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CC(=O)N1CCO[C@H](C1)C(=O)O m_274079__23487676__23468644 [0,0,0,1,0,0|3,0,0]=4 73 B12R1.258 CC(C)N1CCCC(C1)C(=O)O m_270122__11726510__11726786 [0,0,0,1,0,0|2,0,1]=4 74 B12R1.258 CC(C)N1CCC[C@H](C1)C(=O)O m_269956__12632828__7329888 [0,0,0,1,0,0|2,0,1]=4 75 B12R1.258 NC(=O)N1CCC[C@H](C1)C(=O)O m_273452__12632838__11052302 [0,0,0,1,0,0|2,0,1]=4 76 B12R1.389 CC(=O)N[C@H]1CC[C@H](C1)C(=O)N m_270062__14401200__15585492 [0,0,0,1,0,0|3,0,0]=4 77 B12R1.389 CC(=O)N[C@H]1CC[C@H](C1)C(=O)O m_188690__17799346__3007096 [0,0,0,1,0,0|2,0,0]=3 78 B12R1.389 CC(=O)N[C@H]1CC[C@H](C1)C(=O)O m_273652__11622304__11599462 [0,0,0,1,0,0|2,0,0]=3 79 B12R1.389 NC(=O)N[C@H]1CC[C@H](C1)C(=O)O m_273452__11622290__11052302 [0,0,0,1,0,0|2,0,1]=4 80 B12R1.1344 CC(=O)NCC1CC(C1)C(=O)O m_273652__20019656__11599462 [0,0,0,1,0,0|2,0,0]=3 81 B12R1.1344 CC(=O)NC[C@H]1C[C@H](C1)C(=O)O m_188690__23409560__3007096 [0,0,0,1,0,0|2,0,0]=3 82 B12R1.1344 NC(=O)NCC1CC(C1)C(=O)O m_273452__20019674__11052302 [0,0,0,1,0,0|2,0,1]=4 83 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m_44__505050__8799282 [0,0,0,0,0,1|3,0,0]=4 95 B12R0.42 CC(=O)NCCCNC(C)C(=O)O m_273456__11064196__13259262 [0,0,0,0,0,1|2,0,0]=3 96 B12R0.42 CC(=O)NCCSCC(C)C(=O)C m_7__17756534__6958768 [0,0,0,0,0,1|3,0,0]=4 97 B12R0.42 CC(=O)NCCSCC(C)C(=O)O m_274079__23475938__23468644 [0,0,0,0,0,1|2,0,0]=3 98 B9R0.2 C/C=C/CCCCC(=O)N m_22__58357__21202910 [2,0,0,0,0,0|2,0,0]=4 99 B9R0.2 C/C=C/CCSCC(=O)O m_7__26823__23858408 [2,0,0,0,0,0|2,0,0]=4 100 B9R0.2 C=CCCCCNC(=N)N m_58668__8925712__2227896 [2,0,0,0,0,0|2,0,0]=4 101 B9R0.2 C=CCCCCNC(=O)C m_270062__16413582__15585492 [2,0,0,0,0,0|2,0,0]=4 102 B9R0.2 CC(=O)NCCCCCO m_270062__16411460__15585492 [2,0,0,0,0,0|1,0,1]=4 103 B9R0.2 CCNCCCCC(=O)N m_270004__23846992__24715004 [2,0,0,0,0,0|1,0,1]=4 104 B9R0.2 N=C(N)NCCCCCO m_58668__9456960__2227896 [2,0,0,0,0,0|1,0,1]=4 105 B9R0.55 CC(=O)NCCCC(=O)N m_270062__7601600__15585492 [2,0,0,0,0,0|1,0,1]=4 106 B9R0.55 CC(=O)NCCCC(C)N m_240690__15562002__7404532 [2,0,0,0,0,0|1,0,1]=4 107 B9R0.55 CC(=O)NCCCC(C)O m_270062__16413862__15585492 [2,0,0,0,0,0|2,0,0]=4 108 B9R0.55 CC(O)CCCNC(=N)N m_58668__9448690__2227896 [2,0,0,0,0,0|2,0,0]=4 109 B9R0.55 N=C(N)NCCCC(=O)N m_240690__7368526__18231466 [2,0,0,0,0,0|1,0,1]=4 110 B9R0.47 C=CCCCC(N)C(=O)N m_240690__7368526__13219328 [2,0,0,0,0,0|1,0,1]=4 111 B9R0.47 COCCCC(N)C(=O)N m_240690__7368526__18181752 [2,0,0,0,0,0|2,0,0]=4 112 B11R0.42 CC=CCCCNC(C)C(=O)O m_273456__17054604__13259262 [1,1,0,0,0,0|2,0,0]=4 113 B11R0.141 CCNC(=O)CC[C@@H](N)C(=O)O m_240690__7350950__24777256 [1,1,0,0,0,0|0,0,2]=4 114 B11R0.141 CNNC(=O)CC[C@@H](N)C(=O)O m_240690__21584010__24777256 [1,1,0,0,0,0|1,0,1]=4 115 B11R0.141 CONC(=O)CC[C@@H](N)C(=O)O m_240690__7368532__24777256 [1,1,0,0,0,0|1,0,1]=4 116 B11R0.142 CCNCCCC(O)C(=O)OC m_270004__20706088__24715004 [1,1,0,0,0,0|1,0,1]=4 117 B11R0.6 CC(=O)NC(C)CCCC(=O)O m_274079__23474770__23468644 [1,1,0,0,0,0|1,0,0]=3 118 B11R0.6 CC(=O)NC(C)COCC(=O)O m_274079__23483844__23468644 [1,1,0,0,0,0|2,0,0]=4 119 B11R0.6 CC(=O)NCCC(C)CC(=O)O m_274079__23474608__23468644 [1,1,0,0,0,0|1,0,0]=3 120 B11R0.6 CC(=O)NCCN(C)CC(=O)O m_270122__22553968__22563622 [1,1,0,0,0,0|2,0,0]=4 121 B11R0.6 CC(=O)NCC[C@@H](C)CC(=O)O m_188690__21771302__3007096 [1,1,0,0,0,0|1,0,0]=3 122 B11R0.6 N=C(N)NC(=O)CCCC(=O)O m_240690__14445756__24784976 [1,1,0,0,0,0|1,0,1]=4 123 B11R0.31 CS(=O)(=O)NCCCCC(=O)O m_270188__10979826__7877986 [1,1,0,0,0,0|2,0,0]=4 124 B11R0.85 CC(=O)NCC(C)CCC(=O)O m_274079__23480058__23468644 [1,1,0,0,0,0|1,0,0]=3 125 B11R0.85 CC(=O)NCC(O)CCC(=O)O m_188690__16811468__3007096 [1,1,0,0,0,0|1,0,0]=3 126 B11R0.111 CC(=O)NCCCCC(=O)NN m_240690__7868478__24778654 [1,1,0,0,0,0|2,0,0]=4 127 B11R0.111 CC(=O)NCCCNC(=O)CO m_22__505044__7941800 [1,1,0,0,0,0|2,0,0]=4 128 B11R0.111 CC(CF)NCCCCC(=O)O m_273456__11081384__23171790 [1,1,0,0,0,0|1,0,1]=4 129 B11R0.111 CCC(=O)NCCCCC(=O)N m_270062__16417252__22005658 [1,1,0,0,0,0|2,0,0]=4 130 B11R0.111 CCC(=O)NCCCCC(=O)O m_273652__11599370__11599566 [1,1,0,0,0,0|1,0,0]=3 131 B11R0.111 CCC(=O)NCCOCC(=O)O m_272610__18204464__18206920 [1,1,0,0,0,0|2,0,0]=4 132 B11R0.111 CCC(=O)NCCSCC(=O)O m_272610__17766302__18206920 [1,1,0,0,0,0|2,0,0]=4 133 B11R0.111 CCC(=O)NOCCCC(=O)O m_188690__17754950__7312452 [1,1,0,0,0,0|2,0,0]=4 134 B11R0.111 CCC(C)NCCCCC(=O)O m_273456__11063432__23171790 [1,1,0,0,0,0|1,0,1]=4 135 B11R0.111 CNC(=O)CCCCCC(=O)O m_58__24557476__14483276 [1,1,0,0,0,0|2,0,0]=4 136 B11R0.111 CNC(=O)CCCCNC(=N)N m_58668__21502404__2227896 [1,1,0,0,0,0|2,0,0]=4 137 B11R0.111 CNC(=O)CCCCNC(=O)C m_270062__21502412__15585492 [1,1,0,0,0,0|2,0,0]=4 138 B11R0.111 CNC(=O)NCCCCC(=O)N m_68__22164400__22160886 [1,1,0,0,0,0|2,0,0]=4 139 B11R0.111 CNC(=O)NCCCCC(=O)O m_273452__11052562__11052292 [1,1,0,0,0,0|1,0,0]=3 140 B11R0.111 COC(=O)CCCCNC(=N)N m_58668__3047984__2227896 [1,1,0,0,0,0|1,0,0]=3 141 B11R0.111 COC(=O)CCCCNC(=O)C m_270062__7606724__15585492 [1,1,0,0,0,0|1,0,0]=3 142 B11R0.111 COC(=O)CCCCNC(=O)N m_276436__14076652__14089966 [1,1,0,0,0,0|1,0,1]=4 143 B11R0.111 COC(=O)CCCCNC(C)C m_270004__23845338__18313460 [1,1,0,0,0,0|1,0,1]=4 144 B11R0.111 COC(=O)CCCCOC(=O)C m_1458__473186__12341314 [1,1,0,0,0,0|2,0,0]=4 145 B11R0.111 COC(=O)CCCONC(=O)C m_270062__21889884__15585492 [1,1,0,0,0,0|2,0,0]=4 146 B11R0.111 COC(=O)COCCNC(=N)N m_58668__12300408__2227896 [1,1,0,0,0,0|2,0,0]=4 147 B11R0.111 COC(=O)COCCNC(=O)C m_270062__16426584__15585492 [1,1,0,0,0,0|2,0,0]=4 148 B11R0.111 COC(=O)CSCCNC(=O)C m_270062__7614066__15585492 [1,1,0,0,0,0|2,0,0]=4 149 B11R0.111 COC(=O)NCCCCC(=O)N m_282070__22213084__22151046 [1,1,0,0,0,0|2,0,0]=4 150 B11R0.111 COC(=O)NCCCCC(=O)O m_274081__23469888__23468646 [1,1,0,0,0,0|1,0,0]=3 151 B11R0.111 COC(=O)NCCCNC(=N)N m_58668__16768626__2227896 [1,1,0,0,0,0|2,0,0]=4 152 B11R0.111 COC(=O)NCCCNC(=O)C m_270062__16768634__15585492 [1,1,0,0,0,0|2,0,0]=4 153 B11R0.111 COC(=O)NCCOCC(=O)O m_274081__23486504__23468646 [1,1,0,0,0,0|2,0,0]=4 154 B11R0.111 COC(=O)NCCSCC(=O)O m_274081__23474474__23468646 [1,1,0,0,0,0|2,0,0]=4 155 B11R0.111 C[C@H](CO)NCCCCC(=O)O m_273456__11065754__23171790 [1,1,0,0,0,0|1,0,1]=4 156 B11R0.111 N=C(N)NCCCCC(=O)NN m_240690__7868478__18312386 [1,1,0,0,0,0|2,0,0]=4 157 B11R0.111 NC(=O)CCCCNC(=O)CO m_22__8252164__7941800 [1,1,0,0,0,0|2,0,0]=4 158 B11R0.111 NC(=O)NCCCCC(=O)NO m_527__388132__157039 [1,1,0,0,0,0|1,0,1]=4 159 B11R0.111 NCC(=O)NCCCCC(=O)N m_240690__17026030__3025698 [1,1,0,0,0,0|2,0,0]=4 160 B11R0.111 NCC(=O)NCCCCC(=O)O m_273450__11050906__11051014 [1,1,0,0,0,0|1,0,0]=3 161 B11R0.111 O=C(O)CCCCNC(=O)CO m_269946__8266830__16881486 [1,1,0,0,0,0|1,0,0]=3 162 B11R0.111 O=C(O)CCCONC(=O)CO m_188690__17754950__13231324 [1,1,0,0,0,0|2,0,0]=4 163 B11R0.111 O=C(O)COCCNC(=O)CO m_188690__12300420__13231324 [1,1,0,0,0,0|2,0,0]=4 164 B11R0.111 O=C(O)CSCCNC(=O)CO m_188690__7326780__13231324 [1,1,0,0,0,0|2,0,0]=4 165 B11R0.33 N=C(N)NC(=O)C[C@H](N)C(=O)O m_240690__14445756__14156160 [0,1,0,0,1,0|1,0,1]=4 166 B11R0.173 CC(=O)NCC(C)C(F)C(=O)O m_274079__23484128__23468644 [0,1,0,0,1,0|2,0,0]=4 167 B11R0.173 CC(=O)NC[C@H](O)[C@H](O)C(=O)O m_274079__23481718__23468644 [0,1,0,0,1,0|2,0,0]=4 168 B11R0.202 CC(=O)NCCC(C)(C)C(=O)O m_188690__10887706__3007096 [0,1,0,0,1,0|2,0,0]=4 169 B11R0.202 CC(=O)NCCC(C)(O)C(=O)O m_274079__23489230__23468644 [0,1,0,0,1,0|2,0,0]=4 170 B11R0.202 CC(=O)NCCC(F)(F)C(=O)O m_188690__15705276__3007096 [0,1,0,0,1,0|2,0,0]=4 171 B11R0.273 CCC(CCNC(=O)C)C(=O)O m_274079__23475716__23468644 [0,1,0,0,1,0|2,0,0]=4 172 B13R0.51 C=C(C)CNC(=O)CC[C@@H](N)C(=O)O m_240690__17027460__24777256 [0,1,0,0,0,1|1,0,1]=4 173 B13R0.51 CC(=O)NNC(=O)CC[C@@H](N)C(=O)O m_240690__21563898__24777256 [0,1,0,0,0,1|1,0,1]=4 174 B13R0.78 CC(=O)NC(C)CCCC(C)C(=O)O m_274079__23473434__23468644 [0,1,0,0,0,1|2,0,0]=4 175 B13R0.101 C=C(C)CCCSCC(N)C(=O)OC m_7__22849238__13608156 [0,1,0,0,0,1|2,0,0]=4 176 B13R0.101 COC(=O)C(Br)CSCCNC(=O)C m_7__17756534__22787978 [0,1,0,0,0,1|2,0,0]=4 177 B13R0.101 COC(=O)C(C)CSCCNC(=O)C m_7__17756534__22787204 [0,1,0,0,0,1|2,0,0]=4 178 B13R0.101 COC(=O)C(C)NCCCNC(=O)C m_44__505050__9192152 [0,1,0,0,0,1|2,0,0]=4 179 B13R0.101 COC(=O)C(Cl)CSCCNC(=O)C m_7__17756534__22787480 [0,1,0,0,0,1|2,0,0]=4 180 B13R0.101 COC(=O)C(F)CSCCNC(=O)C m_7__17756534__783120 [0,1,0,0,0,1|2,0,0]=4 181 B13R0.101 COC(=O)C(N)CSCCC=C(C)C m_7__22849238__12121616 [0,1,0,0,0,1|2,0,0]=4 182 B13R0.101 COC(=O)C(N)CSCCCC(=O)C m_7__22849238__322712 [0,1,0,0,0,1|2,0,0]=4 183 B13R0.101 COC(=O)C(N)CSCCOC(=O)C m_7__22849238__11982590 [0,1,0,0,0,1|2,0,0]=4 184 B13R0.204 CCC(=O)NCCCC[C@H](O)C(=O)O m_272610__21502740__18206920 [0,1,0,0,0,1|2,0,0]=4 185 B13R0.204 CCC(=O)NCCSCC(C)C(=O)O m_272610__17766658__18206920 [0,1,0,0,0,1|2,0,0]=4 186 B13R0.204 CNC(=O)NCCCNC(C)C(=O)O m_273456__15727004__13259262 [0,1,0,0,0,1|2,0,0]=4 187 B13R0.204 COC(=O)NCCCNC(C)C(=O)O m_273456__16768676__13259262 [0,1,0,0,0,1|2,0,0]=4 188 B13R0.204 COC(=O)NCCSCC(C)C(=O)O m_274081__23475942__23468646 [0,1,0,0,0,1|2,0,0]=4 189 B13R0.353 C=C(C)C(=O)NCCCC(O)C(=O)O m_188690__20706098__15283788 [0,1,0,0,0,1|2,0,0]=4 190 B13R0.353 CC(=O)N(C)CCCNC(C)C(=O)O m_273456__21495130__13259262 [0,1,0,0,0,1|2,0,0]=4 191 B13R0.353 CC(C)C(=O)NCCC[C@H](N)C(=O)O m_240690__24642322__7404556 [0,1,0,0,0,1|1,0,1]=4 192 B13R0.353 CC(N)C(=O)NCCC[C@H](N)C(=O)O m_273450__20634330__11051010 [0,1,0,0,0,1|0,0,2]=4 193 B13R0.353 CC(O)C(=O)NCCC[C@H](N)C(=O)O m_240690__24642322__17025646 [0,1,0,0,0,1|1,0,1]=4 194 B13R0.353 C[C@@H](F)C(=O)NCCC[C@H](N)C(=O)O m_240690__24642322__24784944 [0,1,0,0,0,1|1,0,1]=4 195 B13R0.353 NC(=O)C(=O)NCCC[C@H](N)C(=O)O m_240690__24642322__12876612 [0,1,0,0,0,1|1,0,1]=4 196 B13R0.444 CC(=O)NCCN(C)C[C@@H](O)C(=O)O m_270122__22553968__22563304 [0,1,0,0,0,1|2,0,0]=4 197 B13R0.98 COC(=O)[C@H](N)CCC(=O)NC(=N)N m_240690__14445756__24777158 [0,2,0,0,0,0|1,0,1]=4 198 B13R0.250 CCC(=O)NCCCC(O)C(=O)OC m_270062__20706090__22005658 [0,2,0,0,0,0|2,0,0]=4 199 B13R0.250 CNC(=O)NCCCC(O)C(=O)OC m_68__23347242__22160886 [0,2,0,0,0,0|2,0,0]=4 200 B13R0.250 COC(=O)C(O)CCCNC(=O)CN m_240690__21562876__3025698 [0,2,0,0,0,0|2,0,0]=4 201 B13R0.250 COC(=O)C(O)CCCNC(=O)CO m_22__20706082__7941800 [0,2,0,0,0,0|2,0,0]=4 202 B13R0.250 COC(=O)NCCCC(O)C(=O)OC m_282070__22266048__22151046 [0,2,0,0,0,0|2,0,0]=4 203 B13R0.261 CONC(=O)C(O)CCCNC(=O)C m_274552__23521092__25001246__19101678 [0,2,0,0,0,0|2,0,0]=4 204 B13R0.925 CN[C@@H](CCCNC(=N)N)C(=O)OC m_2230__22410484__2463448 [0,2,0,0,0,0|1,0,0]=3 205 B13R0.1203 COC(=O)C(C)(C)CCCNC(=N)N m_58668__16502158__2227896 [0,2,0,0,0,0|2,0,0]=4 206 B13R0.1203 COC(=O)C(C)(C)CCCNC(=O)C m_270062__16502162__15585492 [0,2,0,0,0,0|2,0,0]=4 207 B13R0.91 C/C=C/C(=O)NCCCC(O)C(=O)O m_188690__20706098__15283786 [0,2,0,0,0,0|2,0,0]=4 208 B13R0.91 C/C=C/C(=O)NCCC[C@H](N)C(=O)O m_240690__24642322__21436330 [0,2,0,0,0,0|1,0,0]=3 209 B13R0.91 C=CCC(=O)NCCC[C@H](N)C(=O)O m_240690__24642322__21409900 [0,2,0,0,0,0|1,0,0]=3 210 B13R0.91 CCCC(=O)NCCCC(C)C(=O)O m_272610__17766398__17767382 [0,2,0,0,0,0|2,0,0]=4 211 B13R0.91 CCCC(=O)NCCCC(O)C(=O)O m_188690__20706098__7312426 [0,2,0,0,0,0|2,0,0]=4 212 B13R0.91 CCCC(=O)NCCC[C@H](N)C(=O)O m_240690__24642322__7404578 [0,2,0,0,0,0|1,0,0]=3 213 B13R0.91 CNCC(=O)NCCC[C@H](N)C(=O)O m_273450__20634330__11051068 [0,2,0,0,0,0|1,0,0]=3 214 B13R0.91 COCC(=O)NCCCC(C)C(=O)O m_274079__23482716__23469146 [0,2,0,0,0,0|2,0,0]=4 215 B13R0.91 COCC(=O)NCCCC(O)C(=O)O m_188690__20706098__7312614 [0,2,0,0,0,0|2,0,0]=4 216 B13R0.91 COCC(=O)NCCC[C@H](N)C(=O)O m_240690__24642322__7404894 [0,2,0,0,0,0|1,0,0]=3 217 B13R0.91 CSCC(=O)NCCCC(C)C(=O)O m_272610__17766398__17768612 [0,2,0,0,0,0|2,0,0]=4 218 B13R0.91 CSCC(=O)NCCCC(O)C(=O)O m_188690__20706098__7313770 [0,2,0,0,0,0|2,0,0]=4 219 B13R0.91 CSCC(=O)NCCC[C@H](N)C(=O)O m_240690__24642322__7407272 [0,2,0,0,0,0|1,0,0]=3 220 B13R0.91 NCCC(=O)NCCC[C@H](N)C(=O)O m_273450__20634330__11051000 [0,2,0,0,0,0|1,0,0]=3 221 B13R0.91 NOCC(=O)NCCC[C@H](N)C(=O)O m_273450__20634330__13151246 [0,2,0,0,0,0|1,0,0]=3 222 B13R0.164 CC(C)(CCCNC(=O)CO)C(=O)O m_188690__16502198__13231324 [0,2,0,0,0,0|2,0,0]=4 223 B13R0.164 CCC(=O)NCCCC(C)(C)C(=O)O m_270112__16502204__13272554 [0,2,0,0,0,0|2,0,0]=4 224 B13R0.164 COC(=O)NCCCC(C)(C)C(=O)O m_274081__23478060__23468646 [0,2,0,0,0,0|2,0,0]=4 225 B13R0.292 CCS(=O)(=O)NCCC[C@H](N)C(=O)O m_270188__20634340__7878764 [0,2,0,0,0,0|2,0,0]=4 226 B13R0.292 CNS(=O)(=O)NCCC[C@H](N)C(=O)O m_270188__20634340__13287404 [0,2,0,0,0,0|2,0,0]=4 227 B13R0.1247 CCC(=O)NCCC[C@@H](NC)C(=O)O m_272610__21502794__18206920 [0,2,0,0,0,0|1,0,0]=3 228 B13R0.329 CC(=O)NCCCC(CCO)C(=O)O m_188690__16811490__3007096 [0,2,0,0,0,0|2,0,0]=4 229 B13R0.446 C[C@@](N)(CCC(=O)NC(=N)N)C(=O)O m_240690__14445756__24777070 [0,2,0,0,0,0|1,0,1]=4 230 B13R0.446 C[C@](N)(CCC(=O)NC(=N)N)C(=O)O m_240690__14445756__19716720 [0,2,0,0,0,0|1,0,1]=4 231 B11R1.75 CC(=O)NC[C@H]1C=C[C@H](C1)N m_240690__17517954__7404532 [1,0,0,1,0,0|2,0,0]=4 232 B11R1.36 NC(=O)C(N)C1CC=CCC1 m_240690__7368526__15768324 [1,0,0,1,0,0|2,0,0]=4 233 B11R1.421 CCN1CCC[C@@]1(C)C(=O)O m_270122__13693756__22567416 [1,0,0,1,0,0|1,0,1]=4 234 B11R1.154 CC(=O)NCCC1CC(=O)C1 m_270062__21864502__15585492 [1,0,0,1,0,0|2,0,0]=4 235 B11R1.157 NC(=O)CC1CCNC(=O)C1 m_22__58357__21205022 [1,0,0,1,0,0|2,0,0]=4 236 B11R1.178 CC(=O)N1CCCC1C(=O)N m_270062__16411314__15585492 [1,0,0,1,0,0|2,0,0]=4 237 B11R1.178 CC(=O)N1CCCC1C(=O)O m_274079__23468814__23468644 [1,0,0,1,0,0|1,0,0]=3 238 B11R1.178 CC(=O)N1CCC[C@@H]1C(=O)N m_527__10747784__156031 [1,0,0,1,0,0|2,0,0]=4 239 B11R1.178 CC(=O)N1CCC[C@@H]1C(=O)O m_269946__9362080__7300386 [1,0,0,1,0,0|1,0,0]=3 240 B11R1.178 CC(=O)N1CCSC1C(=O)O m_274079__23479632__23468644 [1,0,0,1,0,0|2,0,0]=4 241 B11R1.178 CC(=O)N1CSCC1C(=O)O m_274079__23468820__23468644 [1,0,0,1,0,0|2,0,0]=4 242 B11R1.708 CC(=O)N[C@H]1CC[C@H]1C(=O)O m_188690__13267276__3007096 [1,0,0,1,0,0|1,0,0]=3 243 B11R1.711 CC(=O)NC[C@H]1C[C@@H]1C(=O)O m_269946__25345800__7300386 [1,0,0,1,0,0|1,0,0]=3 244 B11R1.711 CC(=O)NC[C@H]1C[C@H]1C(=O)O m_274079__23479094__23468644 [1,0,0,1,0,0|1,0,0]=3 245 B11R1.175 CC(=O)N1CCC(C1)C(=O)O m_274079__23488576__23468644 [0,0,0,1,1,0|2,0,0]=4 246 B11R1.175 CC(=O)N1CC[C@@H](C1)C(=O)O m_269946__20076518__7300386 [0,0,0,1,1,0|2,0,0]=4 247 B11R1.175 NC(=O)[C@H]1CC[C@H](N1)C(=O)O m_240690__7368526__13529754 [0,0,0,1,1,0|1,0,1]=4 248 B11R1.723 CC(=O)N1CCC1(C)C(=O)O m_272610__18203864__18206834 [0,0,0,1,1,0|2,0,0]=4 249 B11R1.743 CC(=O)N[C@H]1C[C@@H](C1)C(=O)O m_269946__12862736__7300386 [0,0,0,1,1,0|2,0,0]=4 250 B11R1.743 CC(=O)N[C@H]1C[C@H](C1)C(=O)O m_274079__23470108__23468644 [0,0,0,1,1,0|2,0,0]=4 251 B13R1.148 CC(NC1CCNC(=O)C1)C(=O)O m_273456__22320884__13259262 [0,0,0,1,0,1|2,0,0]=4 252 B13R1.350 CC(=O)N1CCCC1C(C)C(=O)O m_188690__14597672__3007096 [0,0,0,1,0,1|2,0,0]=4 253 B13R1.350 CC(=O)N1CCC[C@@H]1C(O)C(=O)O m_188690__21464692__3007096 [0,0,0,1,0,1|2,0,0]=4 254 B13R1.587 C=C(C)CN1CCCC(C1)C(=O)O m_270122__11726510__11726916 [0,0,0,1,0,1|2,0,0]=4 255 B13R1.587 C=C(C)CN1CCC[C@H](C1)C(=O)O m_269956__12632828__22437362 [0,0,0,1,0,1|2,0,0]=4 256 B13R1.587 CC(=O)CN1CCC[C@H](C1)C(=O)O m_269956__12632828__22431754 [0,0,0,1,0,1|2,0,0]=4 257 B13R1.587 CC(=O)NC1CCCC(C1)C(=O)O m_269946__14425426__7300386 [0,0,0,1,0,1|2,0,0]=4 258 B13R1.587 CC(=O)NC1CCOC(C1)C(=O)O m_188690__20329036__3007096 [0,0,0,1,0,1|2,0,0]=4 259 B13R1.587 CC(=O)N[C@@H]1CCC[C@H](C1)C(=O)O m_188690__22490086__3007096 [0,0,0,1,0,1|2,0,0]=4 260 B13R1.587 CC(=O)N[C@H]1CCC[C@@H](C1)C(=O)O m_274079__24534142__23468644 [0,0,0,1,0,1|2,0,0]=4 261 B13R1.587 CC(=O)N[C@H]1CCC[C@H](C1)C(=O)O m_269946__14425328__7300386 [0,0,0,1,0,1|2,0,0]=4 262 B13R1.587 CC(=O)N[C@H]1CCC[C@H](C1)C(=O)O m_274079__23475310__23468644 [0,0,0,1,0,1|2,0,0]=4 263 B13R1.587 CC(=O)N[C@H]1CCO[C@@H](C1)C(=O)O m_188690__13450946__3007096 [0,0,0,1,0,1|2,0,0]=4 264 B13R1.1060 CC(=O)N1CCCCC(C1)C(=O)O m_274079__23482282__23468644 [0,0,0,1,0,1|2,0,0]=4 265 B13R1.1060 CC(=O)N1CCOCC(C1)C(=O)O m_188690__15419582__3007096 [0,0,0,1,0,1|2,0,0]=4 266 B13R1.1091 CC(=O)N1CCCCC1(C)C(=O)O m_272610__18205480__18206834 [0,0,0,1,0,1|2,0,0]=4 267 B13R1.1985 CC(=O)NCC1CC(CO1)C(=O)O m_188690__16921812__3007096 [0,0,0,1,0,1|2,0,0]=4 268 B13R1.1985 CC(=O)NC[C@H]1CC[C@H](O1)C(=O)O m_274079__23477424__23468644 [0,0,0,1,0,1|2,0,0]=4 269 B13R1.1989 CC(=O)NCCC1CC(C1)C(=O)O m_188690__21218050__3007096 [0,0,0,1,0,1|2,0,0]=4 270 B13R1.2025 C=C(C)CN1CCCC1(C)C(=O)O m_270122__19464808__11726916 [0,0,0,1,0,1|2,0,0]=4 271 B13R1.2025 C=C(C)CN1CCC[C@@]1(C)C(=O)O m_270122__13693756__11726916 [0,0,0,1,0,1|2,0,0]=4 272 B13R1.2025 CC(=O)NC1CCCC1(C)C(=O)O m_188690__12120546__3007096 [0,0,0,1,0,1|2,0,0]=4 273 B13R1.2025 CC(=O)NC1COCC1(C)C(=O)O m_188690__16949812__3007096 [0,0,0,1,0,1|2,0,0]=4 274 B13R1.295 CC(=O)N1CCCC(C1C(=O)O)C m_274079__23483112__23468644 [0,0,0,1,0,1|2,0,0]=4 275 B13R1.295 CC(=O)N1CCC[C@@H]([C@@H]1C(=O)O)O m_274079__23478980__23468644 [0,0,0,1,0,1|2,0,0]=4 276 B13R1.295 CC(=O)N1CCC[C@@H]([C@H]1C(=O)O)N m_188690__16705400__3007096 [0,0,0,1,0,1|1,0,0]=3 277 B13R1.583 CC(=O)N[C@@H]1CC[C@@H](C1)CC(=O)O m_274079__23481174__23468644 [0,0,0,1,0,1|2,0,0]=4 278 B13R1.1024 CC(=O)NCC1CC(C1)CC(=O)O m_188690__13461878__3007096 [0,0,0,1,0,1|2,0,0]=4 279 B13R1.167 CC(=O)NCCCC1CCOC1=O m_270062__12855850__15585492 [0,1,0,1,0,0|2,0,0]=4 280 B13R1.167 N=C(N)NCCCC1CCOC1=O m_58668__12855842__2227896 [0,1,0,1,0,0|2,0,0]=4 281 B13R1.533 COC(=O)[C@@H]1CC[C@@H](C1)NC(=O)C m_270062__16432478__15585492 [0,1,0,1,0,0|2,0,0]=4 282 B13R1.533 COC(=O)[C@@H]1CC[C@@H](C1)NC(=O)C m_270062__17799296__15585492 [0,1,0,1,0,0|2,0,0]=4 283 B13R1.543 CC(=O)N1CCCC(C1)C(=O)NO m_527__388132__157350 [0,1,0,1,0,0|2,0,0]=4 284 B13R1.543 CCC(=O)N1CCCC(C1)C(=O)O m_272610__17765378__18206920 [0,1,0,1,0,0|2,0,0]=4 285 B13R1.543 CCC(=O)N1CCC[C@H](C1)C(=O)O m_273652__12632850__11599566 [0,1,0,1,0,0|2,0,0]=4 286 B13R1.543 CNC(=O)N1CCC[C@H](C1)C(=O)O m_273452__12632838__11052292 [0,1,0,1,0,0|2,0,0]=4 287 B13R1.543 CNC(=O)[C@@H]1CCC[C@@H](N1)C(=O)O m_188690__10869928__21600078 [0,1,0,1,0,0|2,0,0]=4 288 B13R1.543 COC(=O)C1CCCN(C1)C(=O)C m_270062__7612120__15585492 [0,1,0,1,0,0|2,0,0]=4 289 B13R1.543 COC(=O)N1CCCC(C1)C(=O)O m_274081__23468860__23468646 [0,1,0,1,0,0|2,0,0]=4 290 B13R1.543 COC(=O)[C@H]1CCCN(C1)C(=O)C m_1626__22034426__511242 [0,1,0,1,0,0|2,0,0]=4 291 B13R1.543 NCC(=O)N1CCC[C@H](C1)C(=O)O m_273450__12632824__11051014 [0,1,0,1,0,0|2,0,0]=4 292 B13R1.543 O=C(O)C1CCCN(C1)C(=O)CO m_188690__2991702__13231324 [0,1,0,1,0,0|2,0,0]=4 293 B13R1.543 O=C(O)[C@@H]1CCCN(C1)C(=O)CO m_269946__12632826__16881486 [0,1,0,1,0,0|2,0,0]=4 294 B13R1.1684 COC(=O)[C@@H]1C[C@H]1CCNC(=O)C m_270062__23836246__15585492 [0,1,0,1,0,0|2,0,0]=4 295 B13R1.1693 COC(=O)[C@H]1C[C@H](C1)CNC(=O)C m_270062__23409536__15585492 [0,1,0,1,0,0|2,0,0]=4 296 B13R1.1824 COC(=O)[C@@]1(CCCN1C(=O)C)C m_270062__16416490__15585492 [0,1,0,1,0,0|2,0,0]=4 297 B13R1.126 CC(=O)N1CC(CC(C1)C(=O)O)C m_274079__23485542__23468644 [0,1,0,1,0,0|2,0,0]=4 298 B13R1.126 CC(=O)N1CC(CC(C1)C(=O)O)N m_188690__16313346__3007096 [0,1,0,1,0,0|2,0,0]=4 299 B13R1.126 CC(=O)N1CC(CC(C1)C(=O)O)O m_188690__15494384__3007096 [0,1,0,1,0,0|2,0,0]=4 300 B13R1.126 CC(=O)N1C[C@@H](C[C@@H](C1)C(=O)O)C m_274079__23487184__23468644 [0,1,0,1,0,0|2,0,0]=4 301 B13R1.126 CC(=O)N1C[C@@H](C[C@H](C1)C(=O)O)O m_188690__15137754__3007096 [0,1,0,1,0,0|2,0,0]=4 302 B13R1.138 CC(=O)N[C@@H]1C[C@@H](C[C@H]1O)C(=O)O m_188690__21457486__3007096 [0,1,0,1,0,0|2,0,0]=4 303 B13R1.138 CC(=O)N[C@@H]1C[C@@H](C[C@H]1O)C(=O)O m_274079__23481772__23468644 [0,1,0,1,0,0|2,0,0]=4 304 B13R1.3475 CC(=O)N1CC(CC1(C)C(=O)O)O m_274079__23487928__23468644 [0,1,0,1,0,0|2,0,0]=4 305 B13R1.8683 CC(=O)NCC1(CC(C1)C(=O)O)F m_269946__17659016__7300386 [0,1,0,1,0,0|2,0,0]=4 306 B13R1.8683 CC(=O)NCC1(CC(C1)C(=O)O)O m_274079__23484584__23468644 [0,1,0,1,0,0|2,0,0]=4 307 B13R1.8683 CC(=O)NC[C@@]1(C[C@@H](C1)C(=O)O)O m_269946__25345810__7300386 [0,1,0,1,0,0|2,0,0]=4 308 B13R1.8683 CC(=O)NC[C@@]1(C[C@H](C1)C(=O)O)F m_188690__16501682__3007096 [0,1,0,1,0,0|2,0,0]=4 309 B13R1.1706 CCC(=O)N[C@H]1CC[C@H](C1)C(=O)O m_188690__17799346__7312452 [0,1,0,1,0,0|2,0,0]=4 310 B13R1.1706 CCC(=O)N[C@H]1CC[C@H](C1)C(=O)O m_273652__11622304__11599566 [0,1,0,1,0,0|2,0,0]=4 311 B13R1.1706 CNC(=O)N[C@H]1CC[C@H](C1)C(=O)O m_273452__11622290__11052292 [0,1,0,1,0,0|2,0,0]=4 312 B13R1.1706 NCC(=O)N[C@H]1CC[C@H](C1)C(=O)O m_273450__11955990__11051014 [0,1,0,1,0,0|2,0,0]=4 313 B13R1.1706 O=C(CO)N[C@H]1CC[C@H](C1)C(=O)O m_188690__17799346__13231324 [0,1,0,1,0,0|2,0,0]=4 314 B13R1.1706 O=C(CO)N[C@H]1CC[C@H](C1)C(=O)O m_269946__11622302__16881486 [0,1,0,1,0,0|2,0,0]=4 315 B13R1.1712 CCC(=O)NCC1CC(C1)C(=O)O m_273652__20019656__11599566 [0,1,0,1,0,0|2,0,0]=4 316 B13R1.1712 CCC(=O)NC[C@H]1C[C@H](C1)C(=O)O m_188690__23409560__7312452 [0,1,0,1,0,0|2,0,0]=4 317 B13R1.1712 CNC(=O)NCC1CC(C1)C(=O)O m_273452__20019674__11052292 [0,1,0,1,0,0|2,0,0]=4 318 B13R1.1712 NCC(=O)NCC1CC(C1)C(=O)O m_273450__20019640__11051014 [0,1,0,1,0,0|2,0,0]=4 319 B13R1.1712 O=C(CO)NCC1CC(C1)C(=O)O m_269946__20019652__16881486 [0,1,0,1,0,0|2,0,0]=4 320 B13R1.1712 O=C(CO)NC[C@H]1C[C@H](C1)C(=O)O m_188690__23409560__13231324 [0,1,0,1,0,0|2,0,0]=4 321 B13R1.1856 CC1(CCCN1C(=O)CN)C(=O)O m_240690__24646698__3025698 [0,1,0,1,0,0|2,0,0]=4 322 B13R1.1856 CC1(CCCN1C(=O)CO)C(=O)O m_269946__12206564__16881486 [0,1,0,1,0,0|2,0,0]=4 323 B13R1.1856 CCC(=O)N1CCCC1(C)C(=O)O m_269946__12206564__7300462 [0,1,0,1,0,0|2,0,0]=4 324 B13R1.1856 CCC(=O)N1CCC[C@@]1(C)C(=O)O m_272610__17765958__18206920 [0,1,0,1,0,0|2,0,0]=4 325 B13R1.1856 COC(=O)N1CCC[C@@]1(C)C(=O)O m_274081__23472854__23468646 [0,1,0,1,0,0|2,0,0]=4 326 B13R1.1856 C[C@]1(CCCN1C(=O)CO)C(=O)O m_188690__13693754__13231324 [0,1,0,1,0,0|2,0,0]=4 327 B13R1.2059 CCC(=O)NCC[C@H]1C[C@@H]1C(=O)O m_272610__22493202__18206920 [0,1,0,1,0,0|2,0,0]=4 328 B13R1.2059 COC(=O)NCC[C@H]1C[C@@H]1C(=O)O m_274081__23489732__23468646 [0,1,0,1,0,0|2,0,0]=4 329 B13R1.2059 O=C(CO)NCC[C@H]1C[C@@H]1C(=O)O m_188690__23836260__13231324 [0,1,0,1,0,0|2,0,0]=4 330 B13R1.585 CC(=O)NC1CCC(CC1)C(=O)O m_273652__11599368__11599462 [0,1,0,1,0,0|2,0,0]=4 331 B13R1.585 CC(=O)N[C@H]1CC[C@@H](CC1)C(=O)O m_274079__23471990__23468644 [0,1,0,1,0,0|2,0,0]=4 332 B13R1.3112 CC(=O)N1CCCC1(CO)C(=O)O m_188690__21756138__3007096 [0,1,0,1,0,0|2,0,0]=4 333 B13R1.3112 CCC1(CCCN1C(=O)C)C(=O)O m_274079__23479984__23468644 [0,1,0,1,0,0|2,0,0]=4 334 B13R1.3801 CC(=O)N1CCCC(C1C)C(=O)O m_274079__23473386__23468644 [0,1,0,1,0,0|2,0,0]=4 335 B13R1.3801 CC(=O)N1CCC[C@@H]([C@@H]1C)C(=O)O m_274079__23478512__23468644 [0,1,0,1,0,0|2,0,0]=4 336 B13R1.8652 CC(=O)N1CCCC(CC1)C(=O)O m_274079__23489734__23468644 [0,1,0,1,0,0|2,0,0]=4 337 B13R1.1078 CC(=O)N1CCC(C1)C(F)C(=O)O m_188690__13067832__3007096 [0,1,0,1,0,0|2,0,0]=4 338 B13R1.8780 CC(=O)N1CCCC(C1)(C)C(=O)O m_274079__23473494__23468644 [0,1,0,1,0,0|2,0,0]=4 339 B13R1.8780 CC(=O)N1CCCC(C1)(F)C(=O)O m_269946__21999610__7300386 [0,1,0,1,0,0|2,0,0]=4 340 B13R1.8780 CC(=O)N1CCCC(C1)(O)C(=O)O m_274079__23479196__23468644 [0,1,0,1,0,0|2,0,0]=4 341 B13R1.13 CC(=O)N1CC(CCC1C)C(=O)O m_274079__23486476__23468644 [0,1,0,1,0,0|2,0,0]=4 342 B13R1.13 CC(=O)N1CCC(C(C1)C(=O)O)C m_269946__11574368__7300386 [0,1,0,1,0,0|2,0,0]=4 343 B13R1.13 CC(=O)N1CC[C@@H]([C@@H](C1)C(=O)O)C m_274079__23482350__23468644 [0,1,0,1,0,0|2,0,0]=4 344 B13R1.13 CC(=O)N1C[C@@H](CC[C@@H]1C)C(=O)O m_274079__23480938__23468644 [0,1,0,1,0,0|2,0,0]=4 345 B13R1.1108 CC(=O)N[C@H]1C[C@H](C1)C(F)C(=O)O m_274079__23485554__23468644 [0,1,0,1,0,0|2,0,0]=4 346 B13R1.8677 CC(=O)NC1CCC(C1)(C)C(=O)O m_274079__23481922__23468644 [0,1,0,1,0,0|2,0,0]=4 347 B13R2.13672 CC(=O)N1CC2CC2(C1)C(=O)O m_188690__15090018__3007096 [0,0,0,2,0,0|2,0,0]=4 348 B13R2.13672 CC(=O)N1C[C@@H]2C[C@@]2(C1)C(=O)O m_274079__23485498__23468644 [0,0,0,2,0,0|2,0,0]=4 349 B13R2.13672 CC(=O)N1C[C@H]2C[C@]2(C1)C(=O)O m_272610__18717778__18206834 [0,0,0,2,0,0|2,0,0]=4 350 B13R2.13672 CC(=O)N1C[C@H]2C[C@]2(C1)C(=O)O m_274079__23477406__23468644 [0,0,0,2,0,0|2,0,0]=4 351 B13R2.13987 CC(=O)N1CC2CC1(C2)C(=O)O m_274079__23469422__23468644 [0,0,0,2,0,0|2,0,0]=4 352 B13R2.13768 CC(=O)N1CC[C@@H]2[C@]1(C2)C(=O)O m_188690__22382898__3007096 [0,0,0,2,0,0|2,0,0]=4 353 B9R0.7 CC(=O)NCC(C)C(=O)O m_274079__23469508__23468644 [0,0,0,0,2,0|2,0,0]=4 354 B9R0.7 CC(=O)NCC(O)C(=O)O m_269946__14987758__7300386 [0,0,0,0,2,0|2,0,0]=4 355 B9R0.7 CC(=O)NC[C@@H](O)C(=O)O m_274079__23477176__23468644 [0,0,0,0,2,0|2,0,0]=4 356 B9R0.7 CC(=O)NC[C@H](F)C(=O)O m_274079__23475304__23468644 [0,0,0,0,2,0|2,0,0]=4 357 B9R0.7 CC(=O)NC[C@H](O)C(=O)O m_272610__17765908__18206834 [0,0,0,0,2,0|2,0,0]=4 358 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O m_240690__7368526__24777256 [0,0,0,0,2,0|1,0,1]=4 359 B11R0.30 C=C(Br)CNCCCCC(=O)O m_273456__11067898__23171790 [1,0,0,0,0,1|1,0,1]=4 360 B11R0.30 C=C(Cl)CNCCCCC(=O)O m_273456__11072834__23171790 [1,0,0,0,0,1|1,0,1]=4 361 B11R0.30 C=C(F)CNCCCCC(=O)O m_273456__18716806__23171790 [1,0,0,0,0,1|1,0,1]=4 362 B11R0.30 CC(=O)CCCCCNC(=O)C 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