0|2,0,0]=4 4933 B7R1.20 CC(O)CC1CO1 Amb25745084 [1,0,0,1,0,0|1,0,1]=4 4934 B7R1.20 CS(=O)CC1CO1 Amb25060906 [1,0,0,1,0,0|2,0,0]=4 4935 B7R1.20 CS(=O)C[C@H]1CO1 Amb24431713 [1,0,0,1,0,0|2,0,0]=4 4936 B7R1.20 C[C@@H](O)CC1CO1 Amb24644146 [1,0,0,1,0,0|1,0,1]=4 4937 B7R1.20 C[C@@H](O)C[C@@H]1CO1 Amb24630371 [1,0,0,1,0,0|1,0,1]=4 4938 B7R1.20 C[C@H](O)CC1CO1 Amb25687860 [1,0,0,1,0,0|1,0,1]=4 4939 B7R1.20 NC(=O)CC1CO1 Amb24654802 [1,0,0,1,0,0|1,0,0]=3 4940 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [1,0,0,1,0,0|2,0,0]=4 4941 B7R1.20 OC(=O)CC1CO1 Amb25244347 [1,0,0,1,0,0|0,0,0]=2 4942 B7R1.20 [O-][N+](=O)CC1CO1 Amb23589333 [1,0,0,1,0,0|1,0,1]=4 4943 B7R1.4 CC1CCSC1=O Amb25271791 [1,0,0,1,0,0|1,1,0]=4 4944 B7R1.4 CC1COCC1=O Amb24333426 [1,0,0,1,0,0|2,0,0]=4 4945 B7R1.4 CC1NCOC1=O Amb24409631 [1,0,0,1,0,0|2,0,0]=4 4946 B7R1.4 CC1OCCC1N Amb22058722 [1,0,0,1,0,0|1,0,1]=4 4947 B7R1.4 CC1SCOC1=O Amb25347819 [1,0,0,1,0,0|2,0,0]=4 4948 B7R1.4 CN1CCOC1=O Amb22347786 [1,0,0,1,0,0|2,0,0]=4 4949 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [1,0,0,1,0,0|2,0,0]=4 4950 B7R1.4 C[C@@H]1COC[C@@H]1N Amb25766097 [1,0,0,1,0,0|1,0,1]=4 4951 B7R1.4 C[C@@H]1COC[C@@H]1O Amb22886816 [1,0,0,1,0,0|1,0,1]=4 4952 B7R1.4 C[C@@H]1COC[C@H]1N Amb24353575 [1,0,0,1,0,0|1,0,1]=4 4953 B7R1.4 C[C@@H]1COC[C@H]1O Amb22886616 [1,0,0,1,0,0|1,0,1]=4 4954 B7R1.4 C[C@@H]1NCOC1=O Amb25273957 [1,0,0,1,0,0|2,0,0]=4 4955 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb22886254 [1,0,0,1,0,0|1,0,1]=4 4956 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb24629226 [1,0,0,1,0,0|1,0,1]=4 4957 B7R1.4 C[C@H]1C=CC[C@@H]1O Amb24630805 [1,0,0,1,0,0|2,0,0]=4 4958 B7R1.4 C[C@H]1COC[C@@H]1O Amb24609705 [1,0,0,1,0,0|1,0,1]=4 4959 B7R1.4 C[C@H]1OCC[C@@H]1N Amb24515056 [1,0,0,1,0,0|1,0,1]=4 4960 B7R1.4 C[C@H]1OCC[C@H]1N Amb25174385 [1,0,0,1,0,0|1,0,1]=4 4961 B7R1.4 NC1=CCOC1=O Amb22234102 [1,0,0,1,0,0|0,0,2]=4 4962 B7R1.4 NC1C=CCC1O Amb18639380 [1,0,0,1,0,0|1,0,0]=3 4963 B7R1.4 NC1CCCC1=O Amb17939050 [1,0,0,1,0,0|1,0,0]=3 4964 B7R1.4 NC1CCNC1=O Amb21955321 [1,0,0,1,0,0|1,0,0]=3 4965 B7R1.4 NC1CCOC1=O Amb22233082 [1,0,0,1,0,0|0,0,0]=2 4966 B7R1.4 NC1CNCC1O Amb22235661 [1,0,0,1,0,0|1,0,1]=4 4967 B7R1.4 NC1CNCC1O Amb22497199 [1,0,0,1,0,0|1,0,1]=4 4968 B7R1.4 NC1COCC1Br Amb24369528 [1,0,0,1,0,0|1,0,1]=4 4969 B7R1.4 NC1COCC1N Amb23590778 [1,0,0,1,0,0|1,0,1]=4 4970 B7R1.4 NC1COCC1O Amb18277417 [1,0,0,1,0,0|0,0,1]=3 4971 B7R1.4 NC1COCC1O Amb19515137 [1,0,0,1,0,0|0,0,1]=3 4972 B7R1.4 NC1CONC1=O Amb1865548 [1,0,0,1,0,0|1,0,0]=3 4973 B7R1.4 NC1CONC1O Amb24571000 [1,0,0,1,0,0|1,0,1]=4 4974 B7R1.4 NC1CSCC1=O Amb18202693 [1,0,0,1,0,0|1,1,0]=4 4975 B7R1.4 NC1NOCC1=O Amb25811419 [1,0,0,1,0,0|2,0,0]=4 4976 B7R1.4 N[C@@H]1C=CC[C@H]1O Amb24606664 [1,0,0,1,0,0|1,0,0]=3 4977 B7R1.4 N[C@@H]1CCCC1O Amb24347806 [1,0,0,1,0,0|1,0,1]=4 4978 B7R1.4 N[C@@H]1CCNC1=O Amb19515791 [1,0,0,1,0,0|1,0,0]=3 4979 B7R1.4 N[C@@H]1CCNC1=O Amb22745816 [1,0,0,1,0,0|1,0,0]=3 4980 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [1,0,0,1,0,0|0,0,0]=2 4981 B7R1.4 N[C@@H]1CCSC1=O Amb22745304 [1,0,0,1,0,0|0,1,0]=3 4982 B7R1.4 N[C@@H]1CCSC1=O Amb22750668 [1,0,0,1,0,0|0,1,0]=3 4983 B7R1.4 N[C@@H]1CNC[C@H]1O Amb24604330 [1,0,0,1,0,0|1,0,1]=4 4984 B7R1.4 N[C@@H]1COC[C@@H]1N Amb19515126 [1,0,0,1,0,0|1,0,1]=4 4985 B7R1.4 N[C@@H]1COC[C@@H]1N Amb22802084 [1,0,0,1,0,0|1,0,1]=4 4986 B7R1.4 N[C@@H]1COC[C@@H]1O Amb22748842 [1,0,0,1,0,0|0,0,1]=3 4987 B7R1.4 N[C@@H]1COC[C@@H]1O Amb22754535 [1,0,0,1,0,0|0,0,1]=3 4988 B7R1.4 N[C@@H]1COC[C@H]1N Amb22231694 [1,0,0,1,0,0|1,0,1]=4 4989 B7R1.4 N[C@@H]1COC[C@H]1N Amb22802083 [1,0,0,1,0,0|1,0,1]=4 4990 B7R1.4 N[C@@H]1COC[C@H]1O Amb17933202 [1,0,0,1,0,0|0,0,1]=3 4991 B7R1.4 N[C@@H]1COC[C@H]1O Amb22746728 [1,0,0,1,0,0|0,0,1]=3 4992 B7R1.4 N[C@@H]1COC[C@H]1O Amb24107553 [1,0,0,1,0,0|0,0,1]=3 4993 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb23482790 [1,0,0,1,0,0|0,1,1]=4 4994 B7R1.4 N[C@H]1C=COC1=O Amb25259750 [1,0,0,1,0,0|0,0,2]=4 4995 B7R1.4 N[C@H]1C=NC[C@@H]1N Amb25258941 [1,0,0,1,0,0|2,0,0]=4 4996 B7R1.4 N[C@H]1CCNC1=O Amb19887769 [1,0,0,1,0,0|1,0,0]=3 4997 B7R1.4 N[C@H]1CCNC1=O Amb23385346 [1,0,0,1,0,0|1,0,0]=3 4998 B7R1.4 N[C@H]1CCSC1=O Amb22362833 [1,0,0,1,0,0|0,1,0]=3 4999 B7R1.4 N[C@H]1CNC[C@@H]1O Amb25187848 [1,0,0,1,0,0|1,0,1]=4 5000 B7R1.4 N[C@H]1COC[C@@H]1O Amb22224915 [1,0,0,1,0,0|0,0,1]=3 5001 B7R1.4 N[C@H]1COC[C@H]1O Amb25259808 [1,0,0,1,0,0|0,0,1]=3 5002 B7R1.4 N[C@H]1CONC1O Amb24332118 [1,0,0,1,0,0|1,0,1]=4 5003 B7R1.4 N[C@H]1CSC[C@H]1O Amb25324268 [1,0,0,1,0,0|0,1,1]=4 5004 B7R1.4 O=C1CCCC1Br Amb16234114 [1,0,0,1,0,0|2,0,0]=4 5005 B7R1.4 O=C1CCCC1I Amb25756212 [1,0,0,1,0,0|2,0,0]=4 5006 B7R1.4 O=C1CCCC1O Amb17593081 [1,0,0,1,0,0|2,0,0]=4 5007 B7R1.4 O=C1CCC[C@H]1Br Amb25778341 [1,0,0,1,0,0|2,0,0]=4 5008 B7R1.4 O=C1CCC[C@H]1F Amb25834416 [1,0,0,1,0,0|2,0,0]=4 5009 B7R1.4 O=C1COCC1Br Amb24525921 [1,0,0,1,0,0|2,0,0]=4 5010 B7R1.4 O=C1NCCC1Br Amb20623055 [1,0,0,1,0,0|2,0,0]=4 5011 B7R1.4 O=C1NCCC1C Amb10603701 [1,0,0,1,0,0|2,0,0]=4 5012 B7R1.4 O=C1NCCC1F Amb25838145 [1,0,0,1,0,0|2,0,0]=4 5013 B7R1.4 O=C1NCCC1O Amb10603089 [1,0,0,1,0,0|2,0,0]=4 5014 B7R1.4 O=C1NCCC1S Amb18202686 [1,0,0,1,0,0|2,0,0]=4 5015 B7R1.4 O=C1NCC[C@@H]1O Amb10603274 [1,0,0,1,0,0|2,0,0]=4 5016 B7R1.4 O=C1NCC[C@@H]1S Amb25366927 [1,0,0,1,0,0|2,0,0]=4 5017 B7R1.4 O=C1NCC[C@H]1Cl Amb25331827 [1,0,0,1,0,0|2,0,0]=4 5018 B7R1.4 O=C1NCC[C@H]1F Amb24481058 [1,0,0,1,0,0|2,0,0]=4 5019 B7R1.4 O=C1NCC[C@H]1S Amb25304928 [1,0,0,1,0,0|2,0,0]=4 5020 B7R1.4 O=C1OCCC1C Amb16185414 [1,0,0,1,0,0|1,0,0]=3 5021 B7R1.4 O=C1OCCC1Cl Amb25065373 [1,0,0,1,0,0|1,0,0]=3 5022 B7R1.4 O=C1OCCC1I Amb24418518 [1,0,0,1,0,0|1,0,0]=3 5023 B7R1.4 O=C1OCCC1N Amb1151850 [1,0,0,1,0,0|0,0,0]=2 5024 B7R1.4 O=C1OCCC1N Amb17614991 [1,0,0,1,0,0|0,0,0]=2 5025 B7R1.4 O=C1OCCC1S Amb25146639 [1,0,0,1,0,0|1,0,0]=3 5026 B7R1.4 O=C1OCCN1N Amb10068971 [1,0,0,1,0,0|1,0,0]=3 5027 B7R1.4 O=C1OCC[C@@H]1N Amb10982617 [1,0,0,1,0,0|0,0,0]=2 5028 B7R1.4 O=C1OCC[C@H]1N Amb10601656 [1,0,0,1,0,0|0,0,0]=2 5029 B7R1.4 O=C1OCNC1Br Amb25299209 [1,0,0,1,0,0|2,0,0]=4 5030 B7R1.4 O=C1OCOC1Br Amb25237748 [1,0,0,1,0,0|2,0,0]=4 5031 B7R1.4 O=C1SCCC1N Amb1151877 [1,0,0,1,0,0|0,1,0]=3 5032 B7R1.4 O=C1SCC[C@@H]1Cl Amb25279498 [1,0,0,1,0,0|1,1,0]=4 5033 B7R1.4 OC1C=CCC1O Amb17593080 [1,0,0,1,0,0|2,0,0]=4 5034 B7R1.4 OC1CC=CC1Cl Amb25124733 [1,0,0,1,0,0|2,0,0]=4 5035 B7R1.4 OC1CCCC1N Amb13951342 [1,0,0,1,0,0|1,0,1]=4 5036 B7R1.4 OC1COCC1Br Amb25321008 [1,0,0,1,0,0|1,0,1]=4 5037 B7R1.4 OC1COCC1Cl Amb24479454 [1,0,0,1,0,0|1,0,1]=4 5038 B7R1.4 OC1COCC1I Amb24332672 [1,0,0,1,0,0|1,0,1]=4 5039 B7R1.4 O[C@@H]1CC=C[C@H]1Cl Amb24565726 [1,0,0,1,0,0|2,0,0]=4 5040 B7R1.4 O[C@@H]1CCCC1=O Amb25166028 [1,0,0,1,0,0|2,0,0]=4 5041 B7R1.4 O[C@@H]1CCC[C@@H]1N Amb10603107 [1,0,0,1,0,0|1,0,1]=4 5042 B7R1.4 O[C@@H]1CCC[C@H]1N Amb1993811 [1,0,0,1,0,0|1,0,1]=4 5043 B7R1.4 O[C@@H]1CCC[C@H]1N Amb1993922 [1,0,0,1,0,0|1,0,1]=4 5044 B7R1.4 O[C@@H]1CCNC1=O Amb22225343 [1,0,0,1,0,0|2,0,0]=4 5045 B7R1.4 O[C@@H]1COC[C@@H]1F Amb24600177 [1,0,0,1,0,0|1,0,1]=4 5046 B7R1.4 O[C@@H]1COC[C@@H]1O Amb22406017 [1,0,0,1,0,0|1,0,1]=4 5047 B7R1.4 O[C@@H]1COC[C@H]1Br Amb24356806 [1,0,0,1,0,0|1,0,1]=4 5048 B7R1.4 O[C@@H]1COC[C@H]1F Amb22886831 [1,0,0,1,0,0|1,0,1]=4 5049 B7R1.4 O[C@@H]1COC[C@H]1O Amb22231695 [1,0,0,1,0,0|1,0,1]=4 5050 B7R1.4 O[C@@H]1CSC[C@H]1N Amb1099355 [1,0,0,1,0,0|0,1,1]=4 5051 B7R1.4 O[C@H]1C=CC[C@H]1O Amb24622453 [1,0,0,1,0,0|2,0,0]=4 5052 B7R1.4 O[C@H]1C=NC[C@@H]1O Amb25026278 [1,0,0,1,0,0|2,0,0]=4 5053 B7R1.4 O[C@H]1C=NC[C@H]1O Amb25346333 [1,0,0,1,0,0|2,0,0]=4 5054 B7R1.4 O[C@H]1CCC[C@@H]1N Amb10604100 [1,0,0,1,0,0|1,0,1]=4 5055 B7R1.4 O[C@H]1CCC[C@H]1N Amb1993810 [1,0,0,1,0,0|1,0,1]=4 5056 B7R1.4 O[C@H]1CCC[C@H]1N Amb1993921 [1,0,0,1,0,0|1,0,1]=4 5057 B7R1.4 O[C@H]1COC[C@@H]1Br Amb24519174 [1,0,0,1,0,0|1,0,1]=4 5058 B7R1.4 O[C@H]1COC[C@@H]1F Amb25168929 [1,0,0,1,0,0|1,0,1]=4 5059 B7R1.4 O[C@H]1COC[C@@H]1N Amb10608341 [1,0,0,1,0,0|0,0,1]=3 5060 B7R1.4 O[C@H]1COC[C@@H]1O Amb17938167 [1,0,0,1,0,0|1,0,1]=4 5061 B7R1.4 O[C@H]1COC[C@H]1Cl Amb25321006 [1,0,0,1,0,0|1,0,1]=4 5062 B7R1.4 [NH3+]C1CCSC1=O Amb22045205 [1,0,0,1,0,0|0,1,1]=4 5063 B7R1.4 [NH3+]C1CCSC1=O Amb24112879 [1,0,0,1,0,0|0,1,1]=4 5064 B7R1.8 C=CC1CCC1O Amb25848177 [1,0,0,1,0,0|2,0,0]=4 5065 B7R1.8 CC1CNC1CO Amb25310037 [1,0,0,1,0,0|1,0,1]=4 5066 B7R1.8 CCC1OCC1=O Amb23456089 [1,0,0,1,0,0|2,0,0]=4 5067 B7R1.8 C[C@@H]1CN[C@@H]1CO Amb25230021 [1,0,0,1,0,0|1,0,1]=4 5068 B7R1.8 C[C@H]1CC[C@H]1C=O Amb25373249 [1,0,0,1,0,0|2,0,0]=4 5069 B7R1.8 OC1CNC1CO Amb25276544 [1,0,0,1,0,0|0,0,1]=3 5070 B7R1.8 OC1CSC1CO Amb25044422 [1,0,0,1,0,0|1,0,1]=4 5071 B7R1.8 OCC1CCC1=O Amb24722181 [1,0,0,1,0,0|2,0,0]=4 5072 B7R1.8 OC[C@H]1NCC1=O Amb25313229 [1,0,0,1,0,0|1,0,0]=3 5073 B7R1.8 O[C@@H]1CC[C@@H]1CO Amb25662759 [1,0,0,1,0,0|1,0,1]=4 5074 B7R1.8 O[C@@H]1CN[C@H]1CO Amb25663178 [1,0,0,1,0,0|0,0,1]=3 5075 B7R1.15 C=C1C(O)CC1=O Amb24731884 [1,0,0,1,0,0|1,0,1]=4 5076 B7R1.15 CC1C(C)CC1=O Amb24605096 [1,0,0,1,0,0|2,0,0]=4 5077 B7R1.15 CC1C(C)NC1=O Amb22364651 [1,0,0,1,0,0|2,0,0]=4 5078 B7R1.15 CC1CC(=O)N1N Amb24415255 [1,0,0,1,0,0|2,0,0]=4 5079 B7R1.15 CC1CC(O)C1N Amb24564236 [1,0,0,1,0,0|1,0,1]=4 5080 B7R1.15 CC1NC(=O)C1I Amb24504951 [1,0,0,1,0,0|2,0,0]=4 5081 B7R1.15 CC1NC(=O)C1O Amb24536600 [1,0,0,1,0,0|2,0,0]=4 5082 B7R1.15 CC1OC(=O)C1N Amb25169554 [1,0,0,1,0,0|0,0,0]=2 5083 B7R1.15 C[C@@H]1CC(=O)[C@@H]1Br Amb24656008 [1,0,0,1,0,0|2,0,0]=4 5084 B7R1.15 C[C@@H]1CC(=O)[C@H]1Br Amb24626651 [1,0,0,1,0,0|2,0,0]=4 5085 B7R1.15 C[C@@H]1NC(=O)[C@@H]1O Amb24632755 [1,0,0,1,0,0|2,0,0]=4 5086 B7R1.15 C[C@@H]1NC(=O)[C@H]1Cl Amb24746811 [1,0,0,1,0,0|2,0,0]=4 5087 B7R1.15 C[C@@H]1NC(=O)[C@H]1N Amb22388492 [1,0,0,1,0,0|1,0,0]=3 5088 B7R1.15 C[C@@H]1NC(=O)[C@H]1N Amb22757240 [1,0,0,1,0,0|1,0,0]=3 5089 B7R1.15 C[C@@H]1[C@H](C)CC1=O Amb25745705 [1,0,0,1,0,0|2,0,0]=4 5090 B7R1.15 C[C@H]1NC(=O)[C@H]1Br Amb25327771 [1,0,0,1,0,0|2,0,0]=4 5091 B7R1.15 C[C@H]1NC(=O)[C@H]1I Amb24561079 [1,0,0,1,0,0|2,0,0]=4 5092 B7R1.15 NC1C(S)NC1=O Amb24479821 [1,0,0,1,0,0|1,1,0]=4 5093 B7R1.17 CC1(O)CCC1N Amb24117490 [1,0,0,1,0,0|1,0,1]=4 5094 B7R1.17 C[C@@]1(O)CC[C@@H]1N Amb24694300 [1,0,0,1,0,0|1,0,1]=4 5095 B7R1.18 CC(=O)C1CCO1 Amb25745997 [1,0,0,1,0,0|2,0,0]=4 5096 B7R1.18 CC(=O)C1CCS1 Amb24105980 [1,0,0,1,0,0|2,0,0]=4 5097 B7R1.18 CC(O)C1CCN1 Amb25195548 [1,0,0,1,0,0|1,0,1]=4 5098 B7R1.18 NC(=N)[C@H]1CCN1 Amb24542766 [1,0,0,1,0,0|2,0,0]=4 5099 B7R1.18 NC(=O)C1CCN1 Amb22230240 [1,0,0,1,0,0|1,0,0]=3 5100 B7R1.18 NC(=O)C1CCN1 Amb22491865 [1,0,0,1,0,0|1,0,0]=3 5101 B7R1.18 NC(=O)C1CCO1 Amb24478900 [1,0,0,1,0,0|2,0,0]=4 5102 B7R1.18 O=C(Cl)C1COC1 Amb25201101 [1,0,0,1,0,0|2,0,0]=4 5103 B7R1.18 OC(=O)C1=CCC1 Amb17593068 [1,0,0,1,0,0|1,0,1]=4 5104 B7R1.18 OC(=O)C1CCN1 Amb2371568 [1,0,0,1,0,0|0,0,0]=2 5105 B7R1.18 OC(=O)C1CCO1 Amb2383526 [1,0,0,1,0,0|1,0,0]=3 5106 B7R1.18 OC(=O)C1CNC1 Amb2444164 [1,0,0,1,0,0|2,0,0]=4 5107 B7R1.18 OC(=O)C1CSC1 Amb20171470 [1,0,0,1,0,0|1,1,0]=4 5108 B7R1.19 CC(=O)C1(Br)CC1 Amb22498709 [1,0,0,1,0,0|2,0,0]=4 5109 B7R1.19 CC(=O)C1(C)CC1 Amb1161819 [1,0,0,1,0,0|2,0,0]=4 5110 B7R1.19 CC(=O)C1(Cl)CC1 Amb20671915 [1,0,0,1,0,0|2,0,0]=4 5111 B7R1.19 CC(=O)C1(F)CC1 Amb22388893 [1,0,0,1,0,0|2,0,0]=4 5112 B7R1.19 CC(=O)C1(N)CC1 Amb25279285 [1,0,0,1,0,0|1,0,0]=3 5113 B7R1.19 CC1(CC1)C(N)=O Amb19958822 [1,0,0,1,0,0|2,0,0]=4 5114 B7R1.19 CC1(CC1)C(N)=O Amb22752771 [1,0,0,1,0,0|2,0,0]=4 5115 B7R1.19 CC1(CO1)C(=O)O Amb17593087 [1,0,0,1,0,0|1,0,0]=3 5116 B7R1.19 CC1(CO1)C(N)=O Amb25261467 [1,0,0,1,0,0|2,0,0]=4 5117 B7R1.19 CC1(CS1)C(O)=O Amb24760846 [1,0,0,1,0,0|1,1,0]=4 5118 B7R1.19 C[C@@H](O)[C@]1(C)CO1 Amb24686435 [1,0,0,1,0,0|1,0,1]=4 5119 B7R1.19 C[C@@]1(CO1)C(O)=O Amb25785347 [1,0,0,1,0,0|1,0,0]=3 5120 B7R1.19 C[C@H](O)C1(C)CO1 Amb24719679 [1,0,0,1,0,0|1,0,1]=4 5121 B7R1.19 C[C@H](O)[C@]1(C)CO1 Amb25350322 [1,0,0,1,0,0|1,0,1]=4 5122 B7R1.19 C[C@]1(CO1)C(O)=O Amb25063884 [1,0,0,1,0,0|1,0,0]=3 5123 B7R1.19 ClC(=O)C1(C)CC1 Amb16230812 [1,0,0,1,0,0|2,0,0]=4 5124 B7R1.19 NC(=O)C1(Br)CC1 Amb22234538 [1,0,0,1,0,0|2,0,0]=4 5125 B7R1.19 NC(=O)C1(N)CC1 Amb20622292 [1,0,0,1,0,0|1,0,0]=3 5126 B7R1.19 NC(=O)C1(N)CC1 Amb22001522 [1,0,0,1,0,0|1,0,0]=3 5127 B7R1.19 NC(=O)C1(O)CC1 Amb25745829 [1,0,0,1,0,0|2,0,0]=4 5128 B7R1.19 NC(=S)C1(N)CC1 Amb24640491 [1,0,0,1,0,0|1,1,0]=4 5129 B7R1.19 NC1(CC1)C(=O)Cl Amb24565891 [1,0,0,1,0,0|1,0,0]=3 5130 B7R1.19 O=C(F)C1(F)CC1 Amb24600068 [1,0,0,1,0,0|2,0,0]=4 5131 B7R1.19 OC(=O)C1(Br)CC1 Amb19888922 [1,0,0,1,0,0|1,0,0]=3 5132 B7R1.19 OC(=O)C1(Cl)CC1 Amb25841916 [1,0,0,1,0,0|1,0,0]=3 5133 B7R1.19 OC(=O)C1(F)CC1 Amb22001836 [1,0,0,1,0,0|1,0,0]=3 5134 B7R1.22 C=CC(N)C1CC1 Amb25296753 [1,0,0,1,0,0|2,0,0]=4 5135 B7R1.22 C=CC(O)C1CO1 Amb25806064 [1,0,0,1,0,0|2,0,0]=4 5136 B7R1.22 CC(C=O)C1CC1 Amb25376838 [1,0,0,1,0,0|2,0,0]=4 5137 B7R1.22 C[C@@H](CO)[C@H]1CO1 Amb25257153 [1,0,0,1,0,0|1,0,1]=4 5138 B7R1.22 NC(CO)C1CC1 Amb18282445 [1,0,0,1,0,0|1,0,1]=4 5139 B7R1.22 NC(CO)C1CC1 Amb19374057 [1,0,0,1,0,0|1,0,1]=4 5140 B7R1.22 N[C@@H](CO)C1CC1 Amb24077521 [1,0,0,1,0,0|1,0,1]=4 5141 B7R1.22 N[C@@H](CO)C1CC1 Amb25798421 [1,0,0,1,0,0|1,0,1]=4 5142 B7R1.22 N[C@H](CO)C1CC1 Amb24077489 [1,0,0,1,0,0|1,0,1]=4 5143 B7R1.22 N[C@H](CO)C1CC1 Amb24568257 [1,0,0,1,0,0|1,0,1]=4 5144 B7R1.22 O=CC(=O)C1CO1 Amb25169500 [1,0,0,1,0,0|1,0,1]=4 5145 B7R1.22 O[C@@H](CO)[C@@H]1CO1 Amb25245465 [1,0,0,1,0,0|1,0,1]=4 5146 B7R1.23 CC1(Br)CC1C=O Amb25679179 [1,0,0,1,0,0|2,0,0]=4 5147 B7R1.23 CC1(C)OC1C=O Amb24724709 [1,0,0,1,0,0|2,0,0]=4 5148 B7R1.27 CC1(CC1O)CO Amb24699167 [1,0,0,1,0,0|1,0,1]=4 5149 B7R1.27 CC1CC1(C)C=O Amb25076193 [1,0,0,1,0,0|2,0,0]=4 5150 B7R1.27 CC1OC1(O)CO Amb25173824 [1,0,0,1,0,0|1,0,1]=4 5151 B7R1.27 C[C@@H]1C[C@@]1(C)C=O Amb24513212 [1,0,0,1,0,0|2,0,0]=4 5152 B7R1.27 C[C@H]1C[C@@]1(C)C=O Amb25366302 [1,0,0,1,0,0|2,0,0]=4 5153 B7R1.27 C[C@H]1C[C@]1(N)C=C Amb24560400 [1,0,0,1,0,0|2,0,0]=4 5154 B9R1.35 C=C1CNC(C1)C(O)=O Amb24594868 [0,0,0,1,0,1|1,0,1]=4 5155 B9R1.35 CC(=O)C1CCC(O)C1 Amb24364135 [0,0,0,1,0,1|2,0,0]=4 5156 B9R1.35 CC(C)C1CC(=O)NN1 Amb24071475 [0,0,0,1,0,1|2,0,0]=4 5157 B9R1.35 CC(C)C1NNC(=O)O1 Amb25241817 [0,0,0,1,0,1|2,0,0]=4 5158 B9R1.35 CC(C)N1CC(=O)ON1 Amb20247129 [0,0,0,1,0,1|2,0,0]=4 5159 B9R1.35 CC(C1COC(=O)N1)C Amb10071773 [0,0,0,1,0,1|2,0,0]=4 5160 B9R1.35 CC(O)C1CC(=O)CS1 Amb25087194 [0,0,0,1,0,1|2,0,0]=4 5161 B9R1.35 CC(O)C1CC(=O)OC1 Amb25739837 [0,0,0,1,0,1|1,0,0]=3 5162 B9R1.35 CC(O)C1CC(=O)SC1 Amb24703668 [0,0,0,1,0,1|1,1,0]=4 5163 B9R1.35 CC(O)C1CC(O)CN1 Amb24424058 [0,0,0,1,0,1|1,0,1]=4 5164 B9R1.35 CC(O)C1CCC(=O)N1 Amb24386014 [0,0,0,1,0,1|2,0,0]=4 5165 B9R1.35 CC(O)C1COC(=O)O1 Amb24592152 [0,0,0,1,0,1|1,0,0]=3 5166 B9R1.35 CC(O)c1cc(O)[n][nH]1 Amb25676645 [0,0,0,1,0,1|1,0,1]=4 5167 B9R1.35 CC1=CC(NO1)C(=O)Cl Amb25286220 [0,0,0,1,0,1|1,0,1]=4 5168 B9R1.35 CC1=NC(CO1)C(O)=O Amb20621597 [0,0,0,1,0,1|1,0,1]=4 5169 B9R1.35 CC1C=CC(O1)C(O)=O Amb18642586 [0,0,0,1,0,1|2,0,0]=4 5170 B9R1.35 CC1C=CC(S1)C(O)=O Amb18644111 [0,0,0,1,0,1|2,0,0]=4 5171 B9R1.35 CC1CC(=NO1)C(O)=O Amb25694020 [0,0,0,1,0,1|0,0,2]=4 5172 B9R1.35 CC1CC(CC1)C(O)=O Amb18642624 [0,0,0,1,0,1|2,0,0]=4 5173 B9R1.35 CC1CC(CN1)C(O)=O Amb18832566 [0,0,0,1,0,1|2,0,0]=4 5174 B9R1.35 CC1CC(CO1)C(=O)Cl Amb25832627 [0,0,0,1,0,1|2,0,0]=4 5175 B9R1.35 CC1CC(N=C1)C(O)=O Amb24650545 [0,0,0,1,0,1|1,0,1]=4 5176 B9R1.35 CC1CCC(N1)C(O)=O Amb18832572 [0,0,0,1,0,1|2,0,0]=4 5177 B9R1.35 CC1CCC(O1)C(=O)O Amb17593370 [0,0,0,1,0,1|2,0,0]=4 5178 B9R1.35 CC1CCC(S1)C(O)=O Amb25719281 [0,0,0,1,0,1|2,0,0]=4 5179 B9R1.35 CC1CCC([NH2+]1)C(O)=O Amb22372047 [0,0,0,1,0,1|2,0,0]=4 5180 B9R1.35 CC1CC[C@@H](N1)C(O)=O Amb22748252 [0,0,0,1,0,1|2,0,0]=4 5181 B9R1.35 CC1CNC(O1)C(O)=O Amb25737834 [0,0,0,1,0,1|1,0,0]=3 5182 B9R1.35 CC1CSC(S1)C(O)=O Amb24608602 [0,0,0,1,0,1|2,0,0]=4 5183 B9R1.35 CC1C[C@H](N=C1)C(O)=O Amb24394037 [0,0,0,1,0,1|1,0,1]=4 5184 B9R1.35 CC1N[C@@H](CS1)C(=O)O Amb16203706 [0,0,0,1,0,1|1,1,0]=4 5185 B9R1.35 CC=1CC(NC1)C(O)=O Amb25772613 [0,0,0,1,0,1|1,0,1]=4 5186 B9R1.35 C[C@@H](O)[C@@H]1C=CC(=O)O1 Amb25373835 [0,0,0,1,0,1|2,0,0]=4 5187 B9R1.35 C[C@@H](O)[C@@H]1CC(=O)NC1 Amb25251245 [0,0,0,1,0,1|2,0,0]=4 5188 B9R1.35 C[C@@H](O)[C@@H]1CCC(=O)N1 Amb25305303 [0,0,0,1,0,1|2,0,0]=4 5189 B9R1.35 C[C@@H](O)[C@H]1C=CC(=O)O1 Amb24691316 [0,0,0,1,0,1|2,0,0]=4 5190 B9R1.35 C[C@@H](O)[C@H]1CC(=O)OC1 Amb25215452 [0,0,0,1,0,1|1,0,0]=3 5191 B9R1.35 C[C@@H]1CC[C@@H](C1)C(=O)O Amb10843961 [0,0,0,1,0,1|2,0,0]=4 5192 B9R1.35 C[C@@H]1CC[C@@H](N1)C(O)=O Amb24399449 [0,0,0,1,0,1|2,0,0]=4 5193 B9R1.35 C[C@@H]1CC[C@@H](O1)C(O)=O Amb22886534 [0,0,0,1,0,1|2,0,0]=4 5194 B9R1.35 C[C@@H]1C[C@@H](NC1)C(O)=O Amb19887682 [0,0,0,1,0,1|1,0,0]=3 5195 B9R1.35 C[C@@H]1C[C@@H](NC1)C(O)=O Amb23439040 [0,0,0,1,0,1|1,0,0]=3 5196 B9R1.35 C[C@@H]1C[C@@H](ON1)C(O)=O Amb24680946 [0,0,0,1,0,1|2,0,0]=4 5197 B9R1.35 C[C@@H]1C[C@H](NC1)C(O)=O Amb22008683 [0,0,0,1,0,1|1,0,0]=3 5198 B9R1.35 C[C@@H]1C[C@H](NC1)C(O)=O Amb22752452 [0,0,0,1,0,1|1,0,0]=3 5199 B9R1.35 C[C@@H]1N[C@H](CS1)C(O)=O Amb25294278 [0,0,0,1,0,1|1,1,0]=4 5200 B9R1.35 C[C@H](O)[C@@H]1CCC(=O)O1 Amb25240058 [0,0,0,1,0,1|2,0,0]=4 5201 B9R1.35 C[C@H](O)[C@H]1CCC(=O)O1 Amb25236263 [0,0,0,1,0,1|2,0,0]=4 5202 B9R1.35 C[C@H](O)c1cc(O)[n][nH]1 Amb24363601 [0,0,0,1,0,1|1,0,1]=4 5203 B9R1.35 C[C@H]1CC[C@@H](N1)C(O)=O Amb25260830 [0,0,0,1,0,1|2,0,0]=4 5204 B9R1.35 C[C@H]1CC[C@H](C1)C(=O)O Amb10843955 [0,0,0,1,0,1|2,0,0]=4 5205 B9R1.35 C[C@H]1CC[C@H](N1)C(O)=O Amb24598417 [0,0,0,1,0,1|2,0,0]=4 5206 B9R1.35 C[C@H]1CC[C@H](O1)C(O)=O Amb24651587 [0,0,0,1,0,1|2,0,0]=4 5207 B9R1.35 C[C@H]1C[C@@H](NC1)C(O)=O Amb24752952 [0,0,0,1,0,1|1,0,0]=3 5208 B9R1.35 C[C@H]1C[C@H](CN1)C(O)=O Amb24715999 [0,0,0,1,0,1|2,0,0]=4 5209 B9R1.35 C[C@H]1C[C@H](NC1)C(O)=O Amb19888348 [0,0,0,1,0,1|1,0,0]=3 5210 B9R1.35 C[C@H]1N[C@@H](CS1)C(O)=O Amb25347352 [0,0,0,1,0,1|1,1,0]=4 5211 B9R1.35 C[C@H]1O[C@H](CS1)C(O)=O Amb24625718 [0,0,0,1,0,1|1,1,0]=4 5212 B9R1.35 NC(=O)C1CC(CN1)O Amb1152420 [0,0,0,1,0,1|1,0,0]=3 5213 B9R1.35 NC(=O)C1CC(F)CN1 Amb21963545 [0,0,0,1,0,1|2,0,0]=4 5214 B9R1.35 NC(=O)C1CCC(O)C1 Amb25230928 [0,0,0,1,0,1|2,0,0]=4 5215 B9R1.35 NC(=O)[C@@H]1CC(F)CN1 Amb22747998 [0,0,0,1,0,1|2,0,0]=4 5216 B9R1.35 NC(=O)[C@@H]1CC(F)CN1 Amb22748232 [0,0,0,1,0,1|2,0,0]=4 5217 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F Amb10808100 [0,0,0,1,0,1|2,0,0]=4 5218 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745766 [0,0,0,1,0,1|2,0,0]=4 5219 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745768 [0,0,0,1,0,1|2,0,0]=4 5220 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 Amb24061354 [0,0,0,1,0,1|1,0,0]=3 5221 B9R1.35 NC(=O)[C@@H]1C[C@H](F)CN1 Amb22745753 [0,0,0,1,0,1|2,0,0]=4 5222 B9R1.35 NC(=O)[C@H]1C[C@@H](F)CN1 Amb25256284 [0,0,0,1,0,1|2,0,0]=4 5223 B9R1.35 NC(=O)[C@H]1C[C@H](O)CN1 Amb24575802 [0,0,0,1,0,1|1,0,0]=3 5224 B9R1.35 NC(=O)[C@H]1C[C@H](O)CN1 Amb24586279 [0,0,0,1,0,1|1,0,0]=3 5225 B9R1.35 NC1CC(NC1)C(=O)O Amb10608922 [0,0,0,1,0,1|1,0,0]=3 5226 B9R1.35 NC1CC(OC1)C(O)=O Amb18642828 [0,0,0,1,0,1|2,0,0]=4 5227 B9R1.35 NC1CC(SC1)C(O)=O Amb18831415 [0,0,0,1,0,1|2,0,0]=4 5228 B9R1.35 NC1CCC(C1)C(=O)O Amb10066880 [0,0,0,1,0,1|2,0,0]=4 5229 B9R1.35 N[C@@H]1CC(CC1)C(O)=O Amb25700807 [0,0,0,1,0,1|2,0,0]=4 5230 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O Amb10066881 [0,0,0,1,0,1|2,0,0]=4 5231 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O Amb10070446 [0,0,0,1,0,1|1,0,0]=3 5232 B9R1.35 N[C@@H]1C[C@@H](CC1)C(O)=O Amb22746692 [0,0,0,1,0,1|2,0,0]=4 5233 B9R1.35 N[C@@H]1C[C@@H](NC1)C(O)=O Amb22008702 [0,0,0,1,0,1|1,0,0]=3 5234 B9R1.35 N[C@@H]1C[C@@H](OC1)C(O)=O Amb24548389 [0,0,0,1,0,1|2,0,0]=4 5235 B9R1.35 N[C@@H]1C[C@H](CC1)C(O)=O Amb22756038 [0,0,0,1,0,1|2,0,0]=4 5236 B9R1.35 N[C@@H]1C[C@H](NC1)C(=O)O Amb10603131 [0,0,0,1,0,1|1,0,0]=3 5237 B9R1.35 N[C@@H]1C[C@H](NC1)C(O)=O Amb22224945 [0,0,0,1,0,1|1,0,0]=3 5238 B9R1.35 N[C@@H]1C[C@H](OC1)C(O)=O Amb24117069 [0,0,0,1,0,1|2,0,0]=4 5239 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O Amb10066883 [0,0,0,1,0,1|2,0,0]=4 5240 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O Amb10070445 [0,0,0,1,0,1|1,0,0]=3 5241 B9R1.35 N[C@H]1C[C@@H](NC1)C(O)=O Amb19515889 [0,0,0,1,0,1|1,0,0]=3 5242 B9R1.35 N[C@H]1C[C@@H](OC1)C(O)=O Amb25691536 [0,0,0,1,0,1|2,0,0]=4 5243 B9R1.35 N[C@H]1C[C@H](NC1)C(=O)O Amb10603136 [0,0,0,1,0,1|1,0,0]=3 5244 B9R1.35 N[C@H]1C[C@H](NC1)C(O)=O Amb22386834 [0,0,0,1,0,1|1,0,0]=3 5245 B9R1.35 N[C@H]1C[C@H](OC1)C(O)=O Amb25799075 [0,0,0,1,0,1|2,0,0]=4 5246 B9R1.35 OC(=O)C1CC(Br)CN1 Amb25239348 [0,0,0,1,0,1|1,0,0]=3 5247 B9R1.35 OC(=O)C1CC(CN1)F Amb10608925 [0,0,0,1,0,1|1,0,0]=3 5248 B9R1.35 OC(=O)C1CC(CN1)S Amb10608928 [0,0,0,1,0,1|0,1,0]=3 5249 B9R1.35 OC(=O)C1CCC(F)C1 Amb22886545 [0,0,0,1,0,1|2,0,0]=4 5250 B9R1.35 OC(=O)C1CCC(F)N1 Amb24423850 [0,0,0,1,0,1|2,0,0]=4 5251 B9R1.35 OC(=O)C1CCC(I)C1 Amb23456141 [0,0,0,1,0,1|2,0,0]=4 5252 B9R1.35 OC(=O)C1C[C@H](F)CN1 Amb24598689 [0,0,0,1,0,1|1,0,0]=3 5253 B9R1.35 OC(=O)C=1CC(O)CN1 Amb25141429 [0,0,0,1,0,1|0,0,2]=4 5254 B9R1.35 OC(=O)[C@@H]1CC(=O)CN1 Amb19516117 [0,0,0,1,0,1|0,0,2]=4 5255 B9R1.35 OC(=O)[C@@H]1CC(=O)CN1 Amb22747440 [0,0,0,1,0,1|0,0,2]=4 5256 B9R1.35 OC(=O)[C@@H]1CC(F)CN1 Amb25123838 [0,0,0,1,0,1|1,0,0]=3 5257 B9R1.35 OC(=O)[C@@H]1CCC(F)N1 Amb25032254 [0,0,0,1,0,1|2,0,0]=4 5258 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)Br Amb10603137 [0,0,0,1,0,1|1,0,0]=3 5259 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)F Amb10603139 [0,0,0,1,0,1|1,0,0]=3 5260 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)I Amb10603140 [0,0,0,1,0,1|1,0,0]=3 5261 B9R1.35 OC(=O)[C@@H]1C[C@@H](Cl)CN1 Amb24582915 [0,0,0,1,0,1|1,0,0]=3 5262 B9R1.35 OC(=O)[C@@H]1C[C@@H](S)CN1 Amb22831348 [0,0,0,1,0,1|0,1,0]=3 5263 B9R1.35 OC(=O)[C@@H]1C[C@@H](S)CN1 Amb25245369 [0,0,0,1,0,1|0,1,0]=3 5264 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)Br Amb10603132 [0,0,0,1,0,1|1,0,0]=3 5265 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)F Amb16232298 [0,0,0,1,0,1|1,0,0]=3 5266 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)I Amb10603134 [0,0,0,1,0,1|1,0,0]=3 5267 B9R1.35 OC(=O)[C@@H]1C[C@H](F)CN1 Amb22757085 [0,0,0,1,0,1|1,0,0]=3 5268 B9R1.35 OC(=O)[C@H]1CC(=O)CN1 Amb25360885 [0,0,0,1,0,1|0,0,2]=4 5269 B9R1.35 OC(=O)[C@H]1C[C@@H](CN1)F Amb10067741 [0,0,0,1,0,1|1,0,0]=3 5270 B9R1.35 OC(=O)[C@H]1C[C@H](CN1)F Amb10839999 [0,0,0,1,0,1|1,0,0]=3 5271 B9R1.35 OC1=CC(NN1)C(O)=O Amb25224097 [0,0,0,1,0,1|1,0,1]=4 5272 B9R1.35 OC1CC(C=C1)C(O)=O Amb25078348 [0,0,0,1,0,1|1,0,1]=4 5273 B9R1.35 OC1CC(N=C1)C(O)=O Amb24083052 [0,0,0,1,0,1|0,0,2]=4 5274 B9R1.35 OC1CCC(C1)C(O)=O Amb21963572 [0,0,0,1,0,1|1,0,0]=3 5275 B9R1.35 OC1CNC(=C1)C(=O)O Amb16232008 [0,0,0,1,0,1|0,0,1]=3 5276 B9R1.35 OC1CNC(C1)C(=O)O Amb1151287 [0,0,0,1,0,1|0,0,0]=2 5277 B9R1.35 OC1CN[C@@H](C1)C(O)=O Amb25743296 [0,0,0,1,0,1|0,0,0]=2 5278 B9R1.35 OC1COC(C1)C(O)=O Amb18642869 [0,0,0,1,0,1|1,0,0]=3 5279 B9R1.35 OC1CSC(O1)C(=O)O Amb2432252 [0,0,0,1,0,1|1,0,0]=3 5280 B9R1.35 OC1NC(CS1)C(O)=O Amb25759113 [0,0,0,1,0,1|2,0,0]=4 5281 B9R1.35 O[C@@H]1CC[C@@H](C1)C(O)=O Amb22746073 [0,0,0,1,0,1|1,0,0]=3 5282 B9R1.35 O[C@@H]1CC[C@H](C1)C(O)=O Amb22746558 [0,0,0,1,0,1|1,0,0]=3 5283 B9R1.35 O[C@@H]1CC[C@H](N1)C(O)=O Amb24515622 [0,0,0,1,0,1|1,0,0]=3 5284 B9R1.35 O[C@@H]1CNC(C1)C(O)=O Amb25118054 [0,0,0,1,0,1|0,0,0]=2 5285 B9R1.35 O[C@@H]1CN[C@@H](C1)C(O)=O Amb22748218 [0,0,0,1,0,1|0,0,0]=2 5286 B9R1.35 O[C@@H]1CN[C@H](C1)C(=O)O Amb16230723 [0,0,0,1,0,1|0,0,0]=2 5287 B9R1.35 O[C@@H]1CO[C@@H](C1)C(O)=O Amb24501449 [0,0,0,1,0,1|1,0,0]=3 5288 B9R1.35 O[C@@H]1CO[C@H](C1)C(O)=O Amb24501448 [0,0,0,1,0,1|1,0,0]=3 5289 B9R1.35 O[C@@H]1CS[C@H](O1)C(O)=O Amb25288477 [0,0,0,1,0,1|1,0,0]=3 5290 B9R1.35 O[C@@H]1C[C@H](NC1)C(=O)Cl Amb25174893 [0,0,0,1,0,1|1,0,0]=3 5291 B9R1.35 O[C@H]1CNC(C1)C(O)=O Amb24682710 [0,0,0,1,0,1|0,0,0]=2 5292 B9R1.35 O[C@H]1CN[C@@H](C1)C(=O)O Amb1994991 [0,0,0,1,0,1|0,0,0]=2 5293 B9R1.35 O[C@H]1C[C@@H](NC1)C(=O)Cl Amb25175003 [0,0,0,1,0,1|1,0,0]=3 5294 B9R1.36 CC1(C)CC(Br)C(=O)O1 Amb24340074 [0,0,0,1,0,1|2,0,0]=4 5295 B9R1.36 CC1(C)CC(Cl)C(=O)O1 Amb24513845 [0,0,0,1,0,1|2,0,0]=4 5296 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb18124322 [0,0,0,1,0,1|1,0,0]=3 5297 B9R1.36 CC1(C)CC(O)C(=O)O1 Amb25245118 [0,0,0,1,0,1|2,0,0]=4 5298 B9R1.36 CC1(C)C[C@H](Cl)C(=O)O1 Amb25743067 [0,0,0,1,0,1|2,0,0]=4 5299 B9R1.36 CC1(C)C[C@H](N)C(=O)O1 Amb24476611 [0,0,0,1,0,1|1,0,0]=3 5300 B9R1.36 CC1CC(C)(C)OC1=O Amb24444118 [0,0,0,1,0,1|2,0,0]=4 5301 B9R1.36 CC1NC(C)(C)OC1=O Amb25824700 [0,0,0,1,0,1|2,0,0]=4 5302 B9R1.36 CC1OP(O)(=O)OC1C Amb25195066 [0,0,0,1,0,1|2,0,0]=4 5303 B9R1.36 C[C@@H]1NC(C)(C)OC1=O Amb25229559 [0,0,0,1,0,1|2,0,0]=4 5304 B9R1.36 N[C@@H]1CS(=O)(=O)C[C@@H]1O Amb22757918 [0,0,0,1,0,1|1,0,1]=4 5305 B9R1.36 N[C@@H]1CS(=O)(=O)C[C@H]1O Amb24107550 [0,0,0,1,0,1|1,0,1]=4 5306 B9R1.36 N[C@H]1C[S+]([O-])(=O)C[C@H]1O Amb17727759 [0,0,0,1,0,1|1,0,1]=4 5307 B9R1.36 O=C1OC(SC1C)(C)C Amb15691646 [0,0,0,1,0,1|2,0,0]=4 5308 B9R1.36 OC1CS(=O)(=O)CC1N Amb1420287 [0,0,0,1,0,1|1,0,1]=4 5309 B9R1.36 O[C@@H]1CS(=O)(=O)C[C@H]1N Amb2404841 [0,0,0,1,0,1|1,0,1]=4 5310 B9R1.36 O[C@H]1CS(=O)(=O)C[C@@H]1N Amb10608835 [0,0,0,1,0,1|1,0,1]=4 5311 B9R1.38 CC1(Br)OC(=O)CC1Br Amb25126951 [0,0,0,1,0,1|2,0,0]=4 5312 B9R1.38 CC1(C)OC(=O)CC1Br Amb25831430 [0,0,0,1,0,1|2,0,0]=4 5313 B9R1.38 CC1(C)OC(=O)CC1Cl Amb24552388 [0,0,0,1,0,1|2,0,0]=4 5314 B9R1.38 CC1(C)OC(=O)CC1O Amb25198591 [0,0,0,1,0,1|2,0,0]=4 5315 B9R1.38 CC1(C)OC(=O)N=C1N Amb23515141 [0,0,0,1,0,1|1,0,1]=4 5316 B9R1.38 CC1(C)OC(=O)NC1N Amb24561447 [0,0,0,1,0,1|1,0,0]=3 5317 B9R1.38 CC1CC(N)P(O)(=O)O1 Amb25843150 [0,0,0,1,0,1|1,0,0]=3 5318 B9R1.38 CC1NC(=O)CC1(C)O Amb25233455 [0,0,0,1,0,1|2,0,0]=4 5319 B9R1.38 C[C@@H]1NC(=O)C[C@@]1(C)O Amb25340649 [0,0,0,1,0,1|2,0,0]=4 5320 B9R1.38 C[C@@H]1NC(=O)C[C@]1(C)O Amb24585121 [0,0,0,1,0,1|2,0,0]=4 5321 B9R1.38 C[C@@H]1NC(=O)OC1(C)C Amb24553743 [0,0,0,1,0,1|2,0,0]=4 5322 B9R1.38 C[C@H]1NC(=O)OC1(C)C Amb25268161 [0,0,0,1,0,1|2,0,0]=4 5323 B9R1.44 CC1C[C@]1(N)CC(O)=O Amb25844887 [0,0,0,1,0,1|1,0,0]=3 5324 B9R1.44 C[C@@H]1C[C@@]1(N)CC(O)=O Amb24540980 [0,0,0,1,0,1|1,0,0]=3 5325 B9R1.45 C=C1CC1C(N)C(O)=O Amb24117258 [0,0,0,1,0,1|1,0,1]=4 5326 B9R1.45 CC(C1CC1C)C(O)=O Amb25708709 [0,0,0,1,0,1|2,0,0]=4 5327 B9R1.45 NC([C@H]1C[C@@H]1N)C(O)=O Amb25245366 [0,0,0,1,0,1|1,0,0]=3 5328 B9R1.55 CC(C)C1NC(=O)C1N Amb18832616 [0,0,0,1,0,1|2,0,0]=4 5329 B9R1.55 CC(C)C1OC(=O)C1O Amb25680475 [0,0,0,1,0,1|2,0,0]=4 5330 B9R1.55 CC(O)C1NC(=O)C1O Amb24557165 [0,0,0,1,0,1|2,0,0]=4 5331 B9R1.55 CC(O)[C@@H]1NC(=O)[C@@H]1O Amb24515157 [0,0,0,1,0,1|2,0,0]=4 5332 B9R1.55 CC1C(CC1C)C(O)=O Amb23456159 [0,0,0,1,0,1|2,0,0]=4 5333 B9R1.55 CC1C(OC1=O)C(C)O Amb25177629 [0,0,0,1,0,1|1,0,0]=3 5334 B9R1.55 C[C@H]1[C@@H](C[C@H]1C)C(O)=O Amb24745807 [0,0,0,1,0,1|2,0,0]=4 5335 B9R1.55 C[C@H]1[C@H](C[C@@H]1C)C(O)=O Amb24629706 [0,0,0,1,0,1|2,0,0]=4 5336 B9R1.55 N[C@@H]1[C@H](C[C@@H]1O)C(O)=O Amb24514844 [0,0,0,1,0,1|0,0,0]=2 5337 B9R1.67 CC(=O)N[C@@H]1CC[C@H]1O Amb25297958 [0,0,0,1,0,1|2,0,0]=4 5338 B9R1.67 CC(=O)OC1CCC1O Amb25740537 [0,0,0,1,0,1|2,0,0]=4 5339 B9R1.67 CC1CCC1CC(O)=O Amb24466547 [0,0,0,1,0,1|2,0,0]=4 5340 B9R1.67 N[C@H]1CC[C@@H]1CC(O)=O Amb24700074 [0,0,0,1,0,1|2,0,0]=4 5341 B9R1.69 CC1=CC(=O)OC[C@@H]1O Amb25135034 [0,0,0,1,0,1|1,0,1]=4 5342 B9R1.69 CC1=CC(=O)OC[C@H]1O Amb24458563 [0,0,0,1,0,1|1,0,1]=4 5343 B9R1.69 CC1CC(=O)CCC1O Amb20171463 [0,0,0,1,0,1|2,0,0]=4 5344 B9R1.69 CC1CC(N)C(=O)CC1 Amb18278099 [0,0,0,1,0,1|2,0,0]=4 5345 B9R1.69 CC1CC(N)C(=O)NC1 Amb23586257 [0,0,0,1,0,1|2,0,0]=4 5346 B9R1.69 CC1CC(O)CCC1=O Amb25086312 [0,0,0,1,0,1|2,0,0]=4 5347 B9R1.69 CC1CC(O)CNC1=O Amb25068458 [0,0,0,1,0,1|2,0,0]=4 5348 B9R1.69 CC1COC(=O)C(C)C1 Amb24354559 [0,0,0,1,0,1|2,0,0]=4 5349 B9R1.69 CC1COC(=O)CC1O Amb25781910 [0,0,0,1,0,1|2,0,0]=4 5350 B9R1.69 CC1NC(=O)CCC1O Amb22229985 [0,0,0,1,0,1|2,0,0]=4 5351 B9R1.69 CC1OC(=O)CCC1O Amb24524239 [0,0,0,1,0,1|2,0,0]=4 5352 B9R1.69 CC1OC(O)CCC1=O Amb25050192 [0,0,0,1,0,1|2,0,0]=4 5353 B9R1.69 C[C@@H]1NC(=O)CC[C@@H]1O Amb25081565 [0,0,0,1,0,1|2,0,0]=4 5354 B9R1.69 C[C@@H]1NC(=O)CC[C@H]1O Amb24710524 [0,0,0,1,0,1|2,0,0]=4 5355 B9R1.69 C[C@H]1CC(=O)CC[C@@H]1O Amb25202720 [0,0,0,1,0,1|2,0,0]=4 5356 B9R1.69 C[C@H]1COC(=O)C[C@H]1O Amb24516166 [0,0,0,1,0,1|2,0,0]=4 5357 B9R1.69 C[C@H]1NC(=O)CC[C@H]1O Amb24598792 [0,0,0,1,0,1|2,0,0]=4 5358 B9R1.69 C[C@H]1OC(=O)CC[C@@H]1O Amb25350343 [0,0,0,1,0,1|2,0,0]=4 5359 B9R1.69 NC1CC(O)CNC1=O Amb25076949 [0,0,0,1,0,1|1,0,0]=3 5360 B9R1.69 NC1NC(=O)NCC1Cl Amb25032194 [0,0,0,1,0,1|2,0,0]=4 5361 B9R1.69 NC1NC(=O)NCC1F Amb25682328 [0,0,0,1,0,1|2,0,0]=4 5362 B9R1.69 NC1NC(=O)NCC1I Amb24752319 [0,0,0,1,0,1|2,0,0]=4 5363 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22745558 [0,0,0,1,0,1|1,0,0]=3 5364 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22755435 [0,0,0,1,0,1|1,0,0]=3 5365 B9R1.69 N[C@H]1C[C@@H](O)CNC1=O Amb25277394 [0,0,0,1,0,1|1,0,0]=3 5366 B9R1.69 OC1CC(=O)CCC1O Amb24384658 [0,0,0,1,0,1|2,0,0]=4 5367 B9R1.69 OC1CNC(=O)CC1O Amb25090826 [0,0,0,1,0,1|2,0,0]=4 5368 B9R1.69 OC1COC(=O)CC1O Amb25057673 [0,0,0,1,0,1|1,0,0]=3 5369 B9R1.69 O[C@@H]1CNC(=O)C[C@@H]1O Amb24517387 [0,0,0,1,0,1|2,0,0]=4 5370 B9R1.69 O[C@H]1CNC(=O)C(O)C1 Amb24382736 [0,0,0,1,0,1|2,0,0]=4 5371 B9R1.69 O[C@H]1CNC(=O)C[C@H]1O Amb25211306 [0,0,0,1,0,1|2,0,0]=4 5372 B9R1.112 CC(SC1CC1)C(O)=O Amb25337757 [0,0,0,1,0,1|2,0,0]=4 5373 B9R1.112 C[C@@H](NC1CC1)C(O)=O Amb24398132 [0,0,0,1,0,1|2,0,0]=4 5374 B9R1.112 NC(CC1CC1)C(N)=O Amb25767604 [0,0,0,1,0,1|2,0,0]=4 5375 B9R1.112 NC(CC1CC1)C(O)=O Amb23399727 [0,0,0,1,0,1|1,0,0]=3 5376 B9R1.112 NC(CC1CO1)C(O)=O Amb25800055 [0,0,0,1,0,1|0,0,0]=2 5377 B9R1.112 N[C@@H](CC1CC1)C(N)=O Amb25317927 [0,0,0,1,0,1|2,0,0]=4 5378 B9R1.112 N[C@@H](CC1CC1)C(O)=O Amb24329024 [0,0,0,1,0,1|1,0,0]=3 5379 B9R1.112 N[C@@H](CC1CO1)C(O)=O Amb25709170 [0,0,0,1,0,1|0,0,0]=2 5380 B9R1.112 N[C@H](CC1CC1)C(N)=O Amb24410138 [0,0,0,1,0,1|2,0,0]=4 5381 B9R1.112 OC(=O)C(S)CC1CC1 Amb18296302 [0,0,0,1,0,1|2,0,0]=4 5382 B9R1.112 OC(=O)[C@H](Br)CC1CC1 Amb24480301 [0,0,0,1,0,1|2,0,0]=4 5383 B9R1.112 OC(CC1CC1)C(O)=O Amb25082516 [0,0,0,1,0,1|2,0,0]=4 5384 B9R1.112 O[C@@H](CC1CC1)C(O)=O Amb23401512 [0,0,0,1,0,1|2,0,0]=4 5385 B9R1.137 NC(CC(N)=O)C1CC1 Amb18988331 [0,0,0,1,0,1|2,0,0]=4 5386 B9R1.137 NC(CC(N)=O)C1CC1 Amb19307935 [0,0,0,1,0,1|2,0,0]=4 5387 B9R1.137 N[C@H](CC(N)=O)C1CC1 Amb25259754 [0,0,0,1,0,1|2,0,0]=4 5388 B9R1.137 N[C@H](CC(O)=O)C1CC1 Amb24349802 [0,0,0,1,0,1|1,0,0]=3 5389 B9R1.137 OC(C1CC1)CC(=O)O Amb17231863 [0,0,0,1,0,1|2,0,0]=4 5390 B9R1.137 OC(CC(O)=O)C1CO1 Amb25854287 [0,0,0,1,0,1|1,0,0]=3 5391 B9R1.137 O[C@H](CC(O)=O)C1CC1 Amb25367343 [0,0,0,1,0,1|2,0,0]=4 5392 B9R1.137 [O-]C(=O)C[C@@H](O)[C@H]1CO1 Amb25302277 [0,0,0,1,0,1|1,0,1]=4 5393 B9R1.139 CC1(C)C(Cl)C1C(O)=O Amb25772915 [0,0,0,1,0,1|2,0,0]=4 5394 B9R1.139 CC1(C)[C@@H](Br)[C@H]1C(O)=O Amb24593888 [0,0,0,1,0,1|2,0,0]=4 5395 B9R1.139 CC1(C)[C@H](Cl)[C@@H]1C(O)=O Amb24674137 [0,0,0,1,0,1|2,0,0]=4 5396 B9R1.139 CC1C(C(O)=O)C1(C)C Amb25296484 [0,0,0,1,0,1|2,0,0]=4 5397 B9R1.152 CC(Cl)C1(C)CC(=O)O1 Amb25701611 [0,0,0,1,0,1|2,0,0]=4 5398 B9R1.152 CC1CC(C)(C1)C(O)=O Amb23448860 [0,0,0,1,0,1|2,0,0]=4 5399 B9R1.152 CC1CC(N)(C1)C(O)=O Amb25821754 [0,0,0,1,0,1|1,0,0]=3 5400 B9R1.152 CC1CC(O)(C1)C(O)=O Amb24522784 [0,0,0,1,0,1|2,0,0]=4 5401 B9R1.152 C[C@@]1(C[C@@H](N)C1)C(O)=O Amb23440223 [0,0,0,1,0,1|2,0,0]=4 5402 B9R1.152 C[C@@]1(C[C@@H](N)C1)C(O)=O Amb24730954 [0,0,0,1,0,1|2,0,0]=4 5403 B9R1.152 C[C@@]1(C[C@H](N)C1)C(O)=O Amb23439475 [0,0,0,1,0,1|2,0,0]=4 5404 B9R1.152 C[C@]1(C[C@@H](N)C1)C(O)=O Amb25275111 [0,0,0,1,0,1|2,0,0]=4 5405 B9R1.152 NC1CC(F)(C1)C(O)=O Amb25784332 [0,0,0,1,0,1|2,0,0]=4 5406 B9R1.152 N[C@@]1(C[C@H](F)C1)C(O)=O Amb22746505 [0,0,0,1,0,1|1,0,0]=3 5407 B9R1.152 N[C@]1(C[C@@H](O)C1)C(O)=O Amb25297893 [0,0,0,1,0,1|0,0,0]=2 5408 B9R1.161 CC(C)C1CC1C(O)=O Amb18285139 [0,0,0,1,0,1|2,0,0]=4 5409 B9R1.161 CC(C)[C@@H]1O[C@@H]1C(O)=O Amb24546994 [0,0,0,1,0,1|2,0,0]=4 5410 B9R1.161 CC(C)[C@H]1O[C@@H]1C(O)=O Amb25229035 [0,0,0,1,0,1|2,0,0]=4 5411 B9R1.161 CC(O)C1OC1C(O)=O Amb25227852 [0,0,0,1,0,1|1,0,0]=3 5412 B9R1.161 C[C@@H](O)[C@H]1O[C@@H]1C(O)=O Amb25224671 [0,0,0,1,0,1|1,0,0]=3 5413 B9R1.161 C[C@H](O)[C@@H]1O[C@@H]1C(O)=O Amb25368573 [0,0,0,1,0,1|1,0,0]=3 5414 B9R1.164 CC(=O)C1CC(C)(O)C1 Amb25773446 [0,0,0,1,0,1|2,0,0]=4 5415 B9R1.164 CC(=O)[C@@H]1C[C@@](C)(O)C1 Amb25320013 [0,0,0,1,0,1|2,0,0]=4 5416 B9R1.164 CC(=O)[C@@H]1C[C@](C)(O)C1 Amb25735730 [0,0,0,1,0,1|2,0,0]=4 5417 B9R1.164 CC1(C)CC(N1)C(O)=O Amb24117447 [0,0,0,1,0,1|1,0,0]=3 5418 B9R1.164 CC1(F)CC(C1)C(O)=O Amb23439467 [0,0,0,1,0,1|2,0,0]=4 5419 B9R1.164 CC1(O)CC(C1)C(O)=O Amb19958862 [0,0,0,1,0,1|1,0,0]=3 5420 B9R1.164 C[C@@]1(O)C[C@@H](C1)C(O)=O Amb23440037 [0,0,0,1,0,1|1,0,0]=3 5421 B9R1.164 C[C@@]1(O)C[C@H](C1)C(O)=O Amb23440038 [0,0,0,1,0,1|1,0,0]=3 5422 B9R1.169 CC1(C)CC1(C)C(O)=O Amb25793545 [0,0,0,1,0,1|2,0,0]=4 5423 B9R1.169 CC1(C)CC1(N)C(N)=O Amb24741207 [0,0,0,1,0,1|2,0,0]=4 5424 B9R1.169 CC1(OC1(C)O)C(C)=O Amb24636952 [0,0,0,1,0,1|2,0,0]=4 5425 B9R1.169 NC1(CC1(F)F)C(O)=O Amb25233043 [0,0,0,1,0,1|2,0,0]=4 5426 B9R1.169 N[C@]1(CC1(F)F)C(O)=O Amb25097067 [0,0,0,1,0,1|2,0,0]=4 5427 B9R1.170 CC1(C)CC1CC(O)=O Amb25145962 [0,0,0,1,0,1|2,0,0]=4 5428 B9R1.170 CC1(C)O[C@H]1CC(O)=O Amb25719083 [0,0,0,1,0,1|2,0,0]=4 5429 B9R1.3 CC1C(O)CC=CC1=O Amb25759156 [0,1,0,1,0,0|2,0,0]=4 5430 B9R1.3 CC1C(O)CCOC1=O Amb24592874 [0,1,0,1,0,0|1,0,0]=3 5431 B9R1.3 CC1CCNC(=O)C1N Amb22229171 [0,1,0,1,0,0|2,0,0]=4 5432 B9R1.3 CC1CCOC(=O)C1O Amb25369401 [0,1,0,1,0,0|2,0,0]=4 5433 B9R1.3 CC1CCOC(=O)[C@H]1O Amb25315194 [0,1,0,1,0,0|2,0,0]=4 5434 B9R1.3 CC1OC=CC(=O)C1O Amb24633292 [0,1,0,1,0,0|2,0,0]=4 5435 B9R1.3 CC1OCCC(=O)C1O Amb24723617 [0,1,0,1,0,0|2,0,0]=4 5436 B9R1.3 C[C@H]1CCOC(=O)[C@H]1O Amb25239425 [0,1,0,1,0,0|2,0,0]=4 5437 B9R1.3 C[C@H]1OC=CC(=O)[C@@H]1O Amb24587292 [0,1,0,1,0,0|2,0,0]=4 5438 B9R1.3 C[C@H]1[C@@H](O)CCCC1=O Amb24737440 [0,1,0,1,0,0|2,0,0]=4 5439 B9R1.3 NC1C(O)CCCC1O Amb18642840 [0,1,0,1,0,0|1,0,1]=4 5440 B9R1.3 NC1C(O)CCNC1=O Amb24529078 [0,1,0,1,0,0|1,0,0]=3 5441 B9R1.3 NC1[C@H](O)CCC[C@H]1O Amb25232667 [0,1,0,1,0,0|1,0,1]=4 5442 B9R1.3 N[C@@H]1[C@@H](O)CCNC1=O Amb25220585 [0,1,0,1,0,0|1,0,0]=3 5443 B9R1.3 OC1C(O)COC=C1Br Amb24742627 [0,1,0,1,0,0|2,0,0]=4 5444 B9R1.3 OC1CCCC(=O)C1Br Amb25216961 [0,1,0,1,0,0|2,0,0]=4 5445 B9R1.3 OC1CCCC(=O)C1Cl Amb25138773 [0,1,0,1,0,0|2,0,0]=4 5446 B9R1.3 OC1CCNC(=O)C1Cl Amb23440466 [0,1,0,1,0,0|2,0,0]=4 5447 B9R1.3 OC1CCNC(=O)C1O Amb24712104 [0,1,0,1,0,0|2,0,0]=4 5448 B9R1.3 OC1CCOC(=O)C1O Amb24735003 [0,1,0,1,0,0|1,0,0]=3 5449 B9R1.3 OC1NCNC(=O)C1Cl Amb25143831 [0,1,0,1,0,0|2,0,0]=4 5450 B9R1.3 OC1NCNC(=O)C1I Amb25107725 [0,1,0,1,0,0|2,0,0]=4 5451 B9R1.3 O[C@@H]1CCCC(=O)[C@@H]1O Amb24706773 [0,1,0,1,0,0|2,0,0]=4 5452 B9R1.3 O[C@@H]1CCCC(=O)[C@H]1Cl Amb24591761 [0,1,0,1,0,0|2,0,0]=4 5453 B9R1.3 O[C@@H]1[C@H](O)COC=C1Br Amb24632527 [0,1,0,1,0,0|2,0,0]=4 5454 B9R1.3 O[C@H]1CCCC(=O)[C@H]1O Amb25191514 [0,1,0,1,0,0|2,0,0]=4 5455 B9R1.37 CC1C(Br)C(C)OC1=O Amb24678811 [0,1,0,1,0,0|2,0,0]=4 5456 B9R1.37 CC1C(C)C(O)OC1=O Amb24705671 [0,1,0,1,0,0|1,0,0]=3 5457 B9R1.37 CC1C(C)OC(=O)C1=C Amb24481883 [0,1,0,1,0,0|2,0,0]=4 5458 B9R1.37 CC1C(N)C(=O)OC1=O Amb24549009 [0,1,0,1,0,0|0,0,1]=3 5459 B9R1.37 CC1C(O)C(=O)OC1C Amb24748283 [0,1,0,1,0,0|1,0,1]=4 5460 B9R1.37 CC1C(O)C(C)OC1=O Amb25056081 [0,1,0,1,0,0|1,0,0]=3 5461 B9R1.37 CC1C=C(O)C(=O)C1C Amb25031643 [0,1,0,1,0,0|2,0,0]=4 5462 B9R1.37 CC1OC(=O)C(=O)C1C Amb24360322 [0,1,0,1,0,0|1,0,1]=4 5463 B9R1.37 CC1OC(=O)C(Br)C1O Amb25695369 [0,1,0,1,0,0|1,0,0]=3 5464 B9R1.37 CC1OC(=O)C(N)=C1O Amb24339304 [0,1,0,1,0,0|0,0,2]=4 5465 B9R1.37 CC1OC(=O)C(N)C1=N Amb24580975 [0,1,0,1,0,0|1,0,1]=4 5466 B9R1.37 CC1OC(=O)C(N)C1O Amb25120313 [0,1,0,1,0,0|0,0,0]=2 5467 B9R1.37 CC1OC(=O)C(O)C1O Amb25137171 [0,1,0,1,0,0|1,0,0]=3 5468 B9R1.37 CC1OC(=O)N(C)C1O Amb24502365 [0,1,0,1,0,0|2,0,0]=4 5469 B9R1.37 CC=1OC(=O)C(O)C1O Amb25769590 [0,1,0,1,0,0|1,0,1]=4 5470 B9R1.37 CN1C[C@H](O)[C@@H](O)C1=O Amb24738041 [0,1,0,1,0,0|2,0,0]=4 5471 B9R1.37 C[C@@H]1CN(O)C(=O)[C@@H]1N Amb22747095 [0,1,0,1,0,0|1,0,0]=3 5472 B9R1.37 C[C@@H]1CN(O)C(=O)[C@H]1N Amb24678122 [0,1,0,1,0,0|1,0,0]=3 5473 B9R1.37 C[C@@H]1OC(=O)C(O)=C1O Amb25332813 [0,1,0,1,0,0|1,0,1]=4 5474 B9R1.37 C[C@@H]1OC(=O)C(O)C1O Amb24605729 [0,1,0,1,0,0|1,0,0]=3 5475 B9R1.37 C[C@@H]1OC(=O)[C@@H](O)[C@H]1O Amb25261892 [0,1,0,1,0,0|1,0,0]=3 5476 B9R1.37 C[C@@H]1OC(=O)[C@H](O)[C@@H]1O Amb25327544 [0,1,0,1,0,0|1,0,0]=3 5477 B9R1.37 C[C@@H]1OC(=O)[C@H](O)[C@H]1O Amb24714713 [0,1,0,1,0,0|1,0,0]=3 5478 B9R1.37 C[C@@H]1[C@@H](N)C(=O)O[C@H]1C Amb24575237 [0,1,0,1,0,0|1,0,0]=3 5479 B9R1.37 C[C@@H]1[C@@H](O)[C@@H](C)OC1=O Amb24686935 [0,1,0,1,0,0|1,0,0]=3 5480 B9R1.37 C[C@@H]1[C@H](N)C(=O)O[C@@H]1C Amb24606913 [0,1,0,1,0,0|1,0,0]=3 5481 B9R1.37 C[C@@H]1[C@H](O)C(=O)O[C@@H]1C Amb24592551 [0,1,0,1,0,0|1,0,1]=4 5482 B9R1.37 C[C@@H]1[C@H](O)[C@@H](C)OC1=O Amb25343889 [0,1,0,1,0,0|1,0,0]=3 5483 B9R1.37 C[C@H]1C=C(O)C(=O)[C@@H]1C Amb24583035 [0,1,0,1,0,0|2,0,0]=4 5484 B9R1.37 C[C@H]1CN(O)C(=O)[C@@H]1N Amb24587752 [0,1,0,1,0,0|1,0,0]=3 5485 B9R1.37 C[C@H]1OC(=N)[C@H](O)[C@@H]1O Amb24515434 [0,1,0,1,0,0|2,0,0]=4 5486 B9R1.37 C[C@H]1OC(=O)C(=C)[C@@H]1O Amb25332246 [0,1,0,1,0,0|1,0,1]=4 5487 B9R1.37 C[C@H]1OC(=O)C(=O)C1C Amb24748953 [0,1,0,1,0,0|1,0,1]=4 5488 B9R1.37 C[C@H]1OC(=O)C(Br)[C@@H]1O Amb25179050 [0,1,0,1,0,0|1,0,0]=3 5489 B9R1.37 C[C@H]1OC(=O)C(O)C1O Amb24527858 [0,1,0,1,0,0|1,0,0]=3 5490 B9R1.37 C[C@H]1OC(=O)[C@@H](N)[C@@H]1O Amb24561377 [0,1,0,1,0,0|0,0,0]=2 5491 B9R1.37 C[C@H]1[C@@H](N)C(=O)O[C@@H]1C Amb25259190 [0,1,0,1,0,0|1,0,0]=3 5492 B9R1.37 C[C@H]1[C@@H](O)[C@H](C)OC1=O Amb24520333 [0,1,0,1,0,0|1,0,0]=3 5493 B9R1.37 C[C@H]1[C@H](N)C(=O)OC1C Amb24585127 [0,1,0,1,0,0|1,0,0]=3 5494 B9R1.37 C[C@H]1[C@H](O)[C@@H](C)NC1=O Amb25203685 [0,1,0,1,0,0|2,0,0]=4 5495 B9R1.37 C[C@H]1[C@H](O)[C@@H](C)OC1=O Amb25235586 [0,1,0,1,0,0|1,0,0]=3 5496 B9R1.37 C[C@H]1[C@H](O)[C@H](C)OC1=O Amb25176668 [0,1,0,1,0,0|1,0,0]=3 5497 B9R1.37 NC1C(O)CC(N)C1O Amb25779370 [0,1,0,1,0,0|1,0,1]=4 5498 B9R1.37 OC1C(O)C(=O)OC1=O Amb25188995 [0,1,0,1,0,0|1,0,1]=4 5499 B9R1.37 OC1OC(=O)C(Br)C1Br Amb21811590 [0,1,0,1,0,0|2,0,0]=4 5500 B9R1.37 OC1OC(=O)C(O)C1O Amb24419120 [0,1,0,1,0,0|1,0,0]=3 5501 B9R1.41 CC(=C)C1CNCC1O Amb24568954 [0,1,0,1,0,0|2,0,0]=4 5502 B9R1.41 CC(=C)[C@H]1CNC[C@@H]1O Amb25206231 [0,1,0,1,0,0|2,0,0]=4 5503 B9R1.41 CC(=O)C1CCCC1O Amb25086736 [0,1,0,1,0,0|2,0,0]=4 5504 B9R1.41 CC(=O)C1CSCC1O Amb25685933 [0,1,0,1,0,0|2,0,0]=4 5505 B9R1.41 CC(=O)[C@@H]1CSC[C@@H]1O Amb25046323 [0,1,0,1,0,0|2,0,0]=4 5506 B9R1.41 CC(=O)[C@@H]1CSC[C@H]1O Amb25110108 [0,1,0,1,0,0|2,0,0]=4 5507 B9R1.41 CC(=O)[C@H]1CCC[C@@H]1O Amb24512739 [0,1,0,1,0,0|2,0,0]=4 5508 B9R1.41 CC(=O)[C@H]1CSC[C@@H]1O Amb25174811 [0,1,0,1,0,0|2,0,0]=4 5509 B9R1.41 CC(=O)[C@H]1CSC[C@H]1O Amb24594984 [0,1,0,1,0,0|2,0,0]=4 5510 B9R1.41 CC(C)C1CCOC1=O Amb25311388 [0,1,0,1,0,0|2,0,0]=4 5511 B9R1.41 CC(C)C1COCC1=O Amb23590155 [0,1,0,1,0,0|2,0,0]=4 5512 B9R1.41 CC(C)C1NCCC1=O Amb25094510 [0,1,0,1,0,0|2,0,0]=4 5513 B9R1.41 CC(C)[C@@H]1NCCC1=O Amb18832683 [0,1,0,1,0,0|2,0,0]=4 5514 B9R1.41 CC(O)C1=CCOC1=O Amb25736336 [0,1,0,1,0,0|1,0,1]=4 5515 B9R1.41 CC(O)C1CC=CC1=O Amb24646680 [0,1,0,1,0,0|2,0,0]=4 5516 B9R1.41 CC(O)C1CNN=C1N Amb25212558 [0,1,0,1,0,0|2,0,0]=4 5517 B9R1.41 CC(O)C1CNNC1=O Amb24062250 [0,1,0,1,0,0|1,0,0]=3 5518 B9R1.41 CC1C=CCC1C(O)=O Amb25304598 [0,1,0,1,0,0|2,0,0]=4 5519 B9R1.41 CC1CCNC1C(O)=O Amb22496299 [0,1,0,1,0,0|1,0,0]=3 5520 B9R1.41 CC1CCN[C@@H]1C(O)=O Amb25786199 [0,1,0,1,0,0|1,0,0]=3 5521 B9R1.41 CC1CCOC1C(O)=O Amb20668280 [0,1,0,1,0,0|2,0,0]=4 5522 B9R1.41 CC1COCC1C(O)=O Amb25326733 [0,1,0,1,0,0|1,0,0]=3 5523 B9R1.41 CC1NCCC1C(O)=O Amb18118138 [0,1,0,1,0,0|2,0,0]=4 5524 B9R1.41 CC1OCCC1C(=O)Cl Amb24334543 [0,1,0,1,0,0|2,0,0]=4 5525 B9R1.41 CC1OCCC1C(O)=O Amb22059743 [0,1,0,1,0,0|1,0,0]=3 5526 B9R1.41 CC1OCNC1C(O)=O Amb24564435 [0,1,0,1,0,0|0,0,0]=2 5527 B9R1.41 CC1SC=NC1C(O)=O Amb24419416 [0,1,0,1,0,0|0,1,1]=4 5528 B9R1.41 CC=1NONC1C(O)=O Amb25025845 [0,1,0,1,0,0|0,0,2]=4 5529 B9R1.41 CS(=O)C1CNCC1O Amb24674532 [0,1,0,1,0,0|2,0,0]=4 5530 B9R1.41 CS(=O)[C@@H]1CNC[C@H]1O Amb24495227 [0,1,0,1,0,0|2,0,0]=4 5531 B9R1.41 C[C@@H](N)[C@H]1CCOC1=O Amb24581234 [0,1,0,1,0,0|2,0,0]=4 5532 B9R1.41 C[C@@H](O)C1=CCOC1=O Amb25831551 [0,1,0,1,0,0|1,0,1]=4 5533 B9R1.41 C[C@@H](O)[C@@H]1CNNC1=O Amb24553848 [0,1,0,1,0,0|1,0,0]=3 5534 B9R1.41 C[C@@H](O)[C@H]1CCCC1=O Amb25313194 [0,1,0,1,0,0|2,0,0]=4 5535 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [0,1,0,1,0,0|2,0,0]=4 5536 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [0,1,0,1,0,0|2,0,0]=4 5537 B9R1.41 C[C@@H]1CCN[C@H]1C(O)=O Amb22747259 [0,1,0,1,0,0|1,0,0]=3 5538 B9R1.41 C[C@@H]1CCO[C@@H]1C(O)=O Amb25251332 [0,1,0,1,0,0|2,0,0]=4 5539 B9R1.41 C[C@@H]1CNC[C@H]1C(N)=O Amb25319543 [0,1,0,1,0,0|2,0,0]=4 5540 B9R1.41 C[C@@H]1COC[C@@H]1C(O)=O Amb24649146 [0,1,0,1,0,0|1,0,0]=3 5541 B9R1.41 C[C@@H]1NCC[C@H]1C(O)=O Amb18832568 [0,1,0,1,0,0|2,0,0]=4 5542 B9R1.41 C[C@@H]1OCC[C@@H]1C(O)=O Amb22886528 [0,1,0,1,0,0|1,0,0]=3 5543 B9R1.41 C[C@@H]1SCN[C@@H]1C(O)=O Amb24514827 [0,1,0,1,0,0|0,1,0]=3 5544 B9R1.41 C[C@@H]1SCN[C@H]1C(O)=O Amb24670517 [0,1,0,1,0,0|0,1,0]=3 5545 B9R1.41 C[C@H](O)C1=CCOC1=O Amb25792340 [0,1,0,1,0,0|1,0,1]=4 5546 B9R1.41 C[C@H](O)[C@@H]1CCOC1=O Amb25233110 [0,1,0,1,0,0|1,0,0]=3 5547 B9R1.41 C[C@H](O)[C@H]1CCCC1=O Amb24512738 [0,1,0,1,0,0|2,0,0]=4 5548 B9R1.41 C[C@H]1C=CC[C@@H]1C(O)=O Amb25180008 [0,1,0,1,0,0|2,0,0]=4 5549 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [0,1,0,1,0,0|2,0,0]=4 5550 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [0,1,0,1,0,0|2,0,0]=4 5551 B9R1.41 C[C@H]1CCN[C@@H]1C(N)=O Amb25174509 [0,1,0,1,0,0|2,0,0]=4 5552 B9R1.41 C[C@H]1CCN[C@H]1C(O)=O Amb24715733 [0,1,0,1,0,0|1,0,0]=3 5553 B9R1.41 C[C@H]1CNCC1C(O)=O Amb24546979 [0,1,0,1,0,0|1,0,0]=3 5554 B9R1.41 C[C@H]1COC[C@@H]1C(C)=O Amb24645383 [0,1,0,1,0,0|2,0,0]=4 5555 B9R1.41 C[C@H]1NCC[C@@H]1C(O)=O Amb24539923 [0,1,0,1,0,0|2,0,0]=4 5556 B9R1.41 C[C@H]1OCC[C@H]1C(O)=O Amb25253338 [0,1,0,1,0,0|1,0,0]=3 5557 B9R1.41 C[C@H]1SCN[C@@H]1C(O)=O Amb24539832 [0,1,0,1,0,0|0,1,0]=3 5558 B9R1.41 NC(=O)C1CCCC1O Amb25310986 [0,1,0,1,0,0|2,0,0]=4 5559 B9R1.41 NC(=O)C1NCCC1O Amb24709283 [0,1,0,1,0,0|1,0,0]=3 5560 B9R1.41 NC(=O)[C@@H]1CCC[C@H]1O Amb24120348 [0,1,0,1,0,0|2,0,0]=4 5561 B9R1.41 NC(=O)[C@@H]1NCC[C@H]1O Amb22744802 [0,1,0,1,0,0|1,0,0]=3 5562 B9R1.41 NC(=O)[C@H]1CCC[C@@H]1O Amb24514485 [0,1,0,1,0,0|2,0,0]=4 5563 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O Amb25194866 [0,1,0,1,0,0|1,0,0]=3 5564 B9R1.41 NC1CCN[C@@H]1C(O)=O Amb25032243 [0,1,0,1,0,0|1,0,0]=3 5565 B9R1.41 NC1CCSC1C(O)=O Amb25314364 [0,1,0,1,0,0|2,0,0]=4 5566 B9R1.41 NC1COCC1C(O)=O Amb24709230 [0,1,0,1,0,0|2,0,0]=4 5567 B9R1.41 NC1CSCC1C(O)=O Amb24457278 [0,1,0,1,0,0|2,0,0]=4 5568 B9R1.41 NC1OCCC1C(O)=O Amb24441640 [0,1,0,1,0,0|2,0,0]=4 5569 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=O Amb20241297 [0,1,0,1,0,0|2,0,0]=4 5570 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=O Amb22224830 [0,1,0,1,0,0|2,0,0]=4 5571 B9R1.41 N[C@@H]1CCN[C@@H]1C(O)=O Amb19929517 [0,1,0,1,0,0|1,0,0]=3 5572 B9R1.41 N[C@@H]1CCS[C@H]1C(O)=O Amb24061395 [0,1,0,1,0,0|2,0,0]=4 5573 B9R1.41 N[C@@H]1CNC[C@@H]1C(O)=O Amb25685466 [0,1,0,1,0,0|1,0,0]=3 5574 B9R1.41 N[C@@H]1COC[C@@H]1C(O)=O Amb24078777 [0,1,0,1,0,0|2,0,0]=4 5575 B9R1.41 N[C@@H]1CSC[C@@H]1C(O)=O Amb25685470 [0,1,0,1,0,0|2,0,0]=4 5576 B9R1.41 N[C@@H]1OCC[C@@H]1C(O)=O Amb24581227 [0,1,0,1,0,0|2,0,0]=4 5577 B9R1.41 N[C@H]1CCC[C@@H]1C(O)=O Amb20241298 [0,1,0,1,0,0|2,0,0]=4 5578 B9R1.41 N[C@H]1CCC[C@@H]1C(O)=O Amb22224860 [0,1,0,1,0,0|2,0,0]=4 5579 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993719 [0,1,0,1,0,0|2,0,0]=4 5580 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993764 [0,1,0,1,0,0|2,0,0]=4 5581 B9R1.41 N[C@H]1CCS[C@H]1C(O)=O Amb24061394 [0,1,0,1,0,0|2,0,0]=4 5582 B9R1.41 N[C@H]1CNC[C@H]1C(O)=O Amb24628081 [0,1,0,1,0,0|1,0,0]=3 5583 B9R1.41 N[C@H]1COC[C@@H]1C(O)=O Amb24605467 [0,1,0,1,0,0|2,0,0]=4 5584 B9R1.41 N[C@H]1COC[C@H]1C(O)=O Amb24763623 [0,1,0,1,0,0|2,0,0]=4 5585 B9R1.41 OC(=O)C1=CCC[C@H]1O Amb25795408 [0,1,0,1,0,0|1,0,1]=4 5586 B9R1.41 OC(=O)C1CCCC1Br Amb24480063 [0,1,0,1,0,0|2,0,0]=4 5587 B9R1.41 OC(=O)C1CCCC1S Amb18280971 [0,1,0,1,0,0|1,1,0]=4 5588 B9R1.41 OC(=O)C1NCCC1=S Amb25147125 [0,1,0,1,0,0|0,1,1]=4 5589 B9R1.41 OC(=O)C1NCCC1Br Amb24694082 [0,1,0,1,0,0|1,0,0]=3 5590 B9R1.41 OC(=O)C1NCCC1Cl Amb25080543 [0,1,0,1,0,0|1,0,0]=3 5591 B9R1.41 OC(=O)C1NCCC1F Amb25772909 [0,1,0,1,0,0|1,0,0]=3 5592 B9R1.41 OC(=O)C1NCCC1S Amb24556940 [0,1,0,1,0,0|0,1,0]=3 5593 B9R1.41 OC(=O)C1OCCC1Cl Amb25124121 [0,1,0,1,0,0|2,0,0]=4 5594 B9R1.41 OC(=O)[C@H]1CCC[C@@H]1Br Amb25251282 [0,1,0,1,0,0|2,0,0]=4 5595 B9R1.41 OC(=O)[C@H]1CCC[C@H]1Br Amb24693868 [0,1,0,1,0,0|2,0,0]=4 5596 B9R1.41 OC(=O)[C@H]1NCCC1F Amb25312348 [0,1,0,1,0,0|1,0,0]=3 5597 B9R1.41 OC(=O)[C@H]1NCC[C@@H]1S Amb24548407 [0,1,0,1,0,0|0,1,0]=3 5598 B9R1.41 OC1CCCC1C(=O)Cl Amb24524192 [0,1,0,1,0,0|2,0,0]=4 5599 B9R1.41 OC1CCCC1C(O)=O Amb19148040 [0,1,0,1,0,0|1,0,0]=3 5600 B9R1.41 OC1CCNC1C(O)=O Amb22387784 [0,1,0,1,0,0|0,0,0]=2 5601 B9R1.41 OC1CCN[C@@H]1C(=O)O Amb10604192 [0,1,0,1,0,0|0,0,0]=2 5602 B9R1.41 OC1CCN[C@H]1C(O)=O Amb24359065 [0,1,0,1,0,0|0,0,0]=2 5603 B9R1.41 OC1CCSC1C(O)=O Amb24061424 [0,1,0,1,0,0|1,0,0]=3 5604 B9R1.41 OC1CNCC1C(O)=O Amb22886381 [0,1,0,1,0,0|0,0,0]=2 5605 B9R1.41 OC1CSCC1C(O)=O Amb18831363 [0,1,0,1,0,0|1,0,0]=3 5606 B9R1.41 O[C@@H]1CCC[C@@H]1C(O)=O Amb22747315 [0,1,0,1,0,0|1,0,0]=3 5607 B9R1.41 O[C@@H]1CCC[C@H]1C(O)=O Amb24120349 [0,1,0,1,0,0|1,0,0]=3 5608 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb22746928 [0,1,0,1,0,0|0,0,0]=2 5609 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb23439285 [0,1,0,1,0,0|0,0,0]=2 5610 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb24183503 [0,1,0,1,0,0|0,0,0]=2 5611 B9R1.41 O[C@@H]1CCN[C@H]1C(O)=O Amb22746713 [0,1,0,1,0,0|0,0,0]=2 5612 B9R1.41 O[C@@H]1CCN[C@H]1C(O)=O Amb24183557 [0,1,0,1,0,0|0,0,0]=2 5613 B9R1.41 O[C@@H]1CNC[C@H]1C(O)=O Amb24120417 [0,1,0,1,0,0|0,0,0]=2 5614 B9R1.41 O[C@H]1CCC[C@H]1C(=O)O Amb10844853 [0,1,0,1,0,0|1,0,0]=3 5615 B9R1.41 O[C@H]1CCN[C@@H]1C(O)=O Amb24055327 [0,1,0,1,0,0|0,0,0]=2 5616 B9R1.41 O[C@H]1CCN[C@H]1C(O)=O Amb22230426 [0,1,0,1,0,0|0,0,0]=2 5617 B9R1.41 O[C@H]1CNC[C@H]1C(O)=O Amb22274552 [0,1,0,1,0,0|0,0,0]=2 5618 B9R1.81 CC1CCC1C(=O)OC Amb25110041 [0,1,0,1,0,0|2,0,0]=4 5619 B9R1.81 COC(=O)C1=CCC1O Amb25335472 [0,1,0,1,0,0|1,0,1]=4 5620 B9R1.81 COC(=O)C1CCC1N Amb25363640 [0,1,0,1,0,0|2,0,0]=4 5621 B9R1.81 COC(=O)C1CCC1O Amb24448430 [0,1,0,1,0,0|1,0,0]=3 5622 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb22232595 [0,1,0,1,0,0|2,0,0]=4 5623 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb23439308 [0,1,0,1,0,0|2,0,0]=4 5624 B9R1.81 COC(=O)[C@@H]1CC[C@H]1Cl Amb24635677 [0,1,0,1,0,0|2,0,0]=4 5625 B9R1.81 COC(=O)[C@H]1CC[C@@H]1N Amb25261158 [0,1,0,1,0,0|2,0,0]=4 5626 B9R1.81 COC(=O)[C@H]1CC[C@H]1N Amb22232608 [0,1,0,1,0,0|2,0,0]=4 5627 B9R1.81 COC(=O)[C@H]1NCC1=O Amb24471980 [0,1,0,1,0,0|0,0,2]=4 5628 B9R1.81 COC(=O)[C@H]1NC[C@H]1O Amb24573017 [0,1,0,1,0,0|0,0,0]=2 5629 B9R1.81 C[C@H]1CC[C@H]1C(=O)OC Amb24559896 [0,1,0,1,0,0|2,0,0]=4 5630 B9R1.81 OC(C=O)C1SCC1O Amb25190373 [0,1,0,1,0,0|1,0,1]=4 5631 B9R1.81 OCC(O)C1NCC1O Amb25102544 [0,1,0,1,0,0|0,0,2]=4 5632 B9R1.81 OC[C@H](O)[C@@H]1NC[C@@H]1O Amb24573509 [0,1,0,1,0,0|0,0,2]=4 5633 B9R1.93 C#CC1CC1(N)C(O)=O Amb23456002 [0,1,0,1,0,0|1,0,0]=3 5634 B9R1.93 C=C[C@@H]1C[C@]1(N)C(O)=O Amb22744970 [0,1,0,1,0,0|1,0,0]=3 5635 B9R1.93 C=C[C@H]1C[C@]1(N)C(O)=O Amb25105090 [0,1,0,1,0,0|1,0,0]=3 5636 B9R1.93 CC(=O)C1(Br)CC1CO Amb24593916 [0,1,0,1,0,0|2,0,0]=4 5637 B9R1.93 CC1(CC1CN)C(O)=O Amb24550226 [0,1,0,1,0,0|2,0,0]=4 5638 B9R1.93 CC1(CC1CO)C(O)=O Amb24559345 [0,1,0,1,0,0|1,0,0]=3 5639 B9R1.93 CC1(OC1CO)C(O)=O Amb24746000 [0,1,0,1,0,0|1,0,0]=3 5640 B9R1.93 CCC1CC1(N)C(O)=O Amb24655862 [0,1,0,1,0,0|1,0,0]=3 5641 B9R1.93 CCC1OC1(C)C(C)=O Amb25073390 [0,1,0,1,0,0|2,0,0]=4 5642 B9R1.93 CCC1OC1(C)C(O)=O Amb25843946 [0,1,0,1,0,0|1,0,0]=3 5643 B9R1.93 CC[C@@H]1CC1(N)C(O)=O Amb25104706 [0,1,0,1,0,0|1,0,0]=3 5644 B9R1.93 CC[C@@H]1C[C@@]1(N)C(O)=O Amb23452849 [0,1,0,1,0,0|1,0,0]=3 5645 B9R1.93 CC[C@@H]1C[C@@]1(O)C(O)=O Amb25377855 [0,1,0,1,0,0|2,0,0]=4 5646 B9R1.93 CC[C@@H]1C[C@]1(N)C(O)=O Amb23452884 [0,1,0,1,0,0|1,0,0]=3 5647 B9R1.93 CC[C@@H]1O[C@@]1(C)C(C)=O Amb24760756 [0,1,0,1,0,0|2,0,0]=4 5648 B9R1.93 C[C@]1(C[C@@H]1CN)C(O)=O Amb25339704 [0,1,0,1,0,0|2,0,0]=4 5649 B9R1.93 NC1(CC1C=C)C(=O)O Amb10068409 [0,1,0,1,0,0|1,0,0]=3 5650 B9R1.93 NC1(CC1CO)C(O)=O Amb25828351 [0,1,0,1,0,0|0,0,0]=2 5651 B9R1.93 NC[C@@H]1C[C@@]1(N)C(O)=O Amb24763621 [0,1,0,1,0,0|1,0,0]=3 5652 B9R1.93 N[C@@]1(C[C@H]1CO)C(O)=O Amb25101898 [0,1,0,1,0,0|0,0,0]=2 5653 B9R1.93 N[C@]1(C[C@@H]1CO)C(O)=O Amb24581240 [0,1,0,1,0,0|0,0,0]=2 5654 B9R1.93 OC(=O)C1(Cl)CC1CCl Amb24404084 [0,1,0,1,0,0|2,0,0]=4 5655 B9R1.96 CCC1CCC1C(O)=O Amb25727014 [0,1,0,1,0,0|2,0,0]=4 5656 B9R1.96 CNC1CCC1C(O)=O Amb25340658 [0,1,0,1,0,0|2,0,0]=4 5657 B9R1.96 CSC1CCC1C(O)=O Amb25118114 [0,1,0,1,0,0|1,1,0]=4 5658 B9R1.96 C\C=C/1\CNC1C(O)=O Amb25338611 [0,1,0,1,0,0|1,0,1]=4 5659 B9R1.96 C\C=C\1/CN[C@@H]1C(O)=O Amb25075476 [0,1,0,1,0,0|1,0,1]=4 5660 B9R1.96 NCC1CCC1C(O)=O Amb25269589 [0,1,0,1,0,0|2,0,0]=4 5661 B9R1.96 NC[C@H]1CC[C@H]1C(O)=O Amb24579352 [0,1,0,1,0,0|2,0,0]=4 5662 B9R1.96 OC(=O)C1CCC1C=O Amb25302625 [0,1,0,1,0,0|1,0,1]=4 5663 B9R1.96 OC(=O)C1CCC1CF Amb20667674 [0,1,0,1,0,0|2,0,0]=4 5664 B9R1.96 OCC1CCC1C(O)=O Amb24340315 [0,1,0,1,0,0|1,0,0]=3 5665 B9R1.96 OCC1CCN1C(O)=O Amb22756926 [0,1,0,1,0,0|2,0,0]=4 5666 B9R1.96 ONC1CCC1C(O)=O Amb24471809 [0,1,0,1,0,0|1,0,0]=3 5667 B9R1.96 [O-]C(=O)[C@H]1CC[C@H]1CO Amb25176734 [0,1,0,1,0,0|1,0,1]=4 5668 B9R1.101 CC(C1CC1)C(=O)OC Amb24741006 [0,1,0,1,0,0|2,0,0]=4 5669 B9R1.101 CNC(=O)C(N)C1CC1 Amb25695532 [0,1,0,1,0,0|2,0,0]=4 5670 B9R1.101 COC(=O)C(C1CC1)N Amb13883561 [0,1,0,1,0,0|1,0,0]=3 5671 B9R1.101 COC(=O)C(Cl)C1CC1 Amb20623820 [0,1,0,1,0,0|2,0,0]=4 5672 B9R1.101 COC(=O)C(N)C1CC1 Amb19149335 [0,1,0,1,0,0|1,0,0]=3 5673 B9R1.101 COC(=O)C(O)C1CC1 Amb22059072 [0,1,0,1,0,0|2,0,0]=4 5674 B9R1.101 COC(=O)C(S)C1CC1 Amb24384464 [0,1,0,1,0,0|2,0,0]=4 5675 B9R1.101 COC(=O)[C@@H](O)C1CC1 Amb25332454 [0,1,0,1,0,0|2,0,0]=4 5676 B9R1.101 NC(C1CC1)C(=O)NO Amb24699584 [0,1,0,1,0,0|1,0,0]=3 5677 B9R1.101 NC(C1CC1)C(N)=NO Amb25147192 [0,1,0,1,0,0|2,0,0]=4 5678 B9R1.101 OC(C1CC1)C(=O)CO Amb24467564 [0,1,0,1,0,0|2,0,0]=4 5679 B9R1.101 O[C@@H](C1CC1)C(=O)CO Amb24736984 [0,1,0,1,0,0|2,0,0]=4 5680 B9R1.110 CC(=O)C(N)C1CCC1 Amb25062195 [0,1,0,1,0,0|2,0,0]=4 5681 B9R1.110 CC(C(=O)O)C1CCC1 Amb17087517 [0,1,0,1,0,0|2,0,0]=4 5682 B9R1.110 CC(C1CSC1)C(O)=O Amb25200790 [0,1,0,1,0,0|1,1,0]=4 5683 B9R1.110 C[C@@H](C1CCC1)C(O)=O Amb22748271 [0,1,0,1,0,0|2,0,0]=4 5684 B9R1.110 C[C@H](C1CCC1)C(O)=O Amb24360449 [0,1,0,1,0,0|2,0,0]=4 5685 B9R1.110 NC(C1CCC1)C(O)=O Amb19149365 [0,1,0,1,0,0|1,0,0]=3 5686 B9R1.110 NC(C1CCC1)C(O)=O Amb21858491 [0,1,0,1,0,0|1,0,0]=3 5687 B9R1.110 NC(C1CCC1)P(O)=O Amb25721258 [0,1,0,1,0,0|2,0,0]=4 5688 B9R1.110 NC(C1CCO1)C(N)=O Amb25364480 [0,1,0,1,0,0|1,0,0]=3 5689 B9R1.110 NC(C1COC1)C(O)=O Amb22405987 [0,1,0,1,0,0|0,0,0]=2 5690 B9R1.110 NC(C1CSC1)C(N)=O Amb25287406 [0,1,0,1,0,0|1,1,0]=4 5691 B9R1.110 N[C@@H](C1CCC1)C(N)=O Amb24476623 [0,1,0,1,0,0|2,0,0]=4 5692 B9R1.110 N[C@@H](C1COC1)C(O)=O Amb22737551 [0,1,0,1,0,0|0,0,0]=2 5693 B9R1.110 N[C@H](C(O)=O)C=1CCC1 Amb25680165 [0,1,0,1,0,0|1,0,1]=4 5694 B9R1.110 N[C@H](C1COC1)C(O)=O Amb22737550 [0,1,0,1,0,0|0,0,0]=2 5695 B9R1.110 OC(=O)C(F)C1CNC1 Amb25110697 [0,1,0,1,0,0|2,0,0]=4 5696 B9R1.110 OC(C1CCC1)C(O)=O Amb24426901 [0,1,0,1,0,0|2,0,0]=4 5697 B9R1.110 OC(C1CNC1)C(O)=O Amb24339989 [0,1,0,1,0,0|2,0,0]=4 5698 B9R1.110 OC(C1CSC1)C(O)=O Amb24759238 [0,1,0,1,0,0|1,1,0]=4 5699 B9R1.111 CC(C(C)=O)C1(O)CC1 Amb25162760 [0,1,0,1,0,0|2,0,0]=4 5700 B9R1.111 CC(C(O)=O)C1(C)CC1 Amb18832624 [0,1,0,1,0,0|2,0,0]=4 5701 B9R1.111 CC(C(O)=O)C1(N)CC1 Amb18832571 [0,1,0,1,0,0|2,0,0]=4 5702 B9R1.111 CC1(CC1)C(N)C(O)=O Amb25146159 [0,1,0,1,0,0|1,0,0]=3 5703 B9R1.111 CC1(CC1)[C@@H](N)C(O)=O Amb23439674 [0,1,0,1,0,0|1,0,0]=3 5704 B9R1.111 CC1(CO1)C(=O)C(O)=O Amb25803495 [0,1,0,1,0,0|1,0,1]=4 5705 B9R1.111 CC1(CO1)C(O)C(O)=O Amb24590009 [0,1,0,1,0,0|1,0,0]=3 5706 B9R1.111 C[C@]1(CO1)C(=O)C(O)=O Amb24681893 [0,1,0,1,0,0|1,0,1]=4 5707 B9R1.111 C[C@]1(CO1)[C@H](O)C(O)=O Amb25174908 [0,1,0,1,0,0|1,0,0]=3 5708 B9R1.111 N[C@@H](C(O)=O)C1(O)CC1 Amb22751391 [0,1,0,1,0,0|0,0,0]=2 5709 B9R1.111 N[C@H](C(O)=O)C1(O)CC1 Amb24117270 [0,1,0,1,0,0|0,0,0]=2 5710 B9R1.127 CC(=O)C1OC1(C)CO Amb24662478 [0,1,0,1,0,0|2,0,0]=4 5711 B9R1.127 CC1(CC1C(O)=O)CO Amb24529046 [0,1,0,1,0,0|1,0,0]=3 5712 B9R1.127 CCC1(C)CC1C(O)=O Amb18285802 [0,1,0,1,0,0|2,0,0]=4 5713 B9R1.127 C[C@@]1(CN)C[C@H]1C(O)=O Amb24517240 [0,1,0,1,0,0|2,0,0]=4 5714 B9R1.127 OC[C@@]1(Cl)C[C@H]1C(O)=O Amb24511974 [0,1,0,1,0,0|2,0,0]=4 5715 B9R1.127 OC[C@]1(Cl)C[C@H]1C(O)=O Amb25201489 [0,1,0,1,0,0|2,0,0]=4 5716 B9R1.132 CC1C(CO)CNC1=O Amb25142911 [0,1,0,1,0,0|2,0,0]=4 5717 B9R1.132 CC1C(OCC1=O)OC Amb24690537 [0,1,0,1,0,0|2,0,0]=4 5718 B9R1.132 CC1[C@@H](CO)CNC1=O Amb24724590 [0,1,0,1,0,0|2,0,0]=4 5719 B9R1.132 CCC1CNC(=O)C1N Amb25732553 [0,1,0,1,0,0|2,0,0]=4 5720 B9R1.132 CC[C@@H]1CNC(=O)[C@@H]1N Amb24603686 [0,1,0,1,0,0|2,0,0]=4 5721 B9R1.132 CC[C@@H]1ONC(=O)[C@H]1N Amb25745431 [0,1,0,1,0,0|1,0,0]=3 5722 B9R1.132 CN1C(CO)COC1=O Amb22504497 [0,1,0,1,0,0|2,0,0]=4 5723 B9R1.132 CO[C@@H]1COC(=O)[C@@H]1O Amb24733177 [0,1,0,1,0,0|1,0,0]=3 5724 B9R1.132 C[C@H]1[C@@H](CCC1=O)CO Amb24582507 [0,1,0,1,0,0|2,0,0]=4 5725 B9R1.132 C[C@H]1[C@@H](CO)CNC1=O Amb25204711 [0,1,0,1,0,0|2,0,0]=4 5726 B9R1.132 NC1C(CO)NCC1O Amb25258864 [0,1,0,1,0,0|1,0,1]=4 5727 B9R1.132 N[C@@H]1[C@@H](CO)NC[C@H]1O Amb24671216 [0,1,0,1,0,0|1,0,1]=4 5728 B9R1.132 N[C@H]1[C@@H](CO)NC[C@@H]1O Amb25745255 [0,1,0,1,0,0|1,0,1]=4 5729 B9R1.132 N[C@H]1[C@H](CS)COC1=O Amb24715941 [0,1,0,1,0,0|0,1,0]=3 5730 B9R1.132 O=C1OCC(CCl)C1Cl Amb24653769 [0,1,0,1,0,0|2,0,0]=4 5731 B9R1.132 OC1CC=C(C=O)C1O Amb24647863 [0,1,0,1,0,0|2,0,0]=4 5732 B9R1.132 OCC1=NC[C@@H](O)[C@@H]1O Amb24554743 [0,1,0,1,0,0|2,0,0]=4 5733 B9R1.132 O[C@@H]1[C@@H](C=O)OC[C@H]1O Amb24629264 [0,1,0,1,0,0|1,0,1]=4 5734 B9R1.132 O[C@@H]1[C@H](C=O)OC[C@H]1O Amb24611196 [0,1,0,1,0,0|1,0,1]=4 5735 B9R1.132 O[C@H]1[C@H](COC1=O)CO Amb24733237 [0,1,0,1,0,0|1,0,0]=3 5736 B9R1.138 CC1(C)CNC(=O)C1N Amb25224596 [0,1,0,1,0,0|2,0,0]=4 5737 B9R1.138 CC1(C)CNC(=O)[C@@H]1N Amb24715876 [0,1,0,1,0,0|2,0,0]=4 5738 B9R1.138 CC1(C)COC(=O)C1Br Amb25060181 [0,1,0,1,0,0|2,0,0]=4 5739 B9R1.138 CC1(C)COC(=O)C1N Amb18642696 [0,1,0,1,0,0|1,0,0]=3 5740 B9R1.138 CC1(C)COC(=O)[C@@H]1Br Amb22747532 [0,1,0,1,0,0|2,0,0]=4 5741 B9R1.138 CC1(C)COC(=O)[C@@H]1N Amb25083661 [0,1,0,1,0,0|1,0,0]=3 5742 B9R1.138 CC1(C)COC(=O)[C@H]1N Amb24589212 [0,1,0,1,0,0|1,0,0]=3 5743 B9R1.138 CC1(C)NOC(=O)C1N Amb25828500 [0,1,0,1,0,0|1,0,0]=3 5744 B9R1.138 CC1(C)NOC(=O)[C@H]1N Amb25032224 [0,1,0,1,0,0|1,0,0]=3 5745 B9R1.138 CC1(C)OCC(=O)C1O Amb24645408 [0,1,0,1,0,0|2,0,0]=4 5746 B9R1.138 CC1(C)OCC(=O)[C@H]1O Amb25807640 [0,1,0,1,0,0|2,0,0]=4 5747 B9R1.138 CC1(C)SSC(=O)C1N Amb25238368 [0,1,0,1,0,0|0,2,0]=4 5748 B9R1.138 CC1(O)C=CC(=O)C1O Amb25358942 [0,1,0,1,0,0|2,0,0]=4 5749 B9R1.138 CC1(O)CCC(=O)C1Cl Amb24480148 [0,1,0,1,0,0|2,0,0]=4 5750 B9R1.138 CC1C(=O)CCC1(C)O Amb25263522 [0,1,0,1,0,0|2,0,0]=4 5751 B9R1.138 CC1C(=O)NCC1(C)O Amb24682288 [0,1,0,1,0,0|2,0,0]=4 5752 B9R1.138 C[C@@H]1C(=O)CC[C@@]1(C)O Amb25358833 [0,1,0,1,0,0|2,0,0]=4 5753 B9R1.138 C[C@]1(O)C=CC(=O)[C@H]1O Amb24690831 [0,1,0,1,0,0|2,0,0]=4 5754 B9R1.138 C[C@]1(O)COC(=O)[C@H]1O Amb24515250 [0,1,0,1,0,0|1,0,0]=3 5755 B9R1.141 CC1(C(C)C1C)C(O)=O Amb24429202 [0,1,0,1,0,0|2,0,0]=4 5756 B9R1.141 CC1C(Br)C1(C)C(O)=O Amb24663119 [0,1,0,1,0,0|2,0,0]=4 5757 B9R1.141 CC1C(C)C1(N)C(O)=O Amb24366699 [0,1,0,1,0,0|1,0,0]=3 5758 B9R1.141 C[C@@H]1[C@@H](C)C1(N)C(O)=O Amb24618306 [0,1,0,1,0,0|1,0,0]=3 5759 B9R1.141 C[C@@H]1[C@H](C)[C@@]1(N)C(O)=O Amb25859080 [0,1,0,1,0,0|1,0,0]=3 5760 B9R1.141 C[C@@H]1[C@H](C)[C@]1(N)C(O)=O Amb24402011 [0,1,0,1,0,0|1,0,0]=3 5761 B9R1.141 C[C@H]1[C@H](C)C1(N)C(O)=O Amb25243123 [0,1,0,1,0,0|1,0,0]=3 5762 B9R1.159 CC1(N=CC1O)C(O)=O Amb24078332 [0,1,0,1,0,0|0,0,2]=4 5763 B9R1.159 CC1CCC1(N)C(N)=O Amb24391671 [0,1,0,1,0,0|2,0,0]=4 5764 B9R1.159 CC1CCC1(N)C(O)=O Amb23456072 [0,1,0,1,0,0|1,0,0]=3 5765 B9R1.159 C[C@@H]1CC[C@]1(N)C(O)=O Amb24586126 [0,1,0,1,0,0|1,0,0]=3 5766 B9R1.159 C[C@H]1CC[C@@]1(C)C(O)=O Amb24575030 [0,1,0,1,0,0|2,0,0]=4 5767 B9R1.159 NC1(CCC1F)C(O)=O Amb25223441 [0,1,0,1,0,0|1,0,0]=3 5768 B9R1.159 N[C@@H]1CC[C@]1(N)C(O)=O Amb25233319 [0,1,0,1,0,0|1,0,0]=3 5769 B9R1.159 N[C@@]1(CC[C@H]1O)C(O)=O Amb25313173 [0,1,0,1,0,0|0,0,0]=2 5770 B9R1.159 OC1CCC1(O)C(O)=O Amb24477886 [0,1,0,1,0,0|1,0,0]=3 5771 B9R1.185 CC1(C)C[C@@H]1C(=O)NO Amb25686884 [0,1,0,1,0,0|2,0,0]=4 5772 B9R1.185 COC(=O)C1CC1(C)C Amb25762943 [0,1,0,1,0,0|2,0,0]=4 5773 B9R1.185 COC(=O)C1NC1(C)C Amb23401628 [0,1,0,1,0,0|1,0,0]=3 5774 B9R1.185 COC(=O)[C@H]1CC1(C)C Amb25297242 [0,1,0,1,0,0|2,0,0]=4 5775 B9R1.188 COC(=O)C1(C)CC1F Amb24568549 [0,1,0,1,0,0|2,0,0]=4 5776 B9R1.188 COC(=O)C1(N)CC1Br Amb24728828 [0,1,0,1,0,0|1,0,0]=3 5777 B9R1.188 COC(=O)C1(N)CC1C Amb24375064 [0,1,0,1,0,0|1,0,0]=3 5778 B9R1.188 COC(=O)[C@@]1(N)C[C@@H]1C Amb23452878 [0,1,0,1,0,0|1,0,0]=3 5779 B9R1.188 COC(=O)[C@@]1(N)C[C@H]1Br Amb25061625 [0,1,0,1,0,0|1,0,0]=3 5780 B9R1.188 COC(=O)[C@@]1(N)C[C@H]1C Amb23452871 [0,1,0,1,0,0|1,0,0]=3 5781 B9R1.188 COC(=O)[C@]1(C)C[C@@H]1Br Amb24589399 [0,1,0,1,0,0|2,0,0]=4 5782 B9R1.188 COC(=O)[C@]1(C)C[C@@H]1Cl Amb24583356 [0,1,0,1,0,0|2,0,0]=4 5783 B9R1.188 COC(=O)[C@]1(N)C[C@H]1Br Amb24514845 [0,1,0,1,0,0|1,0,0]=3 5784 B9R1.199 CCC1(C)OC(=O)C1Cl Amb24753405 [0,1,0,1,0,0|2,0,0]=4 5785 B9R1.199 CC[C@@]1(C)OC(=O)[C@@H]1Cl Amb25242419 [0,1,0,1,0,0|2,0,0]=4 5786 B9R1.27 CC1CNC(=O)C1CN Amb24527760 [0,1,0,1,0,0|2,0,0]=4 5787 B9R1.27 CCC1C(O)COC1=O Amb24420023 [0,1,0,1,0,0|1,0,0]=3 5788 B9R1.27 CC[C@@H]1[C@@H](O)COC1=O Amb25332099 [0,1,0,1,0,0|1,0,0]=3 5789 B9R1.32 CC1(C)NC(=O)C1CN Amb25789516 [0,1,0,1,0,0|2,0,0]=4 5790 B9R1.52 CC1CC(C)C1C(O)=O Amb25047286 [0,1,0,1,0,0|2,0,0]=4 5791 B9R1.52 CC1NC(=O)C1C(C)O Amb25026617 [0,1,0,1,0,0|2,0,0]=4 5792 B9R1.116 CCC(C1CC1)C(O)=O Amb18832627 [0,1,0,1,0,0|2,0,0]=4 5793 B9R1.116 CNC(C1CC1)C(N)=O Amb18975566 [0,1,0,1,0,0|2,0,0]=4 5794 B9R1.116 CNC(C1CC1)C(O)=O Amb18975569 [0,1,0,1,0,0|1,0,0]=3 5795 B9R1.116 COC(C1CC1)C(O)=O Amb24524177 [0,1,0,1,0,0|2,0,0]=4 5796 B9R1.116 N#CC(C1CC1)C(O)=O Amb25129623 [0,1,0,1,0,0|1,0,1]=4 5797 B9R1.130 CC1CC1(CN)C(O)=O Amb24502348 [0,1,0,1,0,0|1,0,0]=3 5798 B9R1.130 CCC1(OC1C)C(C)=O Amb25242557 [0,1,0,1,0,0|2,0,0]=4 5799 B9R1.130 CC[C@@]1(C[C@@H]1F)C(O)=O Amb24356743 [0,1,0,1,0,0|2,0,0]=4 5800 B9R1.130 CC[C@@]1(C[C@H]1F)C(O)=O Amb25082106 [0,1,0,1,0,0|2,0,0]=4 5801 B9R1.130 CC[C@@]1(O[C@@H]1C)C(C)=O Amb24383456 [0,1,0,1,0,0|2,0,0]=4 5802 B9R1.130 CNC1(CC1C)C(O)=O Amb24532866 [0,1,0,1,0,0|1,0,0]=3 5803 B9R1.130 CSC1(CC1C)C(O)=O Amb24540432 [0,1,0,1,0,0|2,0,0]=4 5804 B9R1.166 CC1(C)CCC1C(O)=O Amb25032090 [0,1,0,1,0,0|2,0,0]=4 5805 B9R1.166 CC1(C)CNC1C(O)=O Amb24117326 [0,1,0,1,0,0|1,0,0]=3 5806 B9R1.166 NC(=O)C1NCC1(F)F Amb24467750 [0,1,0,1,0,0|2,0,0]=4 5807 B9R1.166 OC(=O)C1CCC1(F)F Amb24452747 [0,1,0,1,0,0|2,0,0]=4 5808 B9R1.168 CC(C)C1(CC1)C(O)=O Amb18061747 [0,1,0,1,0,0|2,0,0]=4 5809 B9R1.168 CC(F)C1(CC1)C(O)=O Amb25174063 [0,1,0,1,0,0|2,0,0]=4 5810 B9R1.168 C[C@H](O)[C@]1(CO1)C(C)=O Amb24552367 [0,1,0,1,0,0|2,0,0]=4 5811 B9R1.65 C[C@H]1C[C@]1(N)P(O)(O)=O Amb25233026 [0,1,0,1,0,0|2,0,0]=4 5812 B9R1.106 CC1(C)C(Br)COC1=O Amb24479961 [0,1,0,1,0,0|2,0,0]=4 5813 B9R1.106 CC1(C)[C@@H](O)CCC1=O Amb25833627 [0,1,0,1,0,0|2,0,0]=4 5814 B9R1.106 CC1(C)[C@@H](O)COC1=O Amb24466275 [0,1,0,1,0,0|1,0,0]=3 5815 B9R1.106 CC1(C)[C@H](O)CCC1=O Amb24532886 [0,1,0,1,0,0|2,0,0]=4 5816 B9R1.106 CC1(Cl)C(O)COC1=O Amb24355065 [0,1,0,1,0,0|1,0,0]=3 5817 B9R1.106 CC1(O)C(O)COC1=O Amb25182892 [0,1,0,1,0,0|1,0,0]=3 5818 B9R1.106 CC1COC(=O)C1(C)O Amb24704831 [0,1,0,1,0,0|2,0,0]=4 5819 B9R1.106 C[C@@]1(O)[C@@H](O)COC1=O Amb24555298 [0,1,0,1,0,0|1,0,0]=3 5820 B9R1.106 C[C@@]1(O)[C@H](O)CNC1=O Amb24618201 [0,1,0,1,0,0|2,0,0]=4 5821 B9R1.106 C[C@@]1(O)[C@H](O)COC1=O Amb22745011 [0,1,0,1,0,0|1,0,0]=3 5822 B9R1.106 C[C@]1(Cl)[C@@H](O)COC1=O Amb25345157 [0,1,0,1,0,0|1,0,0]=3 5823 B9R1.165 CC(N)(C1CC1)C(N)=O Amb18949661 [0,1,0,1,0,0|2,0,0]=4 5824 B9R1.165 CC(N)(C1CC1)C(N)=O Amb19374801 [0,1,0,1,0,0|2,0,0]=4 5825 B9R1.165 CC(N)(C1CC1)C(O)=O Amb19269151 [0,1,0,1,0,0|1,0,0]=3 5826 B9R1.165 CC(N)(C1CC1)C(O)=O Amb22492372 [0,1,0,1,0,0|1,0,0]=3 5827 B9R1.165 CC(N)(C1CO1)C(O)=O Amb25082874 [0,1,0,1,0,0|0,0,0]=2 5828 B9R1.165 CC(O)(C1CC1)C(O)=O Amb18952003 [0,1,0,1,0,0|2,0,0]=4 5829 B9R1.165 OC(=O)C(C1CC1)(N)C Amb2444919 [0,1,0,1,0,0|1,0,0]=3 5830 B9R2.17 N[C@@]12C[C@@H]1COC2=O Amb25175091 [0,0,0,2,0,0|1,0,0]=3 5831 B9R2.29 OC1CC2NC(=O)C21 Amb25272666 [0,0,0,2,0,0|2,0,0]=4 5832 B9R2.147 OC(=O)C1[C@@H]2C[C@H]1C2 Amb24409084 [0,0,0,2,0,0|2,0,0]=4 5833 B9R2.150 OC(=O)C1CC2CC21 Amb25049722 [0,0,0,2,0,0|2,0,0]=4 5834 B9R2.150 OC(=O)C1NC2CC12 Amb25376606 [0,0,0,2,0,0|1,0,0]=3 5835 B7R0.6 CC(=C)CCC(O)=O Amb18641793 [1,0,0,0,0,1|1,0,1]=4 5836 B7R0.6 CC(=N)SCC(O)=O Amb25704672 [1,0,0,0,0,1|1,0,1]=4 5837 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [1,0,0,0,0,1|0,0,2]=4 5838 B7R0.6 CC(=O)NCC(O)O Amb25378443 [1,0,0,0,0,1|2,0,0]=4 5839 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [1,0,0,0,0,1|0,0,2]=4 5840 B7R0.6 CC(=O)SCC(=O)O Amb17607669 [1,0,0,0,0,1|0,0,2]=4 5841 B7R0.6 CC(=S)NCC(O)=O Amb24325138 [1,0,0,0,0,1|0,1,1]=4 5842 B7R0.6 CC(Br)CCC(=O)Cl Amb24483133 [1,0,0,0,0,1|2,0,0]=4 5843 B7R0.6 CC(Br)CCC(N)=O Amb24065438 [1,0,0,0,0,1|2,0,0]=4 5844 B7R0.6 CC(Br)CCC(O)=O Amb18124528 [1,0,0,0,0,1|1,0,0]=3 5845 B7R0.6 CC(Br)CNC(C)=O Amb24727885 [1,0,0,0,0,1|2,0,0]=4 5846 B7R0.6 CC(Br)COC(C)=O Amb25360690 [1,0,0,0,0,1|2,0,0]=4 5847 B7R0.6 CC(Br)\C=C\C(O)=O Amb18648210 [1,0,0,0,0,1|1,0,1]=4 5848 B7R0.6 CC(C)=NCC(O)=O Amb24481383 [1,0,0,0,0,1|1,0,1]=4 5849 B7R0.6 CC(C)CC[13C](O)=O Amb22337922 [1,0,0,0,0,1|1,0,0]=3 5850 B7R0.6 CC(C)CC[13C]([O-])=O Amb22369748 [1,0,0,0,0,1|1,0,1]=4 5851 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [1,0,0,0,0,1|2,0,0]=4 5852 B7R0.6 CC(C)N=CC(O)=O Amb25243501 [1,0,0,0,0,1|1,0,1]=4 5853 B7R0.6 CC(C)OCC([O-])=O Amb22754781 [1,0,0,0,0,1|1,0,1]=4 5854 B7R0.6 CC(C)SCC(C)=O Amb22549127 [1,0,0,0,0,1|2,0,0]=4 5855 B7R0.6 CC(C)\C=C/C(O)=O Amb24481395 [1,0,0,0,0,1|1,0,1]=4 5856 B7R0.6 CC(CCC(=O)O)C Amb1153016 [1,0,0,0,0,1|1,0,0]=3 5857 B7R0.6 CC(CCC(=O)O)N Amb17593212 [1,0,0,0,0,1|1,0,0]=3 5858 B7R0.6 CC(CNC(=O)N)C Amb1151241 [1,0,0,0,0,1|2,0,0]=4 5859 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [1,0,0,0,0,1|2,0,0]=4 5860 B7R0.6 CC(Cl)CCC(N)=O Amb24469692 [1,0,0,0,0,1|2,0,0]=4 5861 B7R0.6 CC(Cl)CCC(O)=O Amb18124448 [1,0,0,0,0,1|1,0,0]=3 5862 B7R0.6 CC(Cl)CNC(C)=O Amb25702921 [1,0,0,0,0,1|2,0,0]=4 5863 B7R0.6 CC(Cl)CNC(N)=O Amb25068414 [1,0,0,0,0,1|2,0,0]=4 5864 B7R0.6 CC(Cl)COC(=O)F Amb24470183 [1,0,0,0,0,1|2,0,0]=4 5865 B7R0.6 CC(Cl)COC(C)=O Amb25783984 [1,0,0,0,0,1|2,0,0]=4 5866 B7R0.6 CC(Cl)CSC(=O)Cl Amb24456190 [1,0,0,0,0,1|2,0,0]=4 5867 B7R0.6 CC(Cl)CSC(C)=O Amb24530194 [1,0,0,0,0,1|2,0,0]=4 5868 B7R0.6 CC(F)CCC(O)=O Amb24682772 [1,0,0,0,0,1|1,0,0]=3 5869 B7R0.6 CC(N)CCC(C)=O Amb24698356 [1,0,0,0,0,1|2,0,0]=4 5870 B7R0.6 CC(N)CCC(N)=O Amb18641901 [1,0,0,0,0,1|2,0,0]=4 5871 B7R0.6 CC(N)CCC(O)=O Amb19515603 [1,0,0,0,0,1|1,0,0]=3 5872 B7R0.6 CC(N)CNC(C)=O Amb18631377 [1,0,0,0,0,1|2,0,0]=4 5873 B7R0.6 CC(N)CNC(N)=O Amb18202688 [1,0,0,0,0,1|2,0,0]=4 5874 B7R0.6 CC(N)\C=C\C(O)=O Amb18641827 [1,0,0,0,0,1|1,0,1]=4 5875 B7R0.6 CC(NCC(=O)N)C Amb2370772 [1,0,0,0,0,1|2,0,0]=4 5876 B7R0.6 CC(NCC(=O)O)C Amb2372347 [1,0,0,0,0,1|1,0,0]=3 5877 B7R0.6 CC(O)CC=C(C)C Amb24645341 [1,0,0,0,0,1|2,0,0]=4 5878 B7R0.6 CC(O)CC=C(Cl)Cl Amb25169372 [1,0,0,0,0,1|2,0,0]=4 5879 B7R0.6 CC(O)CCB(O)O Amb24594819 [1,0,0,0,0,1|1,0,1]=4 5880 B7R0.6 CC(O)CCC(C)=C Amb24062974 [1,0,0,0,0,1|2,0,0]=4 5881 B7R0.6 CC(O)CCC(C)=O Amb25829594 [1,0,0,0,0,1|1,0,0]=3 5882 B7R0.6 CC(O)CCC(O)=O Amb18294804 [1,0,0,0,0,1|0,0,0]=2 5883 B7R0.6 CC(O)CN=C(C)N Amb24370924 [1,0,0,0,0,1|2,0,0]=4 5884 B7R0.6 CC(O)CNS(C)=O Amb24536649 [1,0,0,0,0,1|2,0,0]=4 5885 B7R0.6 CC(O)COC(C)=O Amb24056158 [1,0,0,0,0,1|1,0,0]=3 5886 B7R0.6 CC(O)COP(O)=O Amb24591406 [1,0,0,0,0,1|1,0,0]=3 5887 B7R0.6 CC(O)COP(O)O Amb24475185 [1,0,0,0,0,1|1,0,1]=4 5888 B7R0.6 CC(O)CSC(N)=N Amb25168714 [1,0,0,0,0,1|2,0,0]=4 5889 B7R0.6 CC(O)CSC(N)=S Amb24652391 [1,0,0,0,0,1|1,1,0]=4 5890 B7R0.6 CC(O)NCC(O)=O Amb25141558 [1,0,0,0,0,1|0,0,0]=2 5891 B7R0.6 CC(O)OCC(C)=C Amb24333382 [1,0,0,0,0,1|2,0,0]=4 5892 B7R0.6 CC(O)\C=C\C(C)=O Amb25334941 [1,0,0,0,0,1|1,0,1]=4 5893 B7R0.6 CC(O)\C=C\C(N)=O Amb24597646 [1,0,0,0,0,1|1,0,1]=4 5894 B7R0.6 CC(O)\C=C\C(O)=O Amb18641876 [1,0,0,0,0,1|0,0,1]=3 5895 B7R0.6 CC(S)CNC(C)=O Amb24695989 [1,0,0,0,0,1|1,1,0]=4 5896 B7R0.6 CC(S)\C=C\C(O)=O Amb18124362 [1,0,0,0,0,1|0,1,1]=4 5897 B7R0.6 CC(SCC(=O)O)C Amb1128460 [1,0,0,0,0,1|1,0,0]=3 5898 B7R0.6 CN(C)CCC(O)=O Amb19888182 [1,0,0,0,0,1|2,0,0]=4 5899 B7R0.6 CN(C)NCC(O)=O Amb24481366 [1,0,0,0,0,1|2,0,0]=4 5900 B7R0.6 CS(=O)CCC(O)=O Amb18523762 [1,0,0,0,0,1|1,0,1]=4 5901 B7R0.6 CS(=O)NCC(O)=O Amb25237322 [1,0,0,0,0,1|1,0,1]=4 5902 B7R0.6 C[C@@H](COC(=O)O)O Amb16232417 [1,0,0,0,0,1|0,0,0]=2 5903 B7R0.6 C[C@@H](O)C#CC(O)=O Amb24334413 [1,0,0,0,0,1|0,0,1]=3 5904 B7R0.6 C[C@@H](O)CCB(O)O Amb25683632 [1,0,0,0,0,1|1,0,1]=4 5905 B7R0.6 C[C@@H](O)CCC(C)=C Amb22896943 [1,0,0,0,0,1|2,0,0]=4 5906 B7R0.6 C[C@@H](O)CCC(C)=O Amb22351150 [1,0,0,0,0,1|1,0,0]=3 5907 B7R0.6 C[C@@H](O)CCC(C)O Amb25846912 [1,0,0,0,0,1|1,0,1]=4 5908 B7R0.6 C[C@@H](O)CN=C(C)N Amb25026449 [1,0,0,0,0,1|2,0,0]=4 5909 B7R0.6 C[C@@H](O)CNC(C)=O Amb25133822 [1,0,0,0,0,1|1,0,0]=3 5910 B7R0.6 C[C@@H](O)COC(C)=O Amb25832756 [1,0,0,0,0,1|1,0,0]=3 5911 B7R0.6 C[C@@H](S)CCC(O)=O Amb24587370 [1,0,0,0,0,1|0,1,0]=3 5912 B7R0.6 C[C@H](N)CCC(O)=O Amb25047328 [1,0,0,0,0,1|1,0,0]=3 5913 B7R0.6 C[C@H](O)CNC(N)=N Amb24501581 [1,0,0,0,0,1|2,0,0]=4 5914 B7R0.6 C[C@H](O)CNC(N)=O Amb24384732 [1,0,0,0,0,1|1,0,0]=3 5915 B7R0.6 C[C@H](O)CSC(C)=O Amb25256687 [1,0,0,0,0,1|1,0,0]=3 5916 B7R0.6 C[S+](C)CCC(O)=O Amb22730539 [1,0,0,0,0,1|2,0,0]=4 5917 B7R0.6 OB(O)CCC(O)=O Amb24640288 [1,0,0,0,0,1|2,0,0]=4 5918 B7R0.6 OC(=O)CCC(Cl)Cl Amb25059214 [1,0,0,0,0,1|2,0,0]=4 5919 B7R0.6 OC(=O)CCC(F)F Amb20623135 [1,0,0,0,0,1|2,0,0]=4 5920 B7R0.6 OC(=O)CCC(O)=O Amb22168124 [1,0,0,0,0,1|1,0,1]=4 5921 B7R0.6 OC(=O)CCC(O)=O Amb22349196 [1,0,0,0,0,1|1,0,1]=4 5922 B7R0.6 OC(=O)CCC(O)=O Amb22353352 [1,0,0,0,0,1|1,0,1]=4 5923 B7R0.6 OC(=O)CCC(O)=O Amb22360649 [1,0,0,0,0,1|1,0,1]=4 5924 B7R0.6 OC(=O)C[13CH2][13C](O)=O Amb22353421 [1,0,0,0,0,1|1,0,1]=4 5925 B7R0.6 OC(=O)SCC(O)=O Amb24699018 [1,0,0,0,0,1|1,0,1]=4 5926 B7R0.6 OC(=O)[13CH2][13CH2]C(O)=O Amb22338081 [1,0,0,0,0,1|1,0,1]=4 5927 B7R0.6 OC(=O)[14CH2][14CH2]C(O)=O Amb22337597 [1,0,0,0,0,1|1,0,1]=4 5928 B7R0.6 OC(=S)CCC(O)=O Amb24586272 [1,0,0,0,0,1|1,0,1]=4 5929 B7R0.6 OC(O)CCC(O)=O Amb25762802 [1,0,0,0,0,1|1,0,0]=3 5930 B7R0.6 O[13C](=O)CC[13C](O)=O Amb22056173 [1,0,0,0,0,1|1,0,1]=4 5931 B7R0.6 O[13C](=O)[13CH2][13CH2][13C](O)=O Amb22056172 [1,0,0,0,0,1|1,0,1]=4 5932 B7R0.6 O[14C](=O)CC[14C](O)=O Amb22352661 [1,0,0,0,0,1|1,0,1]=4 5933 B7R0.6 [13CH3][13C](=O)[13CH2]CC(O)=O Amb22056002 [1,0,0,0,0,1|0,0,2]=4 5934 B9R0.7 CC(=C)CC[C@@H](N)C(O)=O Amb25775219 [0,0,0,0,0,2|1,0,1]=4 5935 B9R0.7 CC(=O)CCC(N)C(O)=O Amb20669473 [0,0,0,0,0,2|0,0,2]=4 5936 B9R0.7 CC(=O)CCC(N)C(O)=O Amb22157242 [0,0,0,0,0,2|0,0,2]=4 5937 B9R0.7 CC(=O)CC[C@@H](N)C(O)=O Amb19130479 [0,0,0,0,0,2|0,0,2]=4 5938 B9R0.7 CC(=O)CC[C@H](N)C(O)=O Amb25147501 [0,0,0,0,0,2|0,0,2]=4 5939 B9R0.7 CC(=O)NC[C@H](N)C(O)=O Amb25772091 [0,0,0,0,0,2|0,0,2]=4 5940 B9R0.7 CC(=O)OCC(C(=O)O)N Amb17593668 [0,0,0,0,0,2|0,0,2]=4 5941 B9R0.7 CC(=O)OC[C@@H](N)C(O)=O Amb22756697 [0,0,0,0,0,2|0,0,2]=4 5942 B9R0.7 CC(=O)SCC(N)C(O)=O Amb22490452 [0,0,0,0,0,2|0,0,2]=4 5943 B9R0.7 CC(=O)SC[C@@H](C(=O)O)N Amb16185419 [0,0,0,0,0,2|0,0,2]=4 5944 B9R0.7 CC(=O)[C@@H](N)CCC(O)=O Amb24386065 [0,0,0,0,0,2|0,0,2]=4 5945 B9R0.7 CC(Br)C(Br)\C=C\C(O)=O Amb22347457 [0,0,0,0,0,2|2,0,0]=4 5946 B9R0.7 CC(Br)C(O)\C=C\C(O)=O Amb24611190 [0,0,0,0,0,2|2,0,0]=4 5947 B9R0.7 CC(C)=CC[C@H](N)C(O)=O Amb25836895 [0,0,0,0,0,2|1,0,1]=4 5948 B9R0.7 CC(C)C(Br)CCC(O)=O Amb24640345 [0,0,0,0,0,2|2,0,0]=4 5949 B9R0.7 CC(C)C(Br)\C=C\C(O)=O Amb25733509 [0,0,0,0,0,2|2,0,0]=4 5950 B9R0.7 CC(C)C(C)CCC(O)=O Amb25843702 [0,0,0,0,0,2|2,0,0]=4 5951 B9R0.7 CC(C)C(C)OCC(O)=O Amb24479217 [0,0,0,0,0,2|2,0,0]=4 5952 B9R0.7 CC(C)C(Cl)CCC(O)=O Amb24413514 [0,0,0,0,0,2|2,0,0]=4 5953 B9R0.7 CC(C)C(F)CCC(O)=O Amb24480880 [0,0,0,0,0,2|2,0,0]=4 5954 B9R0.7 CC(C)C(N)CCC(O)=O Amb18124745 [0,0,0,0,0,2|1,0,0]=3 5955 B9R0.7 CC(C)C(N)CNC(C)=O Amb24757730 [0,0,0,0,0,2|2,0,0]=4 5956 B9R0.7 CC(C)C(N)\C=C\C(O)=O Amb24397928 [0,0,0,0,0,2|1,0,0]=3 5957 B9R0.7 CC(C)C(O)C#CC(O)=O Amb17779780 [0,0,0,0,0,2|2,0,0]=4 5958 B9R0.7 CC(C)C(O)CCC(O)=O Amb25252592 [0,0,0,0,0,2|2,0,0]=4 5959 B9R0.7 CC(C)C(S)CCC(O)=O Amb25723893 [0,0,0,0,0,2|2,0,0]=4 5960 B9R0.7 CC(C)C=NC(C)C(O)=O Amb24356117 [0,0,0,0,0,2|2,0,0]=4 5961 B9R0.7 CC(C)CCC(Br)C(O)=O Amb18131059 [0,0,0,0,0,2|2,0,0]=4 5962 B9R0.7 CC(C)CCC(C)C(O)=O Amb19033547 [0,0,0,0,0,2|2,0,0]=4 5963 B9R0.7 CC(C)CCC(N)C(C)=O Amb18831542 [0,0,0,0,0,2|2,0,0]=4 5964 B9R0.7 CC(C)CCC(N)C(O)=O Amb19269152 [0,0,0,0,0,2|1,0,0]=3 5965 B9R0.7 CC(C)CC[C@@H](N)C(=O)Cl Amb25086091 [0,0,0,0,0,2|2,0,0]=4 5966 B9R0.7 CC(C)CC[C@@H](N)C(O)=O Amb19133196 [0,0,0,0,0,2|1,0,0]=3 5967 B9R0.7 CC(C)CC[C@@H](N)C(O)=O Amb22899130 [0,0,0,0,0,2|1,0,0]=3 5968 B9R0.7 CC(C)CN[C@H](C)C(O)=O Amb25300819 [0,0,0,0,0,2|2,0,0]=4 5969 B9R0.7 CC(C)NCC(N)C(O)=O Amb25790256 [0,0,0,0,0,2|1,0,0]=3 5970 B9R0.7 CC(C)NC[C@H](N)C(O)=O Amb24682685 [0,0,0,0,0,2|1,0,0]=3 5971 B9R0.7 CC(C)NC[C@H](O)C(O)=O Amb24479668 [0,0,0,0,0,2|2,0,0]=4 5972 B9R0.7 CC(C)NNC(C)C(O)=O Amb24070154 [0,0,0,0,0,2|2,0,0]=4 5973 B9R0.7 CC(C)OCC(N)C(N)=O Amb25104507 [0,0,0,0,0,2|2,0,0]=4 5974 B9R0.7 CC(C)OCC(O)C(O)=O Amb24583914 [0,0,0,0,0,2|2,0,0]=4 5975 B9R0.7 CC(C)OC[C@@H](N)C(N)=O Amb25267850 [0,0,0,0,0,2|2,0,0]=4 5976 B9R0.7 CC(C)OC[C@@H](N)C(O)=O Amb24479342 [0,0,0,0,0,2|1,0,0]=3 5977 B9R0.7 CC(C)OC[C@H](O)C(O)=O Amb24480796 [0,0,0,0,0,2|2,0,0]=4 5978 B9R0.7 CC(C)SCC(C)C(O)=O Amb18303880 [0,0,0,0,0,2|2,0,0]=4 5979 B9R0.7 CC(C)SCC(N)C(N)=O Amb18788147 [0,0,0,0,0,2|2,0,0]=4 5980 B9R0.7 CC(C)SCC(O)C(O)=O Amb24728812 [0,0,0,0,0,2|2,0,0]=4 5981 B9R0.7 CC(C)SC[C@@H](N)C(O)=O Amb18792510 [0,0,0,0,0,2|1,0,0]=3 5982 B9R0.7 CC(C)SC[C@H](N)C(O)=O Amb25087870 [0,0,0,0,0,2|1,0,0]=3 5983 B9R0.7 CC(C)SC[C@H](O)C(O)=O Amb25362660 [0,0,0,0,0,2|2,0,0]=4 5984 B9R0.7 CC(C)[C@@H](C)CCC(O)=O Amb25076667 [0,0,0,0,0,2|2,0,0]=4 5985 B9R0.7 CC(C)[C@@H](O)C#CC(O)=O Amb25849331 [0,0,0,0,0,2|2,0,0]=4 5986 B9R0.7 CC(C)[C@H](N)C#CC(O)=O Amb25147536 [0,0,0,0,0,2|1,0,0]=3 5987 B9R0.7 CC(C)[C@H](N)CCC(O)=O Amb24452899 [0,0,0,0,0,2|1,0,0]=3 5988 B9R0.7 CC(C)\C=N\[C@@H](C)C(O)=O Amb24446744 [0,0,0,0,0,2|2,0,0]=4 5989 B9R0.7 CC(C)\C=N\[C@H](C)C(O)=O Amb25264740 [0,0,0,0,0,2|2,0,0]=4 5990 B9R0.7 CC(CCC(C)Br)C(O)=O Amb24452260 [0,0,0,0,0,2|2,0,0]=4 5991 B9R0.7 CC(COC(C)=O)C(C)O Amb24719537 [0,0,0,0,0,2|2,0,0]=4 5992 B9R0.7 CC(Cl)=CCC(N)C(O)=O Amb25326840 [0,0,0,0,0,2|1,0,1]=4 5993 B9R0.7 CC(Cl)=CC[C@H](N)C(O)=O Amb24518555 [0,0,0,0,0,2|1,0,1]=4 5994 B9R0.7 CC(Cl)C(O)CCC(O)=O Amb24677604 [0,0,0,0,0,2|2,0,0]=4 5995 B9R0.7 CC(Cl)C(O)\C=C\C(O)=O Amb24739825 [0,0,0,0,0,2|2,0,0]=4 5996 B9R0.7 CC(Cl)CCC(N)C(O)=O Amb24692699 [0,0,0,0,0,2|1,0,0]=3 5997 B9R0.7 CC(Cl)CC[C@H](N)C(O)=O Amb24692939 [0,0,0,0,0,2|1,0,0]=3 5998 B9R0.7 CC(F)=CCC(N)C(O)=O Amb24354283 [0,0,0,0,0,2|1,0,1]=4 5999 B9R0.7 CC(F)C(O)CCC(O)=O Amb25831840 [0,0,0,0,0,2|2,0,0]=4 6000 B9R0.7 CC(N)C(N)CCC(O)=O Amb24377171 [0,0,0,0,0,2|1,0,0]=3 6001 B9R0.7 CC(NCC(C)N)C(O)=O Amb24599775 [0,0,0,0,0,2|2,0,0]=4 6002 B9R0.7 CC(NCC(O)=O)C(C)N Amb24637505 [0,0,0,0,0,2|2,0,0]=4 6003 B9R0.7 CC(NC[C@@H](C)O)C(N)=O Amb25702192 [0,0,0,0,0,2|2,0,0]=4 6004 B9R0.7 CC(O)C(=O)CCC(O)=O Amb25825263 [0,0,0,0,0,2|1,0,1]=4 6005 B9R0.7 CC(O)C(=O)NCC(O)=O Amb24640434 [0,0,0,0,0,2|1,0,1]=4 6006 B9R0.7 CC(O)C(C)C#CC(O)=O Amb25310844 [0,0,0,0,0,2|1,0,0]=3 6007 B9R0.7 CC(O)C(C)OCC(O)=O Amb25185257 [0,0,0,0,0,2|1,0,0]=3 6008 B9R0.7 CC(O)C(N)CNC(N)=O Amb25809645 [0,0,0,0,0,2|1,0,0]=3 6009 B9R0.7 CC(O)C(O)CCC(O)=O Amb25054706 [0,0,0,0,0,2|1,0,0]=3 6010 B9R0.7 CC(O)C(O)\C=C\C(C)=O Amb24633535 [0,0,0,0,0,2|2,0,0]=4 6011 B9R0.7 CC(O)C(O)\C=C\C(O)=O Amb24470539 [0,0,0,0,0,2|1,0,0]=3 6012 B9R0.7 CC(O)CCC(=C)C(O)=O Amb24375911 [0,0,0,0,0,2|1,0,1]=4 6013 B9R0.7 CC(O)CCC(C)C(O)=O Amb25848509 [0,0,0,0,0,2|1,0,0]=3 6014 B9R0.7 CC(O)CCC(F)C(C)=O Amb25093785 [0,0,0,0,0,2|2,0,0]=4 6015 B9R0.7 CC(O)CNC(C)C(O)=O Amb18523859 [0,0,0,0,0,2|1,0,0]=3 6016 B9R0.7 CC(O)CN[C@@H](C)C(O)=O Amb25129862 [0,0,0,0,0,2|1,0,0]=3 6017 B9R0.7 CC(O)COC(C)C(O)=O Amb25146942 [0,0,0,0,0,2|1,0,0]=3 6018 B9R0.7 CC(O)CSC(C)C(O)=O Amb18303285 [0,0,0,0,0,2|1,0,0]=3 6019 B9R0.7 CC(O)NC[C@H](N)C(O)=O Amb24575047 [0,0,0,0,0,2|0,0,0]=2 6020 B9R0.7 CC(OCC(C)F)C(O)=O Amb25350495 [0,0,0,0,0,2|2,0,0]=4 6021 B9R0.7 CC(SCC(C)N)C(O)=O Amb25224815 [0,0,0,0,0,2|2,0,0]=4 6022 B9R0.7 CC(SCC(N)=O)C(C)O Amb24426482 [0,0,0,0,0,2|2,0,0]=4 6023 B9R0.7 CC(\C=C\C(C)N)C(O)=O Amb24374810 [0,0,0,0,0,2|2,0,0]=4 6024 B9R0.7 CC(\C=C\[C@@H](C)N)C(O)=O Amb24401528 [0,0,0,0,0,2|2,0,0]=4 6025 B9R0.7 CN(C)CC[C@H](N)C(O)=O Amb25108550 [0,0,0,0,0,2|2,0,0]=4 6026 B9R0.7 CP(=O)OCC(N)C(O)=O Amb24724745 [0,0,0,0,0,2|1,0,1]=4 6027 B9R0.7 CP(=O)OC[C@H](N)C(O)=O Amb25362185 [0,0,0,0,0,2|1,0,1]=4 6028 B9R0.7 CP(O)CCC(N)C(O)=O Amb25295427 [0,0,0,0,0,2|1,0,0]=3 6029 B9R0.7 CS(=N)CCC(N)C(O)=O Amb25243030 [0,0,0,0,0,2|2,0,0]=4 6030 B9R0.7 CS(=N)CC[C@H](N)C(O)=O Amb25100927 [0,0,0,0,0,2|2,0,0]=4 6031 B9R0.7 CS(=O)CC[C@@H](N)C(O)=O Amb19133021 [0,0,0,0,0,2|1,0,1]=4 6032 B9R0.7 CS(=O)NC[C@H](N)C(O)=O Amb25798536 [0,0,0,0,0,2|1,0,1]=4 6033 B9R0.7 CS(C)CCC(N)C(O)=O Amb25695887 [0,0,0,0,0,2|2,0,0]=4 6034 B9R0.7 CS(C)CC[C@H](N)C(O)=O Amb24440849 [0,0,0,0,0,2|2,0,0]=4 6035 B9R0.7 C[C@@H](CCC(C)=O)[C@@H](C)O Amb22747043 [0,0,0,0,0,2|2,0,0]=4 6036 B9R0.7 C[C@@H](F)[C@H](N)CCC(O)=O Amb25042508 [0,0,0,0,0,2|1,0,0]=3 6037 B9R0.7 C[C@@H](O)[C@H](C)SCC(O)=O Amb25774489 [0,0,0,0,0,2|1,0,0]=3 6038 B9R0.7 C[C@H](N)CC[C@@H](N)C(O)=O Amb25199121 [0,0,0,0,0,2|1,0,0]=3 6039 B9R0.7 C[C@H](O)CC[C@@H](C)C(O)=O Amb25378744 [0,0,0,0,0,2|1,0,0]=3 6040 B9R0.7 C[C@H](O)CNC(=O)C(O)=O Amb25853206 [0,0,0,0,0,2|1,0,1]=4 6041 B9R0.7 C[C@H](O)[C@@H](O)\C=C\C(C)=O Amb24614850 [0,0,0,0,0,2|2,0,0]=4 6042 B9R0.7 C[C@H](O)[C@H](C)CCC(O)=O Amb25340448 [0,0,0,0,0,2|1,0,0]=3 6043 B9R0.7 C[C@H](O)[C@H](O)CCC(N)=O Amb25138530 [0,0,0,0,0,2|2,0,0]=4 6044 B9R0.7 C[S+](C)CC[C@@H](N)C(O)=O Amb22800534 [0,0,0,0,0,2|2,0,0]=4 6045 B9R0.7 C[S+](C)CC[C@@H](N)C(O)=O Amb22800551 [0,0,0,0,0,2|2,0,0]=4 6046 B9R0.7 C\C(=C\CC(C)O)\C(O)=O Amb25368118 [0,0,0,0,0,2|1,0,1]=4 6047 B9R0.7 C\C(\Cl)=C\CC(N)C(O)=O Amb24692752 [0,0,0,0,0,2|1,0,1]=4 6048 B9R0.7 C\C(\Cl)=C\C[C@H](N)C(O)=O Amb24629700 [0,0,0,0,0,2|1,0,1]=4 6049 B9R0.7 NC(CCB(O)O)C(O)=O Amb22497480 [0,0,0,0,0,2|2,0,0]=4 6050 B9R0.7 NC(CCC(O)=O)C(F)F Amb19148415 [0,0,0,0,0,2|2,0,0]=4 6051 B9R0.7 NC(CCC(O)=O)C(O)=O Amb22350008 [0,0,0,0,0,2|1,0,1]=4 6052 B9R0.7 NC(CCC(O)=O)C(O)=O Amb22350165 [0,0,0,0,0,2|1,0,1]=4 6053 B9R0.7 NC(CCC(O)=O)P(O)=O Amb24340498 [0,0,0,0,0,2|2,0,0]=4 6054 B9R0.7 NC(CCC(O)=O)[13C](O)=O Amb22367384 [0,0,0,0,0,2|1,0,1]=4 6055 B9R0.7 NC(CCC(O)=S)C(O)=O Amb25039924 [0,0,0,0,0,2|1,0,1]=4 6056 B9R0.7 NC(CCP(O)=O)C(O)=O Amb25276313 [0,0,0,0,0,2|2,0,0]=4 6057 B9R0.7 NC(CCS(O)=O)C(O)=O Amb22349645 [0,0,0,0,0,2|2,0,0]=4 6058 B9R0.7 NC(CC[13C](O)=O)C(O)=O Amb22366853 [0,0,0,0,0,2|1,0,1]=4 6059 B9R0.7 N[C@@H](CCC(O)=O)[13C](O)=O Amb22353662 [0,0,0,0,0,2|1,0,1]=4 6060 B9R0.7 N[C@@H](CCC(O)=S)C(O)=O Amb24480492 [0,0,0,0,0,2|1,0,1]=4 6061 B9R0.7 N[C@@H](CCP(O)=O)C(O)=O Amb22904307 [0,0,0,0,0,2|2,0,0]=4 6062 B9R0.7 N[C@@H](CSC(F)F)C(O)=O Amb18180315 [0,0,0,0,0,2|2,0,0]=4 6063 B9R0.7 N[C@@H]([13CH2]CC(O)=O)C(O)=O Amb22338711 [0,0,0,0,0,2|1,0,1]=4 6064 B9R0.7 N[C@H](C(=O)O)CCC(C)C Amb16183866 [0,0,0,0,0,2|1,0,0]=3 6065 B9R0.7 N[C@H](C(=O)O)CC[S+](C)C Amb10601599 [0,0,0,0,0,2|2,0,0]=4 6066 B9R0.7 N[C@H](CCS(O)=O)C(O)=O Amb24099404 [0,0,0,0,0,2|2,0,0]=4 6067 B9R0.7 OC(=O)CCC(C(=O)O)N Amb1778181 [0,0,0,0,0,2|1,0,1]=4 6068 B9R0.7 [15NH2]C(CCC(O)=O)C(O)=O Amb22336520 [0,0,0,0,0,2|1,0,1]=4 6069 B9R0.7 [15NH2][13C@@H]([13CH2][13CH2][13C](O)=O)[13C](O)=O Amb22353585 [0,0,0,0,0,2|1,0,1]=4 6070 B9R0.53 CC(C)CC(N)CC(N)=O Amb25785407 [0,0,0,0,0,2|2,0,0]=4 6071 B9R0.53 CC(C)C[C@@H](C)CC(O)=O Amb24455134 [0,0,0,0,0,2|2,0,0]=4 6072 B9R0.53 CC(C)C[C@H](N)CC(O)=O Amb19944305 [0,0,0,0,0,2|1,0,0]=3 6073 B9R0.53 CC(C)C[C@H](O)CC(O)=O Amb24505145 [0,0,0,0,0,2|2,0,0]=4 6074 B9R0.53 CC(C)O[C@H](C)CC(O)=O Amb24463494 [0,0,0,0,0,2|2,0,0]=4 6075 B9R0.53 CC(C)SC(C)CC(O)=O Amb18303284 [0,0,0,0,0,2|2,0,0]=4 6076 B9R0.53 CC(CC(C)O)NC(C)=O Amb25211368 [0,0,0,0,0,2|2,0,0]=4 6077 B9R0.53 CC(CC(CC(=O)O)N)C Amb2438867 [0,0,0,0,0,2|1,0,0]=3 6078 B9R0.53 CC(CC(CC(=O)O)O)C Amb17232005 [0,0,0,0,0,2|2,0,0]=4 6079 B9R0.53 CC(C[C@@H](CC(=O)O)C)C Amb10844383 [0,0,0,0,0,2|2,0,0]=4 6080 B9R0.53 CC(C[C@@H](CC(=O)O)N)C Amb16184017 [0,0,0,0,0,2|1,0,0]=3 6081 B9R0.53 CC(O)CN(C)CC(O)=O Amb18312778 [0,0,0,0,0,2|2,0,0]=4 6082 B9R0.53 CN(C)CC(N)CC(O)=O Amb18644281 [0,0,0,0,0,2|2,0,0]=4 6083 B9R0.53 CN(O)CC(O)CC(O)=O Amb24611959 [0,0,0,0,0,2|2,0,0]=4 6084 B9R0.53 CS(=O)CC(N)CC(O)=O Amb25766509 [0,0,0,0,0,2|1,0,1]=4 6085 B9R0.53 CS(=O)C[C@@H](N)CC(O)=O Amb25321945 [0,0,0,0,0,2|1,0,1]=4 6086 B9R0.53 C[C@@H](C[C@@H](C)O)OC(C)=O Amb25722158 [0,0,0,0,0,2|2,0,0]=4 6087 B9R0.53 C[C@H](C[C@@H](C)O)NC(C)=O Amb24597644 [0,0,0,0,0,2|2,0,0]=4 6088 B9R0.53 C[C@H](C[C@@H](C)O)OC(C)=O Amb24386965 [0,0,0,0,0,2|2,0,0]=4 6089 B9R0.53 C[C@H](C[C@H](C)O)OC(C)=O Amb24474272 [0,0,0,0,0,2|2,0,0]=4 6090 B9R0.53 C[C@H](N)C[C@H](N)CC(O)=O Amb24418565 [0,0,0,0,0,2|1,0,0]=3 6091 B9R0.53 NC(CC(=O)O)CC(=O)O Amb16184013 [0,0,0,0,0,2|1,0,1]=4