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CCOCO[C@H](C)CCC=C(C)C 815ff54149eb6f99f9f4b83408bb0de0 [0,0,0,0,0,0|2,0,1]=3 78 B12R0.233 CN(C)CCCN(C)CCCC=O 14ff0a58569f93d907dd0d34dc8f574f [0,0,0,0,0,0|3,0,1]=4 79 B12R0.233 COCCCN(C)CCC=C(C)C 4e434113315462c576e71284a836a030 [0,0,0,0,0,0|4,0,0]=4 80 B12R0.233 COCCOC(C)CCC=C(C)C 57617e6c402d78616d733d98af958779 [0,0,0,0,0,0|4,0,0]=4 81 B12R0.233 COCCO[C@@H](C)CCC=C(C)C b036c76ea40bf5184b6141b52264305a [0,0,0,0,0,0|4,0,0]=4 82 B12R0.233 COCCO[C@H](C)CCC=C(C)C ddd580351a5772dbcbbbe346fb300a5d [0,0,0,0,0,0|4,0,0]=4 83 B12R0.233 CSCCOC(C)CCC=C(C)C 648c3fe735261627259b9958ed48f689 [0,0,0,0,0,0|4,0,0]=4 84 B12R0.233 CSCCO[C@@H](C)CCC=C(C)C 9aa16c70bcba599dcaf239fb9b9e330c [0,0,0,0,0,0|4,0,0]=4 85 B12R0.233 CSCCO[C@H](C)CCC=C(C)C d94d14891230ee7faaa78ec212f1ce66 [0,0,0,0,0,0|4,0,0]=4 86 B11R0.140 C=CCCC[C@H](C)OC/C=C/C a295c3aebf65d0445c447f1a21f18189 [1,0,0,0,0,0|3,0,0]=4 87 B11R0.140 C=CCCC[C@H](C)OC/C=C\C a4ee5279341be9c12420163890ee38b7 [1,0,0,0,0,0|3,0,0]=4 88 B11R0.147 C#CCCN(C)CCC=C(C)C e6f1be709640027b5e12879dedbf6047 [1,0,0,0,0,0|2,0,1]=4 89 B11R0.147 C#CCOC(C)CCC=C(C)C bf5092bd447ac285b644d048be2dd803 [1,0,0,0,0,0|2,0,1]=4 90 B11R0.147 C#CCO[C@@H](C)CCC=C(C)C 48209c7103826476f9a881576fcc5a91 [1,0,0,0,0,0|2,0,1]=4 91 B11R0.147 C#CCO[C@H](C)CCC=C(C)C 7b35b7976000475d3953759f92be83b9 [1,0,0,0,0,0|2,0,1]=4 92 B11R0.147 C=CCCC(C)NCC=C(C)C 76a272a8b5b6c0c21bd7263c65776771 [1,0,0,0,0,0|2,0,0]=3 93 B11R0.147 C=CCCC(C)OC/C=C(/C)\Cl 05c9aae0f729d56aa115f6c7880444a1 [1,0,0,0,0,0|3,0,0]=4 94 B11R0.147 C=CCCC(C)OC/C=C(/C)\I a5e2c53df0c10f5ce63f29a0929105d4 [1,0,0,0,0,0|3,0,0]=4 95 B11R0.147 C=CCCC(C)OC/C=C(\C)/Cl eb8bec66c0a2f729f3173d432e962d72 [1,0,0,0,0,0|3,0,0]=4 96 B11R0.147 C=CCCC(C)OCC=C(C)C bdf88a1b9ec25c3d11d134de8f1c0304 [1,0,0,0,0,0|2,0,0]=3 97 B11R0.147 C=CCCC(C)OCC=C(C)Cl b305be9ed69096c19d7eb9cf12669998 [1,0,0,0,0,0|3,0,0]=4 98 B11R0.147 C=CCCC(C)OCC=C(C)I 14e9bbb3a2244224eee1620737c34d70 [1,0,0,0,0,0|3,0,0]=4 99 B11R0.147 C=CCCN(C)CCC=C(C)C 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CC(=CCCC(C)OCCF)C 6f022ee59475d770b74ab4919803867b [1,0,0,0,0,0|2,0,1]=4 111 B11R0.147 CC(=CCCC(C)OCCS)C a2b26469484f3cbf7899dbf32cb84698 [1,0,0,0,0,0|1,1,1]=4 112 B11R0.147 CC(=CCCN(C)CCC#N)C f06fcbf8931064af4ba53e223fb545b6 [1,0,0,0,0,0|2,0,1]=4 113 B11R0.147 CC(=CCCN(C)CCCO)C 3d303e8c9e9ebb049a948bdeed587ab8 [1,0,0,0,0,0|1,0,2]=4 114 B11R0.147 CC(=CCCN(C)CCON)C 01d78103e6d896d6651f7cbeafe2fb8d [1,0,0,0,0,0|2,0,0]=3 115 B11R0.147 CC(=CCC[C@@H](C)OCC#N)C e8b9962bae83b2869bfa470b370d5c61 [1,0,0,0,0,0|2,0,1]=4 116 B11R0.147 CC(=CCC[C@@H](C)OCC=O)C 0364b33b8bd8b884465be2c2503684ff [1,0,0,0,0,0|1,0,0]=2 117 B11R0.147 CC(=CCC[C@@H](C)OCCF)C 18579b8ad02e4c56da4c7118eac81a8a [1,0,0,0,0,0|2,0,1]=4 118 B11R0.147 CC(=CCC[C@@H](C)OCCS)C 766548a19a635925c816067f60f931bb [1,0,0,0,0,0|1,1,1]=4 119 B11R0.147 CC(=CCC[C@H](C)OCC#N)C fe40fccf95c9a752c1a19ead63a80c31 [1,0,0,0,0,0|2,0,1]=4 120 B11R0.147 CC(=CCC[C@H](C)OCC=O)C 608b88481931774943f677153fc8c124 [1,0,0,0,0,0|1,0,0]=2 121 B11R0.147 CC(=CCC[C@H](C)OCCF)C 8f8be11acbcb831f0d243c921f1d2bf8 [1,0,0,0,0,0|2,0,1]=4 122 B11R0.147 CC(=CCC[C@H](C)OCCS)C ee7fad11df5e699d73f55eb88f76b9f6 [1,0,0,0,0,0|1,1,1]=4 123 B11R0.147 CC(=CCNC(=O)CCC=O)C 81cee7f251ce05c45391ceda87929f00 [1,0,0,0,0,0|2,0,1]=4 124 B11R0.147 CC(=CCNC(C)CCC#N)C a7f876992313d7d10c470c89bcac46e1 [1,0,0,0,0,0|2,0,1]=4 125 B11R0.147 CC(=CCNC(C)CCCO)C 9232405fec2bfaa5cf2a0bd2f79dd217 [1,0,0,0,0,0|1,0,2]=4 126 B11R0.147 CC(=CCN[C@H](C)CCCO)C 168786d2b0d62872f986f2d29cb6267d [1,0,0,0,0,0|1,0,2]=4 127 B11R0.147 CC(=CCOC(C)CCC#N)C 842e5e61eed66f55b142d519987df54f [1,0,0,0,0,0|2,0,1]=4 128 B11R0.147 CC(C)CCCC(C)NCC=O 212be41fdae34268922ac03ffde11f37 [1,0,0,0,0,0|1,0,2]=4 129 B11R0.147 CC(C)CCCC(C)OCC=O 139a31263efbef093d4dfebe20fb7a5a [1,0,0,0,0,0|1,0,2]=4 130 B11R0.147 CC(C)OCCN(C)CCC=O aa6f3af25e3c75e70f668e72f4186a8c [1,0,0,0,0,0|2,0,1]=4 131 B11R0.147 CCCCC(C)NCC=C(C)C 3a0596904a8d882c410c288dbf61cfb9 [1,0,0,0,0,0|2,0,1]=4 132 B11R0.147 CCCCC(C)OCC=C(C)C 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ccea28c4e9fe32c968bb5ab754f00792 [1,0,0,0,0,0|3,0,0]=4 166 B11R0.148 C=CCCCNCCC=C(C)C de9c2422b9773f16e672feb9eb2bfb28 [1,0,0,0,0,0|3,0,0]=4 167 B11R0.148 C=CCCCOCCC=C(C)C f83e28b723485a5dbb595a621c983776 [1,0,0,0,0,0|3,0,0]=4 168 B11R0.148 C=COCCCNC/C=C(/C)\I 8a97cbe95ae1682e4bfade55a3496666 [1,0,0,0,0,0|3,0,0]=4 169 B11R0.148 C=COCCCNC/C=C(\C)/Cl f66d701f7febab889c1413f4c288ab04 [1,0,0,0,0,0|3,0,0]=4 170 B11R0.148 C=COCCCNCC=C(C)C 0e549aa2436b7fe2bb2fa5b244baa67c [1,0,0,0,0,0|2,0,0]=3 171 B11R0.148 C=COCCCNCC=C(C)Cl cf157389489897e6f58165e9a1bdbd7e [1,0,0,0,0,0|3,0,0]=4 172 B11R0.148 C=COCCCNCC=C(C)I 7302152f26439a7a5c545954b91d355d [1,0,0,0,0,0|3,0,0]=4 173 B11R0.148 C=COCCNCCC=C(C)C 4f80852dad173a85446ea1549550e0a3 [1,0,0,0,0,0|2,0,0]=3 174 B11R0.148 C=COCCOCCC=C(C)C 374a2935d1179c860830be7856dd86af [1,0,0,0,0,0|2,0,0]=3 175 B11R0.148 CC(=CCCOC/C=C/C=O)C 1fab7dde6d99d50de7cd655799af450b [1,0,0,0,0,0|2,0,1]=4 176 B11R0.148 CC(=CCCOCCCC=O)C 0b259a7fba69fcb797286c4baa84f1a9 [1,0,0,0,0,0|2,0,0]=3 177 B11R0.148 CC(=CCCOCCNC=O)C c976fc1bde131923a98cef598ad0b7f3 [1,0,0,0,0,0|2,0,0]=3 178 B11R0.148 CC(=CCCOCCOC=O)C 75c08418015cbf0183a72664bea24e17 [1,0,0,0,0,0|1,0,0]=2 179 B11R0.148 CC(=CCNCCCCC=O)C e6e53b8fca4157086481da987e630892 [1,0,0,0,0,0|2,0,0]=3 180 B11R0.148 CC(=CCNCCOCC=O)C 07051e31b49a0a755fa76b88e78c3598 [1,0,0,0,0,0|3,0,0]=4 181 B11R0.148 CC(=CCOCCCCC=O)C 91f665f5465e82fbaa37ae784ba85c6b [1,0,0,0,0,0|2,0,0]=3 182 B11R0.148 CC(=CCOCCCCC=O)Cl 1f6a8a746a126987ac318223e6715a17 [1,0,0,0,0,0|3,0,0]=4 183 B11R0.148 CC(=CCOCCCCC=O)I bbc3cebc90feec643e4b4aa2ea73ee61 [1,0,0,0,0,0|3,0,0]=4 184 B11R0.148 CC(=CCOCCOCC=O)C 3e5506d57f7fb9c3874282975b5edb63 [1,0,0,0,0,0|3,0,0]=4 185 B11R0.148 CC(=O)CCCOCCOC=O 14869f378e4360f6147f345901af1708 [1,0,0,0,0,0|2,0,1]=4 186 B11R0.148 CC(=O)NCCCCCNC=O 7d69373ad0c3cef6e69d4a5cd2246494 [1,0,0,0,0,0|3,0,0]=4 187 B11R0.148 CC(=O)NCCOCCOC=O ce21fa9b338219f0957504ff32de1451 [1,0,0,0,0,0|3,0,0]=4 188 B11R0.148 CC(=O)OCCOCCOC=O 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B11R0.148 CCOCCOCCC=C(C)C 73540d3b0eb112e058bab7cad361aeb3 [1,0,0,0,0,0|2,0,1]=4 201 B11R0.148 CN(C)CCCCCCNC=O b50a9596a6de180971ebc842411588af [1,0,0,0,0,0|2,0,1]=4 202 B11R0.148 CN(C)CCCOCCOC=O 4d38ffb803830bc01f009aa861dee55d [1,0,0,0,0,0|2,0,1]=4 203 B11R0.148 O=COCCOCCC=C(F)F c806d596dd5b9107402302fab57c2a53 [1,0,0,0,0,0|3,0,0]=4 204 B13R0.1 C#CCCCOC(C)CCC=C(C)C 143eb29310c19c2b73a5341003b26762 [0,1,0,0,0,0|2,0,1]=4 205 B13R0.1 C#CCCCO[C@@H](C)CCC=C(C)C 2b9f916bd075527433334fbc1979c9bc [0,1,0,0,0,0|2,0,1]=4 206 B13R0.1 C#CCCCO[C@H](C)CCC=C(C)C ff4041842f5c930eb3e5638bbbcfa136 [0,1,0,0,0,0|2,0,1]=4 207 B13R0.1 C#CCNCC[C@@H](C)CCC=C(C)C 2c03640e71090157f32fb93d8d160aa3 [0,1,0,0,0,0|2,0,1]=4 208 B13R0.1 C#CCOCCC(C)CCC=C(C)C e1a145d6474db868036cf47e9b9c249e [0,1,0,0,0,0|1,0,1]=3 209 B13R0.1 C#CCOCC[C@@H](C)CCC=C(C)C 5fad80f89bdd2b97d4d35e5eae6e45dd [0,1,0,0,0,0|1,0,1]=3 210 B13R0.1 C#CCOCC[C@H](C)CCC=C(C)C 14c2c0f7ed33985d3f16cec8b82905f8 [0,1,0,0,0,0|1,0,1]=3 211 B13R0.1 C=C(C)CCCC(C)CCOCC=O c1a1083cb05fa50c7f4731bcc15a5a5b [0,1,0,0,0,0|0,0,2]=3 212 B13R0.1 C=CCCCCC(C)OCC=C(C)C 6f6cf95e1e117b60336ace5b12f28f86 [0,1,0,0,0,0|3,0,0]=4 213 B13R0.1 C=CCCCCN(C)CCC=C(C)C 58dcf0a0e1b8c4a3a5d7b7c8ee3ffcd8 [0,1,0,0,0,0|3,0,0]=4 214 B13R0.1 C=CCCCC[C@@H](C)OCC=C(C)C d0cbeeffa1ff25721eb6a8bbd1b1ef90 [0,1,0,0,0,0|3,0,0]=4 215 B13R0.1 C=CCCCOC(C)CCC=C(C)C 896da898db9bbbebfeb87d1df0fb3ade [0,1,0,0,0,0|2,0,0]=3 216 B13R0.1 C=CCCCO[C@@H](C)CCC=C(C)C 9610ad2b250b4f69a6fdc0673f8d00a1 [0,1,0,0,0,0|2,0,0]=3 217 B13R0.1 C=CCCCO[C@H](C)CCC=C(C)C 8af3bfc03e437f3d05255be03c014b2a [0,1,0,0,0,0|2,0,0]=3 218 B13R0.1 C=CCOC/C=C(/C)\CCC=C(C)C b9cbf8ef7954054bcf10788433368a39 [0,1,0,0,0,0|1,0,2]=4 219 B13R0.1 C=CCOC/C=C(\C)/CCC=C(C)C 1c680d6ea9402d51f755687a185a12e1 [0,1,0,0,0,0|1,0,2]=4 220 B13R0.1 C=CCOCCC(C)CCC=C(C)C 576963491f5d85abba06e44f4855fb9d [0,1,0,0,0,0|1,0,0]=2 221 B13R0.1 C=CCOCCC(C)CCCC(=C)C ca017176cc24a22d90dbff954ef6f169 [0,1,0,0,0,0|1,0,2]=4 222 B13R0.1 C=CCOCCC(C)CCCC(C)C 10ded569b4b12f1dfd8c0d92cdb2db98 [0,1,0,0,0,0|1,0,2]=4 223 B13R0.1 C=CCOCC[C@@H](C)CCC=C(C)C cfc59919dde3e243afada1004eb20a24 [0,1,0,0,0,0|1,0,0]=2 224 B13R0.1 C=CCOCC[C@@H](C)CCCC(C)C 9636b34803e342817e18e23ef1a5c2e1 [0,1,0,0,0,0|1,0,2]=4 225 B13R0.1 C=CCOCC[C@H](C)CCC=C(C)C e916ae67148fc8b28a1fef940e806e4b [0,1,0,0,0,0|1,0,0]=2 226 B13R0.1 C=COCCNC(=O)CCC=C(C)C 1c83a477ba21ccff8969e270731d8eb6 [0,1,0,0,0,0|2,0,1]=4 227 B13R0.1 CC(=CCC/C(=C/CNCC=O)/C)C 06753a756feeea885387e806d2f57c27 [0,1,0,0,0,0|1,0,2]=4 228 B13R0.1 CC(=CCC/C(=C/COCC=O)/C)C 320baa642517f1ee317aecd4bfc1bd38 [0,1,0,0,0,0|0,0,2]=3 229 B13R0.1 CC(=CCC/C(=C\COCC=O)/C)C fe109a1d6ce7f63dad1fbec37dfadeb9 [0,1,0,0,0,0|0,0,2]=3 230 B13R0.1 CC(=CCCC(=CCNCC=O)C)C 04bd24719ebddc151b6ece096da6a7d3 [0,1,0,0,0,0|1,0,2]=4 231 B13R0.1 CC(=CCCC(C)CCOCC#N)C 7c572510048ae1fa25ed724c1bd3223b [0,1,0,0,0,0|1,0,1]=3 232 B13R0.1 CC(=CCCC(C)CCOCC=O)C dfb92399a0ce9730e45d733fccd8f64a [0,1,0,0,0,0|0,0,0]=1 233 B13R0.1 CC(=CCCC(C)CCOCCF)C 76839b58ed01c57ea0d2149ff9818ccb [0,1,0,0,0,0|1,0,1]=3 234 B13R0.1 CC(=CCCC(C)CCOCCS)C b7d1daed69d4339004a0d702a92ec020 [0,1,0,0,0,0|0,1,1]=3 235 B13R0.1 CC(=CCCC(C)OCC=CC#N)C bb513f2b393c07d04d18b53770060054 [0,1,0,0,0,0|3,0,0]=4 236 B13R0.1 CC(=CCCC(C)OCCCC#N)C 5ae748bca32756088d9362d79de20313 [0,1,0,0,0,0|2,0,1]=4 237 B13R0.1 CC(=CCCC(C)OCCCC=O)C ca24b2fdb2a702df19fbe1ca49a390ff [0,1,0,0,0,0|1,0,0]=2 238 B13R0.1 CC(=CCCC(C)OCCCCF)C e6bae334bcebba69438a43f82f6de551 [0,1,0,0,0,0|2,0,1]=4 239 B13R0.1 CC(=CCCN(C)CCOCCO)C f3807c055004b50fc092d5811ca1456a [0,1,0,0,0,0|1,0,2]=4 240 B13R0.1 CC(=CCC[C@@H](C)CCOCC#N)C 4b8fff5971b4c5a22b5009c2be72c84d [0,1,0,0,0,0|1,0,1]=3 241 B13R0.1 CC(=CCC[C@@H](C)CCOCC=O)C e8eab99172e1225482176aeb6e83e47c [0,1,0,0,0,0|0,0,0]=1 242 B13R0.1 CC(=CCC[C@@H](C)CCOCCF)C 5738e81ae21d5859898da619eaa39dcd [0,1,0,0,0,0|1,0,1]=3 243 B13R0.1 CC(=CCC[C@@H](C)CCOCCS)C b29886a919aa121ffbf5ae8ccb0b42c5 [0,1,0,0,0,0|0,1,1]=3 244 B13R0.1 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COCOCCC(C)CCC=C(C)C 13d498141bbb179a2dad72c70e9c0b19 [0,1,0,0,0,0|0,0,2]=3 289 B13R0.1 COCOCC[C@@H](C)CCC=C(C)C 940b044d1ffd84dd0db0b5c57a4f082b [0,1,0,0,0,0|0,0,2]=3 290 B13R0.1 COCOCC[C@H](C)CCC=C(C)C 46f8117772bbc9061e51c1e869e201e0 [0,1,0,0,0,0|0,0,2]=3 291 B13R0.1 CSCCCOC(C)CCC=C(C)C 62b21631b2d1c3076c7bbc4f741f5288 [0,1,0,0,0,0|3,0,0]=4 292 B13R0.1 CSCCCO[C@@H](C)CCC=C(C)C 54fa12af9ab0a5f2c17f2faa5402d577 [0,1,0,0,0,0|3,0,0]=4 293 B13R0.1 CSCCCO[C@H](C)CCC=C(C)C bfb1a0c96b6c000b7e5320b3e9cf8748 [0,1,0,0,0,0|3,0,0]=4 294 B13R0.1 CSCOCCC(C)CCC=C(C)C 12f58e6d101ab3ed744c0f5640cf2223 [0,1,0,0,0,0|0,1,1]=3 295 B13R0.1 CSCOCC[C@@H](C)CCC=C(C)C 45802b594b08f8f9854997706d566190 [0,1,0,0,0,0|0,1,1]=3 296 B13R0.1 CSCOCC[C@H](C)CCC=C(C)C 76b57180f9bba5bb5fa9bba705292e68 [0,1,0,0,0,0|0,1,1]=3 297 B13R0.153 CCOCCN(CC)CCC=C(C)C c121e3042f9be0678a4d6a2e426cb04b [0,1,0,0,0,0|2,0,1]=4 298 B13R0.331 CCOC(C)CN(C)CCC=C(C)C 95b646fb729cb9f207d11b1b297f8fa1 [0,1,0,0,0,0|2,0,1]=4 299 B13R0.339 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B13R0.1398 CC(=CCCN(C)CCCC(=O)O)C 400352ebbd43057034df4ab645a8ec22 [0,1,0,0,0,0|2,0,0]=3 321 B13R0.1398 CC(=CCCN(C)CCOC(C)C)C 1d2e3969f43d9ef301e96ba05eaf38c4 [0,1,0,0,0,0|2,0,1]=4 322 B13R0.1398 CC(=CCCN(C)CCOC(F)F)C 7a610ff4491e62f5236926f5226d0878 [0,1,0,0,0,0|2,0,1]=4 323 B13R0.1398 CC(=CCC[C@@H](C)CCOC(C)C)C 650dfc88019a4447cebbe1296436067a [0,1,0,0,0,0|1,0,1]=3 324 B13R0.1398 CC(=CCC[C@@H](C)OC/C=C(/C)\I)C 6d286ce50fe7403e41804d74523fbb21 [0,1,0,0,0,0|3,0,0]=4 325 B13R0.1398 CC(=CCC[C@@H](C)OC/C=C(\C)/Cl)C 6c97048506216277743fc43123d7ede8 [0,1,0,0,0,0|3,0,0]=4 326 B13R0.1398 CC(=CCC[C@@H](C)OCC=C(C)C)C f7b6285c32a1e09a91be152ba02fd294 [0,1,0,0,0,0|3,0,0]=4 327 B13R0.1398 CC(=CCC[C@@H](C)OCC=C(C)Cl)C 490142f808fbb66a0b39ac543aec0e07 [0,1,0,0,0,0|3,0,0]=4 328 B13R0.1398 CC(=CCC[C@@H](C)OCC=C(C)I)C 32836ec4b16a104b482cac05ef22061d [0,1,0,0,0,0|3,0,0]=4 329 B13R0.1398 CC(=CCC[C@@H](C)OCC=C(Cl)Cl)C bb1f75684813d3ccadf484fa6a74b423 [0,1,0,0,0,0|3,0,0]=4 330 B13R0.1398 CC(=CCC[C@@H](C)OCCC(=O)N)C 345a0cd02f47fb85465423922ac55469 [0,1,0,0,0,0|2,0,0]=3 331 B13R0.1398 CC(=CCC[C@@H](C)OCCC(=O)O)C 3e84c776c9a99c8011fa2b9465f54546 [0,1,0,0,0,0|2,0,0]=3 332 B13R0.1398 CC(=CCC[C@@H](C)OCCS(=O)C)C 7e320c70dd83178757171c475c1c676d [0,1,0,0,0,0|3,0,0]=4 333 B13R0.1398 CC(=CCC[C@@H](C)OCOC(C)C)C e6075f4c4e304e2d6572fded3001337e [0,1,0,0,0,0|2,0,1]=4 334 B13R0.1398 CC(=CCC[C@@H](C)OCSC(=O)N)C f63591954d3c50f941c9054d18e187fd [0,1,0,0,0,0|1,1,0]=3 335 B13R0.1398 CC(=CCC[C@H](C)CCOC(C)C)C dd1e9a929cb26783de9a81acab057f52 [0,1,0,0,0,0|1,0,1]=3 336 B13R0.1398 CC(=CCC[C@H](C)OC/C=C(/C)\I)C 0c15e9448b50be21a7f9990a65b72477 [0,1,0,0,0,0|3,0,0]=4 337 B13R0.1398 CC(=CCC[C@H](C)OC/C=C(\C)/Cl)C 85fb20c93349300df3597eab9f341a05 [0,1,0,0,0,0|3,0,0]=4 338 B13R0.1398 CC(=CCC[C@H](C)OCC=C(C)C)C c174aa443c05760eb97d6577bcbf908e [0,1,0,0,0,0|3,0,0]=4 339 B13R0.1398 CC(=CCC[C@H](C)OCC=C(C)Cl)C 5efa50bd06bb8ee9670d4bf86066b02b [0,1,0,0,0,0|3,0,0]=4 340 B13R0.1398 CC(=CCC[C@H](C)OCC=C(C)I)C e25584af994fc50f8bba1a768849c840 [0,1,0,0,0,0|3,0,0]=4 341 B13R0.1398 CC(=CCC[C@H](C)OCC=C(Cl)Cl)C 03ffe7fc8c403b0a868e7af40a685f25 [0,1,0,0,0,0|3,0,0]=4 342 B13R0.1398 CC(=CCC[C@H](C)OCCC(=O)N)C b3769acc9db7f6eae5f4e44cce4f7450 [0,1,0,0,0,0|2,0,0]=3 343 B13R0.1398 CC(=CCC[C@H](C)OCCC(=O)O)C afea08bfa9a9f9434c88884872730abc [0,1,0,0,0,0|2,0,0]=3 344 B13R0.1398 CC(=CCC[C@H](C)OCCS(=O)C)C 09e5e0da6229e2e8c8209d1ac35f3e38 [0,1,0,0,0,0|3,0,0]=4 345 B13R0.1398 CC(=CCC[C@H](C)OCOC(C)C)C b19f9c22cc0909b063481de26e77712b [0,1,0,0,0,0|2,0,1]=4 346 B13R0.1398 CC(=CCC[C@H](C)OCSC(=O)N)C 749030ead511ce20474c35b19d7a9be2 [0,1,0,0,0,0|1,1,0]=3 347 B13R0.1398 CC(=O)CCOC(C)CCC=C(C)C f3276fc2bfccbfaea42b680b8a111808 [0,1,0,0,0,0|2,0,0]=3 348 B13R0.1398 CC(=O)CCO[C@@H](C)CCC=C(C)C c52dd060b622636cf122ab78c833af13 [0,1,0,0,0,0|2,0,0]=3 349 B13R0.1398 CC(=O)CCO[C@H](C)CCC=C(C)C f686836c4881fc26fbe00a9db03eb3ce [0,1,0,0,0,0|2,0,0]=3 350 B13R0.1398 CC(=O)NC/C=C(\C)/CCC=C(C)C 9cc4debf6b69ae7adb2f748c34229fd1 [0,1,0,0,0,0|1,0,2]=4 351 B13R0.1398 CC(=O)NCC=C(C)CCC=C(C)C 3bd7e9608ee8e34c13604cd4e9370f53 [0,1,0,0,0,0|1,0,2]=4 352 B13R0.1398 CC(=O)NCCC(C)CCCC(C)C e4ed329d4b08aedd76f31950f14f31a7 [0,1,0,0,0,0|1,0,2]=4 353 B13R0.1398 CC(=O)OCCC(=O)NCC=C(C)C dac0562576c5e99ecba8a04fe2f21b24 [0,1,0,0,0,0|2,0,1]=4 354 B13R0.1398 CC(=O)OCCN(C)CCCN(C)C 0ab16b951f08ef9dd99aa4802cbcdce7 [0,1,0,0,0,0|2,0,1]=4 355 B13R0.1398 CC(=O)OCCN(C)CCOC(C)C 03a54c170e8884b32b406f95f27f100f [0,1,0,0,0,0|2,0,1]=4 356 B13R0.1398 CC(=O)OCNC(C)CCCC(C)C c432a182a50f1d5cb2790c2c087a09a9 [0,1,0,0,0,0|1,0,2]=4 357 B13R0.1398 CC(=O)OCOC(C)CCC=C(C)C 9e18f5ad9f4cd9d77840d5ac08596c3e [0,1,0,0,0,0|1,0,0]=2 358 B13R0.1398 CC(=O)OCOC(C)CCCC(C)C e99dc1fd7088802a637693a8bcd89d7e [0,1,0,0,0,0|1,0,2]=4 359 B13R0.1398 CC(=O)OCO[C@@H](C)CCC=C(C)C 7cf0f8a79434fbb1f805de304f2c772f [0,1,0,0,0,0|1,0,0]=2 360 B13R0.1398 CC(=O)OCO[C@H](C)CCC=C(C)C f9e58b0a0139e5c8737b6d3e8e66e8ac [0,1,0,0,0,0|1,0,0]=2 361 B13R1.60 C=CC1CCN(C1)CCC=C(C)C 41298d157b0fd8b1965edbe28c1453aa [0,0,0,1,0,0|3,0,0]=4 362 B13R1.149 C/C(=C/CNC1CCNC(=O)C1)/I 322dea4cc8c738cdbf0c4abf827bd41c [0,0,0,1,0,0|3,0,0]=4 363 B13R1.149 C/C(=C/CN[C@@H]1CCNC(=O)C1)/I eccd366e058c6fd6ebe9ac6d9958ec63 [0,0,0,1,0,0|3,0,0]=4 364 B13R1.149 C/C(=C/CN[C@H]1CCNC(=O)C1)/I 48d48e1eda43a5b1a0b3b958b5c488d6 [0,0,0,1,0,0|3,0,0]=4 365 B13R1.149 C/C(=C/COC1CCCC(=O)C1)/Cl be1e154be2f3723ad333e10e29e62e4d [0,0,0,1,0,0|3,0,0]=4 366 B13R1.149 C/C(=C/COC1CCCC(=O)C1)/I 67206bfba0f06c632a17d70fae6394cd [0,0,0,1,0,0|3,0,0]=4 367 B13R1.149 C/C(=C/COC1CCNC(=O)C1)/I 90f109ce49e302b70eef4878c19dd2e6 [0,0,0,1,0,0|3,0,0]=4 368 B13R1.149 C/C(=C/CO[C@@H]1CCNC(=O)C1)/I 0a3b9122edb3ffcd4850682572bc67c5 [0,0,0,1,0,0|3,0,0]=4 369 B13R1.149 C/C(=C/CO[C@H]1CCNC(=O)C1)/I 615ec28a9f10c0695b75aa93a6c72fc4 [0,0,0,1,0,0|3,0,0]=4 370 B13R1.149 C/C(=C\CNC1CCNC(=O)C1)/Cl 20210112524b2f1a4b92c4dfb3f3807e [0,0,0,1,0,0|3,0,0]=4 371 B13R1.149 C/C(=C\CN[C@@H]1CCNC(=O)C1)/Cl 431237986f159c5526b4fa631f1f548c [0,0,0,1,0,0|3,0,0]=4 372 B13R1.149 C/C(=C\CN[C@H]1CCNC(=O)C1)/Cl 1356ccb445602e27f56756829f218bd5 [0,0,0,1,0,0|3,0,0]=4 373 B13R1.149 C/C(=C\COC1CCCC(=O)C1)/Cl 32f550a8a2af22ef193eed2ef94aa077 [0,0,0,1,0,0|3,0,0]=4 374 B13R1.149 C/C(=C\COC1CCNC(=O)C1)/Cl c88e355b8f4816898bca19b740dc0816 [0,0,0,1,0,0|3,0,0]=4 375 B13R1.149 C/C(=C\CO[C@@H]1CCNC(=O)C1)/Cl c65f9d794467d7fe475681204cb8bd58 [0,0,0,1,0,0|3,0,0]=4 376 B13R1.149 C/C(=C\CO[C@H]1CCNC(=O)C1)/Cl ae4bd9722c8cf3e63e42f90394525be6 [0,0,0,1,0,0|3,0,0]=4 377 B13R1.149 C=C(C)CCCN1CCOC(=O)C1 af19c8fb3cdda15a308489f809521704 [0,0,0,1,0,0|1,0,2]=4 378 B13R1.149 CC(=CCCN1CCCC(=O)C1)C 2956f6eead7b5ab652464d28eff3b329 [0,0,0,1,0,0|2,0,0]=3 379 B13R1.149 CC(=CCCN1CCNC(=O)C1)C 63e6cb838ce9adca9b0103d90afd726a [0,0,0,1,0,0|2,0,0]=3 380 B13R1.149 CC(=CCCN1CCOC(=O)C1)C ac877ef3ce3c7e41e006b5cd126a4340 [0,0,0,1,0,0|1,0,0]=2 381 B13R1.149 CC(=CCCN1CCOC(C1)C)C 37debc6c4fdd1be4d19acee8e7b5e4be [0,0,0,1,0,0|2,0,1]=4 382 B13R1.149 CC(=CCCN1CCO[C@@H](C1)C)C 78679f38c1587536960a08d68118311b [0,0,0,1,0,0|2,0,1]=4 383 B13R1.149 CC(=CCCN1CCO[C@H](C1)C)C be2d514a661bb2083ebc0eaf1de94c0e [0,0,0,1,0,0|2,0,1]=4 384 B13R1.149 CC(=CCNC1CCCC(=O)C1)C 3f3f7f47279d2bd5d26df696432c0a84 [0,0,0,1,0,0|2,0,0]=3 385 B13R1.149 CC(=CCNC1CCNC(=O)C1)C 86ceddebd72af79e7031480ca50f6f13 [0,0,0,1,0,0|2,0,0]=3 386 B13R1.149 CC(=CCNC1CCNC(=O)C1)Cl 4a99cc002376d479389ef80d77802023 [0,0,0,1,0,0|3,0,0]=4 387 B13R1.149 CC(=CCNC1CCNC(=O)C1)I 6521a059001e7d553bdfd6f1df415f4c [0,0,0,1,0,0|3,0,0]=4 388 B13R1.149 CC(=CCNC1CCOC(C1)C)C a39db40d03206c16a7076d0c86b91b2c [0,0,0,1,0,0|2,0,1]=4 389 B13R1.149 CC(=CCN[C@@H]1CCNC(=O)C1)C aad9b72105d1f76e895de81ea0d80b54 [0,0,0,1,0,0|2,0,0]=3 390 B13R1.149 CC(=CCN[C@@H]1CCNC(=O)C1)Cl 39bbc0316be3b2e9acc8589d17ffed97 [0,0,0,1,0,0|3,0,0]=4 391 B13R1.149 CC(=CCN[C@@H]1CCNC(=O)C1)I 3d8fc8655d5b03b76a6b70d3bdb28f7c [0,0,0,1,0,0|3,0,0]=4 392 B13R1.149 CC(=CCN[C@@H]1CCO[C@@H](C1)C)C f1a0bddfae1199b1691b4ad259dd189d [0,0,0,1,0,0|2,0,1]=4 393 B13R1.149 CC(=CCN[C@@H]1CCO[C@H](C1)C)C 9a113e6303caee091be69032b1d03390 [0,0,0,1,0,0|2,0,1]=4 394 B13R1.149 CC(=CCN[C@H]1CCNC(=O)C1)C 3e5f6b2d21da5195946221004d21c86b [0,0,0,1,0,0|2,0,0]=3 395 B13R1.149 CC(=CCN[C@H]1CCNC(=O)C1)Cl 3c6d45a201b93f83aa24d63a19fa192c [0,0,0,1,0,0|3,0,0]=4 396 B13R1.149 CC(=CCN[C@H]1CCNC(=O)C1)I af0221cfc05e54a41918ee3de9c6044c [0,0,0,1,0,0|3,0,0]=4 397 B13R1.149 CC(=CCN[C@H]1CCO[C@@H](C1)C)C 877dd0291020f66ee5b19e47ab77fe09 [0,0,0,1,0,0|2,0,1]=4 398 B13R1.149 CC(=CCN[C@H]1CCO[C@H](C1)C)C 866212e3e6aecf4085f1169d1eb5d5aa [0,0,0,1,0,0|2,0,1]=4 399 B13R1.149 CC(=CCOC1CCCC(=O)C1)C c5d09ca42db730eaaa1aec176e0ef2c1 [0,0,0,1,0,0|2,0,0]=3 400 B13R1.149 CC(=CCOC1CCCC(=O)C1)Cl d068efb95c393aa03bd87ba03960ac56 [0,0,0,1,0,0|3,0,0]=4 401 B13R1.149 CC(=CCOC1CCCC(=O)C1)I 8aafa1bc715848a11a474433fc3221ff [0,0,0,1,0,0|3,0,0]=4 402 B13R1.149 CC(=CCOC1CCNC(=O)C1)C 2a5a0cd3448114e6c64f44aa8e7edf50 [0,0,0,1,0,0|2,0,0]=3 403 B13R1.149 CC(=CCOC1CCNC(=O)C1)Cl 923c699a69fcfbffe07a5732f252d45a [0,0,0,1,0,0|3,0,0]=4 404 B13R1.149 CC(=CCOC1CCNC(=O)C1)I f1dbe5d8fac9ba5d4b8c324f85824e41 [0,0,0,1,0,0|3,0,0]=4 405 B13R1.149 CC(=CCOC1CCOC(C1)C)C 06e7871d420c06afe7a19fdab42c467d [0,0,0,1,0,0|2,0,1]=4 406 B13R1.149 CC(=CCO[C@@H]1CCNC(=O)C1)C 38ae2904b0de72e5d8ebc542789b280f [0,0,0,1,0,0|2,0,0]=3 407 B13R1.149 CC(=CCO[C@@H]1CCNC(=O)C1)Cl 4e0eedaa6bce2ac5992599d212839675 [0,0,0,1,0,0|3,0,0]=4 408 B13R1.149 CC(=CCO[C@@H]1CCNC(=O)C1)I 6e736e147293d528fcf32cbbcbff8895 [0,0,0,1,0,0|3,0,0]=4 409 B13R1.149 CC(=CCO[C@@H]1CCO[C@@H](C1)C)C e017f5f1216649f00a557cb23556028c [0,0,0,1,0,0|2,0,1]=4 410 B13R1.149 CC(=CCO[C@@H]1CCO[C@H](C1)C)C 0d1e21b950dcf8bc5778ca588652564f [0,0,0,1,0,0|2,0,1]=4 411 B13R1.149 CC(=CCO[C@H]1CCNC(=O)C1)C 2405ec99b7109d3a021b82718cfcd010 [0,0,0,1,0,0|2,0,0]=3 412 B13R1.149 CC(=CCO[C@H]1CCNC(=O)C1)Cl 62266b1876e50533b3c17dc1ef60f514 [0,0,0,1,0,0|3,0,0]=4 413 B13R1.149 CC(=CCO[C@H]1CCNC(=O)C1)I 0cb4d0feb90ad2db8ac7d95a3f5a2aa7 [0,0,0,1,0,0|3,0,0]=4 414 B13R1.149 CC(=CCO[C@H]1CCO[C@@H](C1)C)C b1a284d169b4f75fef687401a6d5c33d [0,0,0,1,0,0|2,0,1]=4 415 B13R1.149 CC(=CCO[C@H]1CCO[C@H](C1)C)C c423e1fbb7b310b8ea1f26aae3e1af41 [0,0,0,1,0,0|2,0,1]=4 416 B13R1.149 CC(=O)CCCN1CCOC(=O)C1 1269a13bc11da928c74bdacfe3fc2264 [0,0,0,1,0,0|2,0,1]=4 417 B13R1.149 CC(=O)NCCN1CCOC(=O)C1 4496fe8da2280f3a319f04fc2264b337 [0,0,0,1,0,0|3,0,0]=4 418 B13R1.149 CC(=O)OCCN1CCOC(=O)C1 c976b401bd44658b05248c99f7410b4c [0,0,0,1,0,0|3,0,0]=4 419 B13R1.149 CC(=O)SCCN1CCOC(=O)C1 08af5f013afbcdd81e891f001f83c4ac [0,0,0,1,0,0|3,0,0]=4 420 B13R1.149 CC(C)/C=C/CN1CCOC(=O)C1 b7b8c8ce1b062348cf0936ab7f687773 [0,0,0,1,0,0|1,0,2]=4 421 B13R1.149 CC(C)CCCN1CCOC(=O)C1 dfc2d87787db305d205892c19491fc5b [0,0,0,1,0,0|1,0,2]=4 422 B13R1.149 CC(C)OCCN1CCOC(=O)C1 ca8498af76540818e2cd71fe4cc984c1 [0,0,0,1,0,0|2,0,1]=4 423 B13R1.149 CC(C)SCCN1CCOC(=O)C1 7ab67e3f999b531d24d1118ad6b2cdb2 [0,0,0,1,0,0|2,0,1]=4 424 B13R1.149 CN(C)CCCN1CCOC(=O)C1 18853d2b619d9a883716977c18bd89d5 [0,0,0,1,0,0|2,0,1]=4 425 B13R1.149 O=C1CN(CCO1)CCC=C(F)F 66a036c29d8db768e184fe4da84d02c9 [0,0,0,1,0,0|3,0,0]=4 426 B13R1.232 CCOC1CN(C1)CCC=C(C)C ec00021bc0e528cc4603ef31544e9cc3 [0,0,0,1,0,0|2,0,1]=4 427 B13R1.232 CCO[C@H]1C[C@@H](C1)OCC=C(C)C 7850160246fef008e0ceca6bc6f4b63d [0,0,0,1,0,0|2,0,1]=4 428 B13R1.232 CCO[C@H]1C[C@H](C1)OCC=C(C)C b00ccfae7378f65ef92c3e6938983f68 [0,0,0,1,0,0|2,0,1]=4 429 B13R1.280 CC(=CCN1CCOCCC1C)C 5a076c103f7af01cf154bab824211b37 [0,0,0,1,0,0|2,0,1]=4 430 B13R1.342 CC(=CCCN(C)C1CC=CC1)C c11cce7441089f1bb4ae4f849fe5e430 [0,0,0,1,0,0|3,0,0]=4 431 B13R1.342 CC(=CCCN(C)C1CCOC1)C f3b577048c5e5eb684f013877d53cae3 [0,0,0,1,0,0|2,0,1]=4 432 B13R1.342 CC(=CCCN(C)[C@@H]1CCOC1)C 42a73050ca460e0ad2003179f4efbad0 [0,0,0,1,0,0|2,0,1]=4 433 B13R1.342 CC(=CCCN(C)[C@H]1CCOC1)C af3ca567721f041494398e9e457a2f5a [0,0,0,1,0,0|2,0,1]=4 434 B13R1.342 CC(=CCN[C@H](C)C1CCOC1)C 9971b19ba9bc749b9024a009e59a0d85 [0,0,0,1,0,0|2,0,1]=4 435 B13R1.342 CC(=CCOC(C)C1CCOC1)C 092f832fb80868cf48e4312e522cfb36 [0,0,0,1,0,0|2,0,1]=4 436 B13R1.356 CC(C)[C@@H]1CC[C@H](C[C@H]1NC=O)C 745c722c67d1effebf6ec68fdfd412e1 [0,0,0,1,0,0|1,0,2]=4 437 B13R1.356 CC(C)[C@H]1CC[C@@H](C[C@@H]1NC=O)C e877bfe0589db32091134b737859fc61 [0,0,0,1,0,0|1,0,2]=4 438 B13R1.356 CC(C)[C@H]1CC[C@@H](C[C@H]1NC=O)C 3c421dd8e2878094b94f85e5e83b9671 [0,0,0,1,0,0|1,0,2]=4 439 B13R1.356 CC1CCC(C(C1)NC=O)C(C)C 555b4c107f0cb83716eea846f090f131 [0,0,0,1,0,0|1,0,2]=4 440 B13R1.1988 CC(=CCCN1CCCOCC1)C efc0753b49cc97cfbc79c94ae24a95a9 [0,0,0,1,0,0|2,0,1]=4 441 B13R1.1988 CC(=CCNC1CCC=CCC1)C 9e2d69e98d160f3e18246ca29db65797 [0,0,0,1,0,0|3,0,0]=4 442 B13R1.1988 CC(=CCNC1CCCOCC1)C ffe225d726b88cb792ccc5dce6422dc7 [0,0,0,1,0,0|2,0,1]=4 443 B13R1.1988 CC(=CCOC1CCCOCC1)C dce47a956535d2a1ef4372f735010626 [0,0,0,1,0,0|2,0,1]=4 444 B13R1.3566 C/C(=C/CNC1(CCNC1=O)C)/I 110ace24290b9c2a7ae523ad536a2109 [0,0,0,1,0,0|3,0,0]=4 445 B13R1.3566 C/C(=C\CNC1(CCNC1=O)C)/Cl 0cdab0ac2bc9a462267ace9dd65f51e8 [0,0,0,1,0,0|3,0,0]=4 446 B13R1.3566 CC(=CCNC1(CCNC1=O)C)C 299edfd691bcf6dafc3ec464bebddd09 [0,0,0,1,0,0|2,0,0]=3 447 B13R1.3566 CC(=CCNC1(CCNC1=O)C)Cl 59b78a8ddc376aac56ad134c0bd38e67 [0,0,0,1,0,0|3,0,0]=4 448 B13R1.3566 CC(=CCNC1(CCNC1=O)C)I 11d747304d047189a341b59966613c57 [0,0,0,1,0,0|3,0,0]=4 449 B13R1.5134 CC(=CCNC1(CCOCC1)C)C 08c3ab3788eafe8b0eefb8c72df32cde [0,0,0,1,0,0|2,0,1]=4 450 B11R0.46 C=CCCCN(C)CC=C(C)C 764e4f4296e872190a90a30a1fd8b978 [0,0,0,0,1,0|3,0,0]=4 451 B11R0.46 CC(=CCN(C)CCOCF)C 60f98d62b195baca6137464df0986640 [0,0,0,0,1,0|2,0,1]=4 452 B11R0.46 CC(C)CCC(C)COCC=O c1e0aa7b44edd4b2757a5035244ee586 [0,0,0,0,1,0|2,0,1]=4 453 B11R0.46 CC(C)CCC(C)NCCC=O 8583e386491560d5c3b417c051d7ecc8 [0,0,0,0,1,0|2,0,1]=4 454 B11R0.46 CC(C)CCC(C)OCCC=O 4e6da52095aedecf8f59c3f5fe27138a [0,0,0,0,1,0|2,0,1]=4 455 B11R0.46 CC(C)CCN(C)CCCC=O a99809096baa52a3aaa15b5f9c633b44 [0,0,0,0,1,0|2,0,1]=4 456 B11R0.46 CC(CCN(C)C)NCCC=O e70526fe37b3fdce4d8dc9e12736f334 [0,0,0,0,1,0|3,0,0]=4 457 B11R0.46 CC(CCN(C)C)OCCC=O 65e50d7fb20a8fb475dae388c0363b22 [0,0,0,0,1,0|3,0,0]=4 458 B11R0.46 CCOCCN(C)CC=C(C)C f0dff1703d80314bd46a2735c1d8c98c [0,0,0,0,1,0|2,0,1]=4 459 B11R0.46 CN(C)CCN(C)CCCC=O 401b876ce6f3deca0146b10c2105f711 [0,0,0,0,1,0|3,0,0]=4 460 B11R0.46 CN(C)CCN(C)CCNC=O cc0eefc5270fbd7a56a8e8996afa0d18 [0,0,0,0,1,0|3,0,0]=4 461 B11R0.46 C[C@@H](CCN(C)C)NCCC=O 36af88d2965e3e75d2b9ac3d342bf5d7 [0,0,0,0,1,0|3,0,0]=4 462 B11R0.46 C[C@H](CCN(C)C)NCCC=O 176bdf92791b6609de5b95193550afae [0,0,0,0,1,0|3,0,0]=4 463 B13R0.188 C=CCCC[C@H](C)OCCC=C(C)C 179e8137cfc2c595a07a7670e7d217b9 [0,0,0,0,0,1|2,0,0]=3 464 B13R0.188 CCCCCC(C)COCC=C(C)C 2d90ba969bebc88dd62a6fb66050d879 [0,0,0,0,0,1|2,0,1]=4 465 B13R0.188 CCCCCC(C)NCCC=C(C)C 21587cfe43c30bae02d6306932c253b3 [0,0,0,0,0,1|2,0,1]=4 466 B13R0.188 CCCCCC(C)OCCC=C(C)C 9f0c495690181cb516c08194c7741849 [0,0,0,0,0,1|2,0,1]=4 467 B13R0.188 CCCCC[C@@H](C)OCCC=C(C)C 31c3c5c9107a174adb7235799ced77e5 [0,0,0,0,0,1|2,0,1]=4 468 B13R0.188 CCCCC[C@H](C)NCCC=C(C)C 8a37226bdc4c3b837c4c5cb882c7bcaa [0,0,0,0,0,1|2,0,1]=4 469 B13R0.188 CCCCC[C@H](C)OCCC=C(C)C a678d3be2d0e141f3bdfa8fdc07a75bf [0,0,0,0,0,1|2,0,1]=4 470 B10R0.71 C/C=C/CCCOCCC=O 099c08e5c9575bdb23438e08c620b76f [2,0,0,0,0,0|2,0,0]=4 471 B10R0.71 C/C=C/CCOCCCC=O 46be8a5f234e47ed5f7141f11d130e36 [2,0,0,0,0,0|2,0,0]=4 472 B10R0.71 C/C=C/COCCCCC=O c69191768fd3a5cdc75c8954e68658dc [2,0,0,0,0,0|2,0,0]=4 473 B10R0.71 C/C=C\CCCOCCC=O ab415cdd81ed9ccdd379943059deca49 [2,0,0,0,0,0|2,0,0]=4 474 B10R0.71 C/C=C\COCCCCC=O 24a162bb69ad155abd28d7f92eba7dd3 [2,0,0,0,0,0|2,0,0]=4 475 B10R0.71 C=COCCCNC/C=C/C 6dec7fd1287bf943b54507897c395a7a [2,0,0,0,0,0|2,0,0]=4 476 B10R0.71 C=COCCCNC/C=C\C 78a580f3beaa2bd6204eef26ca8168b5 [2,0,0,0,0,0|2,0,0]=4 477 B10R0.71 CC=CCCCOCCC=O 97c9f6fdd6a4de3b92d2d85ba134118f [2,0,0,0,0,0|2,0,0]=4 478 B10R0.71 CC=CCNCCCCC=O d8b092d9ef5e9f30b928b9bc7ef62f08 [2,0,0,0,0,0|2,0,0]=4 479 B10R0.71 CC=CCOCCCCC=O 85eab19089cebb2153fb1e7f93e60c1a [2,0,0,0,0,0|2,0,0]=4 480 B10R0.91 C/C=C/COC(C)CCOC 69612b6c7681993570ae4faf16643dfe [2,0,0,0,0,0|1,0,1]=4 481 B10R0.91 C/C=C\COC(C)CCOC 5a99498f7e7fd58d035c721f75311814 [2,0,0,0,0,0|1,0,1]=4 482 B10R0.91 C=CCCC(C)NCC=CC 64f1f96d29cb6e7ef0378a029298fc62 [2,0,0,0,0,0|2,0,0]=4 483 B10R0.91 C=CCCC(C)OC/C=C/C 882d0fce6ae95c4779a92c2c59eb0d9e [2,0,0,0,0,0|2,0,0]=4 484 B10R0.91 C=CCCC(C)OC/C=C\C 6165e5067e715a669b0c5f6f1057d40f [2,0,0,0,0,0|2,0,0]=4 485 B10R0.91 C=CCCC(C)OCC=CC 44ab2be02255f8502012d678578f9239 [2,0,0,0,0,0|2,0,0]=4 486 B10R0.91 C=CCCC(C)OCCC=O 280a758e8fd0752265ceb917ba851656 [2,0,0,0,0,0|2,0,0]=4 487 B10R0.91 C=CCCN(C)CCCC=O 8f5b7db3f93623d9fbada7e804642bab [2,0,0,0,0,0|2,0,0]=4 488 B10R0.91 C=CCC[C@@H](C)OC/C=C/C dacd808c892b21780bcdfd1b650118ae [2,0,0,0,0,0|2,0,0]=4 489 B10R0.91 C=CCC[C@@H](C)OC/C=C\C af99ebb21431f310fc0271c164cc8c52 [2,0,0,0,0,0|2,0,0]=4 490 B10R0.91 C=CCC[C@@H](C)OCCC=O ab6da2e13571743054f785894b9437f8 [2,0,0,0,0,0|2,0,0]=4 491 B10R0.3 C/C(=C/CNC(C)CCO)/I 43b62d1ad52ef2de4371da8860cb9038 [2,0,0,0,0,0|2,0,0]=4 492 B10R0.3 C/C(=C/CN[C@@H](C)CCO)/I 5ea083b8502caf045a6d0fc40a5da6af [2,0,0,0,0,0|2,0,0]=4 493 B10R0.3 C/C(=C/CN[C@H](C)CCO)/I 1454f3463dc81f1e061ca98b75c80656 [2,0,0,0,0,0|2,0,0]=4 494 B10R0.3 C/C(=C\CNC(C)CCO)/Cl de70a4f64650a584dc0f6de737c8fa5c [2,0,0,0,0,0|2,0,0]=4 495 B10R0.3 C/C(=C\CN[C@@H](C)CCO)/Cl 4a3f5ad0c54d1bc4a14c3f584432d859 [2,0,0,0,0,0|2,0,0]=4 496 B10R0.3 C/C(=C\CN[C@H](C)CCO)/Cl e2e8f88352b55179cbf74e96c4c2545e [2,0,0,0,0,0|2,0,0]=4 497 B10R0.3 C=CCC(C)OCC=C(C)C 83ed649d5a698cf765df6842c42aecaa [2,0,0,0,0,0|1,0,1]=4 498 B10R0.3 C=CCN(C)CCC=C(C)C 5b2c9abc8343724b680fba76cddc4531 [2,0,0,0,0,0|1,0,1]=4 499 B10R0.3 C=CC[C@@H](C)OCC=C(C)C 29288ce61afaf80477bd5370ef3e8d62 [2,0,0,0,0,0|1,0,1]=4 500 B10R0.3 C=CC[C@H](C)OCC=C(C)C b007b3b3bcaaeec558eb96e037b5e782 [2,0,0,0,0,0|1,0,1]=4 501 B10R0.3 CC(=CCCC(C)OCF)C 6664a9ab1ffffce273c0154ca48b84b6 [2,0,0,0,0,0|1,0,1]=4 502 B10R0.3 CC(=CCCN(C)CCF)C 5144a0004b75e54c89fb73b8847fea98 [2,0,0,0,0,0|2,0,0]=4 503 B10R0.3 CC(=CCCN(C)CCO)C 7a93a00825bb54c64cef8f81fafc5f08 [2,0,0,0,0,0|1,0,0]=3 504 B10R0.3 CC(=CCC[C@@H](C)OCF)C 06963be90c9e89a7148fa3e5a57a42c1 [2,0,0,0,0,0|1,0,1]=4 505 B10R0.3 CC(=CCC[C@H](C)OCF)C 3df6c94219d6ff0ecf1b9dc25b9c280d [2,0,0,0,0,0|1,0,1]=4 506 B10R0.3 CC(=CCNC(C)CCO)C 75befb603f41d774c9b67942dc11cf09 [2,0,0,0,0,0|1,0,0]=3 507 B10R0.3 CC(=CCNC(C)CCO)Cl 03740668d505dc6405803268bedffe99 [2,0,0,0,0,0|2,0,0]=4 508 B10R0.3 CC(=CCNC(C)CCO)I f89d39e622538b521b7f3a1fdb99f6f1 [2,0,0,0,0,0|2,0,0]=4 509 B10R0.3 CC(=CCN[C@@H](C)CCO)C 6312599fddeb6ec00e0b09c81dd3ceb5 [2,0,0,0,0,0|1,0,0]=3 510 B10R0.3 CC(=CCN[C@@H](C)CCO)Cl 04d511734d562d4cb94f2e712548b6b5 [2,0,0,0,0,0|2,0,0]=4 511 B10R0.3 CC(=CCN[C@@H](C)CCO)I 53677484e308af58cbcc9f0be05b8bc5 [2,0,0,0,0,0|2,0,0]=4 512 B10R0.3 CC(=CCN[C@H](C)CCO)C d5d8e8c36af2012169bc96d95a42e3f4 [2,0,0,0,0,0|1,0,0]=3 513 B10R0.3 CC(=CCN[C@H](C)CCO)Cl f0fc09b74dff65cd28f1677d6abb9ad5 [2,0,0,0,0,0|2,0,0]=4 514 B10R0.3 CC(=CCN[C@H](C)CCO)I a62f8fc12fa3cc97aba8f407d165e2ba [2,0,0,0,0,0|2,0,0]=4 515 B10R0.3 CCCC(C)NCC=C(C)C 85bf8c5fb879b7f86932bd2858b392f8 [2,0,0,0,0,0|1,0,1]=4 516 B10R0.3 CCCC(C)OCC=C(C)C 9bb7dc10ca82c755a572decaa2b1a303 [2,0,0,0,0,0|1,0,1]=4 517 B10R0.3 CCCN(C)CCC=C(C)C 5429ecc50897d950bfc9c09b3896f07f [2,0,0,0,0,0|1,0,1]=4 518 B10R0.3 CCC[C@@H](C)OCC=C(C)C 645e46d2cdf27930cced2d07b4bca084 [2,0,0,0,0,0|1,0,1]=4 519 B10R0.3 CCC[C@H](C)NCC=C(C)C b9d2a1fef286f78a0925635d27075aba [2,0,0,0,0,0|1,0,1]=4 520 B10R0.3 CCC[C@H](C)OCC=C(C)C 2fbaefff45b7bd0400a77a0408e43f1d [2,0,0,0,0,0|1,0,1]=4 521 B10R0.3 CCOC(C)CCC=C(C)C 1ca9ec3c5864b13eb80e92b783990b96 [2,0,0,0,0,0|1,0,1]=4 522 B10R0.3 CCO[C@@H](C)CCC=C(C)C 312b70b86dafc492e09af82360bc84e2 [2,0,0,0,0,0|1,0,1]=4 523 B10R0.3 CCO[C@H](C)CCC=C(C)C d649eb20379be96eaa844ec4fab7fcca [2,0,0,0,0,0|1,0,1]=4 524 B10R0.3 COCC(C)NCC=C(C)C e336cf69ddf750c09e24d3269112250e [2,0,0,0,0,0|1,0,1]=4 525 B10R0.3 COCC(C)OCC=C(C)C b41c6a14f3f7eab596f98179b29b1e0e [2,0,0,0,0,0|1,0,1]=4 526 B10R0.3 COC[C@@H](C)NCC=C(C)C eff0b064e7112ad0e307f7f912f2026e [2,0,0,0,0,0|1,0,1]=4 527 B10R0.3 COC[C@@H](C)OCC=C(C)C e0d6ea8edaa9c8a625b1135c3c8f0d9d [2,0,0,0,0,0|1,0,1]=4 528 B10R0.3 COC[C@H](C)NCC=C(C)C 7886c3561904f98e616a023f7b43eda1 [2,0,0,0,0,0|1,0,1]=4 529 B10R0.3 COC[C@H](C)OCC=C(C)C 8a358771fe0990f624d4f27aefc803eb [2,0,0,0,0,0|1,0,1]=4 530 B10R0.4 C/C(=C/COCCCC=O)/Cl 0eec9ef34eca28127f9006fdafb8f2b6 [2,0,0,0,0,0|2,0,0]=4 531 B10R0.4 C/C(=C/COCCCC=O)/I b819d9d08de9d0a1cc1dd651c901025e [2,0,0,0,0,0|2,0,0]=4 532 B10R0.4 C/C(=C/COCCOC=O)/I 189b7d4af819a0fbc75ff9b929dcc08b [2,0,0,0,0,0|2,0,0]=4 533 B10R0.4 C/C(=C\COCCCC=O)/Cl f80f54481adfa09255d662e637588577 [2,0,0,0,0,0|2,0,0]=4 534 B10R0.4 C/C(=C\COCCOC=O)/Cl 2113bfcb5c692064ef5d02f326f64569 [2,0,0,0,0,0|2,0,0]=4 535 B10R0.4 C=C(C)CCOCCOC=O 0951eb54268cfe01d4f95bc25b713b88 [2,0,0,0,0,0|1,0,1]=4 536 B10R0.4 C=CCCCNCC=C(C)C 79c26d1e604a5aad779ff6fe84a9295e [2,0,0,0,0,0|2,0,0]=4 537 B10R0.4 C=CCCCOCC=C(C)C 4d25fd904f1c0b4b21857757acaeec93 [2,0,0,0,0,0|2,0,0]=4 538 B10R0.4 C=CCCNCCC=C(C)C 815d11dde6898e3af4cf0f9a659f4605 [2,0,0,0,0,0|2,0,0]=4 539 B10R0.4 C=CCCOCCC=C(C)C 9089ff911ab7f3f48833a2d35fcb090c [2,0,0,0,0,0|2,0,0]=4 540 B10R0.4 C=COCCNCC=C(C)C b93126dc005e35974909628afb3c4ac7 [2,0,0,0,0,0|2,0,0]=4 541 B10R0.4 C=COCCOCC=C(C)C ab505bd3b7ec15bb9a483256cfee71ed [2,0,0,0,0,0|2,0,0]=4 542 B10R0.4 CC(=CCCNCCON)C c219c6cbcd89ff135770c58088829bb8 [2,0,0,0,0,0|2,0,0]=4 543 B10R0.4 CC(=CCCOCCC=O)C 465270458dd49b7be4a0c27ddadf4bd7 [2,0,0,0,0,0|1,0,0]=3 544 B10R0.4 CC(=CCNCCCC=O)C 232cac191724fc164471d75b4f543482 [2,0,0,0,0,0|1,0,0]=3 545 B10R0.4 CC(=CCOCCCC=O)C 5a9b49816e64e87495e1a653bf7d40c8 [2,0,0,0,0,0|1,0,0]=3 546 B10R0.4 CC(=CCOCCCC=O)Cl 62672ba6d4ddab2ec09925bc0b5317f8 [2,0,0,0,0,0|2,0,0]=4 547 B10R0.4 CC(=CCOCCCC=O)I 3df7653c3ea17fc9b66d0d3566672fa2 [2,0,0,0,0,0|2,0,0]=4 548 B10R0.4 CC(=CCOCCNC=O)C 6a2a0a0a021d48518af5c1b8b4cc287a [2,0,0,0,0,0|2,0,0]=4 549 B10R0.4 CC(=CCOCCOC=O)C 76c1219e0bab1297a64abd6022ad9af7 [2,0,0,0,0,0|1,0,0]=3 550 B10R0.4 CC(=CCOCCOC=O)Cl b0b72edcebe666b6b6307aead5017fa3 [2,0,0,0,0,0|2,0,0]=4 551 B10R0.4 CC(=CCOCCOC=O)I 3eee6fe3202732f9425f7e5f82f46b78 [2,0,0,0,0,0|2,0,0]=4 552 B10R0.4 CC(=O)CCOCCOC=O 104c482006349fdbbf411cfdc9db4b72 [2,0,0,0,0,0|2,0,0]=4 553 B10R0.4 CC(C)CCCCCNC=O 241cd0226ae475c9be6d599bf338beb0 [2,0,0,0,0,0|1,0,1]=4 554 B10R0.4 CC(C)CCOCCOC=O e633d59f97e946f8f842b70c7c062796 [2,0,0,0,0,0|1,0,1]=4 555 B10R0.4 CC(C)OCCCCCC=O 032283e7aafb15cf0f6a0d0eb14b8408 [2,0,0,0,0,0|1,0,1]=4 556 B10R0.4 CN(C)CCCCCNC=O 9c75205b3f898c9bdeb7b7b6a3a1031a [2,0,0,0,0,0|2,0,0]=4 557 B10R0.4 CN(C)CCOCCOC=O d1edacbf5a8579d8da14af5e68e40d90 [2,0,0,0,0,0|2,0,0]=4 558 B10R0.4 COCCCNCC=C(C)C 916f91f0e18c3df17b70fbaa42c0f264 [2,0,0,0,0,0|1,0,1]=4 559 B10R0.4 COCCCOCC=C(C)C 43bf918f991a069a57d48ce097b3206d [2,0,0,0,0,0|1,0,1]=4 560 B10R0.4 COCCNCCC=C(C)C 72060b70c2933e3b7c7d542919cdc166 [2,0,0,0,0,0|1,0,1]=4 561 B10R0.4 COCCOCCC=C(C)C e315af0de16af0f3512cf11f7f615bf4 [2,0,0,0,0,0|1,0,1]=4 562 B12R0.47 CCCCCC(C)OCCOC=O 238a5b26d340cd5d6d644c2913fb387d [1,1,0,0,0,0|0,0,2]=4 563 B12R0.47 CCCCC[C@H](C)OCCOC=O a792af06a29254168efec0500f62cce6 [1,1,0,0,0,0|0,0,2]=4 564 B12R0.44 C/C(=C/CNC(C)CCC(=O)O)/I 645958b3d0d027df2becafbd93e5899b [1,1,0,0,0,0|2,0,0]=4 565 B12R0.44 C/C(=C/CN[C@@H](C)CCC(=O)O)/I 642391dd0c832fb433540cf684b1c53e [1,1,0,0,0,0|2,0,0]=4 566 B12R0.44 C/C(=C/COC(C)CCC(=O)O)/Cl 3114984afe28645971089847c39a1d8c [1,1,0,0,0,0|2,0,0]=4 567 B12R0.44 C/C(=C/COC(C)CCC(=O)O)/I 8a1ea2d64d8eaabb098ace09f923961d [1,1,0,0,0,0|2,0,0]=4 568 B12R0.44 C/C(=C\CNC(C)CCC(=O)O)/Cl b5ea4c94e7f0874fed6be2a524f9af8f [1,1,0,0,0,0|2,0,0]=4 569 B12R0.44 C/C(=C\CN[C@@H](C)CCC(=O)O)/Cl a3bbd311129e1a9c22c67c5bdfed6f01 [1,1,0,0,0,0|2,0,0]=4 570 B12R0.44 C/C(=C\COC(C)CCC(=O)O)/Cl df4f79441aedf1ba4f9ae6bffafe02de [1,1,0,0,0,0|2,0,0]=4 571 B12R0.44 C=C(Br)COC(C)CCC=C(C)C 8793d9496e7f6c109df0b5669b095502 [1,1,0,0,0,0|2,0,0]=4 572 B12R0.44 C=C(Br)CO[C@@H](C)CCC=C(C)C 0ccbc52f2c1a257ddbba4d1d57796758 [1,1,0,0,0,0|2,0,0]=4 573 B12R0.44 C=C(Br)CO[C@H](C)CCC=C(C)C 3b3d4994cc74ce2cf154d0785235c729 [1,1,0,0,0,0|2,0,0]=4 574 B12R0.44 C=C(C)COC(C)CCC=C(C)C e8712941c056a76751f14913477b9fd1 [1,1,0,0,0,0|2,0,0]=4 575 B12R0.44 C=C(C)CO[C@@H](C)CCC=C(C)C 5f53fe7f6d00cfa679c68123e71683d6 [1,1,0,0,0,0|2,0,0]=4 576 B12R0.44 C=C(C)CO[C@H](C)CCC=C(C)C 150f31e650a31a83ccf88a63fc19ffd9 [1,1,0,0,0,0|2,0,0]=4 577 B12R0.44 C=C(Cl)COC(C)CCC=C(C)C 809f8eb8f6a826748cec7769bb036679 [1,1,0,0,0,0|2,0,0]=4 578 B12R0.44 C=C(Cl)CO[C@@H](C)CCC=C(C)C 9de10ec95266da9a0f0e708087f191a6 [1,1,0,0,0,0|2,0,0]=4 579 B12R0.44 C=C(Cl)CO[C@H](C)CCC=C(C)C 82a789ccfb745306d76241e3a1271bfe [1,1,0,0,0,0|2,0,0]=4 580 B12R0.44 C=C(F)COC(C)CCC=C(C)C ed0e154e233f234b10924a64d300fc6f [1,1,0,0,0,0|2,0,0]=4 581 B12R0.44 C=C(F)CO[C@@H](C)CCC=C(C)C e88407ddf19908cddcd18d83058b81ba [1,1,0,0,0,0|2,0,0]=4 582 B12R0.44 C=C(F)CO[C@H](C)CCC=C(C)C 3d675bcdff60403e8aced77541e92e58 [1,1,0,0,0,0|2,0,0]=4 583 B12R0.44 CC(=CCCC(C)OCC(=O)N)C ca225acecebe023b9aaeed5724551ebd [1,1,0,0,0,0|1,0,0]=3 584 B12R0.44 CC(=CCCC(C)OCC(=O)O)C 567a294a93b4a65513149f1eaf8e22cd [1,1,0,0,0,0|1,0,0]=3 585 B12R0.44 CC(=CCCC(C)OC[N+](=O)[O-])C 605c376d0bb507e00cb361ca7d9ff769 [1,1,0,0,0,0|2,0,0]=4 586 B12R0.44 CC(=CCCN(C)CCC(=O)N)C 32136045523bb20adf69e8e2e91f5aa3 [1,1,0,0,0,0|1,0,0]=3 587 B12R0.44 CC(=CCCN(C)CCC(=O)O)C d68c8f0a81b1e48c6117823517cc2546 [1,1,0,0,0,0|1,0,0]=3 588 B12R0.44 CC(=CCC[C@@H](C)OCC(=O)N)C 4a522402bef43bbc451909acb81da8ce [1,1,0,0,0,0|1,0,0]=3 589 B12R0.44 CC(=CCC[C@@H](C)OCC(=O)O)C 46f6973184a4fbc8c2d6dc351ac18554 [1,1,0,0,0,0|1,0,0]=3 590 B12R0.44 CC(=CCC[C@@H](C)OC[N+](=O)[O-])C ea5e5ee92c30c725ac41fa110bb74281 [1,1,0,0,0,0|2,0,0]=4 591 B12R0.44 CC(=CCC[C@H](C)OCC(=O)N)C 0ce651e55dfdc2c28f58ab6c7969392d [1,1,0,0,0,0|1,0,0]=3 592 B12R0.44 CC(=CCC[C@H](C)OCC(=O)O)C 118e1521b9be08432e97650940155e45 [1,1,0,0,0,0|1,0,0]=3 593 B12R0.44 CC(=CCC[C@H](C)OC[N+](=O)[O-])C 52a668bbb9dec5e07e9b02af2df7cdd3 [1,1,0,0,0,0|2,0,0]=4 594 B12R0.44 CC(=CCNC(C)CCC(=O)O)C a86bb5551245a48556239871116172a5 [1,1,0,0,0,0|1,0,0]=3 595 B12R0.44 CC(=CCNC(C)CCC(=O)O)Cl 6126b833a55c09ab8e7b2f45be82e411 [1,1,0,0,0,0|2,0,0]=4 596 B12R0.44 CC(=CCNC(C)CCC(=O)O)I aee6150f1e44570f24adfc400ddaa1d5 [1,1,0,0,0,0|2,0,0]=4 597 B12R0.44 CC(=CCN[C@@H](C)CCC(=O)O)C ed017a76585360ff2c68be433f32d7ae [1,1,0,0,0,0|1,0,0]=3 598 B12R0.44 CC(=CCN[C@@H](C)CCC(=O)O)Cl df55dfa9524d033a6649503efcad4ef5 [1,1,0,0,0,0|2,0,0]=4 599 B12R0.44 CC(=CCN[C@@H](C)CCC(=O)O)I b60576c54bcddbdd0337bb3d31f5d361 [1,1,0,0,0,0|2,0,0]=4 600 B12R0.44 CC(=CCOC(C)CCC(=O)O)C 89800d0de27442007ffaf7b2c80d83e1 [1,1,0,0,0,0|1,0,0]=3 601 B12R0.44 CC(=CCOC(C)CCC(=O)O)Cl 80bb6b56dade3afe50465f5ffafc2237 [1,1,0,0,0,0|2,0,0]=4 602 B12R0.44 CC(=CCOC(C)CCC(=O)O)I 77d8b12a9201f1d2e47b82cbc0baeb28 [1,1,0,0,0,0|2,0,0]=4 603 B12R0.44 CC(=O)NCC(C)OCC=C(C)C 17e07e9ee34d53e764bd9d962753cdd5 [1,1,0,0,0,0|2,0,0]=4 604 B12R0.44 CC(=O)OCC(C)OC/C=C(/C)\I 55e224dea7ed8faaa08f742dd55116b7 [1,1,0,0,0,0|2,0,0]=4 605 B12R0.44 CC(=O)OCC(C)OC/C=C(\C)/Cl 3fe1c9173d27e9a41373dbd5047377a7 [1,1,0,0,0,0|2,0,0]=4 606 B12R0.44 CC(=O)OCC(C)OCC=C(C)C 350f90ea25ff1a4ffb045578088cc0b1 [1,1,0,0,0,0|1,0,0]=3 607 B12R0.44 CC(=O)OCC(C)OCC=C(C)Cl d1a7577c21e65e1d3424d250aecd2f1a [1,1,0,0,0,0|2,0,0]=4 608 B12R0.44 CC(=O)OCC(C)OCC=C(C)I 9d712ebe9da4de9412fd77f653f54e69 [1,1,0,0,0,0|2,0,0]=4 609 B12R0.48 CN(CCC=O)CCC(=O)N(C)C a5893b1985a020d485896f1a16a864be [1,1,0,0,0,0|2,0,0]=4 610 B12R0.240 C=CC(C)OC(C)CCC=C(C)C 1f6947ca3fb16df201213f09a8c113ac [1,1,0,0,0,0|2,0,0]=4 611 B12R0.240 C=CC(C)O[C@@H](C)CCC=C(C)C 282e7cc53a727cf94d9a5a03c28a118d [1,1,0,0,0,0|2,0,0]=4 612 B12R0.240 C=CC(C)O[C@H](C)CCC=C(C)C 13eb263f00e28b1e7ab3da876203ed12 [1,1,0,0,0,0|2,0,0]=4 613 B12R0.240 CC(=CCCC(C)OC(C)C=O)C bfdd8a7e91916ed3244791df63fe1bb1 [1,1,0,0,0,0|1,0,0]=3 614 B12R0.240 CC(=CCCC(C)O[C@H](C)C=O)C 55123c3411d019498ddbb83ee4ca40d7 [1,1,0,0,0,0|1,0,0]=3 615 B12R0.240 CC(=CCC[C@@H](C)OC(C)C=O)C 85762d705e87c7fc660e7f9f8af8e4e2 [1,1,0,0,0,0|1,0,0]=3 616 B12R0.240 CC(=CCC[C@@H](C)O[C@H](C)C=O)C 4e749b38cf97e248dca368cf9a5db05a [1,1,0,0,0,0|1,0,0]=3 617 B12R0.240 CC(=CCC[C@H](C)OC(C)C=O)C e23db30d47b24b5e9fccf3621c160ace [1,1,0,0,0,0|1,0,0]=3 618 B12R0.240 CC(=CCC[C@H](C)O[C@H](C)C=O)C bf0bdd394fd100c9cbff792676fd5ac6 [1,1,0,0,0,0|1,0,0]=3 619 B12R0.240 COC(C)CC(C)OCC=C(C)C 4037a07e8caf3dc15676d0d9ad9ae444 [1,1,0,0,0,0|1,0,1]=4 620 B12R0.254 CCN(CCC=C(C)C)CCOC fe1f13cceaf745982a257892c76440c0 [1,1,0,0,0,0|1,0,1]=4 621 B12R0.184 CC(=CCCOCCN(C)C=O)C 92fb925a4e166c5a7c3ba1af314f7858 [1,1,0,0,0,0|2,0,0]=4 622 B12R0.234 C/C(=C/COCCCCCC=O)/Cl 95e72092768d606d3099f1da2f325ba6 [1,1,0,0,0,0|2,0,0]=4 623 B12R0.234 C/C(=C/COCCCCCC=O)/I de83df8982ec32f61046901a48730bd5 [1,1,0,0,0,0|2,0,0]=4 624 B12R0.234 C/C=C/CCCOCCC=C(C)C 3b5724e5b26bd1f439671214d995b513 [1,1,0,0,0,0|2,0,0]=4 625 B12R0.234 C/C=C\CCCOCCC=C(C)C c3ba5feac4a2e9105529b40733cc65c0 [1,1,0,0,0,0|2,0,0]=4 626 B12R0.234 C=CCCCCCNCC=C(C)C c8c7583950ed049e9a5165a3b4462a6f [1,1,0,0,0,0|2,0,0]=4 627 B12R0.234 C=CCCCCCOCC=C(C)C 6582759836efa66c27c01a448f7d4af1 [1,1,0,0,0,0|2,0,0]=4 628 B12R0.234 C=CCCCCNCCC=C(C)C cf5d3d15872928e54096e67727dc9868 [1,1,0,0,0,0|2,0,0]=4 629 B12R0.234 C=CCCCCOCCC=C(C)C db7264384376afa43bdfd18f9c501f40 [1,1,0,0,0,0|2,0,0]=4 630 B12R0.234 C=CCOCCOCCC=C(C)C 14ba48403c7decfc3b23fbd2c7d7558b [1,1,0,0,0,0|2,0,0]=4 631 B12R0.234 C=COCCCCOC/C=C(/C)\I d1ebd0a37f508112ecc62f83ac698076 [1,1,0,0,0,0|2,0,0]=4 632 B12R0.234 C=COCCCCOC/C=C(\C)/Cl c3ca84af0940f24e9fbbf73a10cb80d9 [1,1,0,0,0,0|2,0,0]=4 633 B12R0.234 C=COCCCCOCC=C(C)C 42e8307f77e81d951876dc3ae76e2237 [1,1,0,0,0,0|1,0,0]=3 634 B12R0.234 C=COCCCCOCC=C(C)Cl a5d90168cbbd5430f867683ffabcc0f8 [1,1,0,0,0,0|2,0,0]=4 635 B12R0.234 C=COCCCCOCC=C(C)I 544be8093761fb03d811dff371c75f52 [1,1,0,0,0,0|2,0,0]=4 636 B12R0.234 C=COCCCNCCC=C(C)C e6c96f8539b02d40a285ffd8e342a2db [1,1,0,0,0,0|1,0,0]=3 637 B12R0.234 CC(=C=CCCOCCCC=O)C c235571efb6cd53735e2f6d91ee828c3 [1,1,0,0,0,0|2,0,0]=4 638 B12R0.234 CC(=CCCOCCCCC=O)C d73000ae5246fd6be892021a663e1375 [1,1,0,0,0,0|1,0,0]=3 639 B12R0.234 CC(=CCCOCCOCC=O)C c4cbd3c1d9cf5cede083fd26a8568dca [1,1,0,0,0,0|1,0,0]=3 640 B12R0.234 CC(=CCNCCCCCC=O)C 27d6cd37532a206e09f0e402e035fc0d [1,1,0,0,0,0|1,0,0]=3 641 B12R0.234 CC(=CCOCCCCCC=O)C 59690a1c58cc640204a93c07b7a55ae8 [1,1,0,0,0,0|1,0,0]=3 642 B12R0.234 CC(=CCOCCCCCC=O)I 9fea8caf555e58b0bdfdcf9cf95d43fa [1,1,0,0,0,0|2,0,0]=4 643 B12R0.234 CC(=O)CCCCOCCOC=O ba6187dec17a3a28dca38616a01ff5f3 [1,1,0,0,0,0|1,0,1]=4 644 B12R0.234 CC(=O)NCCCOCCOC=O 926dcff16e0119d956e4bc109e086921 [1,1,0,0,0,0|2,0,0]=4 645 B12R0.234 CC(=O)OCCCOCCOC=O 2da357cb1dc7d5b7d555ed9f39bbcfc9 [1,1,0,0,0,0|2,0,0]=4 646 B12R0.234 CC(=O)SCCCOCCOC=O b979e51d18ad69f9ff1063d039060c82 [1,1,0,0,0,0|2,0,0]=4 647 B12R0.234 CC(=S)OCCCOCCOC=O f88624eef8c4f19ab566723b784849d2 [1,1,0,0,0,0|2,0,0]=4 648 B12R0.234 CC(C)CCCCCCOCC=O 4ac06d6f21830f5c5e8bd2981ce5e15c [1,1,0,0,0,0|0,0,2]=4 649 B12R0.234 CC(C)CCCCOCCOC=O cac82fb1bd25b832eac3ea7cc7d5e16a [1,1,0,0,0,0|0,0,2]=4 650 B12R0.234 CC=CCCCOCCC=C(C)C ba0245c413fda2b3b1e0d94908a1c58e [1,1,0,0,0,0|2,0,0]=4 651 B12R0.234 CCOCCCNCCC=C(C)C 56b138825cfd2f94160ddeca7c8853ca [1,1,0,0,0,0|1,0,1]=4 652 B12R0.234 CCOCCCOCCC=C(C)C 35a134dc247f9d21c6b1bee4b42a9a7b [1,1,0,0,0,0|1,0,1]=4 653 B12R0.234 CN(C)CCCCCCOCC=O a011fb39a3bafba429f19425bc3699bc [1,1,0,0,0,0|1,0,1]=4 654 B12R0.234 CN(C)CCCCOCCOC=O f5862691b1014d2e90a67513fed65677 [1,1,0,0,0,0|1,0,1]=4 655 B12R0.251 CN(C)C(=O)CCOCCOC=O e5caeaa3cd0e8ea67f00dd29ab9a60e8 [1,1,0,0,0,0|2,0,0]=4 656 B12R0.268 CC(=CCCNCCCC(=O)N)C fe447a4f2ebf42eb377c55e165eb0135 [1,1,0,0,0,0|2,0,0]=4 657 B12R0.268 CC(=CCCNCCCC(=O)O)C 398d584b6eae4558dc649076cd6f418a [1,1,0,0,0,0|2,0,0]=4 658 B12R0.268 CC(=CCCOCCCC(=O)N)C fb716b63688561acba08e49beaf9ffd2 [1,1,0,0,0,0|2,0,0]=4 659 B12R0.268 CC(=CCCOCCNC(=O)N)C 9a5b82c7f6d4c2909d5a704acd490d08 [1,1,0,0,0,0|2,0,0]=4 660 B12R0.268 CC(=CCNCCCCC(=O)N)C e6deccff245ff058e495080eb8141a0f [1,1,0,0,0,0|2,0,0]=4 661 B12R0.268 CC(=CCNCCCCC(=O)O)C cb3cff8e59e06de1e3564e84bedaadc8 [1,1,0,0,0,0|2,0,0]=4 662 B12R0.268 CC(=CCOCCCCC(=O)N)C 805c5569fad8abd03f2a7034a1ba010e [1,1,0,0,0,0|2,0,0]=4 663 B12R0.268 CC(=CCOCCCCC(=O)O)C 3759a97d6f78b9d66968b322d015e287 [1,1,0,0,0,0|2,0,0]=4 664 B12R0.268 CC(=CCOCCCO[N+](=O)[O-])C c733314508ada42c46bcaf7f4579a5d1 [1,1,0,0,0,0|2,0,0]=4 665 B12R0.268 CC(=O)CCCCNCC=C(C)C 4e6d0174474948ecffe60ef513eea993 [1,1,0,0,0,0|2,0,0]=4 666 B12R0.268 CC(=O)CCCCOCC=C(C)C d8fba5bccea23bbecd2128433fe1a215 [1,1,0,0,0,0|2,0,0]=4 667 B12R0.268 CC(=O)CCCOCCC=C(C)C 9e2980aca336c79dac316314213789fb [1,1,0,0,0,0|2,0,0]=4 668 B12R0.268 CC(=O)NCCCNCC=C(C)C e05a632f2e345ad87a02308af9ed55b9 [1,1,0,0,0,0|2,0,0]=4 669 B12R0.268 CC(=O)NCCCOCC=C(C)C 4d6d9521a76081bae8c19708e5ecec5d [1,1,0,0,0,0|2,0,0]=4 670 B12R0.268 CC(=O)NCCNCCC=C(C)C 442dc9caf09089f057a8cddc4a9c1c62 [1,1,0,0,0,0|2,0,0]=4 671 B12R0.268 CC(=O)NCCOCCC=C(C)C 7100118f4cbdff7b1b7fefce9140205c [1,1,0,0,0,0|2,0,0]=4 672 B12R0.268 CC(=O)OCCCCCOC(C)C 939bda4169328ffb3af9ef7f6fb13a87 [1,1,0,0,0,0|1,0,1]=4 673 B12R0.268 CC(=O)OCCCNCC=C(C)C dd5bd5f4bb584e7f45babbc343344c6b [1,1,0,0,0,0|1,0,0]=3 674 B12R0.268 CC(=O)OCCCOC/C=C(/C)\Cl 41f8e503c9f005d11034edbddfda4006 [1,1,0,0,0,0|2,0,0]=4 675 B12R0.268 CC(=O)OCCCOC/C=C(/C)\I c6f0083780ba404b76b47e3e8095d674 [1,1,0,0,0,0|2,0,0]=4 676 B12R0.268 CC(=O)OCCCOC/C=C(\C)/Cl 4aa1b197be716a7642113c020d646c01 [1,1,0,0,0,0|2,0,0]=4 677 B12R0.268 CC(=O)OCCCOCC=C(C)C c857421cd85b4c7ccd955259354fd086 [1,1,0,0,0,0|1,0,0]=3 678 B12R0.268 CC(=O)OCCCOCC=C(C)Cl 6abb0d56f7cdde41131e3876dc33bf5a [1,1,0,0,0,0|2,0,0]=4 679 B12R0.268 CC(=O)OCCCOCC=C(C)I 2cfb3235cacbbdb5f953a0148540624d [1,1,0,0,0,0|2,0,0]=4 680 B12R0.268 CC(=O)OCCOCCC=C(C)C 985da71961e640d3f227ce4e803da255 [1,1,0,0,0,0|1,0,0]=3 681 B12R0.268 CC(=O)SCCCNCC=C(C)C 522e047283a5497ef78c08a0001599bd [1,1,0,0,0,0|1,1,0]=4 682 B12R0.268 CC(=O)SCCCOCC=C(C)C 9f3e7cd700f02c121d296710806737ef [1,1,0,0,0,0|1,1,0]=4 683 B12R0.268 CC(=S)OCCCNCC=C(C)C 6018ab6327647b3650827500c97b5e0c [1,1,0,0,0,0|1,1,0]=4 684 B12R0.268 CC(=S)OCCCOCC=C(C)C ae8f44076d43d4e69d704449710d5f95 [1,1,0,0,0,0|1,1,0]=4 685 B14R0.67 CC(=CCCOC(C)CCC=C(C)C)C 7e48ae298c890a53ebcd88fc66d219ee [0,1,0,0,0,1|2,0,0]=4 686 B14R0.67 CC(=CCCO[C@@H](C)CCC=C(C)C)C 703c149526f586def8366e8573d68be1 [0,1,0,0,0,1|2,0,0]=4 687 B14R0.67 CC(=CCCO[C@H](C)CCC=C(C)C)C 8f396e687adb1ba33030bc3a33dbf2ff [0,1,0,0,0,1|2,0,0]=4 688 B14R0.67 CC(=O)OC/C=C(\C)/CNCC=C(C)C 25ed5cf91b00ae5272998cd2ceb0534c [0,1,0,0,0,1|0,0,2]=4 689 B14R0.67 CC(=O)OC/C=C(\C)/COCC=C(C)C 1260e21f9a55d009cc1b3c8020980675 [0,1,0,0,0,1|0,0,2]=4 690 B14R0.2224 C=CCCCCC(C)OCCC=C(C)C 56763a1f09a33c0d4da17dd115348f74 [0,1,0,0,0,1|2,0,0]=4 691 B14R0.2224 C=CCCCC[C@@H](C)OCCC=C(C)C aaa34f5b528652966776bd89002fbc3f [0,1,0,0,0,1|2,0,0]=4 692 B14R0.2 C#CCCOCCC(C)CCC=C(C)C 621ce3f88708f1d8e7181941241f33e6 [0,2,0,0,0,0|1,0,1]=4 693 B14R0.2 C#CCCOCC[C@@H](C)CCC=C(C)C 867b89af1b400131e815debb87e120e6 [0,2,0,0,0,0|1,0,1]=4 694 B14R0.2 C#CCCOCC[C@H](C)CCC=C(C)C 22bea258a0a0d539a044f09117d80f7d [0,2,0,0,0,0|1,0,1]=4 695 B14R0.2 C#CCOCCOC(C)CCC=C(C)C 4c04bf8f08e9760a65a92ae884260a71 [0,2,0,0,0,0|1,0,1]=4 696 B14R0.2 C#CCOCCO[C@@H](C)CCC=C(C)C b7a69a6951efa06dd47665cd5a28e32d [0,2,0,0,0,0|1,0,1]=4 697 B14R0.2 C#CCOCCO[C@H](C)CCC=C(C)C 41df061bf051fdb478a36bc57eb33f26 [0,2,0,0,0,0|1,0,1]=4 698 B14R0.2 C/C=C/COCCC(C)CCC=C(C)C 142715a7de870c52681cfd58df3a853f [0,2,0,0,0,0|1,0,0]=3 699 B14R0.2 C/C=C/COCC[C@@H](C)CCC=C(C)C b6f514c0fbea6bc60ac5b6bc89ee954b [0,2,0,0,0,0|1,0,0]=3 700 B14R0.2 C/C=C/COCC[C@H](C)CCC=C(C)C 8445c87e1d330a9b2e7b40f77276c328 [0,2,0,0,0,0|1,0,0]=3 701 B14R0.2 C/C=C\CCCOC(C)CCC=C(C)C fdf0e1822afe735963361d1c0f461516 [0,2,0,0,0,0|2,0,0]=4 702 B14R0.2 C/C=C\CCCO[C@@H](C)CCC=C(C)C 433d82ff388f00b9ed7ad7d72d527ff8 [0,2,0,0,0,0|2,0,0]=4 703 B14R0.2 C/C=C\CCCO[C@H](C)CCC=C(C)C 5626d95f2e36d1363642fc68048f710e [0,2,0,0,0,0|2,0,0]=4 704 B14R0.2 C/C=C\COCCC(C)CCC=C(C)C 707c379f4c7f341a93c83ba86e6dfa94 [0,2,0,0,0,0|1,0,0]=3 705 B14R0.2 C/C=C\COCC[C@@H](C)CCC=C(C)C 2bd8c575813247061011d3b0388bf153 [0,2,0,0,0,0|1,0,0]=3 706 B14R0.2 C/C=C\COCC[C@H](C)CCC=C(C)C 865485c218446461dfa21c6e60c597bc [0,2,0,0,0,0|1,0,0]=3 707 B14R0.2 C=C(C)CCCC(C)CCOCCC=O 2c6491034f18120596fc66d33dab3178 [0,2,0,0,0,0|0,0,2]=4 708 B14R0.2 C=CCCCCOC(C)CCC=C(C)C 1e00106718f9de22fc572f6c2e77b4fc [0,2,0,0,0,0|2,0,0]=4 709 B14R0.2 C=CCCCCO[C@@H](C)CCC=C(C)C 33a2e3845662ac58c08c3d48ef09a5a0 [0,2,0,0,0,0|2,0,0]=4 710 B14R0.2 C=CCCCCO[C@H](C)CCC=C(C)C 5e7702ad25c1852f58833cc90eb05cb5 [0,2,0,0,0,0|2,0,0]=4 711 B14R0.2 C=CCCNCC[C@@H](C)CCC=C(C)C 29e616e242805eb908eba57606bcecb5 [0,2,0,0,0,0|2,0,0]=4 712 B14R0.2 C=CCCOCCC(C)CCC=C(C)C 8ca45903ec566612cd9aa7d4e40bdc01 [0,2,0,0,0,0|1,0,0]=3 713 B14R0.2 C=CCCOCC[C@@H](C)CCC=C(C)C d7cedf49ccd0cf2bc50bb00997f220f2 [0,2,0,0,0,0|1,0,0]=3 714 B14R0.2 C=CCCOCC[C@H](C)CCC=C(C)C c513b7334d95111b4245eff79c7755b4 [0,2,0,0,0,0|1,0,0]=3 715 B14R0.2 C=CCOCCOC(C)CCC=C(C)C f95a69d1a1be3f8b117a2afe3bb58ca3 [0,2,0,0,0,0|1,0,0]=3 716 B14R0.2 C=CCOCCO[C@@H](C)CCC=C(C)C 4a8689d54257310a2788df45c270e48a [0,2,0,0,0,0|1,0,0]=3 717 B14R0.2 C=CCOCCO[C@H](C)CCC=C(C)C 639a280efb73883fa51a2359708dec87 [0,2,0,0,0,0|1,0,0]=3 718 B14R0.2 CC#CCOCCC(C)CCC=C(C)C 4570696a4f3b3dfac5663ffe2060bf20 [0,2,0,0,0,0|1,0,1]=4 719 B14R0.2 CC#CCOCC[C@@H](C)CCC=C(C)C 9d118d7f522b256c948b0b8e25e4be6c [0,2,0,0,0,0|1,0,1]=4 720 B14R0.2 CC#CCOCC[C@H](C)CCC=C(C)C e10527cd69d0ff9d1a6dbfd03c77e8cd [0,2,0,0,0,0|1,0,1]=4 721 B14R0.2 CC(=CCC/C(=C/CNCCC=O)/C)C 9bbd29111f2e0935eafb9d8e5c001437 [0,2,0,0,0,0|1,0,1]=4 722 B14R0.2 CC(=CCC/C(=C/COCCC=O)/C)C 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bd979582448a218d9a65ea621019982f [0,2,0,0,0,0|0,0,2]=4 828 B14R0.304 CC(C)CCC[C@H](C)CCOC(C)C=O ef7c6215ee166e8123edbe587ca3e7b7 [0,2,0,0,0,0|0,0,2]=4 829 B14R0.304 CC(C)CCC[C@H](C)CCO[C@H](C)C=O c460ccd6daf53b92a4098f3dc60f6a09 [0,2,0,0,0,0|0,0,2]=4 830 B14R0.304 CCC(=O)OCOC(C)CCC=C(C)C e0faaf02c0ba2227a7afb29e2a9d998b [0,2,0,0,0,0|1,0,0]=3 831 B14R0.304 CCC(=O)OCO[C@@H](C)CCC=C(C)C 7e7297ce39d1d1f1e9a399fa8bf457bc [0,2,0,0,0,0|1,0,0]=3 832 B14R0.304 CCC(=O)OCO[C@H](C)CCC=C(C)C 2c029cb797583b9c3e999c557383d46d [0,2,0,0,0,0|1,0,0]=3 833 B14R0.304 CCC(C)OCCC(C)CCC=C(C)C 711e486272512720e8696583a762cb24 [0,2,0,0,0,0|1,0,1]=4 834 B14R0.304 CCC(C)OCC[C@@H](C)CCC=C(C)C fc73d919618409064fa69ad189326c06 [0,2,0,0,0,0|1,0,1]=4 835 B14R0.304 CCC(C)OCC[C@H](C)CCC=C(C)C e55701a266c9b7a0497d82ab92719a6a [0,2,0,0,0,0|1,0,1]=4 836 B14R0.304 CC[C@@H](C)OCC[C@@H](C)CCC=C(C)C 54beb5df56fe788f644bf4db1c073381 [0,2,0,0,0,0|1,0,1]=4 837 B14R0.304 CC[C@H](C)OCC[C@@H](C)CCC=C(C)C 6b9f087f77edeadf88032bbaf871ad49 [0,2,0,0,0,0|1,0,1]=4 838 B14R0.304 CNC(=O)CCOC(C)CCC=C(C)C 7f840719f11a47f4032743616da2e8b1 [0,2,0,0,0,0|2,0,0]=4 839 B14R0.304 CNC(=O)CCO[C@@H](C)CCC=C(C)C 2e83a7bf75803392c15a19816c676a94 [0,2,0,0,0,0|2,0,0]=4 840 B14R0.304 CNC(=O)CCO[C@H](C)CCC=C(C)C 315b81f3b8e6bfb01f36560762c7bd3d [0,2,0,0,0,0|2,0,0]=4 841 B14R0.304 COC(=O)CCCC(C)NCC=C(C)C f38680e45218386a626d1772bd374acd [0,2,0,0,0,0|2,0,0]=4 842 B14R0.304 COC(=O)CCCC(C)OCC=C(C)C 5c65a7e8eb1e821049fd98af152a5da1 [0,2,0,0,0,0|2,0,0]=4 843 B14R0.304 COC(=O)CCOC(C)CCC=C(C)C 1469ceb8732fd5b48cc7c70f411e4f01 [0,2,0,0,0,0|2,0,0]=4 844 B14R0.304 COC(=O)CCO[C@@H](C)CCC=C(C)C 427952e1794d510105a3cef83d8271b4 [0,2,0,0,0,0|2,0,0]=4 845 B14R0.304 COC(=O)CCO[C@H](C)CCC=C(C)C 94063b75400c3e27b9cfd8184d8e670e [0,2,0,0,0,0|2,0,0]=4 846 B14R0.304 COC(=O)OCOC(C)CCC=C(C)C b66904b3d96fb8082aa18a91abd71f19 [0,2,0,0,0,0|1,0,0]=3 847 B14R0.304 COC(=O)OCO[C@@H](C)CCC=C(C)C f89a07d7abf5d3de1eb3443b81b5e35c [0,2,0,0,0,0|1,0,0]=3 848 B14R0.304 COC(=O)OCO[C@H](C)CCC=C(C)C 7d7dd099552611743ea5242f22d8e021 [0,2,0,0,0,0|1,0,0]=3 849 B14R0.431 C=CCC(C)COC(C)CCC=C(C)C 8774e483d332a049b642345ce311e616 [0,2,0,0,0,0|2,0,0]=4 850 B14R0.431 C=CCC(C)CO[C@@H](C)CCC=C(C)C dd2902299580412ec217fbfedf3327d4 [0,2,0,0,0,0|2,0,0]=4 851 B14R0.431 C=CCC(C)CO[C@H](C)CCC=C(C)C 173050ad23934dab65ffed6c6967b624 [0,2,0,0,0,0|2,0,0]=4 852 B14R0.431 C=CCN(C)CC[C@@H](C)CCC=C(C)C a91f4da81ac101f9b21916b0b4f1f112 [0,2,0,0,0,0|2,0,0]=4 853 B14R0.431 C=COC(=O)COC(C)CCC=C(C)C 9499063e7ffbd657118ea1afceb478a2 [0,2,0,0,0,0|1,0,1]=4 854 B14R0.431 C=COC(=O)CO[C@@H](C)CCC=C(C)C 98394b83c0e9d0b6642cb16d7a24f01e [0,2,0,0,0,0|1,0,1]=4 855 B14R0.431 C=COC(=O)CO[C@H](C)CCC=C(C)C 625b87412c0035c7324ccdd20a35b3d5 [0,2,0,0,0,0|1,0,1]=4 856 B14R0.426 CC(=CCCC(C)OC(C)CC(=O)O)C 957e883a85538cb84a8a4b5419ade4ff [0,2,0,0,0,0|2,0,0]=4 857 B14R0.426 CC(=CCC[C@@H](C)OC(C)CC(=O)O)C d77a5b5c14258e11c137c6502da89857 [0,2,0,0,0,0|2,0,0]=4 858 B14R0.426 CC(=CCC[C@H](C)OC(C)CC(=O)O)C b0ef1ee903039abb38255e2a7a7a6612 [0,2,0,0,0,0|2,0,0]=4 859 B14R0.426 CC(=O)OC(C)OC(C)CCC=C(C)C 84f609be7eca627e0930c294ace2f1f4 [0,2,0,0,0,0|1,0,0]=3 860 B14R0.426 CC(=O)OC(C)O[C@@H](C)CCC=C(C)C 9db480491fd947dbe87df473dad6f863 [0,2,0,0,0,0|1,0,0]=3 861 B14R0.426 CC(=O)OC(C)O[C@H](C)CCC=C(C)C 345fe5f8dc81e4caa4542277e4f3f18c [0,2,0,0,0,0|1,0,0]=3 862 B14R0.222 C=C(COC(C)CCC=C(C)C)C(=O)O 7a1f4221ff542767976f7e139552c299 [0,2,0,0,0,0|2,0,0]=4 863 B14R0.222 C=C(CO[C@@H](C)CCC=C(C)C)C(=O)O 17857e25b090e0ba568b7ae6fd7596f4 [0,2,0,0,0,0|2,0,0]=4 864 B14R0.222 C=C(CO[C@H](C)CCC=C(C)C)C(=O)O 84239db6291ff2aa074ff4a0fced0686 [0,2,0,0,0,0|2,0,0]=4 865 B14R0.222 CC(=CCCC(C)OCC(C)C(=O)O)C 05b0ec596d06d246b8b9784b3f09c08f [0,2,0,0,0,0|2,0,0]=4 866 B14R0.222 CC(=CCC[C@@H](C)OCC(C)C(=O)O)C 431b5fc8b4101bd8d0df4e97f55d7df8 [0,2,0,0,0,0|2,0,0]=4 867 B14R0.222 CC(=CCC[C@H](C)OCC(C)C(=O)O)C 31d07f2333339b78cb3977ea08e79703 [0,2,0,0,0,0|2,0,0]=4 868 B14R0.222 CC(=O)C(=O)COC(C)CCC=C(C)C a1c92c837c3b6d55cfbb3571495ca334 [0,2,0,0,0,0|2,0,0]=4 869 B14R0.222 CC(=O)C(=O)CO[C@@H](C)CCC=C(C)C 53b533a3d5c56d7ec990aa54c4fa674a [0,2,0,0,0,0|2,0,0]=4 870 B14R0.222 CC(=O)C(=O)CO[C@H](C)CCC=C(C)C 6cbb6e15eb7fc3d421d985c59255c33f [0,2,0,0,0,0|2,0,0]=4 871 B14R0.222 CC(=O)N(C)CCN(C)CCC=C(C)C f03b4b28b0be676e08067a62e53f6986 [0,2,0,0,0,0|2,0,0]=4 872 B14R0.222 CC(=O)OCCN(C)CCC(=O)N(C)C c3190e5e33bf9ee6b60ea4b3feab80ce [0,2,0,0,0,0|2,0,0]=4 873 B12R1.28 C/C=C/CNC1CCNC(=O)C1 04279e5ce1b0c3ffe4bc2f2978aa3a1c [1,0,0,1,0,0|2,0,0]=4 874 B12R1.28 C/C=C/CN[C@@H]1CCNC(=O)C1 12ba15d0f40f3420e78816d24d279bbf [1,0,0,1,0,0|2,0,0]=4 875 B12R1.28 C/C=C/CN[C@H]1CCNC(=O)C1 8fbc4c48327a163360051919faf2bb29 [1,0,0,1,0,0|2,0,0]=4 876 B12R1.28 C/C=C/COC1CCCC(=O)C1 a48f94e501941b0d9a96dcbf75397510 [1,0,0,1,0,0|2,0,0]=4 877 B12R1.28 C/C=C/COC1CCNC(=O)C1 88db34b7d89d1d98d2fcda6f4cb2beac [1,0,0,1,0,0|2,0,0]=4 878 B12R1.28 C/C=C/CO[C@@H]1CCNC(=O)C1 cfe8cbb53f591ac419a0287792939da4 [1,0,0,1,0,0|2,0,0]=4 879 B12R1.28 C/C=C/CO[C@H]1CCNC(=O)C1 aaa420cf333eab4f126b79bbaefd7e8d [1,0,0,1,0,0|2,0,0]=4 880 B12R1.28 C/C=C\CNC1CCNC(=O)C1 b03e0b902bdc304900f7dc55e718e37d [1,0,0,1,0,0|2,0,0]=4 881 B12R1.28 C/C=C\CN[C@@H]1CCNC(=O)C1 c34dc3195ed816487e8c71a02f1cb74e [1,0,0,1,0,0|2,0,0]=4 882 B12R1.28 C/C=C\CN[C@H]1CCNC(=O)C1 17ec699b2a3dbb399481b0f248e8792b [1,0,0,1,0,0|2,0,0]=4 883 B12R1.28 C/C=C\COC1CCCC(=O)C1 8ba061dcb2f1be12db4fce4366ff0012 [1,0,0,1,0,0|2,0,0]=4 884 B12R1.28 C/C=C\COC1CCNC(=O)C1 f2dcf7ec3cc1224a556ba8e2d3dfb108 [1,0,0,1,0,0|2,0,0]=4 885 B12R1.28 C/C=C\CO[C@@H]1CCNC(=O)C1 6c709b5b807e3315a20746133aec835c [1,0,0,1,0,0|2,0,0]=4 886 B12R1.28 C/C=C\CO[C@H]1CCNC(=O)C1 4b0f6f62459bb7923e2b9533cbf64185 [1,0,0,1,0,0|2,0,0]=4 887 B12R1.28 CC=CCNC1CCCC(=O)C1 9b940e8dd26e7a19be525f9f42270145 [1,0,0,1,0,0|2,0,0]=4 888 B12R1.28 CC=CCOC1CCCC(=O)C1 6442fa991437db402a81642871fa628e [1,0,0,1,0,0|2,0,0]=4 889 B12R1.35 CN(CCCC=O)C1CC=CC1 a440bd0d1cb065863a356063f45e4603 [1,0,0,1,0,0|2,0,0]=4 890 B12R1.1414 O=CCCNC1CCC=CCC1 24e3b2f3ee14706647e5383a90accc8b [1,0,0,1,0,0|2,0,0]=4 891 B12R1.3204 C/C=C/CNC1(CCNC1=O)C 0258a1281bc4054ccd0694694a6e6d96 [1,0,0,1,0,0|2,0,0]=4 892 B12R1.3204 C/C=C\CNC1(CCNC1=O)C 5b9466f299c270c04ccd827fdfea4942 [1,0,0,1,0,0|2,0,0]=4 893 B12R1.105 C/C(=C/COC1CCC(=O)C1)/I 89f40d42a010e081c47c999130cab0fd [1,0,0,1,0,0|2,0,0]=4 894 B12R1.105 C/C(=C/COC1COC(=O)C1)/I e8318fd0f9a4609f02bbcda6535ae5a1 [1,0,0,1,0,0|2,0,0]=4 895 B12R1.105 C/C(=C/CO[C@@H]1COC(=O)C1)/I e6c311a79433488986732ec687736861 [1,0,0,1,0,0|2,0,0]=4 896 B12R1.105 C/C(=C/CO[C@H]1COC(=O)C1)/I ef972149497808e3f742ab7cd5cf1063 [1,0,0,1,0,0|2,0,0]=4 897 B12R1.105 C/C(=C\COC1CCC(=O)C1)/Cl 2f55036e921a243559f08fb229b1c808 [1,0,0,1,0,0|2,0,0]=4 898 B12R1.105 C/C(=C\COC1COC(=O)C1)/Cl 74b0db0c5609b7e78f3c840c141dd980 [1,0,0,1,0,0|2,0,0]=4 899 B12R1.105 C/C(=C\CO[C@@H]1COC(=O)C1)/Cl e36bfed6043feae0c4885781b3c5ed6d [1,0,0,1,0,0|2,0,0]=4 900 B12R1.105 C/C(=C\CO[C@H]1COC(=O)C1)/Cl 23c8c9e5879bbb828a3614e47d209169 [1,0,0,1,0,0|2,0,0]=4 901 B12R1.105 CC(=CCCN1CNC(=O)C1)C 38d02e5f0d086492cfb5ddd8dd115cf3 [1,0,0,1,0,0|2,0,0]=4 902 B12R1.105 CC(=CCNC1CNC(=O)C1)C 4488cf2b976526c715a8ac0010e3abcd [1,0,0,1,0,0|2,0,0]=4 903 B12R1.105 CC(=CCN[C@@H]1CNC(=O)C1)C 47a4422a6ebd7e112115cd47a5056994 [1,0,0,1,0,0|2,0,0]=4 904 B12R1.105 CC(=CCN[C@H]1CNC(=O)C1)C 9b5eb8dcb81b4016bb303c79e3a3e9e4 [1,0,0,1,0,0|2,0,0]=4 905 B12R1.105 CC(=CCOC1CCC(=O)C1)C e11436f4ad0d0c2e9fd06b1b4672e500 [1,0,0,1,0,0|1,0,0]=3 906 B12R1.105 CC(=CCOC1CCC(=O)C1)Cl e3d20b4ad6030363d08d90f24b386107 [1,0,0,1,0,0|2,0,0]=4 907 B12R1.105 CC(=CCOC1CCC(=O)C1)I d2683f793c7540dca2366c299b9242d8 [1,0,0,1,0,0|2,0,0]=4 908 B12R1.105 CC(=CCOC1CNC(=O)C1)C 6ef146e5d8d7082b6c087b686d06a033 [1,0,0,1,0,0|2,0,0]=4 909 B12R1.105 CC(=CCOC1COC(=O)C1)C c6eb3a4459a15598c1df9355e6cc791a [1,0,0,1,0,0|1,0,0]=3 910 B12R1.105 CC(=CCOC1COC(=O)C1)Cl 22b2788f2dadf883f5650293db079614 [1,0,0,1,0,0|2,0,0]=4 911 B12R1.105 CC(=CCOC1COC(=O)C1)I d07cb6330d141b60e267a73b628b26d0 [1,0,0,1,0,0|2,0,0]=4 912 B12R1.105 CC(=CCO[C@@H]1CNC(=O)C1)C 373248f865736537dcc602c1707a5013 [1,0,0,1,0,0|2,0,0]=4 913 B12R1.105 CC(=CCO[C@@H]1COC(=O)C1)C 00946fdc1d43cf8723091db2ab0bef34 [1,0,0,1,0,0|1,0,0]=3 914 B12R1.105 CC(=CCO[C@@H]1COC(=O)C1)Cl 48a4b2e29f9c6eb97c7d2968aae5b905 [1,0,0,1,0,0|2,0,0]=4 915 B12R1.105 CC(=CCO[C@@H]1COC(=O)C1)I 13a3466513dfec51eb325579e0462dc6 [1,0,0,1,0,0|2,0,0]=4 916 B12R1.105 CC(=CCO[C@H]1CNC(=O)C1)C df64d989761633ec30f14dc11bdeccb4 [1,0,0,1,0,0|2,0,0]=4 917 B12R1.105 CC(=CCO[C@H]1COC(=O)C1)C 8f7001e5b9fa3a231f639844427d5402 [1,0,0,1,0,0|1,0,0]=3 918 B12R1.105 CC(=CCO[C@H]1COC(=O)C1)Cl 32ccd6211aa6dbf9f003cb6f4c708a59 [1,0,0,1,0,0|2,0,0]=4 919 B12R1.105 CC(=CCO[C@H]1COC(=O)C1)I 0dd5a6c0045468c9b137ccc46c52ee31 [1,0,0,1,0,0|2,0,0]=4 920 B12R1.188 COC[C@@H]1C[C@@H]1NCC=C(C)C 3f5b7366f032d73f4f32fcdf8758bded [1,0,0,1,0,0|1,0,1]=4 921 B12R1.188 COC[C@H]1C[C@@H]1NCC=C(C)C 11f893b0e7188a02a99bc9eba9edebd5 [1,0,0,1,0,0|1,0,1]=4 922 B12R1.252 CC(=CCCN1CC=CCC1)C 0a501e44ccd54ec4a8b4530f268b3ff1 [1,0,0,1,0,0|2,0,0]=4 923 B12R1.252 CC(=CCCN1CCOCC1)C bc036a5db8386edacf8c139125b0d6af [1,0,0,1,0,0|1,0,1]=4 924 B12R1.252 CC(=CCNC1CCOCC1)C 2a545532eb08b2fd70b694266154231a [1,0,0,1,0,0|1,0,1]=4 925 B12R1.252 CC(=CCOC1CC=CCC1)C 9a16c8e53dc963f46abeb35fc6ab9887 [1,0,0,1,0,0|2,0,0]=4 926 B12R1.252 CC(=CCOC1CCOCC1)C cbcc7ec6cbfb125a11ac3e0185ef7f46 [1,0,0,1,0,0|1,0,1]=4 927 B12R1.430 COC1CC(C1)NCC=C(C)C 44a08cc6f575b5067b4e9ae887f4b1fc [1,0,0,1,0,0|1,0,1]=4 928 B12R1.430 COC1CC(C1)OCC=C(C)C 86a171bf6602fd656a2ce3c0f84698a6 [1,0,0,1,0,0|1,0,1]=4 929 B12R1.430 COC1CN(C1)CCC=C(C)C 3903cf1777b24435017bf8a5db2a2fc6 [1,0,0,1,0,0|1,0,1]=4 930 B12R1.430 CO[C@H]1C[C@@H](C1)NCC=C(C)C 0c6a5fe635f11095dadce3edf7d98367 [1,0,0,1,0,0|1,0,1]=4 931 B12R1.430 CO[C@H]1C[C@@H](C1)OCC=C(C)C 477884a61922006e8826473999bc3f94 [1,0,0,1,0,0|1,0,1]=4 932 B12R1.430 CO[C@H]1C[C@H](C1)NCC=C(C)C 0c17cc3e150ddb3262601701e19a4e9b [1,0,0,1,0,0|1,0,1]=4 933 B12R1.430 CO[C@H]1C[C@H](C1)OCC=C(C)C bb797daa0f1cbd764b16b9408ba739b3 [1,0,0,1,0,0|1,0,1]=4 934 B12R1.1357 CC(=CCCN(C)C1COC1)C 85533d7c3414d2aadd07576c4302ceea [1,0,0,1,0,0|1,0,1]=4 935 B12R1.1357 CC(=CCNC(C)C1COC1)C 4bf97255f16ba873209a2a39245b9a9b [1,0,0,1,0,0|1,0,1]=4 936 B12R1.1357 CC(=CCN[C@@H](C)C1COC1)C 2e9d6545208f4dae89998dc0c3b7d348 [1,0,0,1,0,0|1,0,1]=4 937 B12R1.1357 CC(=CCN[C@H](C)C1COC1)C 12ef653eb6eb484ae53da790e3fd8443 [1,0,0,1,0,0|1,0,1]=4 938 B12R1.1357 CC(=CCOC(C)C1COC1)C 38c1cf995a53f3d0c7b98f020da57d2c [1,0,0,1,0,0|1,0,1]=4 939 B12R1.1357 CC(=CCO[C@@H](C)C1COC1)C 41538ea692acd771bc88c45ed903c854 [1,0,0,1,0,0|1,0,1]=4 940 B12R1.1357 CC(=CCO[C@H](C)C1COC1)C ea5ad7ce47f664a0b598952e3f9aa2b8 [1,0,0,1,0,0|1,0,1]=4 941 B12R1.1809 CC(=CCNC1(CCOC1)C)C c14d0f0283ff64179065f8a83c26cad8 [1,0,0,1,0,0|1,0,1]=4 942 B12R1.130 C/C(=C/CN[C@@H]1CCOC1=O)/I d74df074b9b4c43e9a5acc42e60101ec [1,0,0,1,0,0|2,0,0]=4 943 B12R1.130 C/C(=C/CN[C@H]1CCOC1=O)/I 355f6aa678e02697d18f1cbab319843b [1,0,0,1,0,0|2,0,0]=4 944 B12R1.130 C/C(=C/COC1CCOC1=O)/Cl 2ff833eb567e4a0b25ff18726e33d76a [1,0,0,1,0,0|2,0,0]=4 945 B12R1.130 C/C(=C/COC1CCOC1=O)/I fb31af90ca90c36ff087d59e7c274475 [1,0,0,1,0,0|2,0,0]=4 946 B12R1.130 C/C(=C/CO[C@@H]1CCOC1=O)/I 3013277d0835785154720b6fe03b119c [1,0,0,1,0,0|2,0,0]=4 947 B12R1.130 C/C(=C/CO[C@H]1CCOC1=O)/I cb9fb8160dbb1ef74f601b4e5f0caf13 [1,0,0,1,0,0|2,0,0]=4 948 B12R1.130 C/C(=C\CN[C@@H]1CCOC1=O)/Cl 6e83a523c82f6df264b736ba690dbbb9 [1,0,0,1,0,0|2,0,0]=4 949 B12R1.130 C/C(=C\CN[C@H]1CCOC1=O)/Cl e9ac8fd140fbce23dd46c7a600d7fe84 [1,0,0,1,0,0|2,0,0]=4 950 B12R1.130 C/C(=C\COC1CCOC1=O)/Cl f80f6a827110711349201c51d82fc923 [1,0,0,1,0,0|2,0,0]=4 951 B12R1.130 C/C(=C\CO[C@@H]1CCOC1=O)/Cl 340e804bfc7d12bf14855b12c3b08269 [1,0,0,1,0,0|2,0,0]=4 952 B12R1.130 C/C(=C\CO[C@H]1CCOC1=O)/Cl 6556e15b38231f588ccda07156ae22ad [1,0,0,1,0,0|2,0,0]=4 953 B12R1.130 CC(=CCNC1CCCC1=O)C 4e3c74b293aa25c29113bd13028d6ed0 [1,0,0,1,0,0|2,0,0]=4 954 B12R1.130 CC(=CCNC1CCNC1=O)C a25e4090a0c209b4463f9e69acc57800 [1,0,0,1,0,0|2,0,0]=4 955 B12R1.130 CC(=CCNC1CCOC1=O)C ce02c2eb3080ad103e459569d1f0527a [1,0,0,1,0,0|1,0,0]=3 956 B12R1.130 CC(=CCNC1CCSC1=O)C 3255e5e5b717ff3838a55d6506421732 [1,0,0,1,0,0|1,1,0]=4 957 B12R1.130 CC(=CCN[C@@H]1CCNC1=O)C b306321ad134862c4cd5eeccb0050c24 [1,0,0,1,0,0|2,0,0]=4 958 B12R1.130 CC(=CCN[C@@H]1CCOC1=O)C 99b8fa03caf010dc1bd3873eedd9980a [1,0,0,1,0,0|1,0,0]=3 959 B12R1.130 CC(=CCN[C@@H]1CCOC1=O)Cl a840d0bd2f9c0a7ed4c65b1634752d76 [1,0,0,1,0,0|2,0,0]=4 960 B12R1.130 CC(=CCN[C@@H]1CCOC1=O)I 0dc56c91bbd20957d2f92d01e0d62b8c [1,0,0,1,0,0|2,0,0]=4 961 B12R1.130 CC(=CCN[C@H]1CCNC1=O)C 3e45374c91070b83b13aea81f93cf4fd [1,0,0,1,0,0|2,0,0]=4 962 B12R1.130 CC(=CCN[C@H]1CCOC1=O)C e673a3147f40297e5b554c2ba7cda599 [1,0,0,1,0,0|1,0,0]=3 963 B12R1.130 CC(=CCN[C@H]1CCOC1=O)Cl 75e367cd1f40b79ec993c361bd6bcf4d [1,0,0,1,0,0|2,0,0]=4 964 B12R1.130 CC(=CCN[C@H]1CCOC1=O)I 406d24661fc9e90761719514eaa3c502 [1,0,0,1,0,0|2,0,0]=4 965 B12R1.130 CC(=CCOC1CCCC1=O)C ceee3ccb8b3b91955bdba9f309dbbd23 [1,0,0,1,0,0|2,0,0]=4 966 B12R1.130 CC(=CCOC1CCNC1=O)C 9b57b347947f275b31b4a46d0f87f33d [1,0,0,1,0,0|2,0,0]=4 967 B12R1.130 CC(=CCOC1CCOC1=O)C 14ed3b2956998ec31748f6d65b6ad25e [1,0,0,1,0,0|1,0,0]=3 968 B12R1.130 CC(=CCOC1CCOC1=O)Cl 69dec1b9f4c5bd4fed034b454df4cb7c [1,0,0,1,0,0|2,0,0]=4 969 B12R1.130 CC(=CCOC1CCOC1=O)I e1c727c55eaa9d6a7a5cfc19f0a524e8 [1,0,0,1,0,0|2,0,0]=4 970 B12R1.130 CC(=CCO[C@@H]1CCNC1=O)C 3a6366b54329f3b54b46daff0d525c02 [1,0,0,1,0,0|2,0,0]=4 971 B12R1.130 CC(=CCO[C@@H]1CCOC1=O)C 37c45a24725d6bbc1d54c56da2d9b203 [1,0,0,1,0,0|1,0,0]=3 972 B12R1.130 CC(=CCO[C@@H]1CCOC1=O)Cl 7e216bf174d30dc4d60a12aa110ec258 [1,0,0,1,0,0|2,0,0]=4 973 B12R1.130 CC(=CCO[C@@H]1CCOC1=O)I 6cfdbb5f5bd27067302601b179129439 [1,0,0,1,0,0|2,0,0]=4 974 B12R1.130 CC(=CCO[C@H]1CCNC1=O)C fbd693c2bf1138d47906852b73ebcfb3 [1,0,0,1,0,0|2,0,0]=4 975 B12R1.130 CC(=CCO[C@H]1CCOC1=O)C 643bb44b7155c183e2106bf31f5a7d56 [1,0,0,1,0,0|1,0,0]=3 976 B12R1.130 CC(=CCO[C@H]1CCOC1=O)Cl a494d5c6374f2d88e86483b405c40179 [1,0,0,1,0,0|2,0,0]=4 977 B12R1.130 CC(=CCO[C@H]1CCOC1=O)I 33424c61e5d650d0bea1792590d7774a [1,0,0,1,0,0|2,0,0]=4 978 B12R1.229 C/C(=C/COCC1COC1=O)/Cl c84f1f2295abeb6bb476a9e7da0929a8 [1,0,0,1,0,0|2,0,0]=4 979 B12R1.229 C/C(=C/COCC1COC1=O)/I 70c2c4a82f6e0c84859aa2e822f752a4 [1,0,0,1,0,0|2,0,0]=4 980 B12R1.229 CC(=CCCN[C@H]1CNC1=O)C 469a191fbc8bc3a191915eefe338e2cc [1,0,0,1,0,0|2,0,0]=4 981 B12R1.229 CC(=CCCOC1CCC1=O)C 1a420391728736d56cd61c6ee3815821 [1,0,0,1,0,0|2,0,0]=4 982 B12R1.229 CC(=CCNCC1COC1=O)C 40568d8857196cdf778f9ccc846a8f55 [1,0,0,1,0,0|1,0,0]=3 983 B12R1.229 CC(=CCOCC1CCC1=O)C 04b4696322c1e25af198b0397e0d837f [1,0,0,1,0,0|2,0,0]=4 984 B12R1.229 CC(=CCOCC1COC1=O)C 9895feef43ed166925d799b27f0a7d91 [1,0,0,1,0,0|1,0,0]=3 985 B12R1.229 CC(=CCOCC1COC1=O)I 9b0b8de2e42384f9bac1fe19771f8f82 [1,0,0,1,0,0|2,0,0]=4 986 B12R1.375 O=CCCOCCCC=C1CC1 712924c90ffe12e8dbb5b6d9f2e3bd5e [1,0,0,1,0,0|2,0,0]=4 987 B12R1.1 CC1=CCC(CC1)COCC=O b1dc231125ba7d8dfe35bb2359edf213 [0,0,0,1,1,0|2,0,0]=4 988 B12R1.1 CN1CCC(CC1)CCNC=O ef5c9fa21c6e13f7f9473834f0036f30 [0,0,0,1,1,0|2,0,0]=4 989 B12R1.226 C/C(=C/CN1CCOC(=O)C1)/I 85b66c771b2ed3f5ffb0d2cb60b0f057 [0,0,0,1,1,0|2,0,0]=4 990 B12R1.226 C/C(=C\CN1CCOC(=O)C1)/Cl 6408269f8ebcafe61b736cf008e5dd34 [0,0,0,1,1,0|2,0,0]=4 991 B12R1.226 C=C(C)CCN1CCOC(=O)C1 e6ad1fd2c6207eb6af1af135fa248099 [0,0,0,1,1,0|1,0,1]=4 992 B12R1.226 CC(=CCN1CCCC(=O)C1)C 5985090fb43753351eecfcdfcca6b00a [0,0,0,1,1,0|2,0,0]=4 993 B12R1.226 CC(=CCN1CCNC(=O)C1)C 37c661cd567a580be53912e9793ed2c8 [0,0,0,1,1,0|2,0,0]=4 994 B12R1.226 CC(=CCN1CCOC(=O)C1)C 93a891a0b183e607d3088a4022aa1343 [0,0,0,1,1,0|1,0,0]=3 995 B12R1.226 CC(=CCN1CCOC(=O)C1)Cl 4bf07f0aa6ecce83d39814265753e7c5 [0,0,0,1,1,0|2,0,0]=4 996 B12R1.226 CC(=CCN1CCOC(=O)C1)I af059b4661c9acb025e260c3c7ba7e46 [0,0,0,1,1,0|2,0,0]=4 997 B12R1.226 CC(=O)CCN1CCOC(=O)C1 d2f350942671e879c17b42799e9365e6 [0,0,0,1,1,0|2,0,0]=4 998 B12R1.226 CC(C)CCN1CCOC(=O)C1 e3cdc8e0f5faaf112122261f6b908fc3 [0,0,0,1,1,0|1,0,1]=4 999 B12R1.226 CN(C)CCN1CCOC(=O)C1 66dfde56575aaec76a5b4d0062b58e36 [0,0,0,1,1,0|2,0,0]=4 1000 B14R1.148 C/C(=C/CNCC1CCNC(=O)C1)/I 4bedd8a34d3e03e9c240aa7183a2d320 [0,0,0,1,0,1|2,0,0]=4 1001 B14R1.148 C/C(=C/COCC1CCCC(=O)C1)/I 063d0e8266eea94c7a7a43d0d635b0e0 [0,0,0,1,0,1|2,0,0]=4 1002 B14R1.148 C/C(=C/COCC1CCNC(=O)C1)/Cl 5bfc2d927c59e80a5b80c95bb607e1ce [0,0,0,1,0,1|2,0,0]=4 1003 B14R1.148 C/C(=C/COCC1CCNC(=O)C1)/I 5c9225be8e5ca03853e79f5604f0d1c4 [0,0,0,1,0,1|2,0,0]=4 1004 B14R1.148 C/C(=C\CNCC1CCNC(=O)C1)/Cl 63e7b5d5e58be80aa2cd78a1448be1e1 [0,0,0,1,0,1|2,0,0]=4 1005 B14R1.148 C/C(=C\COCC1CCCC(=O)C1)/Cl fd7c5bfc0eb77bdcb8f358edd2d65a82 [0,0,0,1,0,1|2,0,0]=4 1006 B14R1.148 C/C(=C\COCC1CCNC(=O)C1)/Cl 00df3a9c0eb14237b79c6b9d5be48a34 [0,0,0,1,0,1|2,0,0]=4 1007 B14R1.148 CC(=CCCNC1CCNC(=O)C1)C 457627a2924387c64c2b5e4d7e33ac1a [0,0,0,1,0,1|1,0,0]=3 1008 B14R1.148 CC(=CCCNC1CCOC(C1)C)C 15944bda3f602f3a380f1c757fbf4130 [0,0,0,1,0,1|1,0,1]=4 1009 B14R1.148 CC(=CCCN[C@@H]1CCNC(=O)C1)C 996abd6a0bd17c9d3413448ab7ef1b83 [0,0,0,1,0,1|1,0,0]=3 1010 B14R1.148 CC(=CCCN[C@@H]1CCO[C@@H](C1)C)C 02e37ce36bdf222fc0d41b1b4cbe1352 [0,0,0,1,0,1|1,0,1]=4 1011 B14R1.148 CC(=CCCN[C@@H]1CCO[C@H](C1)C)C 58115aff0cd284721d05943754c5ce12 [0,0,0,1,0,1|1,0,1]=4 1012 B14R1.148 CC(=CCCN[C@H]1CCNC(=O)C1)C 30e7a6046f7aa26beacd1c239ca6132f [0,0,0,1,0,1|1,0,0]=3 1013 B14R1.148 CC(=CCCN[C@H]1CCO[C@@H](C1)C)C 8e8704a6130b660ae082017ae961c0da [0,0,0,1,0,1|1,0,1]=4 1014 B14R1.148 CC(=CCCN[C@H]1CCO[C@H](C1)C)C 27be4716bcb50adffb765e128f3cc103 [0,0,0,1,0,1|1,0,1]=4 1015 B14R1.148 CC(=CCCOC1CCCC(=O)C1)C 1c3ea3bed24161bf86edea47027045f5 [0,0,0,1,0,1|1,0,0]=3 1016 B14R1.148 CC(=CCCOC1CCNC(=O)C1)C 17ac0c326615271f0551ba507a6ff1f3 [0,0,0,1,0,1|1,0,0]=3 1017 B14R1.148 CC(=CCCOC1CCOC(C1)C)C cf0e367ed8aaf83e0e8672dfc761783f [0,0,0,1,0,1|1,0,1]=4 1018 B14R1.148 CC(=CCCO[C@@H]1CCNC(=O)C1)C 4f551ae1e5e09fd1ce607d28987548e7 [0,0,0,1,0,1|1,0,0]=3 1019 B14R1.148 CC(=CCCO[C@@H]1CCO[C@@H](C1)C)C 19e92c537552b7630c6f3ed965405cd0 [0,0,0,1,0,1|1,0,1]=4 1020 B14R1.148 CC(=CCCO[C@@H]1CCO[C@H](C1)C)C 985a25c59dd370aaab5c2ceed733cedc [0,0,0,1,0,1|1,0,1]=4 1021 B14R1.148 CC(=CCCO[C@H]1CCNC(=O)C1)C 9767cb504b4e71b940e9d48b431755c7 [0,0,0,1,0,1|1,0,0]=3 1022 B14R1.148 CC(=CCCO[C@H]1CCO[C@@H](C1)C)C 38dd4101620ac48529bd9c32c5dc2d9e [0,0,0,1,0,1|1,0,1]=4 1023 B14R1.148 CC(=CCCO[C@H]1CCO[C@H](C1)C)C 5af8470ace8a0726fe02b909cc233698 [0,0,0,1,0,1|1,0,1]=4 1024 B14R1.148 CC(=CCNCC1CCCC(=O)N1)C 62d8cba9cdd84d0a37e74f7b2ac284f3 [0,0,0,1,0,1|2,0,0]=4 1025 B14R1.148 CC(=CCNCC1CCNC(=O)C1)C cf275d0c1b1ff6972b7421d0607fefed [0,0,0,1,0,1|1,0,0]=3 1026 B14R1.148 CC(=CCNCC1CCNC(=O)C1)Cl 4a7f54b12c363bf8b4d57c3bb6aee1be [0,0,0,1,0,1|2,0,0]=4 1027 B14R1.148 CC(=CCNCC1CCNC(=O)C1)I ecc907e93cd7f38491700584552b608c [0,0,0,1,0,1|2,0,0]=4 1028 B14R1.148 CC(=CCOCC1CCCC(=O)C1)C ba236ec26f241fd758923ed5520dc3ed [0,0,0,1,0,1|1,0,0]=3 1029 B14R1.148 CC(=CCOCC1CCCC(=O)C1)Cl 9fe073e26099cf0782c6180275955bac [0,0,0,1,0,1|2,0,0]=4 1030 B14R1.148 CC(=CCOCC1CCCC(=O)C1)I 26fab973be25b148765524a55e8ca984 [0,0,0,1,0,1|2,0,0]=4 1031 B14R1.148 CC(=CCOCC1CCCC(=O)N1)C 7a0cf84d854efdf1fb761174549f74ef [0,0,0,1,0,1|2,0,0]=4 1032 B14R1.148 CC(=CCOCC1CCNC(=O)C1)C 88a110dea2e8739253d495bb183dc15a [0,0,0,1,0,1|1,0,0]=3 1033 B14R1.148 CC(=CCOCC1CCNC(=O)C1)Cl d8051dbc4ecaf8c73f2b85e7bb8a8b38 [0,0,0,1,0,1|2,0,0]=4 1034 B14R1.148 CC(=CCOCC1CCNC(=O)C1)I 58f1a3498181c0b705492d63467a6576 [0,0,0,1,0,1|2,0,0]=4 1035 B14R1.148 CC(=CCOC[C@@H]1CCCC(=O)N1)C cdb9c84c706ebaca56dc51edae52433b [0,0,0,1,0,1|2,0,0]=4 1036 B14R1.148 CC(=CCOC[C@H]1CCCC(=O)N1)C a2db64c58b244aaa330023d06e3c4451 [0,0,0,1,0,1|2,0,0]=4 1037 B14R1.279 CCO[C@H]1C[C@@H](C1)OCCC=C(C)C 74a491ab7076db0331c39fdd5fa5df7d [0,0,0,1,0,1|1,0,1]=4 1038 B14R1.279 CCO[C@H]1C[C@H](C1)OCCC=C(C)C 747353ad9e9f88e3f17487cf974470b8 [0,0,0,1,0,1|1,0,1]=4 1039 B14R1.329 CC(=CCCN1CCOCCC1C)C 5f8b910af76fb7223af200754a7152be [0,0,0,1,0,1|1,0,1]=4 1040 B14R1.418 CC(=CCCN[C@H](C)C1CCOC1)C 464bb09b8e13de18a57b1688f05f6456 [0,0,0,1,0,1|1,0,1]=4 1041 B14R1.418 CC(=CCCOC(C)C1CCOC1)C 8b45d00b5ecec68d985824de977551dd [0,0,0,1,0,1|1,0,1]=4 1042 B14R1.4499 C/C(=C/COCC1(CCCC1=O)C)/I aea5f879c249f74e4387f4cdcc257a78 [0,0,0,1,0,1|2,0,0]=4 1043 B14R1.4499 C/C(=C/COCC1(CCNC1=O)C)/I a15512a7246fbd61bc6d70f85bb270f4 [0,0,0,1,0,1|2,0,0]=4 1044 B14R1.4499 C/C(=C\COCC1(CCCC1=O)C)/Cl ae4ba3cf4dee957cf58c836d5a95aecc [0,0,0,1,0,1|2,0,0]=4 1045 B14R1.4499 C/C(=C\COCC1(CCNC1=O)C)/Cl 8442ab35d7d976e60c0675047774f0ac [0,0,0,1,0,1|2,0,0]=4 1046 B14R1.4499 CC(=CCCNC1(CCNC1=O)C)C f5bd4ce5a867672a89656c4a1c5ed8d2 [0,0,0,1,0,1|1,0,0]=3 1047 B14R1.4499 CC(=CCOCC1(CCCC1=O)C)C d87ab02f229a32650ac92a9987407a29 [0,0,0,1,0,1|1,0,0]=3 1048 B14R1.4499 CC(=CCOCC1(CCCC1=O)C)Cl 049736bab44d904315d30198074b97fc [0,0,0,1,0,1|2,0,0]=4 1049 B14R1.4499 CC(=CCOCC1(CCCC1=O)C)I 115f80bc4dd6cc75c47100e000bace25 [0,0,0,1,0,1|2,0,0]=4 1050 B14R1.4499 CC(=CCOCC1(CCNC1=O)C)C fcca79d1d7a97fac25e42ce14edc4638 [0,0,0,1,0,1|1,0,0]=3 1051 B14R1.4499 CC(=CCOCC1(CCNC1=O)C)Cl f000150a57b0bd3077b58c6716310561 [0,0,0,1,0,1|2,0,0]=4 1052 B14R1.4499 CC(=CCOCC1(CCNC1=O)C)I 14dab7d0863fb3515de7f260b8478e1d [0,0,0,1,0,1|2,0,0]=4 1053 B14R1.6343 CC(=CCCNC1CCC=CCC1)C 516a1032ef1f34bcebea967d95d0f167 [0,0,0,1,0,1|2,0,0]=4 1054 B14R1.6343 CC(=CCCNC1CCCOCC1)C 4cda21e0c62f4822f042ff6fd388f4e6 [0,0,0,1,0,1|1,0,1]=4 1055 B14R1.6343 CC(=CCCOC1CCCOCC1)C 3bb8781e5f1f37dac0c69f46eb48eaaa [0,0,0,1,0,1|1,0,1]=4 1056 B14R1.6527 C=CCCC[C@@H]1C[C@H]1OCC=C(C)C f17c93bdb2dfd17f0b8bbb8612cab8d6 [0,0,0,1,0,1|2,0,0]=4 1057 B14R1.16462 CC(=CCCNC1(CCOCC1)C)C ddeeb296998fed762bf74d750c7fc484 [0,0,0,1,0,1|1,0,1]=4 1058 B14R1.16462 CC(=CCNCC1(CCOCC1)C)C 0ee1bd0fb038181c2a0b68cf6a6b51f4 [0,0,0,1,0,1|1,0,1]=4 1059 B14R1.16462 CC(=CCOCC1(CCOCC1)C)C 273ecb62565c316161dbd3d308687481 [0,0,0,1,0,1|1,0,1]=4 1060 B14R1.220 CC(=O)N1CCC(C1)OCCOC=O e0e68e05ae4322fe49817556b3d2b67e [0,1,0,1,0,0|2,0,0]=4 1061 B14R1.760 C=C(C)C1CCC(CC1OCC=O)C 35e14ea36b0f10a7b60f59bcb4c346ab [0,1,0,1,0,0|0,0,2]=4 1062 B14R1.760 C=C(C)[C@@H]1CC[C@H](C[C@H]1OCC=O)C fdd6f958ff6c943789e32325d505cdac [0,1,0,1,0,0|0,0,2]=4 1063 B14R1.760 CC(C)[C@@H]1CC[C@H](C[C@@H]1OCC=O)C 479a17b9d49a94b5bf007e9f39bb67e8 [0,1,0,1,0,0|0,0,2]=4 1064 B14R1.760 CC(C)[C@@H]1CC[C@H](C[C@H]1OCC=O)C f5c4ff75bf610fa09892259524f7a205 [0,1,0,1,0,0|0,0,2]=4 1065 B14R1.760 CC(C)[C@H]1CC[C@@H](C[C@@H]1OCC=O)C c6bb9f4153e2fe8b22d29ee2b4b45319 [0,1,0,1,0,0|0,0,2]=4 1066 B14R1.760 CC(C)[C@H]1CC[C@H](C[C@@H]1OCC=O)C 16733d0ecb76fedc329e07fdec6d96b4 [0,1,0,1,0,0|0,0,2]=4 1067 B14R1.760 CC(C)[C@H]1CC[C@H](C[C@H]1OCC=O)C a7f61e838e8dfc94fc547fc79ca6af58 [0,1,0,1,0,0|0,0,2]=4 1068 B14R1.760 CC1CCC(C(C1)OCC=O)C(C)C 416c7e5204bcf63cc52ce2ed315dfaac [0,1,0,1,0,0|0,0,2]=4 1069 B14R1.810 CC(=CCCC(C)OC1CCOC1)C 45f4b7a0a23b29045d14e77dddef1762 [0,1,0,1,0,0|1,0,1]=4 1070 B14R1.810 CC(=CCCC(C)O[C@@H]1CCOC1)C 6af7df7d11f815b834b6497772a0e8f5 [0,1,0,1,0,0|1,0,1]=4 1071 B14R1.810 CC(=CCCC(C)O[C@H]1CCOC1)C 5fbf7a27043d16b7c584759a5dd523a6 [0,1,0,1,0,0|1,0,1]=4 1072 B14R1.810 CC(=CCC[C@@H](C)OC1CCOC1)C f9d19924e117a3aedae65f66eed7cea6 [0,1,0,1,0,0|1,0,1]=4 1073 B14R1.810 CC(=CCC[C@@H](C)O[C@@H]1CCOC1)C 5d377b175af4c0b5e4c07350e5046baa [0,1,0,1,0,0|1,0,1]=4 1074 B14R1.810 CC(=CCC[C@@H](C)O[C@H]1CCOC1)C 3c3f688c0e887b28843b6b4470d6208e [0,1,0,1,0,0|1,0,1]=4 1075 B14R1.810 CC(=CCC[C@H](C)OC1CCOC1)C 82a4127a28d66d7847184c77750d1b7c [0,1,0,1,0,0|1,0,1]=4 1076 B14R1.810 CC(=CCC[C@H](C)O[C@@H]1CCOC1)C e7691c472ce3206aaeaa93c7b34f95c6 [0,1,0,1,0,0|1,0,1]=4 1077 B14R1.810 CC(=CCC[C@H](C)O[C@H]1CCOC1)C 86e0510ab19e83039c09379ff7b8f006 [0,1,0,1,0,0|1,0,1]=4 1078 B14R1.1469 CC(=CCCC(C)OCC1CCO1)C 8cadede9f0acab75906f2b89a6c25abf [0,1,0,1,0,0|1,0,1]=4 1079 B14R1.1469 CC(=CCCC(C)OC[C@@H]1CCO1)C d29a861b173e03d2049dffc405834f67 [0,1,0,1,0,0|1,0,1]=4 1080 B14R1.1469 CC(=CCCC(C)OC[C@H]1CCO1)C e3ab7718df4b33bd8cb8a0ac21f3929c [0,1,0,1,0,0|1,0,1]=4 1081 B14R1.1469 CC(=CCC[C@@H](C)OCC1CCO1)C b6e4b793a68ccb15a64100fb5bf290ab [0,1,0,1,0,0|1,0,1]=4 1082 B14R1.1469 CC(=CCC[C@@H](C)OC[C@@H]1CCO1)C 546cfdee599729510f3102d89a333a9c [0,1,0,1,0,0|1,0,1]=4 1083 B14R1.1469 CC(=CCC[C@@H](C)OC[C@H]1CCO1)C cc28afd66dcb6fe5fcdcd2405f853b8b [0,1,0,1,0,0|1,0,1]=4 1084 B14R1.1469 CC(=CCC[C@H](C)OCC1CCO1)C d9bd30b1b4d71bf8c1ee9e4a363e967b [0,1,0,1,0,0|1,0,1]=4 1085 B14R1.1469 CC(=CCC[C@H](C)OC[C@@H]1CCO1)C 8b74ae05dfc7723dd8b815ca15105da7 [0,1,0,1,0,0|1,0,1]=4 1086 B14R1.1469 CC(=CCC[C@H](C)OC[C@H]1CCO1)C 4ed31a9fa0a2c56e8ffc0bc3b45393b1 [0,1,0,1,0,0|1,0,1]=4 1087 B14R1.1470 CC(=CCCC(C)CCOC1CC1)C 379338ecc4f0fd04ba4d3c32121ffb20 [0,1,0,1,0,0|1,0,1]=4 1088 B14R1.1470 CC(=CCC[C@@H](C)CCOC1CC1)C fcc2deb79024492ce3b6c3d0a76d89ac [0,1,0,1,0,0|1,0,1]=4 1089 B14R1.1470 CC(=CCC[C@H](C)CCOC1CC1)C 63dd15fa33631920cdf3fc138e09ebd3 [0,1,0,1,0,0|1,0,1]=4 1090 B14R1.1634 CC(=CCCC(C)OC1CC1C=O)C 75211cb4dfe195f13880cd20a6234952 [0,1,0,1,0,0|1,0,0]=3 1091 B14R1.1634 CC(=CCC[C@@H](C)OC1CC1C=O)C f63d9c99a6b5666c0923b179ff753b09 [0,1,0,1,0,0|1,0,0]=3 1092 B14R1.1634 CC(=CCC[C@H](C)OC1CC1C=O)C 22cfe62f19e405ebb551a9fdc5bc4af5 [0,1,0,1,0,0|1,0,0]=3 1093 B14R1.4898 CC(=CCCN1CCCNC(=O)C1)C c51d2de60d31c02f8c9767c03b8c049b [0,1,0,1,0,0|2,0,0]=4 1094 B14R1.4898 CC(=CCOC1CCCNC(=O)C1)C 46d03f9cc2cadefc263a1a6cfc97fd93 [0,1,0,1,0,0|2,0,0]=4 1095 B14R1.6001 CC(=CCCC(C)OC1CCC1=O)C 2ad914b775dbb78b498cebe5523ff164 [0,1,0,1,0,0|1,0,0]=3 1096 B14R1.6001 CC(=CCC[C@@H](C)OC1CCC1=O)C fe88e68fd6c416f837b813ce02e72318 [0,1,0,1,0,0|1,0,0]=3 1097 B14R1.6001 CC(=CCC[C@H](C)OC1CCC1=O)C a862f52b6d12844b531932a6dac77477 [0,1,0,1,0,0|1,0,0]=3 1098 B14R1.6694 CC1(CC(CCO1)OCCOC=O)C b6839c8d9a302e7d69e0613d282a1072 [0,1,0,1,0,0|1,0,1]=4 1099 B14R1.149 CC(=CCC(=O)N1CCOC(=O)C1)C bbba675fc6cca63b9479b8808730fec1 [0,1,0,1,0,0|1,0,1]=4 1100 B14R1.4 CC(=CCCN1CCC(CC1)C=O)C 55f61fcd9fab4b2cd493c9642c7ee80b [0,1,0,1,0,0|2,0,0]=4 1101 B14R1.4 CC(=CCCN1CCN(CC1)C=O)C 6d127d2c6cb15490736c6687f46a91ec [0,1,0,1,0,0|2,0,0]=4 1102 B14R1.4 CC(=CCNC1CCC(CC1)C=O)C d8c51040de68526dc94707858eb424a1 [0,1,0,1,0,0|2,0,0]=4 1103 B14R1.4 CC(=CCOC1CCC(CC1)C=O)C d9b80b87e89642ffb19d2730a6ec1e68 [0,1,0,1,0,0|2,0,0]=4 1104 B14R1.4 CC(=CCO[C@H]1CC[C@@H](CC1)C=O)C e3753d2db7234a8e8c158c36549412e7 [0,1,0,1,0,0|2,0,0]=4 1105 B14R1.4 CC(=CCO[C@H]1CC[C@H](CC1)C=O)C d4151dd3d6a5da5f19ca7ceaa6a00000 [0,1,0,1,0,0|2,0,0]=4 1106 B14R1.154 CC(=CCCN1CCNC(=O)C1C)C 15b8c86c7f3d618d92f2f069a90181d9 [0,1,0,1,0,0|2,0,0]=4 1107 B14R1.154 CC(=CCCN1CCNC(=O)[C@@H]1C)C e7ba32ed05ed9441ab32bf76aac863a2 [0,1,0,1,0,0|2,0,0]=4 1108 B14R1.154 CC(=CCCN1CCNC(=O)[C@H]1C)C 1a31e6b188a85ac63df99e1c0501b6b4 [0,1,0,1,0,0|2,0,0]=4 1109 B14R1.4917 CC(=CCCN1CCCC(=O)CC1)C 1c1932e463c04d5661104284d56190b3 [0,1,0,1,0,0|2,0,0]=4 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CC(=CCCN(C)C1COC(=O)C1)C 6752020100001717ed736622fc5e256d [0,1,0,1,0,0|1,0,0]=3 1121 B14R1.6072 CC(=CCCN1CC(=O)NCC1C)C 16c9b507c0e8db6a283279669ad2eafc [0,1,0,1,0,0|2,0,0]=4 1122 B14R1.6072 CC(=CCCN1CC(=O)NC[C@@H]1C)C 082ecfea179af8a7ed8b0e3b603e6d72 [0,1,0,1,0,0|2,0,0]=4 1123 B14R1.6072 CC(=CCCN1CC(=O)NC[C@H]1C)C 71e2d0a453d0c0f6e8cae52a880a3407 [0,1,0,1,0,0|2,0,0]=4 1124 B14R1.687 CC(=CCCN1CCN(C(=O)C1)C)C dd9da8f1d6cbba3760e4de54969e6add [0,1,0,1,0,0|2,0,0]=4 1125 B14R1.687 CC(=CCNC1CCN(C(=O)C1)C)C 4d0744976b6d0a5c47dead20612803c5 [0,1,0,1,0,0|2,0,0]=4 1126 B14R1.687 CC(=CCN[C@@H]1CCN(C(=O)C1)C)C 232dc12877cd606d3f2f17fae14ebea0 [0,1,0,1,0,0|2,0,0]=4 1127 B14R1.687 CC(=CCN[C@H]1CCN(C(=O)C1)C)C 16f7fb59eecf2e1b18359c15e6ad8ffe [0,1,0,1,0,0|2,0,0]=4 1128 B14R1.1456 CC(=CCCN1CC(C1)CC(=O)O)C 0d7f3c9713fe9a6fc78d7e77125cc873 [0,1,0,1,0,0|2,0,0]=4 1129 B14R1.1456 CC(=CCNC1CC(C1)CC(=O)O)C bd283f9ed76f308828803b3953bc13b0 [0,1,0,1,0,0|2,0,0]=4 1130 B14R1.1456 CC(=CCO[C@H]1C[C@@H](C1)CC(=O)O)C 326912a4aec6d060d8f21bf20a9345e7 [0,1,0,1,0,0|2,0,0]=4 1131 B14R1.1456 CC(=CCO[C@H]1C[C@H](C1)CC(=O)O)C a5c92b13d1a4933bcaab30a80b81a712 [0,1,0,1,0,0|2,0,0]=4 1132 B14R1.1456 CC(=O)NC1CC(C1)NCC=C(C)C 3cb4cb210a35423c70a5a313901e8ae3 [0,1,0,1,0,0|2,0,0]=4 1133 B14R1.1456 CC(=O)NC1CN(C1)CCC=C(C)C 837da1a21cabf9fe612e9d95b0abc7e5 [0,1,0,1,0,0|2,0,0]=4 1134 B14R1.1456 CC(=O)OC1CN(C1)CCC=C(C)C f48e81bb231c0499052316aa4b4389c4 [0,1,0,1,0,0|1,0,0]=3 1135 B14R1.1456 CC(=O)O[C@H]1C[C@@H](C1)OC/C=C(/C)\I 5dab285d46351337d8325ab55a6a6011 [0,1,0,1,0,0|2,0,0]=4 1136 B14R1.1456 CC(=O)O[C@H]1C[C@@H](C1)OC/C=C(\C)/Cl eec50291389ee5f240eb5fa966dfaff0 [0,1,0,1,0,0|2,0,0]=4 1137 B14R1.1456 CC(=O)O[C@H]1C[C@@H](C1)OCC=C(C)C cceffb6d4ded7aff690897b625558173 [0,1,0,1,0,0|1,0,0]=3 1138 B14R1.1456 CC(=O)O[C@H]1C[C@@H](C1)OCC=C(C)Cl 906fd16ca392cca92decc5735449c0fa [0,1,0,1,0,0|2,0,0]=4 1139 B14R1.1456 CC(=O)O[C@H]1C[C@@H](C1)OCC=C(C)I db4bd941a4d7f3fd84dd09536b002f25 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CC(=CCN[C@H]1CC[C@@H](C1)C(=O)O)C 92d6d53098a34f52c9f4899c47419201 [0,1,0,1,0,0|2,0,0]=4 1160 B14R1.6314 CC(=CCN[C@H]1CC[C@H](C1)C(=O)N)C f321b07b5f85e0da29fcc0dde6069f9c [0,1,0,1,0,0|2,0,0]=4 1161 B14R1.6314 CC(=CCN[C@H]1CC[C@H](C1)C(=O)O)C 23f9f8c17f46f21030ae94b7a76f5814 [0,1,0,1,0,0|2,0,0]=4 1162 B14R1.6314 CC(=CCOC1CCC(C1)C(=O)O)C 5a9b248f9cb5229c4c62a1fd8a3d4057 [0,1,0,1,0,0|2,0,0]=4 1163 B14R1.6314 CC(=CCO[C@@H]1CC[C@@H](C1)C(=O)O)C 46c4ff31317f8458e743f5bc6a26b7b2 [0,1,0,1,0,0|2,0,0]=4 1164 B14R1.6314 CC(=CCO[C@@H]1CC[C@H](C1)C(=O)O)C d8086b4589ed613e4d792af31ca05b40 [0,1,0,1,0,0|2,0,0]=4 1165 B14R1.6314 CC(=CCO[C@H]1CC[C@@H](C1)C(=O)O)C fb505a139eea65ef23cf4fe9a85fecf5 [0,1,0,1,0,0|2,0,0]=4 1166 B14R1.6314 CC(=CCO[C@H]1CC[C@H](C1)C(=O)O)C 60a8df6663d5f06cc81c60b0b3980cca [0,1,0,1,0,0|2,0,0]=4 1167 B14R1.6314 CC(=O)C1CCN(C1)CCC=C(C)C 610e807c932e59c5aac7a6e41655012c [0,1,0,1,0,0|2,0,0]=4 1168 B14R1.6314 CC(=O)N1CCC(C1)NCC=C(C)C ca254b2e17e81efca332bb8f7991fa69 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