0 B5R0.1 C(C(=O)O)ON AOA [0,0,0,0,0,0|3,0,1]=4 1 B5R0.1 C(CN)C(=O)O BAL [0,0,0,0,0,0|2,0,2]=4 2 B5R0.1 C(CO)C(=O)O 3OH [0,0,0,0,0,0|2,0,2]=4 3 B5R0.1 C(CS)C(=O)O MPT [0,0,0,0,0,0|2,0,2]=4 4 B5R0.1 C(C[SeH])C(=O)O SLP [0,0,0,0,0,0|2,0,2]=4 5 B5R0.1 CC(=O)CCO BUQ [0,0,0,0,0,0|1,0,2]=3 6 B5R0.1 CC=CC(=O)O BEO [0,0,0,0,0,0|1,0,0]=1 7 B5R0.1 CCCC(=O)C PNH [0,0,0,0,0,0|0,0,2]=2 8 B5R0.1 CCCC(=O)N BMD [0,0,0,0,0,0|1,0,2]=3 9 B5R0.1 CCCC(=O)O BUA [0,0,0,0,0,0|1,0,2]=3 10 B5R0.1 CCC[N+](=O)[O-] N1P [0,0,0,0,0,0|2,0,2]=4 11 B5R0.1 CCOC(=O)C EEE [0,0,0,0,0,0|1,0,1]=2 12 B5R0.1 CCOC(=O)O 01F [0,0,0,0,0,0|2,0,1]=3 13 B5R0.1 CCO[P@H](=O)O ATJ [0,0,0,0,0,0|3,0,1]=4 14 B5R0.1 CCSC(=N)N ITU [0,0,0,0,0,0|3,0,1]=4 15 B5R0.1 CCSC(=N)N SEU [0,0,0,0,0,0|3,0,1]=4 16 B5R0.1 CNCC(=O)O MGY [0,0,0,0,0,0|2,0,1]=3 17 B5R0.1 CNCC(=O)O SAR [0,0,0,0,0,0|2,0,1]=3 18 B5R0.1 CSCC(=O)[O-] MTG [0,0,0,0,0,0|2,0,1]=3 19 B5R0.1 CSC[S@@](=O)C DSS [0,0,0,0,0,0|2,0,1]=3 20 B5R0.1 C[C@H](CC=O)O 5KO [0,0,0,0,0,0|1,0,3]=4 21 B5R0.1 C[Se]CC(=O)[O-] MSF [0,0,0,0,0,0|2,0,1]=3 22 B5R0.1 C[Te]CC(=O)[O-] MTD [0,0,0,0,0,0|2,0,1]=3 23 B5R0.1 N=C(/N)\NCC EGD [0,0,0,0,0,0|3,0,1]=4 24 B5R0.1 N=C(\N)/[Se]CC ISU [0,0,0,0,0,0|3,0,1]=4 25 B4R0.1 C(=C(Cl)Cl)Cl TCV [1,0,0,0,0,0|3,0,0]=4 26 B4R0.1 C(=O)(N)NO NHY [1,0,0,0,0,0|3,0,0]=4 27 B4R0.1 C(=O)C(=O)O GLV [1,0,0,0,0,0|2,0,0]=3 28 B4R0.1 C(C(=O)N)F FTM [1,0,0,0,0,0|2,0,1]=4 29 B4R0.1 C(C(=O)N)N GM1 [1,0,0,0,0,0|2,0,1]=4 30 B4R0.1 C(C(=O)O)Br BRM [1,0,0,0,0,0|2,0,1]=4 31 B4R0.1 C(C(=O)O)Br BXA [1,0,0,0,0,0|2,0,1]=4 32 B4R0.1 C(C(=O)O)Cl R3W [1,0,0,0,0,0|2,0,1]=4 33 B4R0.1 C(C(=O)O)F FAH [1,0,0,0,0,0|2,0,1]=4 34 B4R0.1 C(C(=O)O)I 04E [1,0,0,0,0,0|2,0,1]=4 35 B4R0.1 C(C(=O)O)N GLY [1,0,0,0,0,0|2,0,1]=4 36 B4R0.1 C(C(=O)O)N GLY_LFOH [1,0,0,0,0,0|2,0,1]=4 37 B4R0.1 C(C(=O)O)O GOA [1,0,0,0,0,0|2,0,1]=4 38 B4R0.1 C(C(=O)O)S MCR [1,0,0,0,0,0|2,0,1]=4 39 B4R0.1 C(C(=O)O)[NH-] GLY_LEO2H [1,0,0,0,0,0|2,0,1]=4 40 B4R0.1 C(C(=O)S)N GL3 [1,0,0,0,0,0|2,0,1]=4 41 B4R0.1 C(C(=O)[O-])[NH-] GLY_LEO2 [1,0,0,0,0,0|2,0,1]=4 42 B4R0.1 C(C(=O)[O-])[NH3+] GLY_LFZW [1,0,0,0,0,0|2,0,1]=4 43 B4R0.1 C=CC(=O)N 1HC [1,0,0,0,0,0|1,0,0]=2 44 B4R0.1 C=CC(=O)O AKR [1,0,0,0,0,0|1,0,0]=2 45 B4R0.1 CC(=C)C=C 61G [1,0,0,0,0,0|1,0,0]=2 46 B4R0.1 CC(=C)CN IRS [1,0,0,0,0,0|2,0,1]=4 47 B4R0.1 CC(=O)C=O PVL [1,0,0,0,0,0|1,0,0]=2 48 B4R0.1 CC(=O)CCl ATO [1,0,0,0,0,0|1,0,1]=3 49 B4R0.1 CC(=O)CN GCM [1,0,0,0,0,0|1,0,1]=3 50 B4R0.1 CC(=O)CN GLM [1,0,0,0,0,0|1,0,1]=3 51 B4R0.1 CC(=O)CO 4Y8 [1,0,0,0,0,0|1,0,1]=3 52 B4R0.1 CC(=O)NC NML [1,0,0,0,0,0|1,0,0]=2 53 B4R0.1 CC(=O)NO HAE [1,0,0,0,0,0|2,0,0]=3 54 B4R0.1 CC(=O)OO F50 [1,0,0,0,0,0|2,0,0]=3 55 B4R0.1 CC(=O)O[Hg+] MAC [1,0,0,0,0,0|2,0,0]=3 56 B4R0.1 CC(C)C=O 5OZ [1,0,0,0,0,0|2,0,1]=4 57 B4R0.1 CC=C(C)C 2MB [1,0,0,0,0,0|1,0,0]=2 58 B4R0.1 CCC(=O)N ROP [1,0,0,0,0,0|1,0,1]=3 59 B4R0.1 CCC(=O)O PPI [1,0,0,0,0,0|1,0,1]=3 60 B4R0.1 CC[C@H](C)O SBT [1,0,0,0,0,0|0,0,3]=4 61 B4R0.1 CC[N+](=O)[O-] NIE [1,0,0,0,0,0|2,0,1]=4 62 B4R0.1 CN(C)C=O DMF [1,0,0,0,0,0|3,0,0]=4 63 B4R0.1 CNC(=O)N NMU [1,0,0,0,0,0|2,0,0]=3 64 B4R0.1 CNC(=O)O RGI [1,0,0,0,0,0|2,0,0]=3 65 B4R0.1 COC(=O)O 000 [1,0,0,0,0,0|2,0,0]=3 66 B4R0.1 C[C@@H](C=O)N 5XU [1,0,0,0,0,0|2,0,1]=4 67 B4R0.1 N=C(\N)/NC MGX [1,0,0,0,0,0|3,0,0]=4 68 B4R0.2 C(C=O)C=O MDD [1,0,0,0,0,0|1,0,1]=3 69 B4R0.2 C(CS)C=O MPR [1,0,0,0,0,0|1,0,2]=4 70 B4R0.2 C/C=C/C=O CRD [1,0,0,0,0,0|0,0,0]=1 71 B4R0.2 CC/C=N\O PXO [1,0,0,0,0,0|1,0,2]=4 72 B4R0.2 CCCCC LNK [1,0,0,0,0,0|0,0,3]=4 73 B4R0.2 CCOC=O ETO [1,0,0,0,0,0|1,0,1]=3 74 B4R0.2 CCOCC ETZ [1,0,0,0,0,0|1,0,2]=4 75 B6R0.1 CCC(=O)OCC CA1 [0,1,0,0,0,0|1,0,1]=3 76 B6R0.1 CCNC(=O)OC MEC [0,1,0,0,0,0|1,0,1]=3 77 B6R0.1 CCOC(=O)CN GEE [0,1,0,0,0,0|1,0,1]=3 78 B6R0.1 CCOC(=O)NC EMB [0,1,0,0,0,0|1,0,1]=3 79 B6R0.1 C\C(=C\CO)\CO 6OM [0,1,0,0,0,0|1,0,2]=4 80 B6R0.2 C(C(=O)N)C(=O)O MLM [0,1,0,0,0,0|2,0,1]=4 81 B6R0.2 C(C(=O)O)C(=O)Cl PR6 [0,1,0,0,0,0|2,0,1]=4 82 B6R0.2 C(C(=O)O)C(=O)O MLA [0,1,0,0,0,0|2,0,1]=4 83 B6R0.2 C(C(=O)[O-])C(=O)[O-] MLI [0,1,0,0,0,0|2,0,1]=4 84 B6R0.2 CC(=O)CC(=O)C P2D [0,1,0,0,0,0|0,0,1]=2 85 B6R0.2 CC(=O)CC(=O)O AAE [0,1,0,0,0,0|1,0,1]=3 86 B6R0.2 CC(=O)CC(=O)O LIN [0,1,0,0,0,0|1,0,1]=3 87 B6R0.2 CC(C)CC(=O)O IVA [0,1,0,0,0,0|1,0,2]=4 88 B6R0.2 CN(C)CC(=O)O DMG [0,1,0,0,0,0|2,0,1]=4 89 B6R0.2 CS(C)CC(=O)O 313 [0,1,0,0,0,0|2,0,1]=4 90 B6R0.2 C[C@@H](CC(=O)O)N B3A [0,1,0,0,0,0|1,0,2]=4 91 B6R0.2 C[C@@H](CC(=O)O)O 3HL [0,1,0,0,0,0|1,0,2]=4 92 B6R0.2 C[C@H](CC(=O)O)O 3HR [0,1,0,0,0,0|1,0,2]=4 93 B6R0.3 C(=C(/C(=O)O)\N)\S BB9 [0,1,0,0,0,0|2,0,0]=3 94 B6R0.3 C(=C(\C(=O)O)/N)/[SeH] 30F [0,1,0,0,0,0|2,0,0]=3 95 B6R0.3 C(C(=O)C(=O)O)Br BPV [0,1,0,0,0,0|2,0,1]=4 96 B6R0.3 C(C(=O)C(=O)O)F 65S [0,1,0,0,0,0|2,0,1]=4 97 B6R0.3 C(C(=O)C(=O)O)O 3PY [0,1,0,0,0,0|2,0,1]=4 98 B6R0.3 C/C=C(/C(=O)O)\N DBU [0,1,0,0,0,0|1,0,0]=2 99 B6R0.3 C=C(C[SeH])C(=O)O CC4 [0,1,0,0,0,0|2,0,1]=4 100 B6R0.3 C=CC(=O)C(=C)N 6R3 [0,1,0,0,0,0|1,0,2]=4 101 B6R0.3 C=C[C@@H](C(=O)O)N LVG [0,1,0,0,0,0|1,0,2]=4 102 B6R0.3 C=C[C@H](C(=O)[O-])[NH3+] A3B [0,1,0,0,0,0|1,0,2]=4 103 B6R0.3 CC(=O)[C@H](CO)O DE2 [0,1,0,0,0,0|1,0,2]=4 104 B6R0.3 CCC(=O)C(=O)O 2KT [0,1,0,0,0,0|1,0,1]=3 105 B6R0.3 CCC(C(=O)O)N AA3 [0,1,0,0,0,0|1,0,2]=4 106 B6R0.3 CC[C@@H](C(=O)O)Cl 39J [0,1,0,0,0,0|1,0,2]=4 107 B6R0.3 CC[C@@H](C(=O)O)N AB7 [0,1,0,0,0,0|1,0,2]=4 108 B6R0.3 CC[C@@H](C(=O)O)N ABA [0,1,0,0,0,0|1,0,2]=4 109 B6R0.3 CC[C@@H](C(=O)O)N UNK [0,1,0,0,0,0|1,0,2]=4 110 B6R0.3 CC[C@H](C(=O)O)N DBB [0,1,0,0,0,0|1,0,2]=4 111 B6R0.3 CC[C@H](C)C(=O)O SMB [0,1,0,0,0,0|1,0,2]=4 112 B6R0.3 CN(C=C)C(=O)O EMM [0,1,0,0,0,0|2,0,1]=4 113 B6R0.3 CNC(=C)C(=O)O DAM [0,1,0,0,0,0|2,0,0]=3 114 B6R0.3 C[C@@H](C(=O)N)NC ZZJ [0,1,0,0,0,0|2,0,1]=4 115 B6R0.3 C[C@@H](C(=O)NC)N 0NC [0,1,0,0,0,0|2,0,1]=4 116 B6R0.3 C[C@@H](C(=O)O)NC MAA [0,1,0,0,0,0|2,0,1]=4 117 B6R0.3 C[C@@H](C(=O)OC)N MA [0,1,0,0,0,0|2,0,1]=4 118 B6R0.3 C[C@H](C(=O)O)NC 33X [0,1,0,0,0,0|2,0,1]=4 119 B6R0.3 C\C=C(\C)/C(=O)O MB8 [0,1,0,0,0,0|1,0,0]=2 120 B6R0.3 N=C(/CO)\C(=O)O MH6 [0,1,0,0,0,0|2,0,1]=4 121 B6R0.3 N=C(/CO)\C(=O)O SRI [0,1,0,0,0,0|2,0,1]=4 122 B6R0.4 C(CC(=O)O)C=O SSN [0,1,0,0,0,0|2,0,1]=4 123 B6R0.4 C(CC(=O)O)CBr 0A5 [0,1,0,0,0,0|1,0,2]=4 124 B6R0.4 C(CC(=O)O)CN ABU [0,1,0,0,0,0|1,0,2]=4 125 B6R0.4 CCCCC(=O)O LEA [0,1,0,0,0,0|1,0,2]=4 126 B6R0.4 CCCCC(=O)O PEI [0,1,0,0,0,0|1,0,2]=4 127 B6R0.4 CCCOC(=O)C 4PA [0,1,0,0,0,0|0,0,2]=3 128 B6R0.4 CCNCC(=O)O 2JC [0,1,0,0,0,0|1,0,2]=4 129 B6R0.5 CCO[P@](=O)(C)O VX [0,1,0,0,0,0|2,0,1]=4 130 B6R1.2 C1CC(=O)NC1 BAQ [0,0,0,1,0,0|1,0,1]=3 131 B6R1.2 C1CC(=O)OC1 GBL [0,0,0,1,0,0|1,0,1]=3 132 B6R1.2 C1CCC(=O)C1 MFW [0,0,0,1,0,0|0,0,2]=3 133 B6R1.2 C[n+]1ccsc1 3MT [0,0,0,1,0,0|3,0,0]=4 134 B6R1.2 Cc1[nH]ccn1 2MZ [0,0,0,1,0,0|2,0,1]=4 135 B6R1.2 Cc1c[nH]cn1 4MZ [0,0,0,1,0,0|2,0,1]=4 136 B6R1.2 Cc1c[nH]nc1 4PZ [0,0,0,1,0,0|3,0,0]=4 137 B6R1.2 Cc1cc[nH]c1 5MP [0,0,0,1,0,0|2,0,0]=3 138 B6R1.2 Cn1cc[nH+]c1 1MZ [0,0,0,1,0,0|3,0,0]=4 139 B6R1.2 Cn1cccc1 MR3 [0,0,0,1,0,0|2,0,1]=4 140 B6R1.2 c1cn[nH]c1N 3AX [0,0,0,1,0,0|3,0,0]=4 141 B3R0.1 C(=C/Br)/Br CB0 [2,0,0,0,0,0|2,0,0]=4 142 B3R0.1 C(=CS)N TEE [2,0,0,0,0,0|1,1,0]=4 143 B3R0.1 C(=O)C=O GXT [2,0,0,0,0,0|1,0,0]=3 144 B3R0.1 C(C=O)N GLZ [2,0,0,0,0,0|1,0,1]=4 145 B3R0.1 C=CC#N 6AC [2,0,0,0,0,0|1,0,1]=4 146 B3R0.1 C=CCN AYE [2,0,0,0,0,0|1,0,1]=4 147 B3R0.1 C=CCO 5VQ [2,0,0,0,0,0|0,0,2]=4 148 B3R0.1 CCC=O CBG [2,0,0,0,0,0|0,0,1]=3 149 B3R0.1 CCC=O PNL [2,0,0,0,0,0|0,0,1]=3 150 B3R0.1 CCCC BUT [2,0,0,0,0,0|0,0,2]=4 151 B3R0.1 CCCC NBU [2,0,0,0,0,0|0,0,2]=4 152 B3R0.1 CCCC SBU [2,0,0,0,0,0|0,0,2]=4 153 B3R0.1 CCN=O NOE [2,0,0,0,0,0|1,0,1]=4 154 B3R0.1 CCNC ETN [2,0,0,0,0,0|1,0,1]=4 155 B3R0.1 CCOC 2ME [2,0,0,0,0,0|1,0,1]=4 156 B3R0.1 CNC=S MTF [2,0,0,0,0,0|1,1,0]=4 157 B3R0.1 C\C=C/N AKK [2,0,0,0,0,0|1,0,0]=3 158 B3R0.1 C\C=N\O AXO [2,0,0,0,0,0|1,0,1]=4 159 B3R0.2 BN(C)C 7BZ [2,0,0,0,0,0|2,0,0]=4 160 B3R0.2 C(=O)(N)N URE [2,0,0,0,0,0|2,0,0]=4 161 B3R0.2 C(=O)(N)O OUT [2,0,0,0,0,0|2,0,0]=4 162 B3R0.2 C(=O)(O)[O-] BCT [2,0,0,0,0,0|2,0,0]=4 163 B3R0.2 C(=O)([O-])[O-] CO3 [2,0,0,0,0,0|2,0,0]=4 164 B3R0.2 CC(=C)C MEB [2,0,0,0,0,0|1,0,0]=3 165 B3R0.2 CC(=O)C ACN [2,0,0,0,0,0|0,0,0]=2 166 B3R0.2 CC(=O)N ACM [2,0,0,0,0,0|1,0,0]=3 167 B3R0.2 CC(=O)N CNM [2,0,0,0,0,0|1,0,0]=3 168 B3R0.2 CC(=O)O ACY [2,0,0,0,0,0|1,0,0]=3 169 B3R0.2 CC(=O)O CBM [2,0,0,0,0,0|1,0,0]=3 170 B3R0.2 CC(=O)O CM [2,0,0,0,0,0|1,0,0]=3 171 B3R0.2 CC(=O)[O-] ACT [2,0,0,0,0,0|1,0,0]=3 172 B3R0.2 CC(C)O IOH [2,0,0,0,0,0|0,0,2]=4 173 B3R0.2 CC(C)O IPA [2,0,0,0,0,0|0,0,2]=4 174 B3R0.2 CN(C)C KEN [2,0,0,0,0,0|2,0,0]=4 175 B3R0.2 CS(=O)C DMS [2,0,0,0,0,0|1,0,0]=3 176 B3R0.2 C[P@H](=O)O MPS [2,0,0,0,0,0|2,0,0]=4 177 B3R0.2 C[P@H](=O)O SOM [2,0,0,0,0,0|2,0,0]=4 178 B3R0.2 C[P@H](=O)[O-] VXA [2,0,0,0,0,0|2,0,0]=4 179 B3R0.2 C[Pb+](C)C PBM [2,0,0,0,0,0|2,0,0]=4 180 B5R0.3 C(C(=O)CCl)Cl CHM [1,1,0,0,0,0|1,0,1]=4 181 B5R0.3 C(C(=O)CO)O 2HA [1,1,0,0,0,0|1,0,1]=4 182 B5R0.3 CNC(=O)NC MMU [1,1,0,0,0,0|1,0,0]=3 183 B5R0.3 COC(=O)CN MEU [1,1,0,0,0,0|1,0,0]=3 184 B5R0.4 C=CS(=O)(=O)O VSO [1,1,0,0,0,0|2,0,0]=4 185 B5R0.4 CSS(=O)(=O)C Z22 [1,1,0,0,0,0|2,0,0]=4 186 B5R0.5 C(=O)(C(=O)O)N OXM [1,1,0,0,0,0|2,0,0]=4 187 B5R0.5 C(=O)(C(=O)O)O OXD [1,1,0,0,0,0|2,0,0]=4 188 B5R0.5 C(=O)(C(=O)[O-])[O-] OXL [1,1,0,0,0,0|2,0,0]=4 189 B5R0.5 C=C(C(=O)N)N PYT [1,1,0,0,0,0|1,0,0]=3 190 B5R0.5 C=C(C(=O)O)N DHA [1,1,0,0,0,0|1,0,0]=3 191 B5R0.5 CC(=O)C(=O)N PYM [1,1,0,0,0,0|1,0,0]=3 192 B5R0.5 CC(=O)C(=O)O PYR [1,1,0,0,0,0|1,0,0]=3 193 B5R0.5 CC(=O)N(C)C 5Y9 [1,1,0,0,0,0|1,0,0]=3 194 B5R0.5 CC(=[NH2+])C(=O)[O-] NAK [1,1,0,0,0,0|1,0,0]=3 195 B5R0.5 CC(C)C(=O)N IBO [1,1,0,0,0,0|1,0,1]=4 196 B5R0.5 CC(C)C(=O)O ALQ [1,1,0,0,0,0|1,0,1]=4 197 B5R0.5 CC(C)C(=O)O ISB [1,1,0,0,0,0|1,0,1]=4 198 B5R0.5 C[C@@H](C(=O)C)N ALM [1,1,0,0,0,0|0,0,1]=3 199 B5R0.5 C[C@@H](C(=O)C)O HBS [1,1,0,0,0,0|0,0,1]=3 200 B5R0.5 C[C@@H](C(=O)N)N 66N [1,1,0,0,0,0|1,0,1]=4 201 B5R0.5 C[C@@H](C(=O)O)Cl CNR [1,1,0,0,0,0|1,0,1]=4 202 B5R0.5 C[C@@H](C(=O)O)N ALA [1,1,0,0,0,0|1,0,1]=4 203 B5R0.5 C[C@@H](C(=O)O)N ALA_LFOH [1,1,0,0,0,0|1,0,1]=4 204 B5R0.5 C[C@@H](C(=O)O)O 2OP [1,1,0,0,0,0|1,0,1]=4 205 B5R0.5 C[C@@H](C(=O)O)[NH-] ALA_LEO2H [1,1,0,0,0,0|1,0,1]=4 206 B5R0.5 C[C@@H](C(=O)[O-])[NH-] ALA_LEO2 [1,1,0,0,0,0|1,0,1]=4 207 B5R0.5 C[C@@H](C(=O)[O-])[NH3+] ALA_LFZW [1,1,0,0,0,0|1,0,1]=4 208 B5R0.5 C[C@H](C(=O)C)O HBR [1,1,0,0,0,0|0,0,1]=3 209 B5R0.5 C[C@H](C(=O)O)F 4LT [1,1,0,0,0,0|1,0,1]=4 210 B5R0.5 C[C@H](C(=O)O)N DAL [1,1,0,0,0,0|1,0,1]=4 211 B5R0.5 C[C@H](C(=O)O)O DLA [1,1,0,0,0,0|1,0,1]=4 212 B5R0.5 C[C@H](C(=O)O)O LAC [1,1,0,0,0,0|1,0,1]=4 213 B5R0.2 C(=CC=O)C=O 2FU [1,1,0,0,0,0|0,0,1]=3 214 B5R0.2 C(CCl)NC=O CEC [1,1,0,0,0,0|1,0,1]=4 215 B5R0.2 CCCCC=O PTL [1,1,0,0,0,0|0,0,2]=4 216 B7R0.3 COC(=O)CCCN GVE [0,2,0,0,0,0|0,0,2]=4 217 B7R0.5 C(CO)C(=O)C(=O)O VGX [0,2,0,0,0,0|1,0,1]=4 218 B7R0.5 C/C=C\C(=O)C(=O)O OXP [0,2,0,0,0,0|0,0,1]=3 219 B7R0.5 CCCC(=O)C(=O)O 69O [0,2,0,0,0,0|1,0,1]=4 220 B7R0.5 CS/C=C(/C(=O)O)\O DEI [0,2,0,0,0,0|1,0,0]=3 221 B7R0.10 COC(=O)C(=C)CO 23W [0,2,0,0,0,0|1,0,1]=4 222 B7R0.16 C(=O)(C(=O)O)C(=O)O MAK [0,2,0,0,0,0|2,0,0]=4 223 B7R0.16 CC(=O)[C@@H](C(=O)O)N AKB [0,2,0,0,0,0|1,0,1]=4 224 B7R0.16 CC(C)C(=O)C(=O)O KIV [0,2,0,0,0,0|1,0,1]=4 225 B7R0.16 CC(C)[C@@H](C(=O)C)N VAF [0,2,0,0,0,0|0,0,2]=4 226 B7R0.16 C\C(=C(/C(=O)O)\N)\O MOZ [0,2,0,0,0,0|1,0,0]=3 227 B7R0.16 C\C(=C(/C(=O)O)\N)\S BB6 [0,2,0,0,0,0|1,0,0]=3 228 B7R0.13 CC(=O)[P@](=O)(O)OC ALU [0,2,0,0,0,0|2,0,0]=4 229 B7R0.15 C/C=C(/C(=O)O)\NC MDH [0,2,0,0,0,0|1,0,0]=3 230 B7R0.4 C(\C=C\CN)C(=O)O FBE [0,2,0,0,0,0|1,0,0]=3 231 B7R0.4 CCCCCC(=O)C HTX [0,2,0,0,0,0|0,0,2]=4 232 B7R0.4 CCCCOC(=O)C 8JZ [0,2,0,0,0,0|0,0,2]=4 233 B7R0.6 C(=C\C(=O)O)/C(=O)O FUM [0,2,0,0,0,0|1,0,1]=4 234 B7R0.6 C(=C\C(=O)O)\C(=O)O MAE [0,2,0,0,0,0|1,0,1]=4 235 B7R0.6 C(=C\C(=O)[O-])/C(=O)[O-] FMR [0,2,0,0,0,0|1,0,1]=4 236 B7R0.6 CC(=O)CCC(=O)O SHF [0,2,0,0,0,0|1,0,1]=4 237 B7R0.6 CC(=O)NCC(=O)O AAC [0,2,0,0,0,0|1,0,1]=4 238 B5R1.1 c1c[nH]nc1 PZO [1,0,0,1,0,0|2,0,0]=4 239 B7R1.1 c1cc(oc1)C=O FU2 [0,1,0,1,0,0|1,0,1]=4 240 B7R1.1 c1cscc1CN BVC [0,1,0,1,0,0|2,0,0]=4 241 B7R1.2 C1C(=O)NC(=O)N1 HYN [0,1,0,1,0,0|2,0,0]=4 242 B7R1.2 C1CC(=O)CC1=O CEJ [0,1,0,1,0,0|0,0,1]=3 243 B7R1.2 Cc1c[nH+]c(s1)N 25T [0,1,0,1,0,0|1,1,0]=4 244 B7R1.2 Cc1cc(no1)N M3I [0,1,0,1,0,0|1,0,1]=4 245 B7R1.2 Cc1cc(on1)N MIO [0,1,0,1,0,0|1,0,1]=4 246 B7R1.2 Cc1csc(n1)N 24T [0,1,0,1,0,0|2,0,0]=4 247 B7R1.3 C1CC=CC(=O)C1 A2Q [0,1,0,1,0,0|0,0,0]=2 248 B7R1.3 C1CCC(=O)CC1 CYH [0,1,0,1,0,0|0,0,2]=4 249 B7R1.3 Cc1ccccc1 MBN [0,1,0,1,0,0|1,0,1]=4 250 B7R1.3 Cc1cccnc1 3MP [0,1,0,1,0,0|1,0,1]=4 251 B7R1.3 Cc1ccnnc1 DKG [0,1,0,1,0,0|2,0,0]=4 252 B7R1.4 C1COC(=O)[C@H]1N HSL [0,1,0,1,0,0|1,0,1]=4 253 B7R1.4 C1[C@H](C(=O)NO1)N 4AX [0,1,0,1,0,0|2,0,0]=4 254 B7R1.4 CN1CCCC1=O MB3 [0,1,0,1,0,0|0,0,2]=4 255 B7R1.4 CN1CCOC1=O 3MO [0,1,0,1,0,0|1,0,1]=4