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B11R0.4 CCCCCNCC(=O)CCC 5c0a36c9da6990262983584768700e06 [0,0,0,0,0,0|2,0,2]=4 130 B11R0.4 CCCCCOCC(=O)CCC 8262177c32a9450a29113f02c3e40c8e [0,0,0,0,0,0|2,0,2]=4 131 B11R0.4 CCCCNCOC(=O)CCC cc2e2e110e13b6e9f5212bb3d4681698 [0,0,0,0,0,0|1,0,2]=3 132 B11R0.4 CCCCNCOC(=O)OCC ca409d7539df0c74dbd07384dd478520 [0,0,0,0,0,0|2,0,2]=4 133 B11R0.4 CCCCNCOC(=O)SCC 2bb2d25fa2ef25941c49a8e888b29c57 [0,0,0,0,0,0|2,0,2]=4 134 B11R0.4 CCCCOCOC(=O)CCC b2403cfdcf9e3272dd7d915ff636f487 [0,0,0,0,0,0|1,0,2]=3 135 B11R0.4 CCCCOCOC(=O)OCC f9445a123e97e58df2bd304b13c696ca [0,0,0,0,0,0|2,0,2]=4 136 B11R0.4 CCCCOCOC(=O)SCC 9fbe2d42309e989a4135a7d0aa7273eb [0,0,0,0,0,0|2,0,2]=4 137 B11R0.4 CCCCOCOC(=S)CCC c21ba10898477f356b122da4cbbceb6f [0,0,0,0,0,0|1,1,2]=4 138 B11R0.4 CCCNCCCC(=O)OCC f6461f8e22f3d933186943d4b183108e [0,0,0,0,0,0|3,0,1]=4 139 B11R0.4 CCCOCCCC(=O)OCC 44f3c08715c24b28a3685ca7f9c36e30 [0,0,0,0,0,0|3,0,1]=4 140 B11R0.4 CCCOCCNC(=O)CCC 95c055b4347bfd7bfa9c570d9719ea75 [0,0,0,0,0,0|2,0,1]=3 141 B11R0.4 CCCOCCNC(=O)CCF 784976a9f6c554bfef5890d22be8c3ae [0,0,0,0,0,0|3,0,1]=4 142 B11R0.4 CCCOCCNC(=O)CCO 6d308239c94ac8e860e2d79889c8facb [0,0,0,0,0,0|3,0,1]=4 143 B11R0.4 CCCOCCNC(=O)CCS 0b663011faafdf6c4131448ce79c937a [0,0,0,0,0,0|3,0,1]=4 144 B11R0.4 CCCOCCNC(=O)COC 6067c71ef34c0399492ad8122c06202c [0,0,0,0,0,0|3,0,1]=4 145 B11R0.4 CCCOCCNC(=O)CSC 6996763b3846009de64b111c96742018 [0,0,0,0,0,0|3,0,1]=4 146 B11R0.4 CCCOCCOC(=O)CCC 94efe85d85fae3af0976a73792f0222f [0,0,0,0,0,0|1,0,1]=2 147 B11R0.4 CCCOCCOC(=S)CCC 95a4dad7fc3b1d357922e071080ce62e [0,0,0,0,0,0|1,1,1]=3 148 B11R0.4 CCCOCCOC(C)CCC 0718f8788045b926ec65216173e53bce [0,0,0,0,0,0|2,0,2]=4 149 B11R0.4 CCCOCCO[C@@H](C)CCC 42bbc03cca2630aa13580adad71d1be6 [0,0,0,0,0,0|2,0,2]=4 150 B11R0.4 CCCOCCO[C@H](C)CCC 28ee10e8884a7bb06ea5329ce5b20582 [0,0,0,0,0,0|2,0,2]=4 151 B11R0.4 CCCSCCOC(C)CCC 17743df72a9dba4df426cc8297e4d5b2 [0,0,0,0,0,0|2,0,2]=4 152 B11R0.4 CCC[C@@H](C)OCCCOCC 1e53ecf5115d81f9df80c3e1d1926c21 [0,0,0,0,0,0|2,0,2]=4 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[1,0,0,0,0,0|1,1,1]=4 224 B10R0.1 CCCC(=S)OCCCCF a87f2db53eb48cbc176427ca92313c59 [1,0,0,0,0,0|1,1,1]=4 225 B10R0.1 CCCC(=S)OCCCOC 0f4db520c0f579ec24c237eea823c892 [1,0,0,0,0,0|1,1,1]=4 226 B10R0.1 CCCC(=S)OCCCSC 12882614c3d678eebfd0f7f1164a7738 [1,0,0,0,0,0|1,1,1]=4 227 B10R0.1 CCCC(=S)OCCOCC a1bd1ecdf3a74bbe1c29303e11aeb9ee [1,0,0,0,0,0|1,1,0]=3 228 B10R0.1 CCCC(=S)OCCSCC 57566a2b28663af6eed39d2cf1b8b53f [1,0,0,0,0,0|1,1,0]=3 229 B10R0.1 CCCC(C)OCCOCC f74f7fa41a2da07c6ada5e572fcee475 [1,0,0,0,0,0|2,0,1]=4 230 B10R0.1 CCCC(C)OCCSCC 369979e35e101e7801c5f92538b1f3a1 [1,0,0,0,0,0|2,0,1]=4 231 B10R0.1 CCCCCNC(=O)CCC cd3617b761f054cae655d3c214537a01 [1,0,0,0,0,0|1,0,1]=3 232 B10R0.1 CCCCCNC(=O)CCF 8f55dcb051c9e4fa4d8e7353d886739d [1,0,0,0,0,0|2,0,1]=4 233 B10R0.1 CCCCCNC(=O)CCO e4a8972fa724b6f0f9b4d6b3c835d2fb [1,0,0,0,0,0|2,0,1]=4 234 B10R0.1 CCCCCNC(=O)CCS 3733c740ac8be76287971250e938eadf [1,0,0,0,0,0|2,0,1]=4 235 B10R0.1 CCCCCNC(=O)COC 3c827a5b8568a226ab9d7a96910886e4 [1,0,0,0,0,0|2,0,1]=4 236 B10R0.1 CCCCCNC(=O)CSC a633d95815fa33f04c44be165a312304 [1,0,0,0,0,0|2,0,1]=4 237 B10R0.1 CCCCCOC(=S)CCC e70fcd071a998201c96ff7af83897208 [1,0,0,0,0,0|0,1,1]=3 238 B10R0.1 CCCCCOC(C)CCC 95598e4482fa2acf5532e4fa9a6ad6e3 [1,0,0,0,0,0|1,0,2]=4 239 B10R0.1 CCCCCO[C@@H](C)CCC d796f1fbb42029d496f1afefad90a0c9 [1,0,0,0,0,0|1,0,2]=4 240 B10R0.1 CCCCCO[C@H](C)CCC 8ec1919c97beba8a5a1b87817d43e6ed [1,0,0,0,0,0|1,0,2]=4 241 B10R0.1 CCCCNCC(=O)CCC 453fddd4efd403580a47150fb6a1b943 [1,0,0,0,0,0|1,0,2]=4 242 B10R0.1 CCCCOCC(=O)CCC 3c18382cf685be3b48662cc000c9f11f [1,0,0,0,0,0|1,0,2]=4 243 B10R0.1 CCCNCCC(=O)NCC fed5cf7995e8bcb3cb088a7324683334 [1,0,0,0,0,0|2,0,1]=4 244 B10R0.1 CCCNCCC(=O)OCC a5eca5b369834181d5c681e73bc5df58 [1,0,0,0,0,0|2,0,1]=4 245 B10R0.1 CCCNCOC(=O)CCC 38cbf3506e155a3e433f65aa13f4e89b [1,0,0,0,0,0|1,0,1]=3 246 B10R0.1 CCCNCOC(=O)OCC dd5fb1e82de8f1385da13ffd886652b3 [1,0,0,0,0,0|2,0,1]=4 247 B10R0.1 CCCNCOC(=O)SCC afe6d13e5e63696216df6a5e42e8e018 [1,0,0,0,0,0|2,0,1]=4 248 B10R0.1 CCCOCCC(=O)NCC 716a0638bd662663b8cdb9317f882e86 [1,0,0,0,0,0|2,0,1]=4 249 B10R0.1 CCCOCCC(=O)OCC 7807b520106a1db433af53f99cc9cebe [1,0,0,0,0,0|2,0,1]=4 250 B10R0.1 CCCOCOC(=O)CCC ae34f309fddde79fb1b78768c738001e [1,0,0,0,0,0|1,0,1]=3 251 B10R0.1 CCCOCOC(=O)OCC 00ffc636bc87edde518c508ef349454a [1,0,0,0,0,0|2,0,1]=4 252 B10R0.1 CCCOCOC(=O)SCC db970673b3d242e11b09ecfcd7404053 [1,0,0,0,0,0|2,0,1]=4 253 B10R0.1 CCC[C@@H](C)OCCOCC 3a42c254752838b833672be593233f0d [1,0,0,0,0,0|2,0,1]=4 254 B10R0.1 CCC[C@@H](C)OCCSCC 45039a4155790bf73751859d1594005d [1,0,0,0,0,0|2,0,1]=4 255 B10R0.1 CCC[C@H](C)OCCOCC b689ae6df6247584becb7b7915f481aa [1,0,0,0,0,0|2,0,1]=4 256 B10R0.1 CCC[C@H](C)OCCSCC 3b192f827edc34a5309e84248c0416dd [1,0,0,0,0,0|2,0,1]=4 257 B10R0.1 CCNCCCC(=O)OCC ec7ea6af2e873221783738c3262f1017 [1,0,0,0,0,0|2,0,1]=4 258 B10R0.1 CCOCCCC(=O)OCC 065e688430f5956cbb53aefa5e1e9a90 [1,0,0,0,0,0|2,0,1]=4 259 B10R0.1 CCOCCNC(=O)CCF 30ff3d1e0d42d88b890503467a1d0faf [1,0,0,0,0,0|3,0,0]=4 260 B10R0.1 CCOCCNC(=O)CCO 07fe0269889c2bb3a011a39b226f32c2 [1,0,0,0,0,0|3,0,0]=4 261 B10R0.1 CCOCCNC(=O)CCS ba9fc205a8abbd5100b90e72fc8022c0 [1,0,0,0,0,0|3,0,0]=4 262 B10R0.1 CCOCCNC(=O)COC 78fcea0c24a356c716c115100dc7a09f [1,0,0,0,0,0|3,0,0]=4 263 B10R0.1 CCOCCNC(=O)CSC cc96c76b4bd9e83a7fed71cad246cb3d [1,0,0,0,0,0|3,0,0]=4 264 B10R0.1 CCSCCNC(=O)CCF 546f28f99d32729a57edd07a91f6d52b [1,0,0,0,0,0|3,0,0]=4 265 B10R0.1 CCSCCNC(=O)CCO cdd7f8211b4e390617f39925d56f3718 [1,0,0,0,0,0|3,0,0]=4 266 B10R0.1 CCSCCNC(=O)CCS 7c9b93abf3ea2c2a2c588739c4cb7bac [1,0,0,0,0,0|3,0,0]=4 267 B10R0.1 CCSCCNC(=O)COC a19b0a93f49032c26f16e852a9c205d9 [1,0,0,0,0,0|3,0,0]=4 268 B10R0.1 CCSCCNC(=O)CSC b409c0a5f6b4d3adf33fab235d1c16f6 [1,0,0,0,0,0|3,0,0]=4 269 B10R0.71 C#CCCOCC/C=C/CC 74d74bf4d6c2d75460dfacf68a9a580b [1,0,0,0,0,0|0,0,3]=4 270 B10R0.71 C#CCCOCC/C=C\CC 535e73d5205901617bde8680afff5afa [1,0,0,0,0,0|0,0,3]=4 271 B10R0.71 C/C=C/C=C/COCCCC 5be7c2b1277a2751ff6b685b75a09aa7 [1,0,0,0,0,0|0,0,3]=4 272 B10R0.71 C/C=C/CCCOCCCC 80f6cb269c0f24c47f7493f0858d135b [1,0,0,0,0,0|0,0,3]=4 273 B10R0.71 C/C=C/COCC/C=C/CC b64b9773fa341b27d9d1567b3b462587 [1,0,0,0,0,0|0,0,3]=4 274 B10R0.71 C/C=C/COCC/C=C\CC 67fa2a7eeebb12d9123f78d838c34e53 [1,0,0,0,0,0|0,0,3]=4 275 B10R0.71 C/C=C\CCCOCCCC fe2923e9d84b92616f7a73a5334d712d [1,0,0,0,0,0|0,0,3]=4 276 B10R0.71 C/C=C\COCC/C=C/CC 1d0dedc0b89be954edd17fb1cb04b1e7 [1,0,0,0,0,0|0,0,3]=4 277 B10R0.71 C/C=C\COCC/C=C\CC e69c55870a373fdf3f38e626544c4bc2 [1,0,0,0,0,0|0,0,3]=4 278 B10R0.71 C=CCCOCC/C=C/CC 34e932e8340213e918b96915d5caa9f2 [1,0,0,0,0,0|0,0,3]=4 279 B10R0.71 C=CCCOCC/C=C\CC 6c8897552831f137e84ed17b901023a1 [1,0,0,0,0,0|0,0,3]=4 280 B10R0.71 CC#CCOCC/C=C\CC 808dd0f31617c96f61b90c4c3f9c935f [1,0,0,0,0,0|0,0,3]=4 281 B10R0.71 CC/C=C/CCOCCC#N f73f0b4079b08a2f55b9f71bc1349fc5 [1,0,0,0,0,0|1,0,2]=4 282 B10R0.71 CC/C=C/CCOCCC=O 6872b8e489d755d1798fb75aec622df4 [1,0,0,0,0,0|1,0,2]=4 283 B10R0.71 CC/C=C/CCOCCCC c8bbe4a116e9837c5acb0bd130d88747 [1,0,0,0,0,0|0,0,1]=2 284 B10R0.71 CC/C=C/CCOCCCF 88ecb959ca18d6af5da622832f1b87e9 [1,0,0,0,0,0|1,0,1]=3 285 B10R0.71 CC/C=C/CCOCCCS 2d2a5e2c573307f1405dd0f398018841 [1,0,0,0,0,0|1,0,1]=3 286 B10R0.71 CC/C=C/CCOCCOC 357931dbf492ba690ab5ab15f3f25efc [1,0,0,0,0,0|1,0,1]=3 287 B10R0.71 CC/C=C/CCOCCSC 27ca4bac73680406675dffc3e2b09158 [1,0,0,0,0,0|1,0,1]=3 288 B10R0.71 CC/C=C/CCOCOCC 5bbf3b2e62d730268265b4908a34cbee [1,0,0,0,0,0|1,0,1]=3 289 B10R0.71 CC/C=C/CNCCCCC 396ae7fd2aad2d3062225091f1ed8121 [1,0,0,0,0,0|2,0,1]=4 290 B10R0.71 CC/C=C/COC/C=C/CC 92878b2f196e753b5f98a0bdc3fcafb6 [1,0,0,0,0,0|2,0,1]=4 291 B10R0.71 CC/C=C/COCCCCC 4244476ee625bb91d4c75005fa57b26a [1,0,0,0,0,0|2,0,1]=4 292 B10R0.71 CC/C=C\CCCCOCC 6f672bd2ab358cb454803e83d5c0e284 [1,0,0,0,0,0|2,0,1]=4 293 B10R0.71 CC/C=C\CCCOCCC 7fa768d31f02c71335efb28537f1ed87 [1,0,0,0,0,0|2,0,0]=3 294 B10R0.71 CC/C=C\CCCOCCF 658a9ea094f43dddd25b292c6dad7039 [1,0,0,0,0,0|3,0,0]=4 295 B10R0.71 CC/C=C\CCCOCCS 1514e3b49942a76ee0a62089e52656bf [1,0,0,0,0,0|3,0,0]=4 296 B10R0.71 CC/C=C\CCCOCOC 91c800ab417e820667e507a61cd92b15 [1,0,0,0,0,0|3,0,0]=4 297 B10R0.71 CC/C=C\CCCOCSC 499c8ff2bc650384a31a8ed4ececed9a [1,0,0,0,0,0|3,0,0]=4 298 B10R0.71 CC/C=C\CCNCCCC c4f059f6ebacdc59905230714b6eff68 [1,0,0,0,0,0|1,0,1]=3 299 B10R0.71 CC/C=C\CCNCCCCl 51cddba674b0299a3a928cf64999c244 [1,0,0,0,0,0|2,0,1]=4 300 B10R0.71 CC/C=C\CCNCCCO 289e512a3da0d8201ff3b6a7f6c8a4e6 [1,0,0,0,0,0|2,0,1]=4 301 B10R0.71 CC/C=C\CCNCCOC 898274d4166e713a95b39d4ba4ddea68 [1,0,0,0,0,0|2,0,1]=4 302 B10R0.71 CC/C=C\CCNCCSC 15772fe2a7784e8cbd0582b1e3089109 [1,0,0,0,0,0|2,0,1]=4 303 B10R0.71 CC/C=C\CCOCCC#N c2387d7b7248947432ca79d467ca0131 [1,0,0,0,0,0|1,0,2]=4 304 B10R0.71 CC/C=C\CCOCCC=O d85d7dfe4e2e6e8d032a753a156249ad [1,0,0,0,0,0|1,0,2]=4 305 B10R0.71 CC/C=C\CCOCCCC 8e83903dc8b2dc055f80be84ab4a3d9c [1,0,0,0,0,0|0,0,1]=2 306 B10R0.71 CC/C=C\CCOCCCF 4430bc766f9eb0d9c26980dd0840755d [1,0,0,0,0,0|1,0,1]=3 307 B10R0.71 CC/C=C\CCOCCCS a1e1396ab724ae1f920f1f57a0489d4e [1,0,0,0,0,0|1,0,1]=3 308 B10R0.71 CC/C=C\CCOCCOC 1a6120bf2aea14ad94a33580626ee6c2 [1,0,0,0,0,0|1,0,1]=3 309 B10R0.71 CC/C=C\CCOCCSC 035739549145efd9748ebd13a7349bf7 [1,0,0,0,0,0|1,0,1]=3 310 B10R0.71 CC/C=C\CCOCOCC 0feba21b91979670cd9ecf6b8a0bbf3f [1,0,0,0,0,0|1,0,1]=3 311 B10R0.71 CC/C=C\COC/C=C/CC 3e9e707d6092368519a29ee0f99c7f32 [1,0,0,0,0,0|2,0,1]=4 312 B10R0.71 CC/C=C\COCCCCC 273210e5829d96509e829e222979bc8b [1,0,0,0,0,0|2,0,1]=4 313 B10R0.71 CC=C=CCCOCCCC 49a0b70400a78c3414989a3230bb7ded [1,0,0,0,0,0|0,0,3]=4 314 B10R0.71 CC=CC=CCOCCCC b2db690d4b1d749e1abe5e187adedbf9 [1,0,0,0,0,0|0,0,3]=4 315 B10R0.71 CC=CCCCOCCCC b937b4ad4c5d1a608e7129c714e871ac [1,0,0,0,0,0|0,0,3]=4 316 B10R0.71 CC=CCOCC/C=C\CC 75e1755252a27204ec39b2f227ebda40 [1,0,0,0,0,0|0,0,3]=4 317 B10R0.71 CCC#CCCOCCCC 164797f680cff0f6ad3f9b55f3918282 [1,0,0,0,0,0|0,0,3]=4 318 B10R0.71 CCC/C=C/CCCOCC 96c575cc0a2c58edec4b18e8b3051827 [1,0,0,0,0,0|2,0,1]=4 319 B10R0.71 CCC/C=C/COCCCC 5cb7fad967976b46414fd1e0981df754 [1,0,0,0,0,0|0,0,3]=4 320 B10R0.71 CCC/C=C\CCCOCC 1c8765980afe95de3eca026e03130832 [1,0,0,0,0,0|2,0,1]=4 321 B10R0.71 CCC/C=C\CCOCCC affe8f34b74549b94b8274cb3a319479 [1,0,0,0,0,0|2,0,1]=4 322 B10R0.71 CCC/C=C\COCCCC 12552b98ae2ab17ee7aaf14497e6f771 [1,0,0,0,0,0|0,0,3]=4 323 B10R0.71 CCCCCCOCCCC 938d0ec0b6adc0f1b39dbfc036e22e02 [1,0,0,0,0,0|0,0,3]=4 324 B10R0.71 CCCCOCCCNCC 010734c4fdc877ac094389f744441162 [1,0,0,0,0,0|1,0,2]=4 325 B10R0.71 CCCCOCCCOCC 1158a02552cfd2177bf76faa90c6df77 [1,0,0,0,0,0|1,0,2]=4 326 B10R0.71 CCCCOCCCSCC e04cab22dc6501876d38fc7fb5563829 [1,0,0,0,0,0|1,0,2]=4 327 B10R0.71 CCCCOCCNCCC c10c126aa77fae6dee2817c49229712d [1,0,0,0,0,0|1,0,2]=4 328 B10R0.71 CCCCOCCOCCC 62aa1933f9f6285673b3ff78d496fc74 [1,0,0,0,0,0|1,0,2]=4 329 B10R0.71 CCCCOCCSCCC dd7dd42c58efb56d123dfdb4ec52bdfa [1,0,0,0,0,0|1,0,2]=4 330 B10R0.74 C/C=C/COCOC(=O)CC 44774bc2aa28d40c9ad940049b670606 [1,0,0,0,0,0|1,0,2]=4 331 B10R0.74 C/C=C\COCOC(=O)CC 4d5736899cb6e7814d58b787b16199b3 [1,0,0,0,0,0|1,0,2]=4 332 B10R0.74 C=C(C=O)OCC/C=C\CC ae4d1d6b23b852d32ed8bb0e7baf4902 [1,0,0,0,0,0|2,0,1]=4 333 B10R0.74 C=C(CC)COC/C=C/CC 03d8ab80e9f13fad0cc493c078800673 [1,0,0,0,0,0|3,0,0]=4 334 B10R0.74 C=C(CC)COC/C=C\CC ed33ac598dd56362b1bc14da7c02baa7 [1,0,0,0,0,0|3,0,0]=4 335 B10R0.74 C=C/C=C/CCNC(=O)CC 0d0a7352fe1efcaf56b8333cad920213 [1,0,0,0,0,0|1,0,2]=4 336 B10R0.74 CC/C=C/CCOC(C)CC a24e2ee69d8f4fe32a082cd13a1d9a10 [1,0,0,0,0,0|1,0,1]=3 337 B10R0.74 CC/C=C/CNCC(=O)NC 63e4c7d7f9817e6f9f8b7dfc36081749 [1,0,0,0,0,0|3,0,0]=4 338 B10R0.74 CC/C=C/CNCC(=O)OC 19854a993a13e81af2b3e81b0a9b52b8 [1,0,0,0,0,0|3,0,0]=4 339 B10R0.74 CC/C=C/COCC(=O)CC a01b136a5ca1f88d863986a7bbd53488 [1,0,0,0,0,0|2,0,0]=3 340 B10R0.74 CC/C=C/COCC(=O)NC 62a1e2bf37767c32bd0352f84e8a2b81 [1,0,0,0,0,0|3,0,0]=4 341 B10R0.74 CC/C=C/COCC(=O)OC df91b6626dbab8528a78f4a8549ba0f2 [1,0,0,0,0,0|3,0,0]=4 342 B10R0.74 CC/C=C\CCNC(C)CC dd0e7056aa63fe87fcf1b78e07ce0032 [1,0,0,0,0,0|2,0,1]=4 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f592dee44c3d9467f9a4f9706840fcf0 [1,0,0,0,0,0|1,0,2]=4 355 B10R0.74 CC=CCOCOC(=O)CC 42fba2d6d607cbfc581faa03b79b9624 [1,0,0,0,0,0|1,0,2]=4 356 B10R0.74 CCC(=O)OCCOCCF 75e8b54fcf29a0e03136f1625a8b73df [1,0,0,0,0,0|2,0,1]=4 357 B10R0.74 CCC(=O)OCCOCCS ffcfb497b0e8e847d2aae5949bcc3b02 [1,0,0,0,0,0|2,0,1]=4 358 B10R0.74 CCC(=O)OCCOCOC b0cf2670be1c51cb7d28b494dab7a281 [1,0,0,0,0,0|2,0,1]=4 359 B10R0.74 CCC(=O)OCCOCSC 53ccdfd0347d71d18fb8deaa419fd0a6 [1,0,0,0,0,0|2,0,1]=4 360 B10R0.74 CCCCCCNC(=O)CC f0032df3cc8c2000bc1576b718e1412f [1,0,0,0,0,0|1,0,2]=4 361 B10R0.74 CCCCNCOC(=O)CC e0b802cea9bb962c4bfe33b428a79424 [1,0,0,0,0,0|1,0,2]=4 362 B10R0.74 CCCCOCOC(=O)CC 79f92447ebf68bdbe7c87af9f238ac09 [1,0,0,0,0,0|1,0,2]=4 363 B10R0.74 CCCNCCNC(=O)CC 654790e0c463f303ea5b5f1e104b3b23 [1,0,0,0,0,0|2,0,1]=4 364 B10R0.74 CCCOCCNC(=O)CC 37663f297721ace7d18f666f43feb975 [1,0,0,0,0,0|2,0,1]=4 365 B10R0.74 CCCOCCOC(=O)CC 0266b80a03c10e2cb61b113dd4b9130c [1,0,0,0,0,0|1,0,1]=3 366 B10R0.74 CCCOCCOC(=O)OC 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[0,1,0,0,0,0|0,0,2]=3 378 B12R0.1 C/C=C/CCOCOC(=O)OCC 6a3f3bf3cf8ee6b77ef0cf756289e562 [0,1,0,0,0,0|1,0,2]=4 379 B12R0.1 C/C=C/CCOCOC(=O)SCC 6cf314886c062ae01c07352b740decc2 [0,1,0,0,0,0|1,0,2]=4 380 B12R0.1 C/C=C/COCCOC(=O)CCC 489b53a355793d0d79dffa1cfb2fcc49 [0,1,0,0,0,0|0,0,2]=3 381 B12R0.1 C/C=C\CCCOCC(=O)CCC 490897e6d65ac08f044c38660527e24b [0,1,0,0,0,0|0,0,2]=3 382 B12R0.1 C/C=C\CCCOCC(=O)COC 1f2bf897e37e81c32296a73c9c8d1ef2 [0,1,0,0,0,0|1,0,2]=4 383 B12R0.1 C/C=C\CCCOCC(=O)NCC f53c5cfefc8bbe262d5e01ec3ac6c3f7 [0,1,0,0,0,0|1,0,2]=4 384 B12R0.1 C/C=C\CCCOCC(=O)OCC eb0201d9ba925f38c8b343eb0871d476 [0,1,0,0,0,0|1,0,2]=4 385 B12R0.1 C/C=C\COCCOC(=O)CCC e4085687d87d593233eefa43329df696 [0,1,0,0,0,0|0,0,2]=3 386 B12R0.1 C=C/C=C/CCNCC(=O)CCC e88b1fa3966ad888ad3c7d25c32170a8 [0,1,0,0,0,0|1,0,2]=4 387 B12R0.1 C=C=CCCOCOC(=O)CCC f86f71828c6f055ff87516fb09d25e49 [0,1,0,0,0,0|0,0,3]=4 388 B12R0.1 C=CCCOCCOC(=O)CCC e07adf6e05aeb395e256be8041b382d5 [0,1,0,0,0,0|1,0,2]=4 389 B12R0.1 C=COC(=O)COCC/C=C/CC e597e96197ba6e861d9c601fc2348494 [0,1,0,0,0,0|1,0,2]=4 390 B12R0.1 C=COC(=O)COCC/C=C\CC ceb7b0e74f39806cf1339f2769fa43b8 [0,1,0,0,0,0|1,0,2]=4 391 B12R0.1 CC#CCCCOCC(=O)CCC 6ad348d1ccbde0ec4aa3a553a98c28fd [0,1,0,0,0,0|0,0,3]=4 392 B12R0.1 CC#CCCOCOC(=O)CCC 5b2aba7fa9a760442bc76bf9fe1ad6d7 [0,1,0,0,0,0|0,0,3]=4 393 B12R0.1 CC/C=C/CCOCC(=O)CCC 41317b7200754cb3bcb4d021be103013 [0,1,0,0,0,0|0,0,0]=1 394 B12R0.1 CC/C=C/CCOCC(=O)COC d02dd1e21b81ffbdda1c92d77ff584a9 [0,1,0,0,0,0|1,0,0]=2 395 B12R0.1 CC/C=C/CCOCC(=O)NCC fe9581a6f67d6eb4392a489a78f70f45 [0,1,0,0,0,0|1,0,0]=2 396 B12R0.1 CC/C=C/CCOCC(=O)OCC 792c7b41cf5d663e26e699dcbebba13a [0,1,0,0,0,0|1,0,0]=2 397 B12R0.1 CC/C=C/CCOCC(C)CCC e77527eedeb493fdf856af5502965e55 [0,1,0,0,0,0|1,0,1]=3 398 B12R0.1 CC/C=C/CCOC[C@@H](O)CCO 9948dd4478cc90b390862874d8bbd99e [0,1,0,0,0,0|1,0,2]=4 399 B12R0.1 CC/C=C/CNCCC(=O)OCC c7080bc00fcfe06b560e898587910ed5 [0,1,0,0,0,0|2,0,0]=3 400 B12R0.1 CC/C=C/COCCC(=O)NCC 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[0,1,0,0,0,0|1,0,2]=4 412 B12R0.1 CC/C=C\CCOCC(=O)CCC e77a99429b63562e524ba646f33af3e8 [0,1,0,0,0,0|0,0,0]=1 413 B12R0.1 CC/C=C\CCOCC(=O)COC 87874e1cfd0a0a1629fe0b62f11113d1 [0,1,0,0,0,0|1,0,0]=2 414 B12R0.1 CC/C=C\CCOCC(=O)NCC 8be75100f209e13fc4cfab12ae8d3872 [0,1,0,0,0,0|1,0,0]=2 415 B12R0.1 CC/C=C\CCOCC(=O)OCC 58e8adf0bb2c35a15246ec12bfd9507a [0,1,0,0,0,0|1,0,0]=2 416 B12R0.1 CC/C=C\CCOCC(C)CCC 10f5057994ff4002418b173c9a8ffaba [0,1,0,0,0,0|1,0,1]=3 417 B12R0.1 CC/C=C\CCOCC(C)COC 1a3dc3f44a4b0438a18896bb02c14606 [0,1,0,0,0,0|2,0,1]=4 418 B12R0.1 CC/C=C\CCOCC(C)OCC 22abfcd68d8a7f4a1d66fc883c919d14 [0,1,0,0,0,0|2,0,1]=4 419 B12R0.1 CC/C=C\CCOC[C@@H](C)COC 8f49f7a7ab314e7de1187a8feda277b1 [0,1,0,0,0,0|2,0,1]=4 420 B12R0.1 CC/C=C\CCOC[C@@H](O)CCO b169ccbc48e91cfeed7bb53c821dc592 [0,1,0,0,0,0|1,0,2]=4 421 B12R0.1 CC/C=C\COCCC(=O)NCC 2e31696f5213c0c19d6a7cdfbec267b4 [0,1,0,0,0,0|2,0,0]=3 422 B12R0.1 CC/C=C\COCCC(=O)OCC 336493cc433f868a64b7741f09c7fb3a [0,1,0,0,0,0|2,0,0]=3 423 B12R0.1 CC/C=C\COCOC(=O)CCC 8985582aaa97e002718761b99bc8fde9 [0,1,0,0,0,0|0,0,0]=1 424 B12R0.1 CC/C=C\COCOC(=O)OCC 33322914ff9fb20c2a7a0ac5b896b61f [0,1,0,0,0,0|1,0,0]=2 425 B12R0.1 CC/C=C\COCOC(=O)SCC d10e8c1b956611bf8b7214c5d2e1589b [0,1,0,0,0,0|1,0,0]=2 426 B12R0.1 CC=C=CCCOCC(=O)CCC e89da325309b61da84be6e06938975eb [0,1,0,0,0,0|0,0,2]=3 427 B12R0.1 CC=C=CCCOCC(=O)COC b06e68f493c93ceec0e63dfe28c70c44 [0,1,0,0,0,0|1,0,2]=4 428 B12R0.1 CC=C=CCCOCC(=O)NCC 974e6a3d7b4eb2bc723643f43fdabf97 [0,1,0,0,0,0|1,0,2]=4 429 B12R0.1 CC=C=CCCOCC(=O)OCC 40c722469b7e76bf0040d9d315fe0b5d [0,1,0,0,0,0|1,0,2]=4 430 B12R0.1 CC=CC=CCOCC(=O)CCC bdeb092ed0032652ff25a68bd1f614df [0,1,0,0,0,0|0,0,2]=3 431 B12R0.1 CC=CC=CCOCC(=O)COC 7eb9acd5233d465548fc2c7ce84646a7 [0,1,0,0,0,0|1,0,2]=4 432 B12R0.1 CC=CC=CCOCC(=O)NCC 2a36554957268db0701f1a7625d3c581 [0,1,0,0,0,0|1,0,2]=4 433 B12R0.1 CC=CC=CCOCC(=O)OCC 11c9a31a28afce9881afd1ff414a1991 [0,1,0,0,0,0|1,0,2]=4 434 B12R0.1 CC=CCCCOCC(=O)CCC b53f64b2b3e1001e95f568392413defe [0,1,0,0,0,0|0,0,2]=3 435 B12R0.1 CC=CCCCOCC(=O)COC 5b9339fac39101012e488fd67f542ab9 [0,1,0,0,0,0|1,0,2]=4 436 B12R0.1 CC=CCCCOCC(=O)NCC b145ecd2a18da02365f56f3e91cb326c [0,1,0,0,0,0|1,0,2]=4 437 B12R0.1 CC=CCCCOCC(=O)OCC 11b776a15d039a208f4246f6e31ccce7 [0,1,0,0,0,0|1,0,2]=4 438 B12R0.1 CCC#CCCOCC(=O)CCC b8e82026e5f281b60fb1ada47f500d82 [0,1,0,0,0,0|0,0,2]=3 439 B12R0.1 CCC#CCCOCC(=O)COC 188beef50a2a998d166a934cde3ddcf1 [0,1,0,0,0,0|1,0,2]=4 440 B12R0.1 CCC#CCCOCC(=O)NCC 3a9369e3d772dfedcb5bd18e5858257b [0,1,0,0,0,0|1,0,2]=4 441 B12R0.1 CCC#CCCOCC(=O)OCC 04c2303e1ed0f5a83e456dce682b2300 [0,1,0,0,0,0|1,0,2]=4 442 B12R0.1 CCC#CCOCOC(=O)CCC b3153492de8edee6b06bc882e627c295 [0,1,0,0,0,0|0,0,2]=3 443 B12R0.1 CCC#CCOCOC(=O)OCC 82210f8b34bd14c25844531bd9267859 [0,1,0,0,0,0|1,0,2]=4 444 B12R0.1 CCC#CCOCOC(=O)SCC bbe4c23e8b2beccf87ec123d102d3e86 [0,1,0,0,0,0|1,0,2]=4 445 B12R0.1 CCC/C=C/CNCC(=O)NCC ca5b39c2ccd10ba73600371b8a5a074b [0,1,0,0,0,0|3,0,0]=4 446 B12R0.1 CCC/C=C/CNCC(=O)OCC 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[0,1,0,0,0,0|1,0,2]=4 458 B12R0.1 CCC/C=C\COCC(=O)OCC b1a83b13ff2ea69000dfc22eb839cd73 [0,1,0,0,0,0|1,0,2]=4 459 B12R0.1 CCCC#CCOCC(=O)CCC 46935f3e8b4b0bd447ef04b3d00d6c1c [0,1,0,0,0,0|0,0,3]=4 460 B12R0.1 CCCC(=O)CNCCCOCC cf9fcf9d37635fcff9d531b62f909ca2 [0,1,0,0,0,0|2,0,1]=4 461 B12R0.1 CCCC(=O)COCCCCOC ba578e6a6c514252c9ddc61095379cd7 [0,1,0,0,0,0|1,0,2]=4 462 B12R0.1 CCCC(=O)COCCCCSC 7cdb96ea504df8ebab63f1a358d2a542 [0,1,0,0,0,0|1,0,2]=4 463 B12R0.1 CCCC(=O)COCCCOCC fed4d5d75bd3f99aa8676ec331b92724 [0,1,0,0,0,0|1,0,1]=3 464 B12R0.1 CCCC(=O)COCCCSCC 7d5fb2730485240bea48d27b70716ac1 [0,1,0,0,0,0|1,0,1]=3 465 B12R0.1 CCCC(=O)COCCOCCF 5db5a8899a5055302e76b08bf72f90e8 [0,1,0,0,0,0|2,0,1]=4 466 B12R0.1 CCCC(=O)COCCOCCS af540a90369ab986f9f00af090297fb9 [0,1,0,0,0,0|2,0,1]=4 467 B12R0.1 CCCC(=O)NCCCCCCCl 1c91896f64aa2d0d92d37ed34cf47598 [0,1,0,0,0,0|1,0,2]=4 468 B12R0.1 CCCC(=O)NCCCCCCO 3f322a96f04942107c110bf9e36ea723 [0,1,0,0,0,0|1,0,2]=4 469 B12R0.1 CCCC(=O)NCCCCCOC 05f4c04e3929148dbca50f1f1838398c [0,1,0,0,0,0|1,0,2]=4 470 B12R0.1 CCCC(=O)NCCCCSCC b7f70012763e6c0b319abbde778d7457 [0,1,0,0,0,0|1,0,2]=4 471 B12R0.1 CCCC(=O)NCCCOCCO 5bb506f5db4b1882c3ac10dbcdc8aff7 [0,1,0,0,0,0|2,0,1]=4 472 B12R0.1 CCCC(=O)NCCOCCCO 3af441fc06faa0d53d071c15c3164d39 [0,1,0,0,0,0|2,0,1]=4 473 B12R0.1 CCCC(=O)NCCOCCOC 5f7704d0802a7a8cb7e0d0d4d8be69e8 [0,1,0,0,0,0|2,0,1]=4 474 B12R0.1 CCCC(=O)NCCSSCCO 6e75bd79070f0c3933407ff94e1fde69 [0,1,0,0,0,0|3,0,0]=4 475 B12R0.1 CCCC(=O)OCCCCOCC 2c559d0f20616de60b366d3636c891e2 [0,1,0,0,0,0|0,0,2]=3 476 B12R0.1 CCCC(=O)OCCCCOCF ba1d1216c8e2a634db89324c3f5866c5 [0,1,0,0,0,0|1,0,2]=4 477 B12R0.1 CCCC(=O)OCCOC/C=C/Cl 45cf43878581c7b0bd7ce79e9b1c850a [0,1,0,0,0,0|1,0,2]=4 478 B12R0.1 CCCC(=O)OCCOC/C=C\Cl b9deb4a5c08918199b340bc26e9e145e [0,1,0,0,0,0|1,0,2]=4 479 B12R0.1 CCCC(=O)OCCOCCC#N 0ca6ca8589edb51249fcae1685013b37 [0,1,0,0,0,0|1,0,2]=4 480 B12R0.1 CCCC(=O)OCCOCCC=O 4e0f80cfc42e75ba09c89a67dc6fa030 [0,1,0,0,0,0|1,0,2]=4 481 B12R0.1 CCCC(=O)OCCOCCCF b234e34ea43dd52044f3e1251ff8ac02 [0,1,0,0,0,0|1,0,1]=3 482 B12R0.1 CCCC(=O)OCCOCCCS 04d3a0aeae05f6491c18579c7e9e21af [0,1,0,0,0,0|1,0,1]=3 483 B12R0.1 CCCC(=O)OCCOCCOC ed0f9ea1316dd5a6071787d5822de049 [0,1,0,0,0,0|1,0,1]=3 484 B12R0.1 CCCC(=O)OCCOCCSC 4a6acaebcc214d4229ad3c80859f336a [0,1,0,0,0,0|1,0,1]=3 485 B12R0.1 CCCC(=O)OCCOCOCC 6d5ef10d715929e1d29eb564ac7bfec7 [0,1,0,0,0,0|1,0,1]=3 486 B12R0.1 CCCC(=O)OCNCC#CCO 1021b0021ff8e347aab7567f5034bcb9 [0,1,0,0,0,0|1,0,2]=4 487 B12R0.1 CCCC(=O)OCNCCCCCl aa9ead31f07eeee6fd68c65b495cfa9f [0,1,0,0,0,0|1,0,2]=4 488 B12R0.1 CCCC(=O)OCNCCCCO ff5940adb29bb9f09119af6d66f97f56 [0,1,0,0,0,0|1,0,2]=4 489 B12R0.1 CCCC(=O)OCNCCCCS 238b95922285eb39ae28dbf210e5932e [0,1,0,0,0,0|1,0,2]=4 490 B12R0.1 CCCC(=O)OCNCCCOC 2956cc7073ac5805bc005d551df2955c [0,1,0,0,0,0|1,0,2]=4 491 B12R0.1 CCCC(=O)OCNCCCSC 02825bf5fdb94d427a5e04111fd5df06 [0,1,0,0,0,0|1,0,2]=4 492 B12R0.1 CCCC(=O)OCNCCOCC 89f3295ebb00b983d049eae60baeadd5 [0,1,0,0,0,0|1,0,1]=3 493 B12R0.1 CCCC(=O)OCNCCSCC 1e62dfacf098199f0b5d9063d90e4ff7 [0,1,0,0,0,0|1,0,1]=3 494 B12R0.1 CCCC(=O)OCOC/C=C/C=O 4e99e5c1f3bb2924f6a31774c83377d0 [0,1,0,0,0,0|1,0,1]=3 495 B12R0.1 CCCC(=O)OCOCCCCF 7a9d78108ec0877ad517585baf1f787b [0,1,0,0,0,0|1,0,2]=4 496 B12R0.1 CCCC(=O)OCOCCCCS ae30088fd203344a6f1bf8c3b305686f [0,1,0,0,0,0|1,0,2]=4 497 B12R0.1 CCCC(=O)OCOCCCOC 6accb2058ae2c95d4c416551df064f0a [0,1,0,0,0,0|1,0,2]=4 498 B12R0.1 CCCC(=O)OCOCCCSC 46a1d71fbb47e55a6a2e25c02b5c4d3e [0,1,0,0,0,0|1,0,2]=4 499 B12R0.1 CCCC(=O)OCOCCOCC b9cc1da9cee06bcdfbccb19868b99cce [0,1,0,0,0,0|1,0,1]=3 500 B12R0.1 CCCC(=O)OCOCCSCC e43e69fe0963c529ab4e3450c77fc2f5 [0,1,0,0,0,0|1,0,1]=3 501 B12R0.1 CCCC(=S)OCCCCCCF 26a5b5e2ad767fb2f8b89578f5bd2d90 [0,1,0,0,0,0|0,1,2]=4 502 B12R0.1 CCCC(=S)OCCCCCOC 15f328b4ee1d340085dd8b9b78b3c088 [0,1,0,0,0,0|0,1,2]=4 503 B12R0.1 CCCC(=S)OCCOCCOC e6b3216fe437f9e658659ad4f6fe0540 [0,1,0,0,0,0|1,1,1]=4 504 B12R0.1 CCCC/C=C/COC(=S)CCC f3f857e788666a30eb5b7320f847bf03 [0,1,0,0,0,0|0,1,2]=4 505 B12R0.1 CCCC/C=C\COC(=S)CCC c6831eac0eb458cfd458e6b316b26a18 [0,1,0,0,0,0|0,1,2]=4 506 B12R0.1 CCCCCCCNC(=O)CCC cc2f9bb62ae47c3d56fe2447919a6820 [0,1,0,0,0,0|1,0,2]=4 507 B12R0.1 CCCCCCCOC(=S)CCC 17e54af622772a12df7cd6ce21f2e4c6 [0,1,0,0,0,0|0,1,2]=4 508 B12R0.1 CCCCCCNCC(=O)CCC f47dda3d1f83759950f26c4f3e9b6cda [0,1,0,0,0,0|1,0,2]=4 509 B12R0.1 CCCCCCOCC(=O)CCC a26767bbedda544e6a69ee985b0c3dee [0,1,0,0,0,0|0,0,2]=3 510 B12R0.1 CCCCCCOCC(=O)COC e8fe61cc4918a2434916dd7e928678a8 [0,1,0,0,0,0|1,0,2]=4 511 B12R0.1 CCCCCCOCC(=O)NCC b3fb8ad45dd10df9af353f6793a9e4c8 [0,1,0,0,0,0|1,0,2]=4 512 B12R0.1 CCCCCCOCC(=O)OCC bbe6630c73c21fc02210547f28d8da58 [0,1,0,0,0,0|1,0,2]=4 513 B12R0.1 CCCCCNCOC(=O)CCC 9334475517dd42d0f2b4beac50644a12 [0,1,0,0,0,0|0,0,2]=3 514 B12R0.1 CCCCCNCOC(=O)OCC 68c2ca21685c705ec33c7083f32cd13e [0,1,0,0,0,0|1,0,2]=4 515 B12R0.1 CCCCCNCOC(=O)SCC 05c12a560a25fd0b874a1c3ebf0724db [0,1,0,0,0,0|1,0,2]=4 516 B12R0.1 CCCCCOCOC(=O)CCC f17ce93b5ea3cb9a96eaeded1be5f6c2 [0,1,0,0,0,0|0,0,2]=3 517 B12R0.1 CCCCCOCOC(=O)OCC 69d9cd494ae71bfbe851f78311fd2ef7 [0,1,0,0,0,0|1,0,2]=4 518 B12R0.1 CCCCCOCOC(=O)SCC ed6d123eb2b3fb5535f55c0e9e05498f [0,1,0,0,0,0|1,0,2]=4 519 B12R0.1 CCCCOCCNC(=O)CCC 03e9fca15998d25ee309292e7b99fbef [0,1,0,0,0,0|1,0,2]=4 520 B12R0.1 CCCCOCCOC(=O)CCC ec841e2f1f3644fc6b2f71dcf7762c2f [0,1,0,0,0,0|0,0,2]=3 521 B12R0.1 CCCCOCCOC(=S)CCC 009849dcaf535ca43f0e822d9d8627b7 [0,1,0,0,0,0|0,1,2]=4 522 B12R0.1 CCCOCCCNC(=O)CCC 1e4c263021769b0809a50dbe037e3af0 [0,1,0,0,0,0|1,0,2]=4 523 B12R0.1 CCCOCCCOC(=S)CCC 7bfaad3d7e43e461e37370bb2faa5c28 [0,1,0,0,0,0|0,1,2]=4 524 B12R0.1 CCCOCCNCC(=O)CCC 7ab7539aa342766ce6ea51f6743cf512 [0,1,0,0,0,0|2,0,1]=4 525 B12R0.1 CCCOCCOCC(=O)CCC 8d1b44f9c949b638e8f1b95510f109d5 [0,1,0,0,0,0|1,0,1]=3 526 B12R0.1 CCCOCCOCC(=O)COC 8aa1a8445662292885a5e7701f1c8aaa [0,1,0,0,0,0|2,0,1]=4 527 B12R0.1 CCCOCCOCC(=O)NCC 7cbce38fa9146ad332aa7f526271eb12 [0,1,0,0,0,0|2,0,1]=4 528 B12R0.1 CCCOCCOCC(=O)OCC e956761b010e3123844814131e112ba1 [0,1,0,0,0,0|2,0,1]=4 529 B12R0.1 CCCSCCOCC(=O)CCC 4b4ffe88268892e120ab14ac3bb5a682 [0,1,0,0,0,0|1,0,1]=3 530 B12R0.1 CCCSCCOCC(=O)COC 7c182db9c19d397159abdbf53a9a3da7 [0,1,0,0,0,0|2,0,1]=4 531 B12R0.1 CCCSCCOCC(=O)NCC 5e796b86b04124487836ef1505c77cbd [0,1,0,0,0,0|2,0,1]=4 532 B12R0.1 CCCSCCOCC(=O)OCC 7dc809704e5077e6bd03885f18e6a5e7 [0,1,0,0,0,0|2,0,1]=4 533 B12R0.1 CCNC(=O)COCCCOCC d4a864bc2c0489bc98237b5e00175671 [0,1,0,0,0,0|2,0,1]=4 534 B12R0.1 CCNC(=O)COCCCSCC 5eb2127228c39061dbfe765affd1a332 [0,1,0,0,0,0|2,0,1]=4 535 B12R0.1 CCOC(=O)COCCCSCC b54712bbae2dd3901cfa3d61585de9c0 [0,1,0,0,0,0|2,0,1]=4 536 B12R0.1 CCOC(=O)OCNCCSCC 0e25cbb7ba09485f8607863c2ed9a533 [0,1,0,0,0,0|2,0,1]=4 537 B12R0.1 CCOC(=O)OCOC/C=C/C=O c1d1e1e76cbd029008dc5ce56f7d3324 [0,1,0,0,0,0|2,0,1]=4 538 B12R0.1 CCOC(=O)OCOCCSCC 9a2c5ce33259a8b325641623c4a4a34b [0,1,0,0,0,0|2,0,1]=4 539 B12R0.1 CCOCCCOCC(=O)COC 47bc5ccd3420fa54e86f9cd5fd1e695c [0,1,0,0,0,0|2,0,1]=4 540 B12R0.1 CCOCCCOCC(=O)OCC 5076ceeeee32075b701b383adc26b88e [0,1,0,0,0,0|2,0,1]=4 541 B12R0.1 CCOCCNCOC(=O)OCC ed49ebd14f923e39bb45a52e1425391e [0,1,0,0,0,0|2,0,1]=4 542 B12R0.1 CCOCCNCOC(=O)SCC bf0116d7d2696d3590ab54a4ba4fc9ed [0,1,0,0,0,0|2,0,1]=4 543 B12R0.1 CCOCCOCOC(=O)OCC 3c3895f7c997d4feef6685eda3cec1af [0,1,0,0,0,0|2,0,1]=4 544 B12R0.1 CCOCCOCOC(=O)SCC 2cabfe740a4d08dba824eb271bf72792 [0,1,0,0,0,0|2,0,1]=4 545 B12R0.1 CCSC(=O)OCOC/C=C/C=O 779539bb586180ff3afa5638abae963b [0,1,0,0,0,0|2,0,1]=4 546 B12R0.1 CCSCCCOCC(=O)COC 4f37cacebc21a84fe13b7ef6a88f0a6c [0,1,0,0,0,0|2,0,1]=4 547 B12R0.1 CCSCCNCOC(=O)SCC e4141b52a27a8eb556bb15cf0df00898 [0,1,0,0,0,0|2,0,1]=4 548 B12R0.1 CCSCCOCOC(=O)SCC 9a9e6b7a9f743ce8cf9682c020ad08a2 [0,1,0,0,0,0|2,0,1]=4 549 B12R0.4 C/C=C/COCOC(=O)CC(C)C 4c03486153462dffbbd4d434a96a18c7 [0,1,0,0,0,0|1,0,2]=4 550 B12R0.4 C/C=C\COCOC(=O)CC(C)C f6a86e26a5457dac9ea17b381133a13a [0,1,0,0,0,0|1,0,2]=4 551 B12R0.4 C=C/C=C/CCNC(=O)CC(C)C 33ba94c185268eb2cdf507e959ac6dbf [0,1,0,0,0,0|1,0,2]=4 552 B12R0.4 C=C/C=C/CCNC(=O)CC(C)O 03269c4eb3afb70a4fd3107c3f69019b [0,1,0,0,0,0|1,0,2]=4 553 B12R0.4 C=C/C=C/CCNC(=O)C[C@@H](C)O 52676f921360695aa88a2de3ef0f8c85 [0,1,0,0,0,0|1,0,2]=4 554 B12R0.4 C=C/C=C/CCNC(=O)C[C@H](C)O 84f17d1e49db425e33358ad92a6844d8 [0,1,0,0,0,0|1,0,2]=4 555 B12R0.4 CC/C=C/CCOC(C)CC(C)C 3022b59da2b1bc542c311e3f2679121f [0,1,0,0,0,0|1,0,1]=3 556 B12R0.4 CC/C=C/CNCC(=O)NC(C)C bd0b523040a886e4f9aa570cdfcdf741 [0,1,0,0,0,0|3,0,0]=4 557 B12R0.4 CC/C=C/COCC(=O)CC(C)C ea0d9305b3a45f1d1f0f4bf2f33a3be5 [0,1,0,0,0,0|2,0,0]=3 558 B12R0.4 CC/C=C/COCC(=O)NC(C)C cafb84523768f2dbf77c41e7b3322ca3 [0,1,0,0,0,0|3,0,0]=4 559 B12R0.4 CC/C=C/COCC(=O)OC(C)C fbeaf085116023d33bc0ae2072f13cdd [0,1,0,0,0,0|3,0,0]=4 560 B12R0.4 CC/C=C\CCNC(C)CC(C)C 32926a65f1d844fd933eba76fd943220 [0,1,0,0,0,0|2,0,1]=4 561 B12R0.4 CC/C=C\CCNC(C)CC(C)O 498441db2926777833734dc45ea92ba1 [0,1,0,0,0,0|2,0,1]=4 562 B12R0.4 CC/C=C\CCOC(C)CC(C)C 6f57319143676b6db8616e2222a1c270 [0,1,0,0,0,0|1,0,1]=3 563 B12R0.4 CC/C=C\CCOC(C)CN(C)C d677a1ce02cc8acd703947ea3b659105 [0,1,0,0,0,0|2,0,1]=4 564 B12R0.4 CC/C=C\CCO[C@@H](C)CC(C)C 7556695f0700b5319536d9c38bb3d3f7 [0,1,0,0,0,0|1,0,1]=3 565 B12R0.4 CC/C=C\CCO[C@@H](C)CN(C)C b72a2352d33ea02838c38f1f4a98fca8 [0,1,0,0,0,0|2,0,1]=4 566 B12R0.4 CC/C=C\CCO[C@H](C)CC(C)C 9eb1724e32c16293c887d5c434b95bc6 [0,1,0,0,0,0|1,0,1]=3 567 B12R0.4 CC/C=C\CCO[C@H](C)CN(C)C be889910d05abdc1ff14c1e5761bce30 [0,1,0,0,0,0|2,0,1]=4 568 B12R0.4 CC/C=C\COCC(=O)CC(C)C c7a68c976505b0ee4502e0173c895200 [0,1,0,0,0,0|2,0,0]=3 569 B12R0.4 CC/C=C\COCC(=O)NC(C)C 53ffd229f0017d970e7994f2a0c9b150 [0,1,0,0,0,0|3,0,0]=4 570 B12R0.4 CC/C=C\COCC(=O)OC(C)C ce073b6ca3ecc520f888b358f984c2b2 [0,1,0,0,0,0|3,0,0]=4 571 B12R0.4 CC=CCNCOC(=O)CC(C)C 928807b26f693dd7577da6887d8ce561 [0,1,0,0,0,0|1,0,2]=4 572 B12R0.4 CC=CCOCOC(=O)CC(C)C d5d4427477254d95cfcd3b9665b5a0d6 [0,1,0,0,0,0|1,0,2]=4 573 B12R0.4 CCCCCCNC(=O)CC(C)C e2d134362e4b3b169a1a366090e8721d [0,1,0,0,0,0|1,0,2]=4 574 B12R0.4 CCCCCCNC(=O)CC(C)O 32b3b559c8d90ec3b5ebd997d1c19579 [0,1,0,0,0,0|1,0,2]=4 575 B12R0.4 CCCCCCNC(=O)C[C@@H](C)O d720b44ab195250c4b816c2522179c13 [0,1,0,0,0,0|1,0,2]=4 576 B12R0.4 CCCCCCNC(=O)C[C@H](C)O 5de5d081808d5a3720bc88cf4dabcf1f [0,1,0,0,0,0|1,0,2]=4 577 B12R0.4 CCCCNCOC(=O)CC(C)C 2497fa83e769dfcbf16764adc038e036 [0,1,0,0,0,0|1,0,2]=4 578 B12R0.4 CCCCOCOC(=O)CC(C)C 370e54c1f068cc289efc426b3fe9abc5 [0,1,0,0,0,0|1,0,2]=4 579 B12R0.4 CCCNCCOC(=O)CC(=O)C 2fa44300c32d87a5742905fca3a3dc19 [0,1,0,0,0,0|1,0,2]=4 580 B12R0.4 CCCOCCNC(=O)CC(C)C 6b53d9e0ca955a59dff45695bfcfa823 [0,1,0,0,0,0|2,0,1]=4 581 B12R0.4 CCCOCCNC(=O)CC(C)O 23d34135ec4d4cb31bba7003e2c43dbb [0,1,0,0,0,0|2,0,1]=4 582 B12R0.4 CCCOCCNC(=O)C[C@@H](C)O 30dc87323f04980da15514af4c3d8b32 [0,1,0,0,0,0|2,0,1]=4 583 B12R0.4 CCCOCCNC(=O)C[C@H](C)O c26d75d5a4601257914dffef431078df [0,1,0,0,0,0|2,0,1]=4 584 B12R0.4 CCCOCCOC(=O)CC(=O)C 2d92124473a605775e5060a69a70fc03 [0,1,0,0,0,0|1,0,2]=4 585 B12R0.4 CCOCCCNC(=O)CC(C)C 818ebf8f2fed2c7892fa98e71f4d7619 [0,1,0,0,0,0|2,0,1]=4 586 B12R0.4 CCOCCCNC(=O)CC(C)O 7e0c7d8a45075de3cf854be15f71c82e [0,1,0,0,0,0|2,0,1]=4 587 B12R0.4 CCOCCCNC(=O)C[C@@H](C)O abf3ec743e44271d3fb671b46cc7fd3e [0,1,0,0,0,0|2,0,1]=4 588 B12R0.4 CCOCCCNC(=O)C[C@H](C)O 0402fae037cbc8e82e87dc84f13d6757 [0,1,0,0,0,0|2,0,1]=4 589 B12R0.49 C=C/C=C/CCNC(=O)C(O)CC 12f5e362bacbbfd3dbc3ccbeec686996 [0,1,0,0,0,0|1,0,2]=4 590 B12R0.49 C=C/C=C/CCNC(=O)[C@@H](O)CC a4359dedcc1c32090738e9c896d5f701 [0,1,0,0,0,0|1,0,2]=4 591 B12R0.49 C=C/C=C/CCNC(=O)[C@@H](S)CC 78ac453ef858881579d9251e2a4f98b6 [0,1,0,0,0,0|1,0,2]=4 592 B12R0.49 C=C/C=C/CCNC(=O)[C@H](O)CC a57bd3f9f091cf957b62c44a862a1096 [0,1,0,0,0,0|1,0,2]=4 593 B12R0.49 CC/C=C/CCOC(C)C(=O)CC bd776e7972b328244dc2a41afd36b71c [0,1,0,0,0,0|1,0,2]=4 594 B12R0.49 CC/C=C/CNCC(=O)N(C)CC c2dfb0a4ade6c215ec95c0344e220e67 [0,1,0,0,0,0|3,0,0]=4 595 B12R0.49 CC/C=C/COCC(=O)C(C)CC 8c54d1f6fd0e669b4317afe0560e7a89 [0,1,0,0,0,0|2,0,0]=3 596 B12R0.49 CC/C=C/COCC(=O)N(C)CC e8f73cf036ef0a8f675b5e91f96857a9 [0,1,0,0,0,0|3,0,0]=4 597 B12R0.49 CC/C=C\CCNC(C)C(C)CC 97c4406e33bae7b6c8ddaf40c8614cc7 [0,1,0,0,0,0|2,0,1]=4 598 B12R0.49 CC/C=C\CCOC(C)C(=O)CC 1805d488af564027019114240f2ce542 [0,1,0,0,0,0|1,0,2]=4 599 B12R0.49 CC/C=C\CCOC(C)C(C)CC f98fb203244e837a33b89039158f6a4a [0,1,0,0,0,0|1,0,1]=3 600 B12R0.49 CC/C=C\CCOC(C)C(C)OC 233032448cb4bbe953ef17f9920284a9 [0,1,0,0,0,0|2,0,1]=4 601 B12R0.49 CC/C=C\COCC(=O)C(C)CC 0d6005c9323435f280a912ffed36d843 [0,1,0,0,0,0|2,0,0]=3 602 B12R0.49 CC/C=C\COCC(=O)N(C)CC e8ab28a425aedd3ed2471c3adcde4604 [0,1,0,0,0,0|3,0,0]=4 603 B12R0.49 CCCCCCNC(=O)C(O)CC 2dfea7a29e1f1e17066b0443b9b3b5d1 [0,1,0,0,0,0|1,0,2]=4 604 B12R0.49 CCCCCCNC(=O)[C@@H](O)CC ef709ce52ace53a564fc6f54c3771e3a [0,1,0,0,0,0|1,0,2]=4 605 B12R0.49 CCCCCCNC(=O)[C@@H](S)CC 68fcc5e375da4a1f458720ad00f998ff [0,1,0,0,0,0|1,0,2]=4 606 B12R0.49 CCCCCCNC(=O)[C@H](O)CC 1101341d39415ea85dd3b3c27fdee73b [0,1,0,0,0,0|1,0,2]=4 607 B12R0.49 CCCOCCNC(=O)C(O)CC 89e8baa7e85ca1a249ed5c1a95844311 [0,1,0,0,0,0|2,0,1]=4 608 B12R0.49 CCCOCCNC(=O)[C@@H](O)CC 84d3d59f9ec1a97253495961fe599948 [0,1,0,0,0,0|2,0,1]=4 609 B12R0.49 CCCOCCNC(=O)[C@@H](S)CC d6ca6047a38925641dd42efcb05e3d48 [0,1,0,0,0,0|2,0,1]=4 610 B12R0.49 CCCOCCNC(=O)[C@H](O)CC 79380398f36c905b8b1ade02a1071a51 [0,1,0,0,0,0|2,0,1]=4 611 B12R0.49 CCOCCCNC(=O)C(O)CC 167747e8c6410e958f142b0e256ba04a [0,1,0,0,0,0|2,0,1]=4 612 B12R0.49 CCOCCCNC(=O)[C@@H](O)CC b0dc51477be07cc202403603aa0a8dfa [0,1,0,0,0,0|2,0,1]=4 613 B12R0.49 CCOCCCNC(=O)[C@@H](S)CC 26bd658e323fe7dc638a013cca003f81 [0,1,0,0,0,0|2,0,1]=4 614 B12R0.49 CCOCCCNC(=O)[C@H](O)CC c5a6b9675fe01735a284b80800911ece [0,1,0,0,0,0|2,0,1]=4 615 B12R0.101 CCCC(=O)NCC(O)COCC 1b42f124a08f92a2c428ba307c7eb679 [0,1,0,0,0,0|2,0,1]=4 616 B12R0.101 CCCCC(O)CNC(=O)CCC c20e00c1f46f1480bcaaae25aa1b5e2b [0,1,0,0,0,0|1,0,2]=4 617 B12R0.101 CCCCN(C)COC(=O)CCC 0460f4ae494da9dca9fc21dc9436b249 [0,1,0,0,0,0|1,0,2]=4 618 B12R0.114 CC/C=C/CN[C@@H](C)C(=O)NCC 39754b4a14af569b6f35da4a2459aaed [0,1,0,0,0,0|3,0,0]=4 619 B12R0.114 CC/C=C/CN[C@H](C)C(=O)OCC b3e5591ca458497461557e786d7835cc [0,1,0,0,0,0|3,0,0]=4 620 B12R0.114 CC/C=C/COC(C)C(=O)NCC 6868db27689000425adc5813e765fcbd [0,1,0,0,0,0|3,0,0]=4 621 B12R0.114 CC/C=C/COC(C)C(=O)OCC f2cea9971444dbcffed0c2feb288e262 [0,1,0,0,0,0|3,0,0]=4 622 B12R0.114 CC/C=C/COC(F)C(=O)OCC 27b6cef80ab9f902e5ce534e316f461e [0,1,0,0,0,0|3,0,0]=4 623 B12R0.114 CC/C=C/CO[C@@H](C)C(=O)OCC 36449a9ff657caa97446b20039345a40 [0,1,0,0,0,0|3,0,0]=4 624 B12R0.114 CC/C=C/CO[C@H](C)C(=O)OCC 63c660edec86631b3ef8b3102d12021d [0,1,0,0,0,0|3,0,0]=4 625 B12R0.114 CC/C=C\COC(C)C(=O)NCC 604fcbfc25593e4f1ce0b3c6b40d72d4 [0,1,0,0,0,0|3,0,0]=4 626 B12R0.114 CC/C=C\COC(C)C(=O)OCC fd865918001f654f9e23fefefb163d40 [0,1,0,0,0,0|3,0,0]=4 627 B12R0.114 CC/C=C\COC(F)C(=O)OCC 5ef91f001e8f47c71a3f4d195dd315a5 [0,1,0,0,0,0|3,0,0]=4 628 B12R0.114 CC/C=C\CO[C@@H](C)C(=O)OCC e9172c691cd549b87f1b4ba422e4f43f [0,1,0,0,0,0|3,0,0]=4 629 B12R0.114 CC/C=C\CO[C@H](C)C(=O)OCC c2cae9bbaf303a255a18189fd31454f6 [0,1,0,0,0,0|3,0,0]=4 630 B12R0.114 CCCCCCN(C)C(=O)CCC 82617a20b6b1ff5cb831b764a82a5141 [0,1,0,0,0,0|1,0,2]=4 631 B12R0.121 C#CC(CCC)OCC/C=C\CC 6fb81431bbe18bb3a954e46c10bc3207 [0,1,0,0,0,0|1,0,1]=3 632 B12R0.121 C=CC(CCC)OCC/C=C\CC 81a74bc5953d7b5aecbd48b4bf31c3a5 [0,1,0,0,0,0|1,0,1]=3 633 B12R0.121 CC/C=C/CCOC(CC)CCC f09dee902ede92d129ddbdd0ae46da04 [0,1,0,0,0,0|1,0,1]=3 634 B12R0.121 CC/C=C/CCO[C@@H](CO)CCO c7cc88c31b8b7f7761a6570d12edf3c9 [0,1,0,0,0,0|1,0,2]=4 635 B12R0.121 CC/C=C\CCNC(CO)CCC 1e018d77ec9aa216be352e6745154c19 [0,1,0,0,0,0|1,0,2]=4 636 B12R0.121 CC/C=C\CCN[C@@H](CO)CCC 2c2c81ff87751e20101f4de0c4932592 [0,1,0,0,0,0|1,0,2]=4 637 B12R0.121 CC/C=C\CCN[C@H](CO)CCC 657e3bd7c352570b822a8d4572217fb7 [0,1,0,0,0,0|1,0,2]=4 638 B12R0.121 CC/C=C\CCOC(C#N)CCC 90a3736d6c86bcd925ab6c63febbf788 [0,1,0,0,0,0|1,0,1]=3 639 B12R0.121 CC/C=C\CCOC(CBr)CCBr 0984e4cf76a53226c5dfdfd828660e11 [0,1,0,0,0,0|2,0,1]=4 640 B12R0.121 CC/C=C\CCOC(CC)CCC bfef214d76a461052dd4e43a4f1b7470 [0,1,0,0,0,0|1,0,1]=3 641 B12R0.121 CC/C=C\CCOC(CC)COC d2a521c9052865fffde110eea47d077d [0,1,0,0,0,0|2,0,1]=4 642 B12R0.121 CC/C=C\CCOC(CC)CSC abc763f52b05d96a26cb1e605dcf57f8 [0,1,0,0,0,0|2,0,1]=4 643 B12R0.121 CC/C=C\CCOC(CCl)CCCl 033b8d259cb5e5f678cecb8ef646e3cb [0,1,0,0,0,0|2,0,1]=4 644 B12R0.121 CC/C=C\CCO[C@@H](CO)CCO 88c06bdfc12fed330dc18a101b81d323 [0,1,0,0,0,0|1,0,2]=4 645 B12R0.121 CC/C=C\CCO[C@H](CC)CCC 99b179ef0a3511a83c0a41c9ef8d9740 [0,1,0,0,0,0|1,0,1]=3 646 B12R0.206 C/C=C/COCOC(=O)CCCC d4041b9d4d7a72bae843be4c9919916d [0,1,0,0,0,0|1,0,2]=4 647 B12R0.206 C/C=C/COCOC(=O)OCCC 93ae5696d43baa24e28e2d5ee07a8532 [0,1,0,0,0,0|1,0,2]=4 648 B12R0.206 C/C=C\COCOC(=O)CCCC ce94c554d58b61f248a031f235ebd0c8 [0,1,0,0,0,0|1,0,2]=4 649 B12R0.206 C/C=C\COCOC(=O)OCCC ae467fad0e8acd69276c93c11b93d991 [0,1,0,0,0,0|1,0,2]=4 650 B12R0.206 C=C/C=C/CCNC(=O)CCCC 69fb512a879b1e5bf69150f2d059e4bb [0,1,0,0,0,0|1,0,2]=4 651 B12R0.206 C=C/C=C/CCNC(=O)CCCF e6ceb6fa4d414786399efee3095c9274 [0,1,0,0,0,0|1,0,2]=4 652 B12R0.206 C=C/C=C/CCNC(=O)CCCS 3519ad6aad48eb098b5a32d850bf98dd [0,1,0,0,0,0|1,0,2]=4 653 B12R0.206 C=C/C=C/CCNC(=O)CCOC 5e123dc39c65f7fedb51a31965174087 [0,1,0,0,0,0|1,0,2]=4 654 B12R0.206 C=C/C=C/CCNC(=O)CCSC 052fb5b42f5bb01f454ee5da18954828 [0,1,0,0,0,0|1,0,2]=4 655 B12R0.206 C=C/C=C/CCNC(=O)COCC a40659feba7ba266d8bbfec8c5fce395 [0,1,0,0,0,0|1,0,2]=4 656 B12R0.206 C=C/C=C/CCNC(=O)CSCC 4a65538eed95d118cd2421a14204b657 [0,1,0,0,0,0|1,0,2]=4 657 B12R0.206 C=C/C=C/CCNC(=O)NCCC 51afec64967172fa1fe42e74933f3e3c [0,1,0,0,0,0|1,0,2]=4 658 B12R0.206 C=CCCC(C)OCC/C=C/CC 359635063a8bc773489c6ed7445c5e32 [0,1,0,0,0,0|1,0,2]=4 659 B12R0.206 C=CCCC(C)OCC/C=C\CC cb7ff1a3ed89abcef0ed90ada0129139 [0,1,0,0,0,0|1,0,2]=4 660 B12R0.206 C=CCC[C@@H](C)OCC/C=C\CC cd0342dee14628ebe56f736747b13465 [0,1,0,0,0,0|1,0,2]=4 661 B12R0.206 CC/C=C/CCOC(C)CCC#N 33be6bb80509859fb7d17ab87750d202 [0,1,0,0,0,0|1,0,2]=4 662 B12R0.206 CC/C=C/CCOC(C)CCCC e88db4de158c05cd7d055f606f6e9bde [0,1,0,0,0,0|1,0,1]=3 663 B12R0.206 CC/C=C/CNCC(=O)NCCC bf70af709524f032c63aebd06cb8d204 [0,1,0,0,0,0|2,0,0]=3 664 B12R0.206 CC/C=C/CNCC(=O)NCCO b45de5b45f4fe347cefdf6f23d41ffa8 [0,1,0,0,0,0|3,0,0]=4 665 B12R0.206 CC/C=C/COCC(=O)CCSC f6e46595108d373f6e2ef84488fdadb5 [0,1,0,0,0,0|2,0,0]=3 666 B12R0.206 CC/C=C/COCC(=O)NCCC 99117867365771a6ee0d9c4b9dfa611f [0,1,0,0,0,0|2,0,0]=3 667 B12R0.206 CC/C=C/COCC(=O)OCCC 148277ebe64a5aabc6b02ad4b47563d2 [0,1,0,0,0,0|2,0,0]=3 668 B12R0.206 CC/C=C\CCNC(C)CCCC 8d869dea513cd452265416076e2c6df2 [0,1,0,0,0,0|2,0,1]=4 669 B12R0.206 CC/C=C\CCNC(C)CCCO e4ff409019757f92291c448e548ccf53 [0,1,0,0,0,0|2,0,1]=4 670 B12R0.206 CC/C=C\CCN[C@H](C)CCCC 5858a515333bbc0d0bfae419f5ff619b [0,1,0,0,0,0|2,0,1]=4 671 B12R0.206 CC/C=C\CCN[C@H](C)CCCO 49e4aea08439727660c6f37216b89cd8 [0,1,0,0,0,0|2,0,1]=4 672 B12R0.206 CC/C=C\CCOC(C)CCC#N 9d0cf840a8dfb10e1596eb84d5206688 [0,1,0,0,0,0|1,0,2]=4 673 B12R0.206 CC/C=C\CCOC(C)CCCC e75fb44695bcc9916114aa36898f33b4 [0,1,0,0,0,0|1,0,1]=3 674 B12R0.206 CC/C=C\CCOC(C)CCOC 6f47cf8d324fef3e097fc1ff6bf26ff0 [0,1,0,0,0,0|1,0,1]=3 675 B12R0.206 CC/C=C\CCOC(C)CCSC 0b1b5b7d508f01d4df3cd380efd042b8 [0,1,0,0,0,0|1,0,1]=3 676 B12R0.206 CC/C=C\CCOC(C)COCC 2bd4dab7707dfe31e8b0eef8cf9cb040 [0,1,0,0,0,0|1,0,1]=3 677 B12R0.206 CC/C=C\CCO[C@@H](C)CCCC 22e34ec79d10eb7a22946c6504044bcb [0,1,0,0,0,0|1,0,1]=3 678 B12R0.206 CC/C=C\CCO[C@H](C)CCCC 2a7cdc60f19cc632aa22bc7ba8b7c600 [0,1,0,0,0,0|1,0,1]=3 679 B12R0.206 CC/C=C\COCC(=O)CCSC 8f891d725baab0bf0e7d2ffa48c7c5a8 [0,1,0,0,0,0|2,0,0]=3 680 B12R0.206 CC/C=C\COCC(=O)NCCC 3e3952e3c631db51da9abfdfef94ecc3 [0,1,0,0,0,0|2,0,0]=3 681 B12R0.206 CC/C=C\COCC(=O)OCCC 44307ea44b3c248be23eb8777239ebea [0,1,0,0,0,0|2,0,0]=3 682 B12R0.206 CC=CCNCOC(=O)CCCC bb910e3b8eef0aa73be2872b396b0fcb [0,1,0,0,0,0|1,0,2]=4 683 B12R0.206 CC=CCNCOC(=O)OCCC df63a5b0f0e125bb5788e8aa1d9e9991 [0,1,0,0,0,0|1,0,2]=4 684 B12R0.206 CC=CCOCOC(=O)CCCC 2b9b4b0b4efb69d06c4587a4c54cfd46 [0,1,0,0,0,0|1,0,2]=4 685 B12R0.206 CC=CCOCOC(=O)OCCC 2865c6e6422b8db3097a0a67397799c2 [0,1,0,0,0,0|1,0,2]=4 686 B12R0.206 CCC#CC(C)OCC/C=C\CC 180279628b63313a9c5644c3be64576b [0,1,0,0,0,0|1,0,2]=4 687 B12R0.206 CCC/C=C/CCC(=O)NCCC 17e3c7580280fb58ca270138a5bcee72 [0,1,0,0,0,0|1,0,2]=4 688 B12R0.206 CCC/C=C\CCC(=O)NCCC 57c13cab41f080ae0ca043de717f3601 [0,1,0,0,0,0|1,0,2]=4 689 B12R0.206 CCCCC(=O)NCCCOCC 1ab2a8b6d814674961e457a217ed670b [0,1,0,0,0,0|2,0,1]=4 690 B12R0.206 CCCCC(=O)NCCOCCC 6a024cb730827e4472b09220771d10fd [0,1,0,0,0,0|2,0,1]=4 691 B12R0.206 CCCCCCCC(=O)NCCC 803c3b5f65103b7f1c85f768d717c2f2 [0,1,0,0,0,0|1,0,2]=4 692 B12R0.206 CCCCCCNC(=O)CCCC 70acaae11b2c6b1fd45feafe6ffa5b78 [0,1,0,0,0,0|1,0,2]=4 693 B12R0.206 CCCCCCNC(=O)CCCF 0e993041ca52f0859a511df998766182 [0,1,0,0,0,0|1,0,2]=4 694 B12R0.206 CCCCCCNC(=O)CCCS d10e075b1852f7856eaccec0857dcaaa [0,1,0,0,0,0|1,0,2]=4 695 B12R0.206 CCCCCCNC(=O)CCOC b4c31b8a66eba6314d589b98dd099b43 [0,1,0,0,0,0|1,0,2]=4 696 B12R0.206 CCCCCCNC(=O)CCSC 59d90d84443cb158320da85f181ac89e [0,1,0,0,0,0|1,0,2]=4 697 B12R0.206 CCCCCCNC(=O)COCC 4c932b059f758f3b35b21b0624ff070a [0,1,0,0,0,0|1,0,2]=4 698 B12R0.206 CCCCCCNC(=O)CSCC 5c1f59ea001a51aa153486a70e0a9d7e [0,1,0,0,0,0|1,0,2]=4 699 B12R0.206 CCCCCCNC(=O)NCCC f36e2e39309d437e377f2067d3d3eff8 [0,1,0,0,0,0|1,0,2]=4 700 B12R0.206 CCCCNCOC(=O)CCCC 1bafb601242da8a8d946db52f1bbeaf0 [0,1,0,0,0,0|1,0,2]=4 701 B12R0.206 CCCCNCOC(=O)OCCC d83cefbdb3981c9e3c96c1cd40b4f56b [0,1,0,0,0,0|1,0,2]=4 702 B12R0.206 CCCCOCOC(=O)CCCC fba6deb132e6e7f7f7861343ba29d758 [0,1,0,0,0,0|1,0,2]=4 703 B12R0.206 CCCCOCOC(=O)OCCC 071c97a3bb68cd2ecd9925c15aaf1564 [0,1,0,0,0,0|1,0,2]=4 704 B12R0.206 CCCNC(=O)CCCCOCC b5b1837a84cecb8e93b60a73927b2d74 [0,1,0,0,0,0|2,0,1]=4 705 B12R0.206 CCCNC(=O)CCCOCCC 435e5a2e43d294bff9b948a4f65ab99d [0,1,0,0,0,0|2,0,1]=4 706 B12R0.206 CCCNC(=O)NCCCOCC d714c40e165f327a9a129525803ce408 [0,1,0,0,0,0|2,0,1]=4 707 B12R0.206 CCCNC(=O)NCCOCCC 270129a94826db6ababc00fc15112a7b [0,1,0,0,0,0|2,0,1]=4 708 B12R0.206 CCCNCCCC(=O)NCCC b3989e6e752d16b37af92ec59dbde35e [0,1,0,0,0,0|2,0,1]=4 709 B12R0.206 CCCOCCNC(=O)CCCF dc5a48f08ca6357a67b4ac99f8f2198d [0,1,0,0,0,0|2,0,1]=4 710 B12R0.206 CCCOCCNC(=O)CCCS b32d77f2830975559988ddb2e181f686 [0,1,0,0,0,0|2,0,1]=4 711 B12R0.206 CCCOCCNC(=O)CCOC 9ef45dfe14d53154c9b4ae5291ccc7cf [0,1,0,0,0,0|2,0,1]=4 712 B12R0.206 CCCOCCNC(=O)CCSC a1a72933c38d4fbf2bf13bd69a5128b5 [0,1,0,0,0,0|2,0,1]=4 713 B12R0.206 CCCOCCNC(=O)COCC 2aee6b126539cc9ff72436117d573816 [0,1,0,0,0,0|2,0,1]=4 714 B12R0.206 CCCOCCNC(=O)CSCC b56bde388ef4f750117394d9220222ce [0,1,0,0,0,0|2,0,1]=4 715 B12R0.206 CCOCCCNC(=O)CCCF b7c8891201c1e9b495a01de5d354e12d [0,1,0,0,0,0|2,0,1]=4 716 B12R0.206 CCOCCCNC(=O)CCCS ac183174555220d933ff57ff91e858a0 [0,1,0,0,0,0|2,0,1]=4 717 B12R0.206 CCOCCCNC(=O)CCOC 4c679ef267eccebcc7ff027fb681e972 [0,1,0,0,0,0|2,0,1]=4 718 B12R0.206 CCOCCCNC(=O)CCSC 9680e4c55e1adb37fcd81bf772481581 [0,1,0,0,0,0|2,0,1]=4 719 B12R0.206 CCOCCCNC(=O)COCC 11952c318e7c8d69a9517c642900d017 [0,1,0,0,0,0|2,0,1]=4 720 B12R0.206 CCOCCCNC(=O)CSCC 834ff0f7868123758683db4a0f7cba0a [0,1,0,0,0,0|2,0,1]=4 721 B12R0.239 CCCCCC(C)NC(=O)CCC 40689ef52d2540f485dd28780810c0e1 [0,1,0,0,0,0|1,0,2]=4 722 B12R0.239 CCCCCC(C)OC(=S)CCC cb491ca31ef38fa137f25eca9041b317 [0,1,0,0,0,0|0,1,2]=4 723 B12R0.239 CCCCC[C@H](C)NC(=O)CCC f24b9425ac6b3e481a8865d19f6433a1 [0,1,0,0,0,0|1,0,2]=4 724 B12R0.239 CCCCC[C@H](C)OC(=S)CCC 42483c12356d923e5ecc6e50b9fbd89e [0,1,0,0,0,0|0,1,2]=4 725 B12R0.276 CCC(=O)NCCNC(=O)CCF 6b7cf3dc9ac1b5b6a16db57eb76e24fb [0,1,0,0,0,0|3,0,0]=4 726 B12R0.276 CCC(=O)NCCNC(=O)CCO 7f10207840e21cbafe4f87cc3715a292 [0,1,0,0,0,0|3,0,0]=4 727 B12R0.276 CCC(=O)NCCNC(=O)CCS 5ba20049ea7eba1ec1470203ce033618 [0,1,0,0,0,0|3,0,0]=4 728 B12R0.276 CCC(=O)NCCNC(=O)COC 372ba2677d424f2271cddccdd9eddfec [0,1,0,0,0,0|3,0,0]=4 729 B12R0.276 CCC(=O)NCCNC(=O)CSC e82de18eeb83b76c1d55149eba967bfa [0,1,0,0,0,0|3,0,0]=4 730 B12R0.276 CCCC(=O)NCCCC(=O)OC 0b6d878da113c887b1650eb508a860cf [0,1,0,0,0,0|2,0,1]=4 731 B12R0.276 CCCC(=O)NCCCN(C)CC 1fa3bb713caffb490857dea70d222b0d [0,1,0,0,0,0|2,0,1]=4 732 B12R0.276 CCCC(=O)NCCNC(=O)CC b34acb0ac4f8f5b80c853213c5dd2688 [0,1,0,0,0,0|2,0,0]=3 733 B12R0.276 CCCC(=O)OCCOC(C)CC a4a6a2589daf29b089c1916679f2ee47 [0,1,0,0,0,0|1,0,1]=3 734 B12R0.276 CCCC(=O)OCNCC(=O)NC 481054dbe1a6186629c8da61cb1f5cbc [0,1,0,0,0,0|2,0,1]=4 735 B12R0.276 CCCC(=O)OCNCC(=O)OC 42fc508b3f6855685d2f11bc5b7cf3d2 [0,1,0,0,0,0|2,0,1]=4 736 B12R0.276 CCCC(=O)OCNCC(C)CC e131bf4ecd9f14af8743b770d3a33652 [0,1,0,0,0,0|1,0,2]=4 737 B12R0.276 CCCC(=O)OCNCC(O)CC c75b80727e50c6fd43c640c7d3a47288 [0,1,0,0,0,0|1,0,2]=4 738 B12R0.276 CCCC(=O)OCNC[C@@H](C)CC 32e4757c004e17d1a4c06a6ca7ba9e37 [0,1,0,0,0,0|1,0,2]=4 739 B12R0.276 CCCC(=O)OCNC[C@H](O)CC 1ec0baa2338bbf9bb8cd2784e2a15135 [0,1,0,0,0,0|1,0,2]=4 740 B12R0.276 CCCC(=O)OCOCC(=O)CC 1cc4b38efa7c501f34136db55a54cb2f [0,1,0,0,0,0|1,0,1]=3 741 B12R0.276 CCCC(=O)OCOCC(=O)NC 1e956095281dddd267e59a5175faab35 [0,1,0,0,0,0|2,0,1]=4 742 B12R0.276 CCCC(=O)OCOCC(=O)OC c5ad0689f3f17cb4ece56825443040d7 [0,1,0,0,0,0|2,0,1]=4 743 B12R0.276 CCCC(=O)OCOCC(C)CC 258f6f6dc38197d29685f235e6f4317e [0,1,0,0,0,0|1,0,2]=4 744 B12R0.276 CCCC(=O)OCOC[C@@H](C)CC 251e3f0d67663a862b5bfbc94c847e1e [0,1,0,0,0,0|1,0,2]=4 745 B12R0.276 CCCC(=O)OCOC[C@H](C)CC 02c7c60e9861764e38c0bd96fa99d3b1 [0,1,0,0,0,0|1,0,2]=4 746 B12R0.276 CCCC(=S)OC/C=C/C(=O)OC 46b166edc7aa32fd72c76c6c98d6720e [0,1,0,0,0,0|1,1,1]=4 747 B12R0.276 CCCC(=S)OC/C=C\C(=O)OC 5666c4a7af5785a34aa4cc0d3ac3aa43 [0,1,0,0,0,0|1,1,1]=4 748 B12R0.276 CCCC(=S)OCC=CC(=O)OC 9a3089eaf861cc8128a8140a7f4addc5 [0,1,0,0,0,0|1,1,1]=4 749 B12R0.276 CCCC(=S)OCCCC(=O)NC d7d5e8fa6a577208ed7cd3bd59b14baa [0,1,0,0,0,0|1,1,1]=4 750 B12R0.276 CCCC(=S)OCCCC(=O)OC 8fcf57b0290d5df6df42a85499942761 [0,1,0,0,0,0|1,1,1]=4 751 B12R0.276 CCCC(C)OCCNC(=O)CC d976bb519bea1a293d1dd6919c701153 [0,1,0,0,0,0|2,0,1]=4 752 B12R0.276 CCCC(C)OCCOC(=O)CC 6c12fb8e79e26251cefc91c70f2b409d [0,1,0,0,0,0|2,0,1]=4 753 B12R0.276 CCOC(=O)CCCNC(=O)CC ef05590912234997853b2f5a970cfbd0 [0,1,0,0,0,0|3,0,0]=4 754 B12R0.276 CCOC(=O)OCOCC(=O)CC d6a631b74a3f47bd4c01943fc8ae7111 [0,1,0,0,0,0|2,0,1]=4 755 B12R0.276 CCSC(=O)OCOCC(=O)CC a03ac965041727aa71d235d3ac539ff1 [0,1,0,0,0,0|2,0,1]=4 756 B12R0.277 C=C(C)COCCOC(=O)CCC 58eca89829538ab29e3630ff0e963d23 [0,1,0,0,0,0|1,0,2]=4 757 B12R0.277 CCCC(=O)NCCCOC(C)C e987865254bd6cf15cecf0cd05fee4e5 [0,1,0,0,0,0|2,0,1]=4 758 B12R0.277 CCCC(=O)NCCCSC(C)C 85f371fa37a3cc4b41a944250493f1d6 [0,1,0,0,0,0|2,0,1]=4 759 B12R0.277 CCCC(=O)OCCOCC(C)C 0d6c23e4e2c081651a9e8ed36175fa54 [0,1,0,0,0,0|1,0,1]=3 760 B12R0.277 CCCC(=O)OCCOCC(F)F 1caa82f8d0ed1abd173f33246a405d3f [0,1,0,0,0,0|2,0,1]=4 761 B12R0.277 CCCC(=O)OCCOCN(C)C 027b2bfe613a9d2ec218fb7953e92d44 [0,1,0,0,0,0|2,0,1]=4 762 B12R0.277 CCCC(=O)OCNCC=C(C)C b112877f73d041d55e57c042c580e903 [0,1,0,0,0,0|1,0,2]=4 763 B12R0.277 CCCC(=O)OCNCCC(C)C 3965b5f710098be8254116ed16eb6bd2 [0,1,0,0,0,0|1,0,2]=4 764 B12R0.277 CCCC(=O)OCNCCC(C)O 850e8804b12e9cd489ab622800f4ee35 [0,1,0,0,0,0|1,0,2]=4 765 B12R0.277 CCCC(=O)OCNCC[C@@H](C)O cb4e9dadadc81a8e9356bc9ea2288ae0 [0,1,0,0,0,0|1,0,2]=4 766 B12R0.277 CCCC(=O)OCNCC[C@H](C)O 23dd082ae5f991062ed03dac0cee15c4 [0,1,0,0,0,0|1,0,2]=4 767 B12R0.277 CCCC(=O)OCOC/C=C(/C)\Cl 3ae90d4a983d00c6fd13f100686286bf [0,1,0,0,0,0|1,0,2]=4 768 B12R0.277 CCCC(=O)OCOC/C=C(/C)\I 5e13c77e14d519b86a39064f2ebbe0dd [0,1,0,0,0,0|1,0,2]=4 769 B12R0.277 CCCC(=O)OCOCC=C(C)C e1898a86800b705380c4ef0ee89e0c48 [0,1,0,0,0,0|1,0,2]=4 770 B12R0.277 CCCC(=O)OCOCC=C(C)I b64d7b4966827a68d708110b6dc7f332 [0,1,0,0,0,0|1,0,2]=4 771 B12R0.277 CCCC(=O)OCOCCC(C)C e62877fa3856a6a73a06deeca331957a [0,1,0,0,0,0|1,0,2]=4 772 B12R0.277 CCCC(=S)OCCCCC(C)C f4a18bc73988d6655c431a725b3b188c [0,1,0,0,0,0|0,1,2]=4 773 B12R0.277 CCCC(=S)OCCOCC(C)C 0b3dcec2de2387c3c681a7dff96718b9 [0,1,0,0,0,0|1,1,1]=4 774 B12R0.277 CCNC(=O)CNC/C=C/C(C)C 5d2795e344739534ee39c8ff225d5589 [0,1,0,0,0,0|3,0,0]=4 775 B12R0.277 CCNC(=O)COC/C=C/C(C)C bc37556b1245e92f24d8893e30274c76 [0,1,0,0,0,0|3,0,0]=4 776 B12R0.277 CCOC(=O)CNC/C=C/C(C)C 5b662f49c6619a721bb8d1b64ab2d828 [0,1,0,0,0,0|3,0,0]=4 777 B12R0.277 CCOC(=O)COC/C=C/C(C)C f3c073c120dd5dfacaf778bf43b56092 [0,1,0,0,0,0|3,0,0]=4 778 B12R0.285 C/C=C/C(C)OCOC(=O)CCC 65e8d9fafb152faf34c2e158cb8f1c7e [0,1,0,0,0,0|1,0,2]=4 779 B12R0.285 CC=CC(C)OCOC(=O)CCC 2728a9e5723b74dea6488092779e1a21 [0,1,0,0,0,0|1,0,2]=4 780 B12R0.285 CCCC(=O)CNCC(=O)NCC d9c1d00d3bed65207ca66f874a5e414e [0,1,0,0,0,0|3,0,0]=4 781 B12R0.285 CCCC(=O)CNCC(=O)OCC 4273b410c54abbca5e56f1e24fcf3456 [0,1,0,0,0,0|3,0,0]=4 782 B12R0.285 CCCC(=O)COCC(=O)NCC 9a0a615b1fcc645e4218f557b1ef35e8 [0,1,0,0,0,0|3,0,0]=4 783 B12R0.285 CCCC(=O)COCC(=O)OCC cfebe1bb4f0b1a45ba0eabc2a4ae09be [0,1,0,0,0,0|3,0,0]=4 784 B12R0.285 CCCC(=O)NCCC(=O)OCC 2a4c82757e413b6c1114d6f6ab2b9be3 [0,1,0,0,0,0|2,0,0]=3 785 B12R0.285 CCCC(=O)OCOC(=S)CCC 0e6ee6171da93b78fad3e9d87d90c2b1 [0,1,0,0,0,0|1,0,1]=3 786 B12R0.285 CCCC(=S)OCCC(=O)NCC 29b960f61b430bd7cf3234ded29a671e [0,1,0,0,0,0|1,1,0]=3 787 B12R0.285 CCCC(=S)OCCC(=O)OCC 4f9217f816851d2da20ce05ae421a9b7 [0,1,0,0,0,0|1,1,0]=3 788 B12R0.285 CCCC(=S)OCOC(=O)OCC ddea40c9d95a67ce40598b358c4c6e19 [0,1,0,0,0,0|2,0,1]=4 789 B12R0.285 CCCC(=S)OCOC(=O)SCC 301a24041aecdf412dc421a84df724e7 [0,1,0,0,0,0|2,0,1]=4 790 B12R0.285 CCCC(C)OCCC(=O)NCC 219ee2132711417eb19f5bdf0630b3b8 [0,1,0,0,0,0|2,0,1]=4 791 B12R0.285 CCCC(C)OCCC(=O)OCC f52795c3ba21a61d9a5059769aaaa2d4 [0,1,0,0,0,0|2,0,1]=4 792 B12R0.285 CCC[C@@H](C)OCCC(=O)NCC 4eb7c9e4592967f892219ba0bc23e01f [0,1,0,0,0,0|2,0,1]=4 793 B12R0.285 CCC[C@@H](C)OCCC(=O)OCC 845dbeed2a7367c3d713dc5fade4094e [0,1,0,0,0,0|2,0,1]=4 794 B12R0.285 CCC[C@H](C)OCCC(=O)NCC 468c14a36d6714c7029d996a345f0c8d [0,1,0,0,0,0|2,0,1]=4 795 B12R0.285 CCC[C@H](C)OCCC(=O)OCC 21fccf0af59fae58f73d557abd6c2b9e [0,1,0,0,0,0|2,0,1]=4 796 B12R0.285 CCOC(=O)CCNC(=O)CCF e750b0a8f4bdffb37f82315507d3d519 [0,1,0,0,0,0|3,0,0]=4 797 B12R0.285 CCOC(=O)CCNC(=O)CCO 5d92ccad0667c7244dc530b15547079b [0,1,0,0,0,0|3,0,0]=4 798 B12R0.285 CCOC(=O)CCNC(=O)CCS 5fba45a226005a2710426d8c37c34b78 [0,1,0,0,0,0|3,0,0]=4 799 B12R0.285 CCOC(=O)CCNC(=O)COC ed6d215ea7c829ad00d0eb591175309c [0,1,0,0,0,0|3,0,0]=4 800 B12R0.285 CCOC(=O)CCNC(=O)CSC c461646afd2f2ee75c1ab8ad665f6adb [0,1,0,0,0,0|3,0,0]=4 801 B12R1.28 CC/C=C/CN1CCCC(=O)C1 ab6ba7f27b9c1721bb8000d415d741bf [0,0,0,1,0,0|2,0,0]=3 802 B12R1.28 CC/C=C/CN1CCNC(=O)C1 e6e542650270909d2dc1197bf5fc7dec [0,0,0,1,0,0|3,0,0]=4 803 B12R1.28 CC/C=C/CN1CCOC(=O)C1 d6adda8b0495ec2809df313fd91bc271 [0,0,0,1,0,0|3,0,0]=4 804 B12R1.28 CCCNCC1CCCC(=O)N1 a9eaae5aab3cd0e87b11bb0dc817f0d5 [0,0,0,1,0,0|2,0,1]=4 805 B12R1.28 CCCOCC1CCCC(=O)C1 c6e6f3ef9305507b0c23e35e7961f245 [0,0,0,1,0,0|2,0,1]=4 806 B12R1.28 CCCOCC1CCCC(=O)N1 d5af32a49d0e7a4fa330977d8cfbd2a5 [0,0,0,1,0,0|2,0,1]=4 807 B12R1.28 CCCOC[C@@H]1CCCC(=O)N1 07b3982aee0fc054cb605d90e0ad4c36 [0,0,0,1,0,0|2,0,1]=4 808 B12R1.28 CCCOC[C@H]1CCCC(=O)N1 be60bf160650b163d22b518bac9c0c02 [0,0,0,1,0,0|2,0,1]=4 809 B12R1.32 CCCC(=O)CN1CC=CCC1 f32a8ba69cd95b1db8ab959ffa6ed515 [0,0,0,1,0,0|2,0,0]=3 810 B12R1.32 CCCC(=O)NC1C=CCCC1 36c95ec18fdc016256cc30fadeb7012e [0,0,0,1,0,0|1,0,2]=4 811 B12R1.32 CCCC(=O)NC1CCCOC1 8c81ab714233f6309bdde7ce1479873c [0,0,0,1,0,0|2,0,1]=4 812 B12R1.32 CCCC(=O)NC1CCOCC1 6f14188852f524783821ecb37569b134 [0,0,0,1,0,0|2,0,1]=4 813 B12R1.32 CCCC(=O)N[C@@H]1CCCOC1 2f289e113c6d947829d2418a1a352ab5 [0,0,0,1,0,0|2,0,1]=4 814 B12R1.32 CCCC(=O)N[C@H]1CCCOC1 2030bcf89c24fc3619ae216b76b0bc8d [0,0,0,1,0,0|2,0,1]=4 815 B12R1.32 CCCC(=S)OC1C=CCCC1 45892db4442e317a429f03e56f679402 [0,0,0,1,0,0|0,1,2]=4 816 B12R1.32 CCCC(=S)OC1CCCCC1 052dfad4b5172ffbcf806d81aaa08654 [0,0,0,1,0,0|0,1,2]=4 817 B12R1.32 CCCC(=S)OC1CCCOC1 116116d530abcf3fbd9a017c1fa50468 [0,0,0,1,0,0|1,1,1]=4 818 B12R1.32 CCCC(=S)OC1CCOCC1 d88820189a5e921771b39c12b75b929b [0,0,0,1,0,0|1,1,1]=4 819 B12R1.32 CCCC(=S)OC1CCSCC1 3cb7109ba54f2189e5fe89b900282b64 [0,0,0,1,0,0|1,1,1]=4 820 B12R1.32 CCCC(C)OC1CC=CCC1 f15094d2530c2ec1537f491b4684b9d4 [0,0,0,1,0,0|1,0,1]=3 821 B12R1.32 CCCN(C)CC1CC=CCC1 d394c0bf5f50d5bccc3d305701fe387c [0,0,0,1,0,0|3,0,0]=4 822 B12R1.32 CCNC(=O)CN1CC=CCC1 97a644e1d9155894f520ca051feeaf4c [0,0,0,1,0,0|3,0,0]=4 823 B12R1.32 CCOC(=O)CN1CC=CCC1 5afbc2601051c957201bb2bf9efee672 [0,0,0,1,0,0|3,0,0]=4 824 B12R1.32 COCC(C)OC1CC=CCC1 6afb925721e9fb42fa23adba8cb5a1ba [0,0,0,1,0,0|2,0,1]=4 825 B12R1.37 CC/C=C/CCOC1CCCC1 ddcd652bd1d83f24d68ba31d077aa1e0 [0,0,0,1,0,0|1,0,1]=3 826 B12R1.37 CC/C=C/CCOC1CCOC1 e71a62ce6e40c42916357f3beb14d861 [0,0,0,1,0,0|2,0,1]=4 827 B12R1.37 CC/C=C/CCO[C@@H]1CCOC1 572c6c7203a5e9d8df98fa156d85dcda [0,0,0,1,0,0|2,0,1]=4 828 B12R1.37 CC/C=C/CCO[C@H]1CCOC1 294ff299dbdaaa385d929647c0b694f0 [0,0,0,1,0,0|2,0,1]=4 829 B12R1.37 CC/C=C/COCC1=CCCC1 fe7df03b7991d02f6768611744bf7f02 [0,0,0,1,0,0|3,0,0]=4 830 B12R1.37 CC/C=C\CCNC1CCCC1 43ec2659d1850e69fc9e66343408bde1 [0,0,0,1,0,0|2,0,1]=4 831 B12R1.37 CC/C=C\CCOC1C=CCC1 dd95ede8be45839819672269d03b66f9 [0,0,0,1,0,0|1,0,2]=4 832 B12R1.37 CC/C=C\CCOC1CCCC1 6697c31ca6f1d37dedfede98e97cbc54 [0,0,0,1,0,0|1,0,1]=3 833 B12R1.37 CC/C=C\CCOC1CCCO1 6e8584a96797af38114b7c67b2bf9a63 [0,0,0,1,0,0|0,0,2]=3 834 B12R1.37 CC/C=C\CCOC1CCOC1 84a0e980d618b007b8ec839d82c5571e [0,0,0,1,0,0|2,0,1]=4 835 B12R1.37 CC/C=C\CCOC1CCSC1 6941d240f20eae382b9fbfbde93c7bf1 [0,0,0,1,0,0|2,0,1]=4 836 B12R1.37 CC/C=C\CCO[C@@H]1CCOC1 792eebefd512a71ef8cd02555a7fd0ee [0,0,0,1,0,0|2,0,1]=4 837 B12R1.37 CC/C=C\CCO[C@@H]1CCSC1 230561fc84e8d6ea170786957ca4325b [0,0,0,1,0,0|2,0,1]=4 838 B12R1.37 CC/C=C\CCO[C@H]1CCOC1 19c2e2a799fdc63b30cd31f35256abef [0,0,0,1,0,0|2,0,1]=4 839 B12R1.37 CC/C=C\CCO[C@H]1CCSC1 f7d8fe5f50778d50d647ea5f48c7165c [0,0,0,1,0,0|2,0,1]=4 840 B12R1.37 CC/C=C\COCC1=CCCC1 c2f0296dd9d12ada27b45a9ed923e8f9 [0,0,0,1,0,0|3,0,0]=4 841 B12R1.51 CCCC(=O)COC1C=CCC1 e2d01f708d19cdc3147b14c6e250c5b8 [0,0,0,1,0,0|2,0,0]=3 842 B12R1.51 CCCC(=O)NCC1CC=CC1 b7e9005608be16444c4d1e1a45480565 [0,0,0,1,0,0|1,0,2]=4 843 B12R1.51 CCCC(=O)NCC1CCCC1 cfcb200415709c214a1d801f83e6a4b6 [0,0,0,1,0,0|1,0,2]=4 844 B12R1.51 CCCC(=O)NCC1CCCO1 e4a03b1f607ff098a7b99b505f41ca9d [0,0,0,1,0,0|2,0,1]=4 845 B12R1.51 CCCC(=O)NCC1CCOC1 0059562e061f3db7f993cab5ce4b010a [0,0,0,1,0,0|2,0,1]=4 846 B12R1.51 CCCC(=O)NC[C@@H]1CCCO1 fa412fcaf3ac17029c350efdfa77a0ca [0,0,0,1,0,0|2,0,1]=4 847 B12R1.51 CCCC(=O)NC[C@@H]1CCOC1 142bbab18148f83d6a881c091ad157d7 [0,0,0,1,0,0|2,0,1]=4 848 B12R1.51 CCCC(=O)NC[C@H]1CCCO1 09ba24c92f7c743a1d210609eeb0d318 [0,0,0,1,0,0|2,0,1]=4 849 B12R1.51 CCCC(=O)NC[C@H]1CCOC1 90f0df9a6003c98e94f82e7235bcb390 [0,0,0,1,0,0|2,0,1]=4 850 B12R1.51 CCCC(=O)OCN1CC=CC1 3fc29dbb67c21514fc1bff5d56ee4c98 [0,0,0,1,0,0|1,0,2]=4 851 B12R1.51 CCCC(=O)OCN1CCSC1 9a8d222f261a1ed1c068662b128ae5a1 [0,0,0,1,0,0|2,0,1]=4 852 B12R1.51 CCCC(=S)OCC1=CCCC1 b2f2478f9267ed016c7a562ce03e2a3c [0,0,0,1,0,0|0,1,2]=4 853 B12R1.51 CCCC(=S)OCC1CC=CC1 34c831f54484936066bb4a1f36421cbb [0,0,0,1,0,0|0,1,2]=4 854 B12R1.51 CCCC(=S)OCC1CCCC1 dbb56b416236bceabe144b79562a70fc [0,0,0,1,0,0|0,1,2]=4 855 B12R1.51 CCCC(=S)OCC1CCCO1 b0b7deffb14dc9b7b714948792f41892 [0,0,0,1,0,0|1,1,1]=4 856 B12R1.51 CCCC(=S)OCC1CCOC1 96f491f1917c321df4bf780870050342 [0,0,0,1,0,0|1,1,1]=4 857 B12R1.51 CCCC(C)OCC1C=CCC1 43ab0838cf1a7854b1b87a2fb89ef3ad [0,0,0,1,0,0|1,0,1]=3 858 B12R1.51 CCNC(=O)COC1C=CCC1 f7160bf928a7d877dec2f06072466257 [0,0,0,1,0,0|3,0,0]=4 859 B12R1.51 CCOC(=O)COC1C=CCC1 26e6f86a2b6c0528d1ccab6cc88fc586 [0,0,0,1,0,0|3,0,0]=4 860 B12R1.51 COCC(=O)COC1C=CCC1 ab923d8cda293f06373cea82eb5840d5 [0,0,0,1,0,0|3,0,0]=4 861 B12R1.51 COCC(C)OCC1C=CCC1 3abb7ccc86d5e00310bf73dda746ce6f [0,0,0,1,0,0|2,0,1]=4 862 B12R1.62 CC/C=C\CCOC1CC(C1)C ad1e1cde29ff2fd6660f867e517cf8e0 [0,0,0,1,0,0|1,0,1]=3 863 B12R1.62 CC/C=C\CCOC1CC(C1)F b0a61fa0079bd47579538af52a36ddd7 [0,0,0,1,0,0|2,0,1]=4 864 B12R1.62 CC/C=C\CCOC1CN(C1)C 38bec3e0ebf0d8d023842a46c143db1e [0,0,0,1,0,0|2,0,1]=4 865 B12R1.62 CC/C=C\CCO[C@H]1C[C@@H](C1)F 62c612aaedc8d46e923117bbcff5769a [0,0,0,1,0,0|2,0,1]=4 866 B12R1.62 CC/C=C\CCO[C@H]1C[C@H](C1)F ca0f7f109a0d5eaa400d3e69f47fac3b [0,0,0,1,0,0|2,0,1]=4 867 B12R1.69 CCCOC1CCC(=O)CC1C 89bf2ebc9c694040d723abd3742c1391 [0,0,0,1,0,0|2,0,1]=4 868 B12R1.172 CCOC1CCCC(=O)CCC1 09769734fda33316df4cb84bd1d8e6bd [0,0,0,1,0,0|2,0,1]=4 869 B12R1.308 CCCC(=O)N1CCCCC1C 7d075d0c0acf0d9446431e41494dcc3e [0,0,0,1,0,0|1,0,2]=4 870 B12R1.308 CCCC(=O)N1CCCC[C@@H]1C 5e8ed4ab5c1c0bd8bb3ebc86f1d3822a [0,0,0,1,0,0|1,0,2]=4 871 B12R1.308 CCCC(=O)N1CCCC[C@H]1C eb466f6802ecb7cb17e439645fd356fd [0,0,0,1,0,0|1,0,2]=4 872 B12R1.308 CCCC(=O)N1CCOCC1C 67f11d72198c4e0ad84fe5a87f254c29 [0,0,0,1,0,0|2,0,1]=4 873 B12R1.308 CCCC(=O)N1CCOC[C@@H]1C de7974f38d7981d624657fcb83be6501 [0,0,0,1,0,0|2,0,1]=4 874 B12R1.308 CCCC(=O)N1CCOC[C@H]1C 5ed03702f0027c4b56db85ef9735dc22 [0,0,0,1,0,0|2,0,1]=4 875 B12R1.310 CCCC(=O)NCCOC1CC1 5eef59f7cdc291e46b19d99b5f39e8f3 [0,0,0,1,0,0|2,0,1]=4 876 B12R1.310 CCCC(=O)OCCOC1CC1 c6355cd2c488ee5c8251c82f789bd58c [0,0,0,1,0,0|1,0,1]=3 877 B12R1.310 CCCC(=O)OCNCC1CC1 5054915f96cb1a18ad842b1948acbcc8 [0,0,0,1,0,0|1,0,2]=4 878 B12R1.310 CCCC(=O)OCOCC1CC1 827ee871609f5dfa9d7df47c0a9a3eef [0,0,0,1,0,0|1,0,2]=4 879 B12R1.310 CCCC(=S)OCCOC1CC1 ed2b16a5dde6b35df010eab9e0bf1589 [0,0,0,1,0,0|1,1,1]=4 880 B12R1.310 CCCN(C)CCCC=C1CC1 41e05c40a1643e72deeec5be841319bc [0,0,0,1,0,0|3,0,0]=4 881 B12R1.315 CCCC(=O)NCCC1CCC1 549fc1b699f41761744f1a3c4fdf8ffc [0,0,0,1,0,0|1,0,2]=4 882 B12R1.315 CCCC(=O)NCCC1CCO1 8189c68730c638b16c10ba9ef2bcb817 [0,0,0,1,0,0|2,0,1]=4 883 B12R1.315 CCCC(=O)NCCN1CCC1 a09804f8d584f0b958284f809b96b83d [0,0,0,1,0,0|2,0,1]=4 884 B12R1.315 CCCC(=O)NCC[C@@H]1CCO1 3b823b36d7475cc335fe3267a11dd09f [0,0,0,1,0,0|2,0,1]=4 885 B12R1.315 CCCC(=O)OCNC1CCC1 aedd0edf9c7670a18cdc341b4c3d779c [0,0,0,1,0,0|1,0,2]=4 886 B12R1.315 CCCC(=O)OCOC1CCC1 868af7332a80d5c01a4aa342c0dc846a [0,0,0,1,0,0|1,0,2]=4 887 B12R1.315 CCCC(=S)OCCC1CCC1 20e8338f880556764713bf6a8e75c30f [0,0,0,1,0,0|0,1,2]=4 888 B12R1.315 CCCC(=S)OCCC1CCO1 9417a236decd275228d42ffc3e3bea56 [0,0,0,1,0,0|1,1,1]=4 889 B12R1.316 CCCC(=O)N1CCCC1CC 6812d3ea08b8867ea9d904f4cd446b52 [0,0,0,1,0,0|1,0,2]=4 890 B12R1.316 CCCC(=O)N1CCC[C@H]1CC 5cba11f5e16a67053aa92c62aea88515 [0,0,0,1,0,0|1,0,2]=4 891 B12R1.348 CCCOC1CCCC(=O)NC1 a17f0ae950cf40edc28159112625c840 [0,0,0,1,0,0|2,0,1]=4 892 B12R1.372 CC/C=C/CNC1CCNC1=O b2c831aa7426d503e06e86952aa3591f [0,0,0,1,0,0|3,0,0]=4 893 B12R1.372 CC/C=C/CNC1CCSC1=O 1f215dbbc62e5e0359b17b276003fa6c [0,0,0,1,0,0|3,0,0]=4 894 B12R1.372 CC/C=C/CN[C@@H]1CCNC1=O 81d78203d1afd052f26ae7d71b9f33d5 [0,0,0,1,0,0|3,0,0]=4 895 B12R1.372 CC/C=C/CN[C@@H]1CCOC1=O 8932a278fde22b6b367f509a19016386 [0,0,0,1,0,0|3,0,0]=4 896 B12R1.372 CC/C=C/CN[C@H]1CCNC1=O 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85bda718466235f1baa5c22eb779e820 [0,0,0,1,0,0|1,0,2]=4 908 B12R1.372 CC/C=C\CCN1CCC[C@@H]1C d6f568d4a07abd58ef3be0dc16c1f24b [0,0,0,1,0,0|2,0,1]=4 909 B12R1.372 CC/C=C\CCN1CCC[C@H]1C e453e34575c359471a87bf401da319fc [0,0,0,1,0,0|2,0,1]=4 910 B12R1.372 CC/C=C\COC1CCCC1=O 5fdad308191915844741d6c4db0b39c5 [0,0,0,1,0,0|2,0,0]=3 911 B12R1.372 CC/C=C\COC1CCNC1=O f277feb2f42784e2f6edc0fce94f054d [0,0,0,1,0,0|3,0,0]=4 912 B12R1.372 CC/C=C\COC1CCOC1=O 4d215afa9037442d0fa8993363bb921c [0,0,0,1,0,0|3,0,0]=4 913 B12R1.372 CCCNCCN1CCCC1=O 38f0f8ba483f1750ff441fc6bdfc384c [0,0,0,1,0,0|2,0,1]=4 914 B12R1.372 CCCOCCN1CCCC1=O 7b5ed8bcb4a3c5a6085cdd9832fd6bf3 [0,0,0,1,0,0|2,0,1]=4 915 B12R1.372 CCNCCCN1CCCC1=O eb7727125c7e45885d666a75794c1e2c [0,0,0,1,0,0|2,0,1]=4 916 B12R1.372 CCOCCCN1CCCC1=O b7a5a9adf6e9c3b980ad8af856bf4c51 [0,0,0,1,0,0|2,0,1]=4 917 B12R1.456 C/C=C/COC1OC(=O)CC1C 5dce1aa8469997c304aace45f12a6142 [0,0,0,1,0,0|1,0,2]=4 918 B12R1.456 C/C=C\COC1OC(=O)CC1C 0a83a0cff0cb4fd0c0dadcb72b1ec00b [0,0,0,1,0,0|1,0,2]=4 919 B12R1.456 CCCCOC1OC(=O)CC1C 06715f69c09a20e4a6e8248562d47e9f [0,0,0,1,0,0|1,0,2]=4 920 B12R1.542 CCCN1CCNC(=O)C1CC 459f9374ebcb2ea4ee16c7e8fe87fb61 [0,0,0,1,0,0|2,0,1]=4 921 B12R1.923 C/C=C/COCOC(=O)C1CC1 8a3cc2aea34bf6258f99b2eabf75af6e [0,0,0,1,0,0|1,0,2]=4 922 B12R1.923 C/C=C\COCOC(=O)C1CC1 2752b4c93e67ba9d81c2155f868f9ecd [0,0,0,1,0,0|1,0,2]=4 923 B12R1.923 CC/C=C/CCOC(C)C1CC1 742a307a6f0235ed7ebca69a76feaa60 [0,0,0,1,0,0|1,0,1]=3 924 B12R1.923 CC/C=C/COCC(=O)C1CC1 e09410851f4e6e3419534fa7138b53af [0,0,0,1,0,0|2,0,0]=3 925 B12R1.923 CC/C=C\CCN[C@@H](C)C1CC1 59fc498bf502ff679eaddba24b0bb984 [0,0,0,1,0,0|2,0,1]=4 926 B12R1.923 CC/C=C\CCN[C@H](C)C1CC1 92c8d645ec3c3e547c0ee5acaedccaa0 [0,0,0,1,0,0|2,0,1]=4 927 B12R1.923 CC/C=C\CCOC(C)C1CC1 3f2957118176c275e7af752aab7474a7 [0,0,0,1,0,0|1,0,1]=3 928 B12R1.923 CC/C=C\CCO[C@@H](C)C1CC1 107b58c7a5130da3e531c28345e8701f [0,0,0,1,0,0|1,0,1]=3 929 B12R1.923 CC/C=C\CCO[C@H](C)C1CC1 19f2717ceb3a082623d8b388d840d368 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141f60b34558e8dbf5ffba7be4ff80f9 [2,0,0,0,0,0|1,1,0]=4 977 B9R0.5 CCCC(=S)OCCCF 656dc88ae36c655edad34b161382f41a [2,0,0,0,0,0|1,1,0]=4 978 B9R0.5 CCCC(=S)OCCCS 23b64448f461e9f987487e187aec0d4a [2,0,0,0,0,0|1,1,0]=4 979 B9R0.5 CCCC(=S)OCCOC d3db63e9a9ba0e487e0033504dd762c1 [2,0,0,0,0,0|1,1,0]=4 980 B9R0.5 CCCC(=S)OCCSC ea004ea4cab93907812e5d91a99ec056 [2,0,0,0,0,0|1,1,0]=4 981 B9R0.5 CCCC(=S)OCOCC adf12bc5807344f3b284867173cde60b [2,0,0,0,0,0|1,1,0]=4 982 B9R0.5 CCCCNC(=O)CCC 2cce597b848ae107def59bee54a0a0bb [2,0,0,0,0,0|1,0,0]=3 983 B9R0.5 CCCCNC(=O)CCF 53b9813d116057ff8c4b15658e94e51c [2,0,0,0,0,0|2,0,0]=4 984 B9R0.5 CCCCNC(=O)CCO 0298cd2468e4d9499261be651df2adcd [2,0,0,0,0,0|2,0,0]=4 985 B9R0.5 CCCCNC(=O)CCS 1641ac5db70e3fc675ef1771e3defee2 [2,0,0,0,0,0|2,0,0]=4 986 B9R0.5 CCCCNC(=O)COC 36ff378b0254a17f19e8bd23cda67723 [2,0,0,0,0,0|2,0,0]=4 987 B9R0.5 CCCCNC(=O)CSC fd9e07d4285a6169aceb5bd025ecd890 [2,0,0,0,0,0|2,0,0]=4 988 B9R0.5 CCCCOC(=S)CCC f1235a4363bf9e2174e43a15f0090624 [2,0,0,0,0,0|0,1,0]=3 989 B9R0.5 CCCCOC(C)CCC 92f21439e18e4a0212372a80f0159639 [2,0,0,0,0,0|1,0,1]=4 990 B9R0.5 CCCCO[C@@H](C)CCC 5b752837ff25253bec29faef567e59b2 [2,0,0,0,0,0|1,0,1]=4 991 B9R0.5 CCCCO[C@H](C)CCC 5384ca464c5bc70cb67ae7c0e1b63cd2 [2,0,0,0,0,0|1,0,1]=4 992 B9R0.5 CCCNCC(=O)CCC 3eec0edc7aa18c3c159d3b72b32db52a [2,0,0,0,0,0|1,0,1]=4 993 B9R0.5 CCCOCC(=O)CCC 74c3c5e5bd02e359466cf1cc878b65e0 [2,0,0,0,0,0|1,0,1]=4 994 B9R0.5 CCNCCC(=O)OCC 2335a4402c7edabd02b888af3e7ee79f [2,0,0,0,0,0|2,0,0]=4 995 B9R0.5 CCOCCC(=O)OCC 09e1caf8e51242de5bdcbf4174bb2e9c [2,0,0,0,0,0|2,0,0]=4 996 B9R0.45 C#CCOCC/C=C/CC c23b6ff3165e2c405d442da9650e031e [2,0,0,0,0,0|0,0,2]=4 997 B9R0.45 C#CCOCC/C=C\CC 37b0a4e3a365db5d411110af84c79eb0 [2,0,0,0,0,0|0,0,2]=4 998 B9R0.45 C/C=C/C=C/COCCC 8f1e48b4facc41411447438079f84a28 [2,0,0,0,0,0|0,0,2]=4 999 B9R0.45 C/C=C/CCCOCCC 6078f7ffc27dfa8185f6236738ef681e [2,0,0,0,0,0|0,0,2]=4 1000 B9R0.45 C/C=C/CCOCCCC 34807d765a53dafaafda84290da499b4 [2,0,0,0,0,0|0,0,1]=3 1001 B9R0.45 C/C=C/CCOCCCF 7aa23dea8d53e360b9f2d936094e90b4 [2,0,0,0,0,0|1,0,1]=4 1002 B9R0.45 C/C=C/CCOCCCS 16508b6b2e4961769bb0921f28d0d285 [2,0,0,0,0,0|1,0,1]=4 1003 B9R0.45 C/C=C/CCOCCOC 59a729a9ab4033a1eb656d78838ea440 [2,0,0,0,0,0|1,0,1]=4 1004 B9R0.45 C/C=C/CCOCCSC 2d38818cd58c8496cbe29fdb8c8df6f6 [2,0,0,0,0,0|1,0,1]=4 1005 B9R0.45 C/C=C/CCOCOCC 70f3c48b000346091f71231d91c9996a [2,0,0,0,0,0|1,0,1]=4 1006 B9R0.45 C/C=C\CCCNCCC bd38004b14a3ffe818d001cefe29aee7 [2,0,0,0,0,0|2,0,0]=4 1007 B9R0.45 C/C=C\CCCOCCC 083c73f409535e210af3eb7849dd56ad [2,0,0,0,0,0|0,0,2]=4 1008 B9R0.45 C=CCOCC/C=C/CC d3a6361fd98a3a77c09decf732113b8c [2,0,0,0,0,0|0,0,2]=4 1009 B9R0.45 C=CCOCC/C=C\CC 75e789e3e347a0b07ef9e85b5dbe7cef [2,0,0,0,0,0|0,0,2]=4 1010 B9R0.45 CC/C=C/CCOCC#N bf4c789ee434fec2fbbb7b719e847697 [2,0,0,0,0,0|1,0,1]=4 1011 B9R0.45 CC/C=C/CCOCC=O ad17a670e163a34530891c854a5f696c [2,0,0,0,0,0|1,0,1]=4 1012 B9R0.45 CC/C=C/CCOCCC 0a76c2aa4cb5309f57046e961567e1f0 [2,0,0,0,0,0|0,0,0]=2 1013 B9R0.45 CC/C=C/CCOCCF 67cb50c940f1ea24e380ed351a9e27a4 [2,0,0,0,0,0|1,0,0]=3 1014 B9R0.45 CC/C=C/CCOCCS 4e6dcfeca03f19c51d7947aefe2b01ad [2,0,0,0,0,0|1,0,0]=3 1015 B9R0.45 CC/C=C/CCOCOC 796ebdddd1f42ca6def4f4ec2bad3826 [2,0,0,0,0,0|1,0,0]=3 1016 B9R0.45 CC/C=C/CCOCSC ec77883b00b8cd5828d5d0af69a4f670 [2,0,0,0,0,0|1,0,0]=3 1017 B9R0.45 CC/C=C/CNCCCC 205e3a3cf2dfbd78bc9d1c77318f250d [2,0,0,0,0,0|1,0,1]=4 1018 B9R0.45 CC/C=C/COCCCC 9dcd55c6f51e3b003595f546e655282b [2,0,0,0,0,0|0,0,1]=3 1019 B9R0.45 CC/C=C/COCCCF 1bdd7c31c17136a0ee0cf9ba9dbb1645 [2,0,0,0,0,0|1,0,1]=4 1020 B9R0.45 CC/C=C/COCCCS b790b5be01e61725cece8582b2949c8d [2,0,0,0,0,0|1,0,1]=4 1021 B9R0.45 CC/C=C/COCCOC 2ab85f3f4b406678e53b18145e6c066d [2,0,0,0,0,0|1,0,1]=4 1022 B9R0.45 CC/C=C/COCCSC 18b89071df33ae0d8403f439f52dcb53 [2,0,0,0,0,0|1,0,1]=4 1023 B9R0.45 CC/C=C/COCOCC 50e4f4dcb8fa3a706b0c7b393f8b8c0d [2,0,0,0,0,0|1,0,1]=4 1024 B9R0.45 CC/C=C\CCCOCC f3a75a504e13faa2cf8e35adf4ed3e3b [2,0,0,0,0,0|1,0,1]=4 1025 B9R0.45 CC/C=C\CCNCCBr d0103383ad5ee115dba2a58f31111ba9 [2,0,0,0,0,0|2,0,0]=4 1026 B9R0.45 CC/C=C\CCNCCC 3bbbe00683e3d998587775bf41dd95d1 [2,0,0,0,0,0|1,0,0]=3 1027 B9R0.45 CC/C=C\CCNCCF e69284276f386d7b30fc1c6037cf6bba [2,0,0,0,0,0|2,0,0]=4 1028 B9R0.45 CC/C=C\CCNCCI 17b98b9b79873be0890495201214d847 [2,0,0,0,0,0|2,0,0]=4 1029 B9R0.45 CC/C=C\CCNCCO a24354b5170b61b119e5744674583b1d [2,0,0,0,0,0|2,0,0]=4 1030 B9R0.45 CC/C=C\CCNCCS ba9aaf18a6f89fc41cd3a82c946b808c [2,0,0,0,0,0|2,0,0]=4 1031 B9R0.45 CC/C=C\CCOCC#N c5cc4aa26373c4551193308f135ee433 [2,0,0,0,0,0|1,0,1]=4 1032 B9R0.45 CC/C=C\CCOCC=O 43305c6de6e2aa8f989b2fa311880427 [2,0,0,0,0,0|1,0,1]=4 1033 B9R0.45 CC/C=C\CCOCCC 5fdb5a65a47740420a9d274005a3115f [2,0,0,0,0,0|0,0,0]=2 1034 B9R0.45 CC/C=C\CCOCCF abbcbf46201292033d3f156f0dd55de6 [2,0,0,0,0,0|1,0,0]=3 1035 B9R0.45 CC/C=C\CCOCCS 7038af308828495d311d4bc2f471647f [2,0,0,0,0,0|1,0,0]=3 1036 B9R0.45 CC/C=C\CCOCOC 888241aa2c4a0a3e7d9b504c0bf516e6 [2,0,0,0,0,0|1,0,0]=3 1037 B9R0.45 CC/C=C\CCOCSC db623e610663b8da8c1cd9145a0ca2fa [2,0,0,0,0,0|1,0,0]=3 1038 B9R0.45 CC/C=C\COCCCC 02179af6b133216a2e2f2900dac6b807 [2,0,0,0,0,0|0,0,1]=3 1039 B9R0.45 CC/C=C\COCCCF 72a1b5ac285dce171db4f5111b128f43 [2,0,0,0,0,0|1,0,1]=4 1040 B9R0.45 CC/C=C\COCCCS 6e33151a0a5cf56487e599bfb322c44a [2,0,0,0,0,0|1,0,1]=4 1041 B9R0.45 CC/C=C\COCCOC 4b82bbbe9d74c1cfc60aec77e1a195d5 [2,0,0,0,0,0|1,0,1]=4 1042 B9R0.45 CC/C=C\COCCSC a73a03f865a08d6a2c8e0d94d81b602b [2,0,0,0,0,0|1,0,1]=4 1043 B9R0.45 CC/C=C\COCOCC e813f39c64d857c1984d9d6aae25f396 [2,0,0,0,0,0|1,0,1]=4 1044 B9R0.45 CC=C=CCCOCCC c98648b64a6bd61fce8033f3515764f0 [2,0,0,0,0,0|0,0,2]=4 1045 B9R0.45 CC=CC=CCOCCC 56450f7f936a8924869fea1d2e9622e7 [2,0,0,0,0,0|0,0,2]=4 1046 B9R0.45 CC=CCCCOCCC 544004ad9efa2af2fea80f1c7a474136 [2,0,0,0,0,0|0,0,2]=4 1047 B9R0.45 CCC#CCCOCCC 4cc8a61a8d84e6a0c5e1fcd690fd5b56 [2,0,0,0,0,0|0,0,2]=4 1048 B9R0.45 CCC/C=C/COCCC e2603f506af8247235a50f3fd3dcc6bb [2,0,0,0,0,0|0,0,2]=4 1049 B9R0.45 CCC/C=C\CCOCC 22a9a7febcfe7dc866e40e1f973d5118 [2,0,0,0,0,0|2,0,0]=4 1050 B9R0.45 CCC/C=C\COCCC c19f5c31ee9318be226094f6198923ec [2,0,0,0,0,0|0,0,2]=4 1051 B9R0.45 CCCCCCOCCC e53b5b4f9e861a4f0969c775813c954e [2,0,0,0,0,0|0,0,2]=4 1052 B9R0.45 CCCCCOCCCC 452d4f5e08ae861a8237c2e4edaffcee [2,0,0,0,0,0|0,0,2]=4 1053 B9R0.45 CCCCOCCNCC c0f6eb404167932e0e88f86a69bff347 [2,0,0,0,0,0|1,0,1]=4 1054 B9R0.45 CCCCOCCOCC bc40d3f7a271e2ee8715a56f03d564ef [2,0,0,0,0,0|1,0,1]=4 1055 B9R0.45 CCCCOCCSCC 4b27bedc971633e9128e01c7169daa62 [2,0,0,0,0,0|1,0,1]=4 1056 B9R0.45 CCCNCCOCCC c9636642ffae561b1adc5cd9ae1dccad [2,0,0,0,0,0|1,0,1]=4 1057 B9R0.45 CCCOCCCNCC 9c5f9e1a8eab534703971dfcd50dc3a4 [2,0,0,0,0,0|1,0,1]=4 1058 B9R0.45 CCCOCCCOCC 7ae5cc2cef81f72870de148e55495f6e [2,0,0,0,0,0|1,0,1]=4 1059 B9R0.45 CCCOCCCSCC a587632712094e0a386067bb302c3743 [2,0,0,0,0,0|1,0,1]=4 1060 B9R0.45 CCCOCCOCCC 96ef823798ad295a7793168e0a9a50d1 [2,0,0,0,0,0|1,0,1]=4 1061 B9R0.45 CCCOCCSCCC ef95f0015148e44bf9c71ec82f7f1f36 [2,0,0,0,0,0|1,0,1]=4 1062 B9R0.46 C/C=C/CCOC(C)CC 24e3cbba50c85cd72892fd069a4e6975 [2,0,0,0,0,0|1,0,1]=4 1063 B9R0.46 C/C=C/COCC(=O)CC e1656228407acd54ce7a771a1321ad28 [2,0,0,0,0,0|2,0,0]=4 1064 B9R0.46 C/C=C\COCC(=O)CC c14112dc2d18bee881fce853ea783f26 [2,0,0,0,0,0|2,0,0]=4 1065 B9R0.46 CC/C=C/COC(C)CC bb53281b9974a90f85650cbbacb4a7df [2,0,0,0,0,0|1,0,1]=4 1066 B9R0.46 CC/C=C/CO[C@@H](C)CC e5d8c30d9c656c3e93e8de7b95835dd5 [2,0,0,0,0,0|1,0,1]=4 1067 B9R0.46 CC/C=C/CO[C@H](C)CC 121e3c512c899a11d31a58b4f890d9b7 [2,0,0,0,0,0|1,0,1]=4 1068 B9R0.46 CC/C=C\CCN(C)CC 258c6874fe45d3108b864247b32bcd51 [2,0,0,0,0,0|2,0,0]=4 1069 B9R0.46 CC/C=C\COC(C)CC b6ae26b919cfe256a079292116543e0c [2,0,0,0,0,0|1,0,1]=4 1070 B9R0.46 CC=CCNCC(=O)CC 3eb40bc620336efcbc3652bfc1f9b519 [2,0,0,0,0,0|2,0,0]=4 1071 B9R0.46 CC=CCOCC(=O)CC 19b16142301c4f605365fb0e3e29736d [2,0,0,0,0,0|2,0,0]=4 1072 B9R0.46 CCC(=O)OCCOCF dac9515ba882d559f224c99beb993b2d [2,0,0,0,0,0|2,0,0]=4 1073 B9R0.46 CCCCCNC(=O)CC 849a8920618781fdb82a0336e223971a [2,0,0,0,0,0|1,0,1]=4 1074 B9R0.46 CCCNCOC(=O)CC 5135722cfe6a14d8256a85f8111be929 [2,0,0,0,0,0|1,0,1]=4 1075 B9R0.46 CCCOCOC(=O)CC fc12ca63d515d86d2f674d2f74a06865 [2,0,0,0,0,0|1,0,1]=4 1076 B9R0.46 CCNCCNC(=O)CC d05b1a7e2d3cebad7ef561e08a9f68d4 [2,0,0,0,0,0|2,0,0]=4 1077 B9R0.46 CCOCCNC(=O)CC bb89549179010db70c29ee3b9f4248d0 [2,0,0,0,0,0|2,0,0]=4 1078 B9R0.46 CCOCCOC(=O)CC cbe8829b561f0b4f11227dbb7fca44b4 [2,0,0,0,0,0|1,0,0]=3 1079 B9R0.46 CCOCCOC(=O)OC b297131086651eb5dcd01a50837d46c4 [2,0,0,0,0,0|2,0,0]=4 1080 B9R0.46 CCSCCNC(=O)CC 70f4cbcf01905cc3c094d724b73e5668 [2,0,0,0,0,0|2,0,0]=4 1081 B9R0.2 CC/C=C/CCOC(C)C ef00627bff77b325217a906a5597bbd9 [2,0,0,0,0,0|1,0,1]=4 1082 B9R0.2 CC/C=C/CNCC(=O)C bb03016005aff92d60de25a5fb2dde7e [2,0,0,0,0,0|2,0,0]=4 1083 B9R0.2 CC/C=C/COCC(=O)C 5aaebc977bb6e5ae3b7dabe2f590edd8 [2,0,0,0,0,0|2,0,0]=4 1084 B9R0.2 CC/C=C\CCOC(C)C 4692840deafd8699b89a7fcb39f78d25 [2,0,0,0,0,0|1,0,1]=4 1085 B9R0.2 CCCNCCOC(=O)C 1f7e1f87180a6b7613488d41ed0bd627 [2,0,0,0,0,0|1,0,1]=4 1086 B9R0.2 CCCOCCOC(=O)C f41b865aa303cc7ca2bd22086d82154a [2,0,0,0,0,0|1,0,1]=4 1087 B9R0.2 CCOCCCOC(=O)C 521ac746c4773e46268f3042c9c9e91c [2,0,0,0,0,0|1,0,1]=4 1088 B11R0.2 C/C=C/CCOC(C)CC(C)C 0166a290a696d882f71c34295044f35e [1,1,0,0,0,0|1,0,1]=4 1089 B11R0.2 C/C=C/COCC(=O)CC(C)C f448b5f308df3ab89dc02d9c2e0e3865 [1,1,0,0,0,0|2,0,0]=4 1090 B11R0.2 C/C=C\COCC(=O)CC(C)C a20569288167ea8e80859b47340ec6f9 [1,1,0,0,0,0|2,0,0]=4 1091 B11R0.2 CC/C=C/COC(C)CC(C)C 19f1dc43b1f3a0732932fc415ccfb72c [1,1,0,0,0,0|1,0,1]=4 1092 B11R0.2 CC/C=C/CO[C@@H](C)CC(C)C c9d9c04553663f9aa719528bf87da969 [1,1,0,0,0,0|1,0,1]=4 1093 B11R0.2 CC/C=C/CO[C@H](C)CC(C)C d78c07dc9f540693ed5c4bd9e99e4345 [1,1,0,0,0,0|1,0,1]=4 1094 B11R0.2 CC/C=C\CCN(C)CC(C)C bea7aedbd5e571f82b637d50fe4b7b6c [1,1,0,0,0,0|2,0,0]=4 1095 B11R0.2 CC/C=C\CCN(C)CC(C)O 6fb3603a7b50496fec2d63b2e5ab14fc [1,1,0,0,0,0|2,0,0]=4 1096 B11R0.2 CC/C=C\CCN(C)C[C@H](C)O 14273269b67ac7c418ab7e3b1749c9a2 [1,1,0,0,0,0|2,0,0]=4 1097 B11R0.2 CC/C=C\COC(C)CC(C)C 60c4855b2a5f969c4dedce65fa571be2 [1,1,0,0,0,0|1,0,1]=4 1098 B11R0.2 CC=CCNCC(=O)CC(C)C d54a2224453750124ef4768564d9dd8a [1,1,0,0,0,0|2,0,0]=4 1099 B11R0.2 CC=CCOCC(=O)CC(C)C 054c1490a43ef1f7bf8b961cda62d2c0 [1,1,0,0,0,0|2,0,0]=4 1100 B11R0.2 CCCCCNC(=O)CC(C)C 692756888e78a392ba26d7edfbe106d1 [1,1,0,0,0,0|1,0,1]=4 1101 B11R0.2 CCCCCNC(=O)CC(C)O a7310630ee05db8507d17f6f5635f1f7 [1,1,0,0,0,0|1,0,1]=4 1102 B11R0.2 CCCCCNC(=O)C[C@@H](C)O 74bdad8f051e73e767c01c34354bb00a [1,1,0,0,0,0|1,0,1]=4 1103 B11R0.2 CCCCCNC(=O)C[C@H](C)O 0641d6521812951e3665c5f041988d44 [1,1,0,0,0,0|1,0,1]=4 1104 B11R0.2 CCCNCOC(=O)CC(C)C 03b8532101a58edc6670b3ee855d793c [1,1,0,0,0,0|1,0,1]=4 1105 B11R0.2 CCCOCOC(=O)CC(C)C e5fa797e9f664b75ef33720be87bc236 [1,1,0,0,0,0|1,0,1]=4 1106 B11R0.2 CCOCCNC(=O)CC(C)C cb162822ec16b8301c9a66a6a107d8a2 [1,1,0,0,0,0|2,0,0]=4 1107 B11R0.2 CCOCCNC(=O)CC(C)O fd4466b818ee2c9986533eff19a5f286 [1,1,0,0,0,0|2,0,0]=4 1108 B11R0.2 CCOCCNC(=O)C[C@@H](C)O e8fb69fcde1b2631ba0c3bad607b375b [1,1,0,0,0,0|2,0,0]=4 1109 B11R0.2 CCOCCNC(=O)C[C@H](C)O ddd6bd9aea43238095b575e5a9a008c3 [1,1,0,0,0,0|2,0,0]=4 1110 B11R0.2 CCSCCNC(=O)CC(C)C 6a696d42ecea470a00c5d7ee065504bb [1,1,0,0,0,0|2,0,0]=4 1111 B11R0.2 CCSCCNC(=O)CC(C)O 71abab4563844dea9cb7571a81a28b67 [1,1,0,0,0,0|2,0,0]=4 1112 B11R0.2 CCSCCNC(=O)C[C@@H](C)O b95fa1652ca1da94ac878099c1c745d3 [1,1,0,0,0,0|2,0,0]=4 1113 B11R0.2 CCSCCNC(=O)C[C@H](C)O 50d078858b13aea0e29010cac3849b3b [1,1,0,0,0,0|2,0,0]=4 1114 B11R0.5 CCCCC(C)NC(=O)CCC 43436934f24e745885dfbadec08128d1 [1,1,0,0,0,0|1,0,1]=4 1115 B11R0.5 CCCCC(C)OC(=S)CCC 0c4270cad6dfde75c78c81454c1eb24c [1,1,0,0,0,0|0,1,1]=4 1116 B11R0.5 CCCC[C@@H](C)NC(=O)CCC b900024a5ad230bdc04e528498061486 [1,1,0,0,0,0|1,0,1]=4 1117 B11R0.62 C/C=C/C(C)OCC(=O)CCC 18e3a6e93405de4d8151f091d27a307a [1,1,0,0,0,0|2,0,0]=4 1118 B11R0.62 CC=CC(C)OCC(=O)CCC de3aa83619be27f80a7d4a4d21f62c13 [1,1,0,0,0,0|2,0,0]=4 1119 B11R0.62 CCCC(=O)COC(=S)CCC 09b6a45b0e488d394f5eefb65d74c8c0 [1,1,0,0,0,0|0,1,1]=4 1120 B11R0.62 CCCC(=O)NCC(=O)NCC 2a2660959ca6f0735149c94db3c7882c [1,1,0,0,0,0|2,0,0]=4 1121 B11R0.62 CCCC(=O)NCC(=O)OCC 845c9aa0b59016b80af4d37cc5afeb13 [1,1,0,0,0,0|2,0,0]=4 1122 B11R0.62 CCCC(=O)NCC(C)OCC 5402a150bb43f858f655038d2be6e996 [1,1,0,0,0,0|2,0,0]=4 1123 B11R0.62 CCCC(=O)NCC(O)CCC 4a65aec58a4bf3eeef8107bd670efb46 [1,1,0,0,0,0|1,0,1]=4 1124 B11R0.62 CCCC(=O)OCN(C)CCC 3f81cb354cfe83830751d858b6d8e501 [1,1,0,0,0,0|1,0,1]=4 1125 B11R0.62 CCCC(=S)OCC(=O)NCC ca79de622a2b4d20e5ae2c0514f647bd [1,1,0,0,0,0|1,1,0]=4 1126 B11R0.62 CCCC(=S)OCC(=O)OCC 2f52924dc3d6f6907f50d368446d6cbe [1,1,0,0,0,0|1,1,0]=4 1127 B11R0.62 CCCC(=S)OCC(C)CCC e073cff525470b00703e360819cad89b [1,1,0,0,0,0|0,1,1]=4 1128 B11R0.81 C/C=C/CCCC(=O)NCCBr 3d68366afaf50874cd1e42173ab1d64c [1,1,0,0,0,0|2,0,0]=4 1129 B11R0.81 C/C=C/CCCC(=O)NCCC 320cd7ca372be81d7dd0b97c4069ce50 [1,1,0,0,0,0|1,0,0]=3 1130 B11R0.81 C/C=C/CCCC(=O)NCCF 49616904daac32934a54b1d06249e20d [1,1,0,0,0,0|2,0,0]=4 1131 B11R0.81 C/C=C/CCCC(=O)NCCI 0140a75d36510a68019392e5948384dd [1,1,0,0,0,0|2,0,0]=4 1132 B11R0.81 C/C=C/CCCC(=O)NCCO ee0d5d0d30a7a14d1f37d68caccbf7f9 [1,1,0,0,0,0|2,0,0]=4 1133 B11R0.81 C/C=C/CCCC(=O)NCCS 662dee10f1de41884d43a19ca1c0d001 [1,1,0,0,0,0|2,0,0]=4 1134 B11R0.81 C/C=C/CCOC(C)CCCC fc755d5939ac545b621671d079cee386 [1,1,0,0,0,0|1,0,1]=4 1135 B11R0.81 C/C=C/CNCC(=O)NCCC 750b2045302869c52b8c5167974632e0 [1,1,0,0,0,0|2,0,0]=4 1136 B11R0.81 C/C=C/COCC(=O)CCSC 0260c17e2a01a02ca2415759cf2174f6 [1,1,0,0,0,0|2,0,0]=4 1137 B11R0.81 C/C=C/COCC(=O)NCCC 56ef844870fd0d49a91ad24bb67c2ae0 [1,1,0,0,0,0|2,0,0]=4 1138 B11R0.81 C/C=C/COCC(=O)OCCC fc9ddd92128015db65856ff7285f202d [1,1,0,0,0,0|2,0,0]=4 1139 B11R0.81 C/C=C\CNCC(=O)NCCC 5f30a8efa0db6abd9031888607c6eb08 [1,1,0,0,0,0|2,0,0]=4 1140 B11R0.81 C/C=C\COCC(=O)CCSC de25132cc2587707c36140f398c96e71 [1,1,0,0,0,0|2,0,0]=4 1141 B11R0.81 C/C=C\COCC(=O)NCCC 6a8f69bdada74004404a364a1bdf613b [1,1,0,0,0,0|2,0,0]=4 1142 B11R0.81 C/C=C\COCC(=O)OCCC 663c40ab73f619bda2c225171df1ee74 [1,1,0,0,0,0|2,0,0]=4 1143 B11R0.81 CC/C=C/COC(C)CCCC 42b37d9860f90ae1395ebb1fa01f0a58 [1,1,0,0,0,0|1,0,1]=4 1144 B11R0.81 CC/C=C/COC(C)CCOC 8f2c0fbfc08b3d95c2209ef615f281d4 [1,1,0,0,0,0|1,0,1]=4 1145 B11R0.81 CC/C=C/COC(C)CCSC 15e3fb0d1bfb4d9fccfa3fb47909c1e5 [1,1,0,0,0,0|1,0,1]=4 1146 B11R0.81 CC/C=C/COC(C)COCC c6059682e2445a3a9c5740a70cc0f737 [1,1,0,0,0,0|1,0,1]=4 1147 B11R0.81 CC/C=C/CO[C@@H](C)CCCC e4d373f852c3e3656bf4fcd1d8dc87f5 [1,1,0,0,0,0|1,0,1]=4 1148 B11R0.81 CC/C=C/CO[C@H](C)CCCC a61448b5c4d7007538aaf40b63254bb0 [1,1,0,0,0,0|1,0,1]=4 1149 B11R0.81 CC/C=C\CCN(C)CCCC ec9dc44d647d04a82557832f950258f9 [1,1,0,0,0,0|2,0,0]=4 1150 B11R0.81 CC/C=C\CCN(C)CCCO 967067046764fb4805a1de92d4437b27 [1,1,0,0,0,0|2,0,0]=4 1151 B11R0.81 CC/C=C\CCN(C)CCOC 3d81a72c596598f31ce7868878a994aa [1,1,0,0,0,0|2,0,0]=4 1152 B11R0.81 CC/C=C\CCN(C)CCSC 39b78a2888d51d612380c96257df4c5c [1,1,0,0,0,0|2,0,0]=4 1153 B11R0.81 CC/C=C\COC(C)CCCC 2c34bb4d4c5cae98da461010746a1e1c [1,1,0,0,0,0|1,0,1]=4 1154 B11R0.81 CC=CCNCC(=O)CCSC adb05690d5ca4fe9649cdf7a624ebbc9 [1,1,0,0,0,0|2,0,0]=4 1155 B11R0.81 CC=CCNCC(=O)NCCC f1719c40e68e24bfd8ab298aa4a5bf70 [1,1,0,0,0,0|2,0,0]=4 1156 B11R0.81 CC=CCNCC(=O)OCCC cc9a9946aaa7efdb3824fd87e94e11bc [1,1,0,0,0,0|2,0,0]=4 1157 B11R0.81 CC=CCOCC(=O)CCSC 1a33a809474c634be9432885f386a972 [1,1,0,0,0,0|2,0,0]=4 1158 B11R0.81 CC=CCOCC(=O)NCCC 75ddb8adabaf44b89d339eea6f9c3ae0 [1,1,0,0,0,0|2,0,0]=4 1159 B11R0.81 CC=CCOCC(=O)OCCC 2d72f130f78b56101482ac4a54bfb905 [1,1,0,0,0,0|2,0,0]=4 1160 B11R0.81 CCC/C=C/CC(=O)NCCC 40794eac8680af8f7b27b0cc3497eac7 [1,1,0,0,0,0|0,0,2]=4 1161 B11R0.81 CCCCC(=O)NCCOCC bcdbd9d41426e95de40e68225afe50a3 [1,1,0,0,0,0|2,0,0]=4 1162 B11R0.81 CCCCC(=O)NCCSCC 3dc1a80f6b8f71092a353e3e3c630639 [1,1,0,0,0,0|2,0,0]=4 1163 B11R0.81 CCCCC(=O)OCNCCC 189a0251ea5eef3ed179b78ec37eca6d [1,1,0,0,0,0|1,0,1]=4 1164 B11R0.81 CCCCC(=O)OCOCCC 0911490fac5c15eab77dc944203f025f [1,1,0,0,0,0|1,0,1]=4 1165 B11R0.81 CCCCCCC(=O)NCCC 87d8790730f902707f59eb54172a1efa [1,1,0,0,0,0|0,0,2]=4 1166 B11R0.81 CCCCCNC(=O)CCCC a06834419102a1558a19fb3a1406cfb0 [1,1,0,0,0,0|1,0,1]=4 1167 B11R0.81 CCCCCNC(=O)CCCF cb3b728da5cd7a0af32935f0696071b9 [1,1,0,0,0,0|1,0,1]=4 1168 B11R0.81 CCCCCNC(=O)CCCS 2ce8fa8be7e233b98c683adc51803bf5 [1,1,0,0,0,0|1,0,1]=4 1169 B11R0.81 CCCCCNC(=O)CCOC 99bac40aabd096dca01631fdf32d2a4b [1,1,0,0,0,0|1,0,1]=4 1170 B11R0.81 CCCCCNC(=O)CCSC 307383e6c5c252e00e4647926ad02c1d [1,1,0,0,0,0|1,0,1]=4 1171 B11R0.81 CCCCCNC(=O)COCC 11ebeee9fef7d60698beadcb88e4cda2 [1,1,0,0,0,0|1,0,1]=4 1172 B11R0.81 CCCCCNC(=O)CSCC bf3d4e842c78e9ee2405e5f2f5ac3c0b [1,1,0,0,0,0|1,0,1]=4 1173 B11R0.81 CCCCCNC(=O)NCCC 2fb53f51cf25e3deb1739f07400adf03 [1,1,0,0,0,0|1,0,1]=4 1174 B11R0.81 CCCNC(=O)CCOCCC 42553a8c8b926fca8611ff8d68aeae7a [1,1,0,0,0,0|1,0,1]=4 1175 B11R0.81 CCCNC(=O)NCCOCC 80e1f0671ff882759d81829124c92ad6 [1,1,0,0,0,0|2,0,0]=4 1176 B11R0.81 CCCNC(=O)NCCSCC c2a740fdab08c6ec989b5f9aea85bf6c [1,1,0,0,0,0|2,0,0]=4 1177 B11R0.81 CCCNCOC(=O)OCCC 4d1a92bf22713f11d028be261523bf97 [1,1,0,0,0,0|1,0,1]=4 1178 B11R0.81 CCCOCCC(=O)OCCC 6ee22521ff14ec2304cdca3071c00c79 [1,1,0,0,0,0|1,0,1]=4 1179 B11R0.81 CCCOCOC(=O)OCCC 7cd19f7197089ff3a04837dd12236c27 [1,1,0,0,0,0|1,0,1]=4 1180 B11R0.81 CCOCC(=O)NCCSCC dc2db358571e9ce17f4f7e3af62ea85f [1,1,0,0,0,0|2,0,0]=4 1181 B11R0.81 CCOCCNC(=O)CCCF 143244bf937b80e80b1012bf493a68c2 [1,1,0,0,0,0|2,0,0]=4 1182 B11R0.81 CCOCCNC(=O)CCCS 19665b86e7c7d0a3fb523bfbe3572199 [1,1,0,0,0,0|2,0,0]=4 1183 B11R0.81 CCOCCNC(=O)CCOC ac2e4792b39278e1be00015aba1c14ba [1,1,0,0,0,0|2,0,0]=4 1184 B11R0.81 CCOCCNC(=O)CCSC e921116d3831e309cf43a8831d286efa [1,1,0,0,0,0|2,0,0]=4 1185 B11R0.81 CCOCCNC(=O)COCC ccff2589632a0830014f62e4f65641f2 [1,1,0,0,0,0|2,0,0]=4 1186 B11R0.81 CCOCCNC(=O)CSCC ad5aa08f7211c115983356636b1745f4 [1,1,0,0,0,0|2,0,0]=4 1187 B11R0.81 CCSCCNC(=O)CCCF 27a5d2edf7fbd02ff957d5e4ca1b276f [1,1,0,0,0,0|2,0,0]=4 1188 B11R0.81 CCSCCNC(=O)CCCS d71a7511e56051353f5f76d32534489f [1,1,0,0,0,0|2,0,0]=4 1189 B11R0.81 CCSCCNC(=O)CCOC 43174eb7b6b512a7d0afbe0b9f344a65 [1,1,0,0,0,0|2,0,0]=4 1190 B11R0.81 CCSCCNC(=O)CCSC 4dce0d397f7e5f7bb9ff360e55b32e5e [1,1,0,0,0,0|2,0,0]=4 1191 B11R0.81 CCSCCNC(=O)CSCC 618931eb3238ccd09997ba70bf359774 [1,1,0,0,0,0|2,0,0]=4 1192 B11R0.142 C/C=C/CCCC(=O)N(C)CC 7da8fb77904b422877e067010a58f316 [1,1,0,0,0,0|2,0,0]=4 1193 B11R0.142 C/C=C/COCC(=O)C(C)CC 467bb7a5fb2f99d7ee7028a9491e2b31 [1,1,0,0,0,0|2,0,0]=4 1194 B11R0.142 C/C=C\COCC(=O)C(C)CC 77b3c482042a3b609bf751eb821bc79c [1,1,0,0,0,0|2,0,0]=4 1195 B11R0.142 CC/C=C/COC(C)C(C)CC ac0d0b11b9ca2384a20bbf29f7bba083 [1,1,0,0,0,0|1,0,1]=4 1196 B11R0.142 CC/C=C\CCN(C)C(C)CC fc75b598f482955b4f54f65bbe7ff04d [1,1,0,0,0,0|2,0,0]=4 1197 B11R0.142 CC=CCNCC(=O)C(C)CC 140ad21928d643f7f339bb95245d0b4e [1,1,0,0,0,0|2,0,0]=4 1198 B11R0.142 CC=CCOCC(=O)C(C)CC e992834b88c2a21c77c55355af01f499 [1,1,0,0,0,0|2,0,0]=4 1199 B11R0.142 CCCCCNC(=O)C(O)CC 21183fd884d39603cb719fdbecbc4633 [1,1,0,0,0,0|1,0,1]=4 1200 B11R0.142 CCCCCNC(=O)[C@@H](O)CC 97180f2a7c742a9531384571b2698814 [1,1,0,0,0,0|1,0,1]=4 1201 B11R0.142 CCCCCNC(=O)[C@@H](S)CC 247195dcf6a85e69c6026cceff638d19 [1,1,0,0,0,0|1,0,1]=4 1202 B11R0.142 CCCCCNC(=O)[C@H](O)CC 12b674743e61cba5d7a335a161d32295 [1,1,0,0,0,0|1,0,1]=4 1203 B11R0.142 CCOCCNC(=O)C(O)CC 6983d019b0c80d30d2deaf6c80cd0b51 [1,1,0,0,0,0|2,0,0]=4 1204 B11R0.142 CCOCCNC(=O)[C@@H](O)CC 6260dc75d7f6ff2bf0bcf13abdbb968b [1,1,0,0,0,0|2,0,0]=4 1205 B11R0.142 CCOCCNC(=O)[C@@H](S)CC a0b67b9f1f2e20248d3ec448813e788e [1,1,0,0,0,0|2,0,0]=4 1206 B11R0.142 CCOCCNC(=O)[C@H](O)CC 54f6644b61a551b2b3a9538d71e048fe [1,1,0,0,0,0|2,0,0]=4 1207 B11R0.142 CCSCCNC(=O)C(O)CC 889db32b39034530a2dc32a55872a69a [1,1,0,0,0,0|2,0,0]=4 1208 B11R0.142 CCSCCNC(=O)[C@@H](O)CC 88b856c02c6b52c0983a2189b4cc5dd4 [1,1,0,0,0,0|2,0,0]=4 1209 B11R0.142 CCSCCNC(=O)[C@@H](S)CC a8b19f96fe38dc8bcf1eeffa5d27841c [1,1,0,0,0,0|2,0,0]=4 1210 B11R0.142 CCSCCNC(=O)[C@H](O)CC f7896de571d46b3a2d97cb183f694162 [1,1,0,0,0,0|2,0,0]=4 1211 B11R0.155 CC=CCNC(=O)C(=O)CCC a5f23b2865207d12034fac9dc7642233 [1,1,0,0,0,0|2,0,0]=4 1212 B11R0.155 CCCC(=O)N(C)CCOCC db00de519d1de829c327f6faf2225a0c [1,1,0,0,0,0|2,0,0]=4 1213 B11R0.155 CCCCCN(C)C(=O)CCC f69c208eb29980023e139971dcc14c2a [1,1,0,0,0,0|1,0,1]=4 1214 B11R0.161 C#CC(CCC)OC/C=C/CC e167e2b75d77696f6cab9ced38efeb7a [1,1,0,0,0,0|1,0,1]=4 1215 B11R0.161 C/C=C/CCOC(CC)CCC 5d7b7ab8db759c7c22e44fe7bb260424 [1,1,0,0,0,0|1,0,1]=4 1216 B11R0.161 C=CC(CCC)OC/C=C/CC 85211e77f58049f701662ccefee7f253 [1,1,0,0,0,0|1,0,1]=4 1217 B11R0.161 CC/C=C/COC(C#N)CCC 53d0da6c004062003ab3592fb8c56439 [1,1,0,0,0,0|1,0,1]=4 1218 B11R0.161 CC/C=C/COC(CC)CCC 1bbdcc5fca8108eeeb638fb3d78cc0fa [1,1,0,0,0,0|1,0,1]=4 1219 B11R0.161 CC/C=C/CO[C@H](CC)CCC 6235691545508d1d150e6161368964ce [1,1,0,0,0,0|1,0,1]=4 1220 B11R0.161 CC/C=C\CCN(CC)CCC dbd317682f16ec26aa2e77a8725d8aa3 [1,1,0,0,0,0|2,0,0]=4 1221 B11R0.161 CC/C=C\COC(CC)CCC 67a1a11af686676ea6e0175915509b27 [1,1,0,0,0,0|1,0,1]=4 1222 B11R0.174 C=C(C=O)OCOC(=O)CCC 5e06f3369c3f3bf72f048b83c87a0cc0 [1,1,0,0,0,0|2,0,0]=4 1223 B11R0.174 CCCC(=O)COCC(=O)CC 91dc256878eb6cf16348b6d554bcdbd9 [1,1,0,0,0,0|1,0,1]=4 1224 B11R0.174 CCCC(=O)NCCC(=O)NC a2cbeb6ba298dfc8cf8942b6dcb71f3f [1,1,0,0,0,0|2,0,0]=4 1225 B11R0.174 CCCC(=O)NCCC(=O)OC 4d6fb7da32841880d13d6f13be995f2c [1,1,0,0,0,0|2,0,0]=4 1226 B11R0.174 CCCC(=O)NCCC(C)CC 79808c5a5da21586a7f0cddccceb82d2 [1,1,0,0,0,0|1,0,1]=4 1227 B11R0.174 CCCC(=S)OCCC(=O)NC f9a881469a62d1b4732c0dc801ac9611 [1,1,0,0,0,0|1,1,0]=4 1228 B11R0.174 CCCC(=S)OCCC(=O)OC fc5d4b6a28a0db2c29f6eabef0f1c853 [1,1,0,0,0,0|1,1,0]=4 1229 B11R0.174 CCCC(=S)OCCC(C)CC 2ba61eadda133515d7485573787bb76b [1,1,0,0,0,0|0,1,1]=4 1230 B11R0.174 CCCC(=S)OCCS(=O)CC 2b06843b6c87c654bbe5e4424f1b7bfe [1,1,0,0,0,0|1,1,0]=4 1231 B11R0.174 CCCC(=S)OCOC(=O)CC 845ebcc1def87d3b0ee7c2b3643c5ed1 [1,1,0,0,0,0|1,1,0]=4 1232 B11R0.174 CCOC(=O)CCNC(=O)CC 2c6ee93110ee2203e50937f45b3e12e5 [1,1,0,0,0,0|2,0,0]=4 1233 B11R0.176 C=C(C)CCCOC(=S)CCC 06f0d2133543f9c78504c69a8dcd99b6 [1,1,0,0,0,0|0,1,1]=4 1234 B11R0.176 C=C(C)CNCOC(=O)CCC 2c571cde0834552be7ace0df261bed5e [1,1,0,0,0,0|1,0,1]=4 1235 B11R0.176 C=C(C)COCOC(=O)CCC 703e5b52959455f5f84dfadfe1e3f05c [1,1,0,0,0,0|1,0,1]=4 1236 B11R0.176 CCCC(=O)CNCC=C(C)C 8ab97d76a02b4d4571871d2ce955ad30 [1,1,0,0,0,0|2,0,0]=4 1237 B11R0.176 CCCC(=O)COC/C=C(/C)\Cl 772a3befa2bd492825d2151639a613df [1,1,0,0,0,0|2,0,0]=4 1238 B11R0.176 CCCC(=O)COC/C=C(/C)\I 583bc40c01ae96ff62a33eb87f03f4e2 [1,1,0,0,0,0|2,0,0]=4 1239 B11R0.176 CCCC(=O)COCC=C(C)C e6cb437c8d0e95c570cab34b02b069e0 [1,1,0,0,0,0|2,0,0]=4 1240 B11R0.176 CCCC(=O)COCC=C(C)I 0583d230250676c9fc3cc8c62b576b73 [1,1,0,0,0,0|2,0,0]=4 1241 B11R0.176 CCCC(=O)NCCCC(C)C 0addf1beaad564b615d19ab8a52af8fd [1,1,0,0,0,0|1,0,1]=4 1242 B11R0.176 CCCC(=O)NCCNC(=O)C fdf56c8b8f95ea88b4cd5b93357b35e6 [1,1,0,0,0,0|2,0,0]=4 1243 B11R0.176 CCCC(=O)NCCOC(C)C 8e1bc54ad65925ded434d7161bb4da8d [1,1,0,0,0,0|2,0,0]=4 1244 B11R0.176 CCCC(=O)OCCOC(C)C d6fb9d55c8594e21b596cb2208cfae4e [1,1,0,0,0,0|1,0,0]=3 1245 B11R0.176 CCCC(=O)OCNCC(=O)C b5673b9cd851f7367e2fa76dc814d144 [1,1,0,0,0,0|1,0,1]=4 1246 B11R0.176 CCCC(=O)OCNCC(C)C 462175424f431d5efe3005b98c3393e4 [1,1,0,0,0,0|1,0,1]=4 1247 B11R0.176 CCCC(=O)OCNCC(C)O b304759118d7c52a7f930f37e90b9124 [1,1,0,0,0,0|1,0,1]=4 1248 B11R0.176 CCCC(=O)OCNC[C@@H](C)O 0787f3e46adef2052e68a66bfd8172d2 [1,1,0,0,0,0|1,0,1]=4 1249 B11R0.176 CCCC(=O)OCNC[C@H](C)O 5ce52f7828f664ce01404fd1978aef6f [1,1,0,0,0,0|1,0,1]=4 1250 B11R0.176 CCCC(=O)OCOCC(=O)C 0cac0d6e16ed0d347915ddf8df507054 [1,1,0,0,0,0|1,0,1]=4 1251 B11R0.176 CCCC(=O)OCOCC(C)C 9d6081c835bc8424ad8872c9637ba9b8 [1,1,0,0,0,0|1,0,1]=4 1252 B11R0.176 CCCC(=O)OCOCC(C)F 95a6308264889399aeb20497624f246a [1,1,0,0,0,0|1,0,1]=4 1253 B11R0.176 CCCC(=O)OCOCC(C)S f505a3385959087b173f866d932faed1 [1,1,0,0,0,0|1,0,1]=4 1254 B11R0.176 CCCC(=O)OCOC[C@@H](C)F f5a607bf0a321f8665b4338b4b2e95ba [1,1,0,0,0,0|1,0,1]=4 1255 B11R0.176 CCCC(=O)OCOC[C@H](C)F 059a603dece5a36f772994b06679f618 [1,1,0,0,0,0|1,0,1]=4 1256 B11R0.176 CCCC(=S)OC/C=C/C(C)C 612e6401099c5564ea000cc248a17431 [1,1,0,0,0,0|0,1,0]=3 1257 B11R0.176 CCCC(=S)OCCC=C(C)C 38284e115eab0ddc4aaad1f7731e77ed [1,1,0,0,0,0|0,1,0]=3 1258 B11R0.176 CCCC(=S)OCCC=C(F)F 24dcc04d15bdd50e84fc9c69963248da [1,1,0,0,0,0|1,1,0]=4 1259 B11R0.176 CCCC(=S)OCCCC(=O)C ff8c32e800cfc46d63e45dc82c5e6201 [1,1,0,0,0,0|0,1,1]=4 1260 B11R0.176 CCCC(=S)OCCCC(C)C 0022d3acc9a321b5b7157c3dd124934e [1,1,0,0,0,0|0,1,1]=4 1261 B11R0.176 CCCC(=S)OCCNC(=O)C cc2665946396f075cc7bf5e63c2955bb [1,1,0,0,0,0|1,1,0]=4 1262 B11R0.176 CCCC(=S)OCCOC(=O)C ae069b6cbcfcd18a36157920621bff1f [1,1,0,0,0,0|1,1,0]=4 1263 B11R0.176 CCCC(=S)OCCOC(C)C 83ae0a38e2e7a1397a1ad203d1a72a47 [1,1,0,0,0,0|1,1,0]=4 1264 B11R0.176 CCCC(=S)OCCSC(=O)C 69852cfae80e84a25ad632eb466e80ef [1,1,0,0,0,0|1,1,0]=4 1265 B11R0.176 CCCC(=S)OCCSC(C)C 1b2e3e0bc770d0a913575700f740552a [1,1,0,0,0,0|1,1,0]=4 1266 B11R0.176 CCCC(C)OC/C=C/C(C)C 166c798843657b78d88676bd1a3e14e2 [1,1,0,0,0,0|1,0,1]=4 1267 B11R0.176 CCCC(C)OCCC=C(C)C 9511b5ed2303b3f367dff911bcb93f8d [1,1,0,0,0,0|1,0,1]=4 1268 B11R0.176 CCC[C@@H](C)OC/C=C/C(C)C fba119e0be35016870228ebaeafe0e10 [1,1,0,0,0,0|1,0,1]=4 1269 B11R0.176 CCC[C@@H](C)OCCC=C(C)C 557a757e72b91089c17d060683377757 [1,1,0,0,0,0|1,0,1]=4 1270 B11R0.176 CCC[C@H](C)OC/C=C/C(C)C 4f6cbf8e927288a6038da28f0185d2da [1,1,0,0,0,0|1,0,1]=4 1271 B11R0.176 CCC[C@H](C)OCCC=C(C)C 294caa694905787103e452dd5e386229 [1,1,0,0,0,0|1,0,1]=4 1272 B11R0.3 C#CCCCOCC/C=C/CC 6bc38f56792f3234470150204fc3bfef [1,1,0,0,0,0|0,0,2]=4 1273 B11R0.3 C#CCCCOCC/C=C\CC 9b65faf9da063b37e8c4f0e66f4e1b83 [1,1,0,0,0,0|0,0,2]=4 1274 B11R0.3 C/C=C/CCOCC/C=C\CC 130e75a457431060e807634c54ca368d [1,1,0,0,0,0|0,0,2]=4 1275 B11R0.3 C=CCCCOCC/C=C/CC 1f450e7ca7b65d300cb21122a428399c [1,1,0,0,0,0|0,0,2]=4 1276 B11R0.3 C=CCCCOCC/C=C\CC 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B11R0.3 CC/C=C/CCOCCSCC 5285bf5ad09cbcadaa8cb6988b0408aa [1,1,0,0,0,0|0,0,1]=3 1289 B11R0.3 CC/C=C/CNCCCCCC 4ea6a89a67bd880060b4122692e295c2 [1,1,0,0,0,0|1,0,1]=4 1290 B11R0.3 CC/C=C/CNCCOCCC 94f91dd23595886db93579c9fde26409 [1,1,0,0,0,0|2,0,0]=4 1291 B11R0.3 CC/C=C/COC/C=C/CCC 431c1240655b5db582c40d0d8df16b11 [1,1,0,0,0,0|1,0,0]=3 1292 B11R0.3 CC/C=C/COC/C=C\CCC 0ae03e71a753812c17f82bfd4033f61d [1,1,0,0,0,0|1,0,0]=3 1293 B11R0.3 CC/C=C/COCC#CCCC 1be4752b37171641cc95f20745848159 [1,1,0,0,0,0|1,0,1]=4 1294 B11R0.3 CC/C=C/COCCCCCC eb90121bb3484ddc510c42f4817c7d41 [1,1,0,0,0,0|1,0,1]=4 1295 B11R0.3 CC/C=C/COCCOCCC 9cc7e8c4d1d9a97715bfc8cbef889868 [1,1,0,0,0,0|2,0,0]=4 1296 B11R0.3 CC/C=C/COCCSCCC 95cab5376c5a30e2fc8eb4f66f596d44 [1,1,0,0,0,0|2,0,0]=4 1297 B11R0.3 CC/C=C/COCOCCCC 0d636c9ea306623be56f563bf5b5ad56 [1,1,0,0,0,0|0,0,1]=3 1298 B11R0.3 CC/C=C/COCOCCOC 7338080f804dd040d28cba7bbb054186 [1,1,0,0,0,0|1,0,1]=4 1299 B11R0.3 CC/C=C\CC/C=C/COCC c4775277c610e2a512b2810ad8f6e57c [1,1,0,0,0,0|1,0,0]=3 1300 B11R0.3 CC/C=C\CC/C=C/COCF 1fa87ffc3658f764572a559409bf78c6 [1,1,0,0,0,0|2,0,0]=4 1301 B11R0.3 CC/C=C\CCCCCOCC 3fcd157868f9d6a02a7d59a5bad0c445 [1,1,0,0,0,0|1,0,1]=4 1302 B11R0.3 CC/C=C\CCCCOCCC b91b66aedbd8d3f44f429a8b1d860578 [1,1,0,0,0,0|1,0,1]=4 1303 B11R0.3 CC/C=C\CCCOCCCC 4cdaf8803428e2d9f645148af5a0d0b2 [1,1,0,0,0,0|0,0,1]=3 1304 B11R0.3 CC/C=C\CCCOCCCF 98835682c1129b1c7916d471184b4885 [1,1,0,0,0,0|1,0,1]=4 1305 B11R0.3 CC/C=C\CCCOCCCS 665272f90257bf8bbc1f5634ba395f6f [1,1,0,0,0,0|1,0,1]=4 1306 B11R0.3 CC/C=C\CCCOCCOC b1bbbe91f93c611f79d8b0fb289f6aad [1,1,0,0,0,0|1,0,1]=4 1307 B11R0.3 CC/C=C\CCCOCCSC 0d602f7c41af76f66157c88769ec6ec6 [1,1,0,0,0,0|1,0,1]=4 1308 B11R0.3 CC/C=C\CCCOCOCC 33dae2e12167b7eabf2c7ee083b312ad [1,1,0,0,0,0|1,0,1]=4 1309 B11R0.3 CC/C=C\CCNCCCCC ca3a0d15ea7c79f615890d56cab14290 [1,1,0,0,0,0|1,0,1]=4 1310 B11R0.3 CC/C=C\CCNCCCCCl dda2a530611fdbf5cddb0da844142b75 [1,1,0,0,0,0|1,0,1]=4 1311 B11R0.3 CC/C=C\CCNCCCCO 8f9446d6f8c1d403a5239feba0633bcf [1,1,0,0,0,0|1,0,1]=4 1312 B11R0.3 CC/C=C\CCNCCCCS 41e22787e6bd684e714fb3824d1a92b3 [1,1,0,0,0,0|1,0,1]=4 1313 B11R0.3 CC/C=C\CCNCCCOC 38419656a7bfb9551b88b8ef34315094 [1,1,0,0,0,0|1,0,1]=4 1314 B11R0.3 CC/C=C\CCNCCCSC 093fb32e4e5e7565a978551e5033c7ed [1,1,0,0,0,0|1,0,1]=4 1315 B11R0.3 CC/C=C\CCNCCOCC 7586b845ef1626eb48de22bcee77f37b [1,1,0,0,0,0|1,0,1]=4 1316 B11R0.3 CC/C=C\CCNCCSCC 3c861bbe373217ef0e7c857e52753952 [1,1,0,0,0,0|1,0,1]=4 1317 B11R0.3 CC/C=C\CCOC/C=C/CC 4967ea7bb96107ad52335773945d5447 [1,1,0,0,0,0|0,0,1]=3 1318 B11R0.3 CC/C=C\CCOC/C=C\CC 9ffbf7e8ff743b19e5d3a827e1362fae [1,1,0,0,0,0|0,0,1]=3 1319 B11R0.3 CC/C=C\CCOCCCC#N 6f51585e5cf231cccdf7e8868b34a8e6 [1,1,0,0,0,0|0,0,2]=4 1320 B11R0.3 CC/C=C\CCOCCCC=O d9f9e81c0e1218665dea141d10997379 [1,1,0,0,0,0|0,0,2]=4 1321 B11R0.3 CC/C=C\CCOCCCCC 26ad29cfc366b08d786d9b655a0964e4 [1,1,0,0,0,0|0,0,1]=3 1322 B11R0.3 CC/C=C\CCOCCCCF 3fd058640593676b2194ed4dd999eb72 [1,1,0,0,0,0|0,0,1]=3 1323 B11R0.3 CC/C=C\CCOCCCCS 85bb847715880a394fd78eea2b3c923b [1,1,0,0,0,0|0,0,1]=3 1324 B11R0.3 CC/C=C\CCOCCCOC d9dc9776c04f9dda2dfd8674e381212a [1,1,0,0,0,0|0,0,1]=3 1325 B11R0.3 CC/C=C\CCOCCCSC 8f41472641c02a41ae5f67f4917f0af3 [1,1,0,0,0,0|0,0,1]=3 1326 B11R0.3 CC/C=C\CCOCCOCC 04dac999673e037fe50cf5f521ee462d [1,1,0,0,0,0|0,0,1]=3 1327 B11R0.3 CC/C=C\CCOCCSCC 67d16d9b6fc19034eb83a73318f27b0e [1,1,0,0,0,0|0,0,1]=3 1328 B11R0.3 CC/C=C\COC/C=C/CCC 9f0304d675a3454ce4d3415b70d9a844 [1,1,0,0,0,0|1,0,0]=3 1329 B11R0.3 CC/C=C\COC/C=C\CCC f28d8c97e11462919c333ccf3c8c08af [1,1,0,0,0,0|1,0,0]=3 1330 B11R0.3 CC/C=C\COCCCCCC 9755557f3f5961e4b7217afb6d53fd2f [1,1,0,0,0,0|1,0,1]=4 1331 B11R0.3 CC/C=C\COCCOCCC 8399b5ba7d8ae3af7874349b04bbbee4 [1,1,0,0,0,0|2,0,0]=4 1332 B11R0.3 CC/C=C\COCOCCCC ecbff20520a997a442bc1e107ec28aeb [1,1,0,0,0,0|0,0,1]=3 1333 B11R0.3 CC/C=C\COCOCCOC 277c631a8c44db0f00bb69dcc3513e5b [1,1,0,0,0,0|1,0,1]=4 1334 B11R0.3 CCC#CCOCC/C=C/CC 2bf7dec6d1acfb68134ee2c8ac97ce4a [1,1,0,0,0,0|0,0,2]=4 1335 B11R0.3 CCC#CCOCC/C=C\CC 05026b7f910f127b0b3699727a003e4f [1,1,0,0,0,0|0,0,2]=4 1336 B11R0.3 CCC/C=C/CCCOCCC dae1775eca5913317c5cd584ee8751c6 [1,1,0,0,0,0|2,0,0]=4 1337 B11R0.3 CCC/C=C\CCCOCCC 9d2652818f4292c6bd7658d96bf7fce0 [1,1,0,0,0,0|2,0,0]=4 1338 B11R0.3 CCC/C=C\CCOCCCC 9e74787723b6c36b8e5fff0d11977396 [1,1,0,0,0,0|0,0,1]=3 1339 B11R0.3 CCC/C=C\CCOCCCF dd989db2289351ef5ce7df50d48f6ddb [1,1,0,0,0,0|1,0,1]=4 1340 B11R0.3 CCC/C=C\CCOCCCS b79df2321dfd6b64cfc3914ae100f69d [1,1,0,0,0,0|1,0,1]=4 1341 B11R0.3 CCC/C=C\CCOCCOC 54b94a67fbd01818f073011ed3235f49 [1,1,0,0,0,0|1,0,1]=4 1342 B11R0.3 CCC/C=C\CCOCCSC d1fbff8adee1bfbcb12bdd9d9ad6634b [1,1,0,0,0,0|1,0,1]=4 1343 B11R0.3 CCC/C=C\CCOCOCC b227ec100de3b879ddd32c02a1864e6a [1,1,0,0,0,0|1,0,1]=4 1344 B11R0.3 CCC=CCCC=CCOCC 002eeb171ac1bc76c2fb1e09fb71288f [1,1,0,0,0,0|1,0,0]=3 1345 B11R0.3 CCC=CCCC=CCOCF 737c3d25039b6df5eb6388ca5e71e0c4 [1,1,0,0,0,0|2,0,0]=4 1346 B11R0.3 CCC=CCCCCCOCC acb4ebc5d4b9da3999d78f72f192ac9b [1,1,0,0,0,0|1,0,1]=4 1347 B11R0.40 C=C(CC)COCC/C=C/CC af27fe86ee193e68613a59926e431592 [1,1,0,0,0,0|0,0,2]=4 1348 B11R0.40 C=C(CC)COCC/C=C\CC 08b27437140fb8c6693e3a7f24cd18e1 [1,1,0,0,0,0|0,0,2]=4 1349 B11R0.40 CC/C=C/CCOCC(=O)CC 5dd2e8d1d699073d1052090261a24f09 [1,1,0,0,0,0|0,0,2]=4 1350 B11R0.40 CC/C=C/CCOCC(C)CC a18893e95294266df641a7f75df77371 [1,1,0,0,0,0|0,0,1]=3 1351 B11R0.40 CC/C=C/CCOCC(C)OC b69bab836f7ce24a669ac84b7b97f67c [1,1,0,0,0,0|1,0,1]=4 1352 B11R0.40 CC/C=C/CCOCC(O)CO d5bb2cc2b2fc8bfe0132ad28ede8c792 [1,1,0,0,0,0|1,0,1]=4 1353 B11R0.40 CC/C=C/CCOC[C@@H](C)CC 6a7ff2db86ad7259184ffa9f1833190d [1,1,0,0,0,0|0,0,1]=3 1354 B11R0.40 CC/C=C/CCOC[C@@H](C)OC 88bc44add226273e3e2aad0182353713 [1,1,0,0,0,0|1,0,1]=4 1355 B11R0.40 CC/C=C/CCOC[C@@H](O)CO de6e33a79b3953dc1a3a4f890c222712 [1,1,0,0,0,0|1,0,1]=4 1356 B11R0.40 CC/C=C/CCOC[C@H](C)CC 46f27b7828b11bb004eebf552002aba2 [1,1,0,0,0,0|0,0,1]=3 1357 B11R0.40 CC/C=C/CCOC[C@H](C)OC f5782ff7224b37eae9c4f50ed5cfc96b [1,1,0,0,0,0|1,0,1]=4 1358 B11R0.40 CC/C=C/CCOC[C@H](O)CO 27d1638a089071e638bedc7e8339f1dd [1,1,0,0,0,0|1,0,1]=4 1359 B11R0.40 CC/C=C\CCCOC(C)CC d3d8b9519d2be88cee2ffda7eda847dd [1,1,0,0,0,0|2,0,0]=4 1360 B11R0.40 CC/C=C\CCNCC(C)CC f95284a6652f89b8ca36267b81279e41 [1,1,0,0,0,0|1,0,1]=4 1361 B11R0.40 CC/C=C\CCNCC(O)CC d3e06e192f877304707d30533ae19d86 [1,1,0,0,0,0|1,0,1]=4 1362 B11R0.40 CC/C=C\CCNC[C@@H](C)CC 37e68e9372b32a11010391a5104a30df [1,1,0,0,0,0|1,0,1]=4 1363 B11R0.40 CC/C=C\CCNC[C@H](O)CC 607e86fcce4ce79a2d479a974464af41 [1,1,0,0,0,0|1,0,1]=4 1364 B11R0.40 CC/C=C\CCOCC(=O)CC 8b7645a2c7d49be789738e918c3d3344 [1,1,0,0,0,0|0,0,2]=4 1365 B11R0.40 CC/C=C\CCOCC(Br)CBr ec53f3d2cfbb06d4dbc41c4fd310eeb7 [1,1,0,0,0,0|1,0,1]=4 1366 B11R0.40 CC/C=C\CCOCC(C)CC 7be206bf36abd75136c6f76c2f007f15 [1,1,0,0,0,0|0,0,1]=3 1367 B11R0.40 CC/C=C\CCOCC(C)OC 55a39f855b2d92803c0b3307dbb6f098 [1,1,0,0,0,0|1,0,1]=4 1368 B11R0.40 CC/C=C\CCOCC(Cl)CCl 4ab6e4728c31e7ab1c2d0742ac958bba [1,1,0,0,0,0|1,0,1]=4 1369 B11R0.40 CC/C=C\CCOCC(O)CO 6118ec4778b8f6429a46f3ec34b19ffe [1,1,0,0,0,0|1,0,1]=4 1370 B11R0.40 CC/C=C\CCOCC(S)CS f4e3db4a0c7cff2da01377cfe7c40518 [1,1,0,0,0,0|1,0,1]=4 1371 B11R0.40 CC/C=C\CCOC[C@@H](C)CC c3d86722637108e275c54b064d03985d [1,1,0,0,0,0|0,0,1]=3 1372 B11R0.40 CC/C=C\CCOC[C@@H](C)OC 062e2347423372bafb74a66ee6342756 [1,1,0,0,0,0|1,0,1]=4 1373 B11R0.40 CC/C=C\CCOC[C@@H](O)CO 7320fcc4720f09f20b0e5859446bfd13 [1,1,0,0,0,0|1,0,1]=4 1374 B11R0.40 CC/C=C\CCOC[C@H](C)CC 31b408c8a11bab3cf180e17165f8d169 [1,1,0,0,0,0|0,0,1]=3 1375 B11R0.40 CC/C=C\CCOC[C@H](C)OC bbea1b798c5ce3ceee890ace608f3c13 [1,1,0,0,0,0|1,0,1]=4 1376 B11R0.40 CC/C=C\CCOC[C@H](O)CO 6ce47864b8dc30ad9bbfa39c55d7d2b8 [1,1,0,0,0,0|1,0,1]=4 1377 B11R0.40 CCCCOCCNC(=O)CC e75a887cb4393e27da632a529a3d90a7 [1,1,0,0,0,0|1,0,1]=4 1378 B11R0.40 CCCCOCCOC(=O)CC 6522276dd406ffc521118952ffb4c4ea [1,1,0,0,0,0|1,0,1]=4 1379 B11R0.148 C=C(C)CCOCC/C=C/CC ea5e23e2de50deab35d9cd15f31be91d [1,1,0,0,0,0|0,0,2]=4 1380 B11R0.148 C=C(C)CCOCC/C=C\CC 5e94700de9e1a0ab3559c16378631e52 [1,1,0,0,0,0|0,0,2]=4 1381 B11R0.148 CC/C=C/CCOCCC(=O)C c4bfcc2faa6b266f64a44f7a2cea6d9f [1,1,0,0,0,0|0,0,2]=4 1382 B11R0.148 CC/C=C/CCOCCC(C)C 0c409bbce4f0953e5714918144060bc0 [1,1,0,0,0,0|0,0,1]=3 1383 B11R0.148 CC/C=C/CCOCCN(C)C 9f9441228ffa3eb3071f32bb4c2156e6 [1,1,0,0,0,0|1,0,1]=4 1384 B11R0.148 CC/C=C/CCOCCS(=O)C 636f7d472631c8a28f47af68fbf3dd18 [1,1,0,0,0,0|1,0,1]=4 1385 B11R0.148 CC/C=C/CCOCOC(C)C e78ad72511e971952ad04bd7608f4fa0 [1,1,0,0,0,0|1,0,1]=4 1386 B11R0.148 CC/C=C\CCCOCC(C)C f8bf2f68b16ad84043bbf53ff7974f2b [1,1,0,0,0,0|2,0,0]=4 1387 B11R0.148 CC/C=C\CCNCCC(C)C 6a3cabd009c8f25df7594bac6c761814 [1,1,0,0,0,0|1,0,1]=4 1388 B11R0.148 CC/C=C\CCNCCC(C)O c665383f5fbf967ba7cfc2537fb515ab [1,1,0,0,0,0|1,0,1]=4 1389 B11R0.148 CC/C=C\CCNCC[C@@H](C)O 7c9b7f670eefb8999e7ad7fc265a06c6 [1,1,0,0,0,0|1,0,1]=4 1390 B11R0.148 CC/C=C\CCNCC[C@H](C)O 55c96021768f05b6ad6bfef79bc6610d [1,1,0,0,0,0|1,0,1]=4 1391 B11R0.148 CC/C=C\CCOCCC(=O)C 28eb2f180b3260523b6c71f60031cd53 [1,1,0,0,0,0|0,0,2]=4 1392 B11R0.148 CC/C=C\CCOCCC(C)C 5dbcceee9676e5d2ec6618069adfb935 [1,1,0,0,0,0|0,0,1]=3 1393 B11R0.148 CC/C=C\CCOCCC(F)F 752db6921ca46bb8d65ed41490791cc0 [1,1,0,0,0,0|1,0,1]=4 1394 B11R0.148 CC/C=C\CCOCCN(C)C 99d65fa6de9052da231c731a4b8a2965 [1,1,0,0,0,0|1,0,1]=4 1395 B11R0.148 CC/C=C\CCOCCS(=O)C d50d518acb592b170308ddca015fb4ba [1,1,0,0,0,0|1,0,1]=4 1396 B11R0.148 CC/C=C\CCOCOC(C)C b7888d582109a153668c730912944546 [1,1,0,0,0,0|1,0,1]=4 1397 B11R0.42 CC/C=C/CCOC(C)C(C)C 619bf1e45e1c07343b6c32b31b26512d [1,1,0,0,0,0|1,0,1]=4 1398 B11R0.42 CC/C=C/COCC(=O)C(C)C 575afa7845ab5a70c62dcb955b435711 [1,1,0,0,0,0|2,0,0]=4 1399 B11R0.42 CC/C=C\CCOC(C)C(C)C 7a13b6bfc45f68691bd1d7ed0c8df182 [1,1,0,0,0,0|1,0,1]=4 1400 B11R0.42 CC/C=C\CCOC(C)C(C)S 1adf5f4589f9621118b23139aca6b492 [1,1,0,0,0,0|1,0,1]=4 1401 B11R0.42 CC/C=C\CCO[C@@H](C)C(C)C 00e50cb0dece4fb1b47f85786f40b6a4 [1,1,0,0,0,0|1,0,1]=4 1402 B11R0.42 CC/C=C\CCO[C@H](C)C(C)C 95fb3fb47ca4bdeca61bb4c1af8f3da3 [1,1,0,0,0,0|1,0,1]=4 1403 B11R0.42 CC/C=C\COCC(=O)C(C)C 7d77da8d9570e1867b2da14454b60932 [1,1,0,0,0,0|2,0,0]=4 1404 B11R0.42 CCCOCCOC(=O)C(C)C 18acbd40de983c60d8c14c656cc35337 [1,1,0,0,0,0|1,0,1]=4 1405 B11R0.106 CCC(=O)COCOC(=O)CC 59703a00f2c88730943f6b74bb710e65 [1,1,0,0,0,0|1,0,1]=4 1406 B11R0.106 CCC(=O)NCCNC(=O)CC 1a93d978d3a6fb6f474e4397112a0f50 [1,1,0,0,0,0|2,0,0]=4 1407 B11R0.106 CCC(=O)OCCOC(C)CC f0ea60d04e18431aabc16e7fa3a3fc58 [1,1,0,0,0,0|1,0,1]=4 1408 B11R0.111 CCC(=O)COC/C=C/C(C)C 1bec8286cd359f6208fd67fa38ee6d26 [1,1,0,0,0,0|2,0,0]=4 1409 B11R0.111 CCC(=O)OCCOCC(C)C 50d6d7032a8c30d3c2e4cd419a7563eb [1,1,0,0,0,0|1,0,1]=4 1410 B11R0.124 C#CC(CC)OCC/C=C\CC 57217f10c51f2c7ccd86a3c94370fee6 [1,1,0,0,0,0|1,0,1]=4 1411 B11R0.124 C=CC(CC)OCC/C=C\CC 40776d61ca46a12c45a53eb3092d2461 [1,1,0,0,0,0|1,0,1]=4 1412 B11R0.124 CC/C=C/CCOC(C=O)CC d73764839fb3b49c8bd6466aa8f126fc [1,1,0,0,0,0|0,0,1]=3 1413 B11R0.124 CC/C=C/CCOC(CC)CC cc64be8f689b030f7425d66a879d2208 [1,1,0,0,0,0|1,0,1]=4 1414 B11R0.124 CC/C=C\CCOC(C#N)CC f2de680aea8717e0061bc7a0629b0582 [1,1,0,0,0,0|1,0,1]=4 1415 B11R0.124 CC/C=C\CCOC(C=O)CC 6f214a95249d43c4b4bec48cec56b6fd [1,1,0,0,0,0|0,0,1]=3 1416 B11R0.124 CC/C=C\CCOC(CC)CC 8b76e182edcaae22f6a1e2378f99370b [1,1,0,0,0,0|1,0,1]=4 1417 B13R0.2 C#CCCCOCCOC(=O)CCC e5f4b906e8d43bf5f82850b7d074b75f [0,2,0,0,0,0|1,0,1]=4 1418 B13R0.2 C/C=C/C=C/COCOC(=O)CCC d5dc5b9004aac0086fe11f7a7d9a1390 [0,2,0,0,0,0|0,0,1]=3 1419 B13R0.2 C/C=C/C=C/COCOC(=O)OCC 4b0803c6ac32d29e7c4819421b299cbc [0,2,0,0,0,0|1,0,1]=4 1420 B13R0.2 C/C=C/C=C/COCOC(=O)SCC 9eff92d0fb950b0bfa1835530d4479ab [0,2,0,0,0,0|1,0,1]=4 1421 B13R0.2 C/C=C/CCCOCOC(=O)CCC a5ed737af3b6f92eb20f7d16c99d2dac [0,2,0,0,0,0|0,0,2]=4 1422 B13R0.2 C/C=C\CCCOCOC(=O)CCC fa18b501087cc2d47e19054fad78447b [0,2,0,0,0,0|0,0,2]=4 1423 B13R0.2 C=C/C=C/CCNCOC(=O)CCC 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CC/C=C/CCOCC(=O)OCCC 05e807d7fa637b47083c7e00f1eb459f [0,2,0,0,0,0|0,0,0]=2 1547 B13R0.66 CC/C=C/COCCC(=O)OCCC 338d970eaa353043b54fc67ce712bc41 [0,2,0,0,0,0|1,0,0]=3 1548 B13R0.66 CC/C=C/COCOC(=O)CCCC 02a168759682a628eadf3ca4b3ceef2c [0,2,0,0,0,0|0,0,0]=2 1549 B13R0.66 CC/C=C/COCOC(=O)OCCC 1dde129a7857be3f8e5ffdecfeef937f [0,2,0,0,0,0|0,0,0]=2 1550 B13R0.66 CC/C=C\CCCOC(C)CCCC a97bcd30d1eca581b92e6d4b04a91116 [0,2,0,0,0,0|1,0,1]=4 1551 B13R0.66 CC/C=C\CCNCC(=O)NCCC 652a09c6d7e7e2052c8274500f5c0e0a [0,2,0,0,0,0|1,0,0]=3 1552 B13R0.66 CC/C=C\CCNCC(=O)NCCO c479aa4da8686651c5dc67650294b305 [0,2,0,0,0,0|2,0,0]=4 1553 B13R0.66 CC/C=C\CCOCC(=O)CCSC cd93ef425dea85b9d7362a6e64fb7b0e [0,2,0,0,0,0|0,0,0]=2 1554 B13R0.66 CC/C=C\CCOCC(=O)NCC#N 372c9e2b85da4d762581d900466ae030 [0,2,0,0,0,0|1,0,1]=4 1555 B13R0.66 CC/C=C\CCOCC(=O)NCCC 7aa446aa1c13e92b72336c2f1f301c0b [0,2,0,0,0,0|0,0,0]=2 1556 B13R0.66 CC/C=C\CCOCC(=O)OCCC 60ccb19ee2df3bb2637c9b137906e7f3 [0,2,0,0,0,0|0,0,0]=2 1557 B13R0.66 CC/C=C\CCOCC(C)CCCC 3d9df6a9cddf5c103b5420d99fe9bf25 [0,2,0,0,0,0|1,0,1]=4 1558 B13R0.66 CC/C=C\CCOCC(C)COCC 674cf8b24d659baf08d6537292fd5077 [0,2,0,0,0,0|1,0,1]=4 1559 B13R0.66 CC/C=C\COCOC(=O)CCCC b34fdcd4cdad8610c666da0554f64477 [0,2,0,0,0,0|0,0,0]=2 1560 B13R0.66 CC/C=C\COCOC(=O)OCCC 3d979cebd744f991807819a02ecf0a1e [0,2,0,0,0,0|0,0,0]=2 1561 B13R0.66 CC=C=CCCOCC(=O)CCSC 08a04e2e3ce297122449f9070e134746 [0,2,0,0,0,0|0,0,2]=4 1562 B13R0.66 CC=C=CCCOCC(=O)NCCC dbc933299a01743064af306ebaab264d [0,2,0,0,0,0|0,0,2]=4 1563 B13R0.66 CC=C=CCCOCC(=O)OCCC 47bce389a38c49ee14909a2bd757b0e0 [0,2,0,0,0,0|0,0,2]=4 1564 B13R0.66 CC=CC=CCOCC(=O)CCSC e2fd86084b2e47af3d29c1be9af3567c [0,2,0,0,0,0|0,0,2]=4 1565 B13R0.66 CC=CC=CCOCC(=O)NCCC 44f3c3b4c58ca75891a010a1febc32ba [0,2,0,0,0,0|0,0,2]=4 1566 B13R0.66 CC=CC=CCOCC(=O)OCCC 2bd64ac3cc28bccd70b986838837610b [0,2,0,0,0,0|0,0,2]=4 1567 B13R0.66 CC=CCCCOCC(=O)CCSC 948ec2827afe2a601890086c50f82dc4 [0,2,0,0,0,0|0,0,2]=4 1568 B13R0.66 CC=CCCCOCC(=O)NCCC badf96832ab88a2d62d90d1f7a409171 [0,2,0,0,0,0|0,0,2]=4 1569 B13R0.66 CC=CCCCOCC(=O)OCCC c637b6a19bc1939569d4933906fdd00f [0,2,0,0,0,0|0,0,2]=4 1570 B13R0.66 CCC#CCCOCC(=O)CCSC 65daef02c58af34e1e512767ba7218d3 [0,2,0,0,0,0|0,0,2]=4 1571 B13R0.66 CCC#CCCOCC(=O)NCCC 0321973fca82dac37bab74a6bdc96a55 [0,2,0,0,0,0|0,0,2]=4 1572 B13R0.66 CCC#CCCOCC(=O)OCCC e0ff73bded91af664c17b39d16052446 [0,2,0,0,0,0|0,0,2]=4 1573 B13R0.66 CCC#CCOCOC(=O)CCCC 6afc940b97571d00c6114a961717c3a9 [0,2,0,0,0,0|0,0,2]=4 1574 B13R0.66 CCC#CCOCOC(=O)OCCC 560a7533b392c39d1f1872f11ee6a74e [0,2,0,0,0,0|0,0,2]=4 1575 B13R0.66 CCC/C=C/CCCC(=O)NCCBr 459028e94b65bf0c553b515f84a9dd8c [0,2,0,0,0,0|2,0,0]=4 1576 B13R0.66 CCC/C=C/CCCC(=O)NCCC fcc7b47c52ccec929be73b8366d385d9 [0,2,0,0,0,0|1,0,0]=3 1577 B13R0.66 CCC/C=C/CCCC(=O)NCCF 8d9fda9efe38ebe5f8fcec4badecc3ce [0,2,0,0,0,0|2,0,0]=4 1578 B13R0.66 CCC/C=C/CCCC(=O)NCCI 3cef943d590d86ac05c3c7f09d29dd95 [0,2,0,0,0,0|2,0,0]=4 1579 B13R0.66 CCC/C=C/CCCC(=O)NCCO f06f73c26a57372aee80a97c69379625 [0,2,0,0,0,0|2,0,0]=4 1580 B13R0.66 CCC/C=C/CCCC(=O)NCCS a86c6f673849ea2d255984ec4cb87657 [0,2,0,0,0,0|2,0,0]=4 1581 B13R0.66 CCC/C=C/CNCC(=O)NCCC 82ffd0b2cfc18d126fff38d3e4d6f370 [0,2,0,0,0,0|2,0,0]=4 1582 B13R0.66 CCC/C=C/COCC(=O)CCSC 88ebeac819cf75645c26ad2fe59a3d09 [0,2,0,0,0,0|0,0,2]=4 1583 B13R0.66 CCC/C=C/COCC(=O)NCCC 076c6d7f3313051f6b8de3205b7ee749 [0,2,0,0,0,0|0,0,2]=4 1584 B13R0.66 CCC/C=C/COCC(=O)OCCC e1f925b28e1e385c196a6790621973f8 [0,2,0,0,0,0|0,0,2]=4 1585 B13R0.66 CCC/C=C\CCOC(C)CCCC 407540d9c88fe1df3a3a0156e60142ac [0,2,0,0,0,0|1,0,1]=4 1586 B13R0.66 CCC/C=C\CNCC(=O)NCCC 2dbdc0d27fc8b02b14112d93d879cfa9 [0,2,0,0,0,0|2,0,0]=4 1587 B13R0.66 CCC/C=C\COCC(=O)CCSC b6585a80c501bcf3aa1f72b345299ae0 [0,2,0,0,0,0|0,0,2]=4 1588 B13R0.66 CCC/C=C\COCC(=O)NCCC 4081990479782a724b139f2e5b76a6ee [0,2,0,0,0,0|0,0,2]=4 1589 B13R0.66 CCC/C=C\COCC(=O)OCCC 199fb6346a1dd6fa5f14c580c774e3ff [0,2,0,0,0,0|0,0,2]=4 1590 B13R0.66 CCCCC(=O)OCNCCOCC 4f335f6ec138a6115f5c277f953158de [0,2,0,0,0,0|1,0,1]=4 1591 B13R0.66 CCCCC(=O)OCNCCSCC 5d1a50e6041894b44e5e07f6da173c2e [0,2,0,0,0,0|1,0,1]=4 1592 B13R0.66 CCCCC(=O)OCOC/C=C/C=O c0ed7f752d06da35b8b798d085eec83a [0,2,0,0,0,0|1,0,1]=4 1593 B13R0.66 CCCCC(=O)OCOCCOCC da1c30fb13ba845433dd9dc762496586 [0,2,0,0,0,0|1,0,1]=4 1594 B13R0.66 CCCCC(=O)OCOCCSCC 1aa269d37591f683c7b9aef09b38f848 [0,2,0,0,0,0|1,0,1]=4 1595 B13R0.66 CCCCCCOCC(=O)CCSC 090eace8f41effd70d4270a8fcd07f74 [0,2,0,0,0,0|0,0,2]=4 1596 B13R0.66 CCCCCCOCC(=O)NCCC 26b263992edbfa53df49a4b91b94e9ec [0,2,0,0,0,0|0,0,2]=4 1597 B13R0.66 CCCCCCOCC(=O)OCCC d005979674755503a456ea7894191e9e [0,2,0,0,0,0|0,0,2]=4 1598 B13R0.66 CCCCCNCOC(=O)CCCC d956c20abea1be619b02522e8f602b09 [0,2,0,0,0,0|0,0,2]=4 1599 B13R0.66 CCCCCNCOC(=O)OCCC 4dd0cdfa02480877d468e904e316e0a7 [0,2,0,0,0,0|0,0,2]=4 1600 B13R0.66 CCCCCOCOC(=O)CCCC 3f76bdaee6f01cc5d754e6c5cf40c35d [0,2,0,0,0,0|0,0,2]=4 1601 B13R0.66 CCCCCOCOC(=O)OCCC 2b9c07fc63ba8f501ff6f882c30d4e2e [0,2,0,0,0,0|0,0,2]=4 1602 B13R0.66 CCCNC(=O)COCCCOCC 41f2195c6307c6cd3a62fbbdd5471ceb [0,2,0,0,0,0|1,0,1]=4 1603 B13R0.66 CCCNC(=O)COCCCSCC 0a00924e7ec3692bcd68affb1691e511 [0,2,0,0,0,0|1,0,1]=4 1604 B13R0.66 CCCNC(=O)COCCOCCC 2ebfcbb6600ca6271369d0e45facc650 [0,2,0,0,0,0|1,0,1]=4 1605 B13R0.66 CCCNC(=O)COCCSCCC fac428660d7eae358c36177da8860e63 [0,2,0,0,0,0|1,0,1]=4 1606 B13R0.66 CCCOC(=O)COCCCOCC d0b0560035f27e3c01dd496291fb2b25 [0,2,0,0,0,0|1,0,1]=4 1607 B13R0.66 CCCOC(=O)COCCCSCC 954da4a6f104f3a7e52a22b2f6484837 [0,2,0,0,0,0|1,0,1]=4 1608 B13R0.66 CCCOC(=O)COCCSCCC 01b24229302f2b6fb3767b943378e591 [0,2,0,0,0,0|1,0,1]=4 1609 B13R0.66 CCCOC(=O)OCNCCOCC 75c0c7f74718e9527e14df81e859b0f0 [0,2,0,0,0,0|1,0,1]=4 1610 B13R0.66 CCCOC(=O)OCNCCSCC 94d5365aa33f2c34310e437265a6aabe [0,2,0,0,0,0|1,0,1]=4 1611 B13R0.66 CCCOC(=O)OCOC/C=C/C=O 9a6a5cbb01376953b5c1350b96eddde4 [0,2,0,0,0,0|1,0,1]=4 1612 B13R0.66 CCCOC(=O)OCOCCOCC 4225d1e022f078e0f7cb63ba0b928397 [0,2,0,0,0,0|1,0,1]=4 1613 B13R0.66 CCCOC(=O)OCOCCSCC 7bd70455514ffc71955c621e216e3ce7 [0,2,0,0,0,0|1,0,1]=4 1614 B13R0.66 CCCOCCOCC(=O)CCSC b582a954908b556f0d98a0e8d7c1d287 [0,2,0,0,0,0|1,0,1]=4 1615 B13R0.66 CCCOCCOCC(=O)OCCC 7ba8198de6093b9c50828d348eca7544 [0,2,0,0,0,0|1,0,1]=4 1616 B13R0.66 CCCSCCOCC(=O)CCSC 12283a1af3a1cffe9d14cdc6cc99d1c7 [0,2,0,0,0,0|1,0,1]=4 1617 B13R0.66 CCOCCCOCC(=O)CCSC 3fdc8e8851226009e62113ac821f4522 [0,2,0,0,0,0|1,0,1]=4 1618 B13R0.66 CCSCCCOCC(=O)CCSC 456d2b875352874b1cdd6a0919e6028b [0,2,0,0,0,0|1,0,1]=4 1619 B13R0.87 C#C/C(=C/COCOC(=O)CCC)/C eb06d7869b591529f2db8b4093c85cab [0,2,0,0,0,0|0,0,2]=4 1620 B13R0.87 C#C/C(=C\COCOC(=O)CCC)/C 103962ecb8b34c313d209b0c6cb81617 [0,2,0,0,0,0|0,0,2]=4 1621 B13R0.87 C=C(CC)COCCOC(=O)CCC 1ceb1283727441276a51ba733089a741 [0,2,0,0,0,0|0,0,1]=3 1622 B13R0.87 C=C(COCCOC(=O)CCC)OC 3cdc0070a0b747b321c9b4d57b7bac4d [0,2,0,0,0,0|1,0,1]=4 1623 B13R0.87 CCC(=O)NCCOCC(=O)COC b83519f2b662e74d67082c040d831f7b [0,2,0,0,0,0|2,0,0]=4 1624 B13R0.87 CCC(=O)OCCOCC(=O)COC a22743846f0fade650505ad152291510 [0,2,0,0,0,0|2,0,0]=4 1625 B13R0.87 CCCC(=O)CNCCNC(=O)CC f2b533b29a932b813ac9a003c7bc37c5 [0,2,0,0,0,0|2,0,0]=4 1626 B13R0.87 CCCC(=O)COC/C=C/C(=O)OC 66fc7602710d43df5b40bd5187482192 [0,2,0,0,0,0|1,0,1]=4 1627 B13R0.87 CCCC(=O)COCCCC(=O)NC 84a398cc633d4fefbd69acb0fbe66c5e [0,2,0,0,0,0|1,0,1]=4 1628 B13R0.87 CCCC(=O)COCCCC(C)CC d66adeb2e85eb013c947927cb2df7cf3 [0,2,0,0,0,0|0,0,2]=4 1629 B13R0.87 CCCC(=O)COCCCN(C)CC d272483c97b3bcfb2551e82054da19a0 [0,2,0,0,0,0|1,0,1]=4 1630 B13R0.87 CCCC(=O)COCCC[C@@H](C)CC 5dd8bddcfd6726c6f19e58f22340f114 [0,2,0,0,0,0|0,0,2]=4 1631 B13R0.87 CCCC(=O)COCCNC(=O)CC 27df7f3538224b9175d0f41f2404e48c [0,2,0,0,0,0|1,0,0]=3 1632 B13R0.87 CCCC(=O)COCCOC(=O)CC 4c0ec3e684224b8dc0c258988d1dd5b3 [0,2,0,0,0,0|1,0,0]=3 1633 B13R0.87 CCCC(=O)COCCOC(=O)OC f33b576e21d2933a371e5ae90372bef8 [0,2,0,0,0,0|2,0,0]=4 1634 B13R0.87 CCCC(=O)OCCOCC(=O)CC e1d182923ebc7729af2e0f96a7adc706 [0,2,0,0,0,0|0,0,1]=3 1635 B13R0.87 CCCC(=O)OCCOCC(=O)NC 481480e27ad2f76e08e9d8a9b4f1536e [0,2,0,0,0,0|1,0,1]=4 1636 B13R0.87 CCCC(=O)OCCOCC(=O)OC ff4000b14e7d9e38cd0d45f9fb401df3 [0,2,0,0,0,0|1,0,1]=4 1637 B13R0.87 CCCC(=O)OCCOCC(C)C#N 1d4a33b56ddcb6c533c1e7de16b20deb [0,2,0,0,0,0|1,0,1]=4 1638 B13R0.87 CCCC(=O)OCCOCC(C)CC bd9bd14f7fea3be34789b426da1b82a5 [0,2,0,0,0,0|0,0,2]=4 1639 B13R0.87 CCCC(=O)OCCOCC(C)OC 8e6ec6b587cca2c3fd2219dd7fadf76c [0,2,0,0,0,0|1,0,1]=4 1640 B13R0.87 CCCC(=O)OCCOCC(O)CO f2504ee617b28803557c8d4343c251ac [0,2,0,0,0,0|1,0,1]=4 1641 B13R0.87 CCCC(=O)OCCOC[C@@H](C)CC 885bd95462b694a3dbc7d74761359b02 [0,2,0,0,0,0|0,0,2]=4 1642 B13R0.87 CCCC(=O)OCCOC[C@@H](C)OC 00ae987ce599cf9934a0594615943267 [0,2,0,0,0,0|1,0,1]=4 1643 B13R0.87 CCCC(=O)OCCOC[C@@H](O)CO bdee9673a08cfa4316380d285e1df26a [0,2,0,0,0,0|1,0,1]=4 1644 B13R0.87 CCCC(=O)OCCOC[C@H](C)CC 5aaff944614942c0c14868e803a9eaab [0,2,0,0,0,0|0,0,2]=4 1645 B13R0.87 CCCC(=O)OCCOC[C@H](C)OC 48e23fa5107689e1fccdd69645fbceef [0,2,0,0,0,0|1,0,1]=4 1646 B13R0.87 CCCC(=O)OCCOC[C@H](O)CO 89a927195dcbf71f82be8c778cb5b21f [0,2,0,0,0,0|1,0,1]=4 1647 B13R0.87 CCCC(=O)OCNCCC(=O)NC f854d8d779f3eeb262348de5be53cf8d [0,2,0,0,0,0|1,0,1]=4 1648 B13R0.87 CCCC(=O)OCNCCC(=O)OC 6528afa8dcea8c9713eb2f1424c9a438 [0,2,0,0,0,0|1,0,1]=4 1649 B13R0.87 CCCC(=O)OCNCCC(C)CC 5810cf48ac88327d08b47e7e138dee22 [0,2,0,0,0,0|0,0,2]=4 1650 B13R0.87 CCCC(=O)OCOCCC(=O)NC 803a83afdba5dc3d4bf725924a6b5aee [0,2,0,0,0,0|1,0,1]=4 1651 B13R0.87 CCCC(=O)OCOCCC(=O)OC cf12cf424f40c1cdb11d04d6fb1be612 [0,2,0,0,0,0|1,0,1]=4 1652 B13R0.87 CCCC(=O)OCOCCC(C)CC 9a305cad921e352d3c0f5cef44b86559 [0,2,0,0,0,0|0,0,2]=4 1653 B13R0.87 CCCC(=O)OCOCCC(S)CC c8f13bf9b30f9765a158b4c8ba54e1c8 [0,2,0,0,0,0|0,0,2]=4 1654 B13R0.87 CCCC(=O)OCOCC[C@@H](C)CC d423348311efd53f84b6bbd62946579c [0,2,0,0,0,0|0,0,2]=4 1655 B13R0.87 CCCC(=S)OCCCCC(=O)CC f78d4401a39275306c4cd68e7ee89016 [0,2,0,0,0,0|0,1,1]=4 1656 B13R0.87 CCNC(=O)COCCNC(=O)CC ede579d6fabb3e2a8326e34fa4f4b5e7 [0,2,0,0,0,0|2,0,0]=4 1657 B13R0.87 CCNC(=O)COCCOC(=O)CC 3ad869539fe227740a89fe3045c7e1c6 [0,2,0,0,0,0|2,0,0]=4 1658 B13R0.87 CCOC(=O)COCCNC(=O)CC 283c0c115325ecab962a2cc7dfc25774 [0,2,0,0,0,0|2,0,0]=4 1659 B13R0.87 CCOC(=O)COCCOC(=O)CC 25fae345a9d4d7ac4939af8bb5bfcef5 [0,2,0,0,0,0|2,0,0]=4 1660 B13R0.88 C=C(C)CCOCCOC(=O)CCC 4d0965b06208eea0c03d1dca9c175748 [0,2,0,0,0,0|1,0,1]=4 1661 B13R0.88 CCCC(=O)COCCC=C=C(C)C c765f49048f111c35cb86e5ef6fc4318 [0,2,0,0,0,0|0,0,2]=4 1662 B13R0.88 CCCC(=O)COCCCCC(C)C 02b08f2bd85f289427e05af2a837f942 [0,2,0,0,0,0|0,0,2]=4 1663 B13R0.88 CCCC(=O)COCCCOC(C)C 9601c2d4658b68483baa37ef9746ddfe [0,2,0,0,0,0|1,0,1]=4 1664 B13R0.88 CCCC(=O)COCCCSC(C)C bd25802058d0c65b143ab714535c78f8 [0,2,0,0,0,0|1,0,1]=4 1665 B13R0.88 CCCC(=O)COCCOCC(C)C 505a3d7441f734cb14ea41a85162f796 [0,2,0,0,0,0|1,0,1]=4 1666 B13R0.88 CCCC(=O)COCCSCC(C)C 47874bf6bb5ffcd81e8911eba160491f [0,2,0,0,0,0|1,0,1]=4 1667 B13R0.88 CCCC(=O)OCCCCOC(C)C 28231985a671e0e11169778dda38d8b4 [0,2,0,0,0,0|0,0,2]=4 1668 B13R0.88 CCCC(=O)OCCOC/C=C(/C)\I 4cb0264cb7a53662aae67c5a37a31727 [0,2,0,0,0,0|0,0,2]=4 1669 B13R0.88 CCCC(=O)OCCOC/C=C(\C)/Cl 343c005f00808cb197f6426cf9583380 [0,2,0,0,0,0|0,0,2]=4 1670 B13R0.88 CCCC(=O)OCCOCC=C(C)C f3779e5e089ce04a58b7090a848371b9 [0,2,0,0,0,0|0,0,2]=4 1671 B13R0.88 CCCC(=O)OCCOCC=C(C)Cl c78b612568e85720302fda6efe5bff92 [0,2,0,0,0,0|0,0,2]=4 1672 B13R0.88 CCCC(=O)OCCOCC=C(C)I e002049addc2e0cf0ee1ae86cbb9f822 [0,2,0,0,0,0|0,0,2]=4 1673 B13R0.88 CCCC(=O)OCCOCCC(=O)C 8885c7f6561466c80b5f2281d24bf5d5 [0,2,0,0,0,0|1,0,1]=4 1674 B13R0.88 CCCC(=O)OCCOCCC(C)C e06d38bef8bd799de9f72708c6060aac [0,2,0,0,0,0|0,0,2]=4 1675 B13R0.88 CCCC(=O)OCCOCCN(C)C 2594796e41c4d9c0e6ed7fd5e0f58960 [0,2,0,0,0,0|1,0,1]=4 1676 B13R0.88 CCCC(=O)OCCOCCS(=O)C a2e8207ddf6a2896c0c97e6339a393e2 [0,2,0,0,0,0|1,0,1]=4 1677 B13R0.88 CCCC(=O)OCCOCOC(C)C 45b9966ddeecb01c2b7ca9ce45661afe [0,2,0,0,0,0|1,0,1]=4 1678 B13R0.88 CCCC(=O)OCNC/C=C/C(=O)O 63ecb156d3156942063bf95b217cac95 [0,2,0,0,0,0|1,0,1]=4 1679 B13R0.88 CCCC(=O)OCNCC=CC(=O)O e3db2566e52df89ec5656d8a452e9904 [0,2,0,0,0,0|1,0,1]=4 1680 B13R0.88 CCCC(=O)OCNCCCC(C)C 80fae2335f2589e400c54bfa6e9e2b29 [0,2,0,0,0,0|0,0,2]=4 1681 B13R0.88 CCCC(=O)OCNCCOC(C)C 6a897e8d957820a1d59e8856ab780fa7 [0,2,0,0,0,0|1,0,1]=4 1682 B13R0.88 CCCC(=O)OCOC/C=C/C(=O)O 3f4b6e02b7f538932d5e6b17101d22f5 [0,2,0,0,0,0|1,0,1]=4 1683 B13R0.88 CCCC(=O)OCOCC=CC(=O)O fabb23d915cc38706772d148a89053cd [0,2,0,0,0,0|1,0,1]=4 1684 B13R0.88 CCCC(=O)OCOCCCC(C)C 42045fbe00572176bf2a7fe09d7080b4 [0,2,0,0,0,0|0,0,2]=4 1685 B13R0.88 CCCC(=O)OCOCCOC(C)C bc71659ce087d41cb7802574c2edcda1 [0,2,0,0,0,0|1,0,1]=4 1686 B13R0.88 CCCC(=O)OCOCCSC(C)C 5bb7b4a044794eb850a14396add97e77 [0,2,0,0,0,0|1,0,1]=4 1687 B13R0.88 CCOC(=O)CCNC/C=C/C(C)C d663408b488dc98091eab86a85e7226f [0,2,0,0,0,0|2,0,0]=4 1688 B13R0.88 CCOC(=O)CCOC/C=C/C(C)C 2f13d0f06942dcaad49a3e066c6174b5 [0,2,0,0,0,0|2,0,0]=4 1689 B13R0.175 CCC#CC(C)OCOC(=O)CCC 3142311099fde990509fe2d6d4ab154b [0,2,0,0,0,0|0,0,2]=4 1690 B13R0.175 CCCC(=O)CCCC(=O)NCCBr 21788940d8ce570e76f72665defca2ae [0,2,0,0,0,0|2,0,0]=4 1691 B13R0.175 CCCC(=O)CCCC(=O)NCCF 2a566a1f8d3e1e5895680d0ce80ef2be [0,2,0,0,0,0|2,0,0]=4 1692 B13R0.175 CCCC(=O)CCCC(=O)NCCI fefa4809f0701d9d170c61a529243ffb [0,2,0,0,0,0|2,0,0]=4 1693 B13R0.175 CCCC(=O)CCCC(=O)NCCO f02fc04d4e7a3f1548b8457b81e99191 [0,2,0,0,0,0|2,0,0]=4 1694 B13R0.175 CCCC(=O)CCCC(=O)NCCS 892f8f3db54da59fe92cdbd9520d53d1 [0,2,0,0,0,0|2,0,0]=4 1695 B13R0.175 CCCC(=O)COCC(C)COCC bd359d0f43caff793af5d288ead5982e [0,2,0,0,0,0|1,0,1]=4 1696 B13R0.175 CCCCC(=O)NCCC(=O)OCC 7206b85b4e19e03bf69fa7dc50b98951 [0,2,0,0,0,0|2,0,0]=4 1697 B13R0.175 CCCCC(=O)OCOC(=S)CCC 86fcf33a14adbf81018ff2333c63bfc2 [0,2,0,0,0,0|1,0,1]=4 1698 B13R0.175 CCCCC(C)COCC(=O)CCC 6266a8ccc6dcfe5ffee58e00dc0a1a28 [0,2,0,0,0,0|0,0,2]=4 1699 B13R0.175 CCCNC(=O)CCCC(=O)CCC 2349949e0e25bade89806744e9f9262e [0,2,0,0,0,0|1,0,1]=4 1700 B13R0.175 CCCNC(=O)CCCC(=O)NCC 45c894abbb5cd98af9583b2513c90cb9 [0,2,0,0,0,0|2,0,0]=4 1701 B13R0.175 CCCNC(=O)CCCC(=O)OCC 20d32ebebcf98543e677445305591972 [0,2,0,0,0,0|2,0,0]=4 1702 B13R0.175 CCCNC(=O)NCCC(=O)OCC 85dbfa15a5d7478654426fa6e5159ec9 [0,2,0,0,0,0|2,0,0]=4 1703 B13R0.175 CCCOC(=O)OCOC(=S)CCC f53219768f24a8239fb9e1d0d7b18ac6 [0,2,0,0,0,0|1,0,1]=4 1704 B13R0.175 CCOC(=O)CCNC(=O)CCCF 3a8da3efa58547d324d334adc083f90b [0,2,0,0,0,0|2,0,0]=4 1705 B13R0.175 CCOC(=O)CCNC(=O)CCCS e273c4b92bbe06a401f1eb3b16dd1fde [0,2,0,0,0,0|2,0,0]=4 1706 B13R0.175 CCOC(=O)CCNC(=O)CCOC 611e7a0cd7bbf142975e8c4254544a1e [0,2,0,0,0,0|2,0,0]=4 1707 B13R0.175 CCOC(=O)CCNC(=O)CCSC e2801a2baad801097aeca4c525bffa97 [0,2,0,0,0,0|2,0,0]=4 1708 B13R0.175 CCOC(=O)CCNC(=O)CSCC 5ab40b5e3b1f04fcecf48d472cef1884 [0,2,0,0,0,0|2,0,0]=4 1709 B13R0.175 CCOCC(=O)NCCC(=O)OCC 1048a8d88dc2725fb234f0f9c3e60451 [0,2,0,0,0,0|2,0,0]=4 1710 B13R0.193 CC/C=C/CN(C)CCC(=O)OCC 320702724609716805859703af4281fa [0,2,0,0,0,0|2,0,0]=4 1711 B13R0.193 CCCC(=O)OCN(C)CCOCC ca23aaf65d8c814e5bc4ed3ad145c620 [0,2,0,0,0,0|1,0,1]=4 1712 B13R0.193 CCCCCC(C)OCC(=O)CCC 1255839d283a5a47da1b5a174be5bb52 [0,2,0,0,0,0|0,0,2]=4 1713 B13R0.193 CCCCCN(C)COC(=O)CCC af2abf8ffe752699b271a4f45ce19a1d [0,2,0,0,0,0|0,0,2]=4 1714 B13R0.193 CCCCC[C@@H](C)OCC(=O)CCC f91fc00534395b9e9ac94a0a26d47655 [0,2,0,0,0,0|0,0,2]=4 1715 B13R0.193 CCCCC[C@H](C)OCC(=O)CCC d6d666cd39c33c9c887025edc37b8cff [0,2,0,0,0,0|0,0,2]=4 1716 B13R0.193 CCCOCC(C)OCC(=O)CCC dbe35521ccdc4c566ba3b1d18d89887c [0,2,0,0,0,0|1,0,1]=4 1717 B13R0.275 C=C(COC/C=C/CC)C(=O)OCC 5808d9485a8b9f1672ac7ff17f81c56e [0,2,0,0,0,0|2,0,0]=4 1718 B13R0.275 C=C(COC/C=C\CC)C(=O)OCC 6961950a4128196a705a2db764ac38a8 [0,2,0,0,0,0|2,0,0]=4 1719 B13R0.275 CC/C=C/CCOC(=O)C(C)OCC 7263f07c83ca3f60cf5fbd56d67d9e1c [0,2,0,0,0,0|0,0,0]=2 1720 B13R0.275 CC/C=C/CCOC(=O)C(C)OCF 4af7123442fce881b23bfe1bc318845f [0,2,0,0,0,0|1,0,0]=3 1721 B13R0.275 CC/C=C/CCOC(C)C(=O)NCC ec80c9e2991b3d55452478ae5b215d12 [0,2,0,0,0,0|1,0,0]=3 1722 B13R0.275 CC/C=C/CCOC(C)C(=O)OCC 1511b310ceb79152eb0a4a0f5b895b59 [0,2,0,0,0,0|1,0,0]=3 1723 B13R0.275 CC/C=C/CCOC(F)C(=O)OCC 96aee68d5b2e58183ceb0cd2ea565c95 [0,2,0,0,0,0|1,0,0]=3 1724 B13R0.275 CC/C=C/CCO[C@@H](C)C(=O)OCC 5ba986aa192253772e27fe899ab00a04 [0,2,0,0,0,0|1,0,0]=3 1725 B13R0.275 CC/C=C/CCO[C@H](C)C(=O)OCC a853fd483021735996b9fb46493a6170 [0,2,0,0,0,0|1,0,0]=3 1726 B13R0.275 CC/C=C/CNCC(C)C(=O)OCC db301b50bd17d23310e6759d3a206a28 [0,2,0,0,0,0|2,0,0]=4 1727 B13R0.275 CC/C=C/COCC(=O)C(=O)OCC c9a8724587c22842dab677de9a84e626 [0,2,0,0,0,0|2,0,0]=4 1728 B13R0.275 CC/C=C/COCC(C)C(=O)OCC 284c0650a913fdeb21bd6e0111b2a06e [0,2,0,0,0,0|2,0,0]=4 1729 B13R0.275 CC/C=C\CCN[C@@H](C)C(=O)NCC 28350f28f1826ff7fccfcb3120f6046f [0,2,0,0,0,0|2,0,0]=4 1730 B13R0.275 CC/C=C\CCN[C@H](C)C(=O)OCC 9a49c9de27219bfdbceb3d3f251d00db [0,2,0,0,0,0|2,0,0]=4 1731 B13R0.275 CC/C=C\CCOC(=O)C(C)OCC 100f433891a73fa9479a97609d211df6 [0,2,0,0,0,0|0,0,0]=2 1732 B13R0.275 CC/C=C\CCOC(=O)C(C)OCF 4db27746878949a30f6567a99675824c [0,2,0,0,0,0|1,0,0]=3 1733 B13R0.275 CC/C=C\CCOC(C)C(=O)NCC 182c35fee09508b632991291ab8f47e8 [0,2,0,0,0,0|1,0,0]=3 1734 B13R0.275 CC/C=C\CCOC(C)C(=O)OCC e232f2f274b907bed6a7b1f1bad369fd [0,2,0,0,0,0|1,0,0]=3 1735 B13R0.275 CC/C=C\CCOC(F)C(=O)OCC a5d6e30b524aa2ab54f32853f6e535ce [0,2,0,0,0,0|1,0,0]=3 1736 B13R0.275 CC/C=C\CCO[C@@H](C)C(=O)OCC 3ecc640ec2d5d64a36b6fa564c92139d [0,2,0,0,0,0|1,0,0]=3 1737 B13R0.275 CC/C=C\CCO[C@H](C)C(=O)OCC 7c6fbc1e3a52b1fea115734f51d968fe [0,2,0,0,0,0|1,0,0]=3 1738 B13R0.275 CC/C=C\COCC(=O)C(=O)OCC 88acd1f4e5664d7e341bc8a73e1da27e [0,2,0,0,0,0|2,0,0]=4 1739 B13R0.275 CCC=CCCOC(=O)C(C)OCC e31b25270fbd379359eb0beec463d80c [0,2,0,0,0,0|0,0,0]=2 1740 B13R0.275 CCC=CCCOC(=O)C(C)OCF b4655968ad8fadbdbb31389222bbda27 [0,2,0,0,0,0|1,0,0]=3 1741 B13R0.282 CC/C=C\CCCOC(CC)CCC ca0bc9ae84d6c1ec252002da990f3b7e [0,2,0,0,0,0|1,0,1]=4 1742 B13R0.282 CC/C=C\CCOCC(CC)CCC afd3b1baebddc8a094b6721aec1c83a2 [0,2,0,0,0,0|1,0,1]=4 1743 B13R0.282 CCC/C=C\CCOC(CC)CCC d86540cd0b78bc9d93c751c6141d3e62 [0,2,0,0,0,0|1,0,1]=4 1744 B13R0.330 CC/C=C/CNC(C)CC(=O)OCC 70cb05f228fc1023e3a785bd4c431117 [0,2,0,0,0,0|2,0,0]=4 1745 B13R0.330 CC/C=C/COC(C)CC(=O)OCC 8d3e840178e1c389986b8333ac22010c [0,2,0,0,0,0|2,0,0]=4 1746 B13R0.330 CC/C=C/COC(C)OC(=O)OCC 1914d965bd9b0f18cebec120f2a5e819 [0,2,0,0,0,0|1,0,0]=3 1747 B13R0.330 CC/C=C/CO[C@@H](C)CC(=O)OCC 38ea11719fe9f85564f5783ba2dd8c32 [0,2,0,0,0,0|2,0,0]=4 1748 B13R0.330 CC/C=C/CO[C@H](C)CC(=O)OCC 43b879df9418535ce6fc9da8e264fd15 [0,2,0,0,0,0|2,0,0]=4 1749 B13R0.330 CC/C=C\COC(C)OC(=O)OCC 0952e40d6839f8628e1eba5423238990 [0,2,0,0,0,0|1,0,0]=3 1750 B13R0.335 C/C=C/C=C/COCC(=O)CC(C)C 6bd00f1658a33990ce58cfca446cb010 [0,2,0,0,0,0|0,0,2]=4 1751 B13R0.335 C/C=C/CCCOCC(=O)CC(C)C 29b42d0f7ea179901f9464c52c3fd602 [0,2,0,0,0,0|0,0,2]=4 1752 B13R0.335 C/C=C/CCOCOC(=O)CC(C)C 950aed7b8ff6da5fad61bc43a5063a20 [0,2,0,0,0,0|0,0,2]=4 1753 B13R0.335 C/C=C\CCCOCC(=O)CC(C)C ad37fd7ab5568fee0c54eca3630fc55e [0,2,0,0,0,0|0,0,2]=4 1754 B13R0.335 CC(C)CC(=O)OCOC/C=C/C=O 0e35bd8b4f4741e8ed5a425c1782f600 [0,2,0,0,0,0|1,0,1]=4 1755 B13R0.335 CC/C=C/CCOCC(=O)CC(=O)O ae04b1be82925dc77dbb654c07dbac7a [0,2,0,0,0,0|1,0,1]=4 1756 B13R0.335 CC/C=C/CCOCC(=O)CC(C)C e030e97de21aa19e90450c5d58f2337e [0,2,0,0,0,0|0,0,0]=2 1757 B13R0.335 CC/C=C/CCOCC(=O)NC(C)C 5e021a25fae348469d238a13d5cb552f [0,2,0,0,0,0|1,0,0]=3 1758 B13R0.335 CC/C=C/CCOCC(=O)OC(C)C caa2f730d1460718ea1d9fb7151f55a8 [0,2,0,0,0,0|1,0,0]=3 1759 B13R0.335 CC/C=C/COCCC(=O)NC(C)C 6df0351a79586a6b89b4551b5ab9d8cc [0,2,0,0,0,0|2,0,0]=4 1760 B13R0.335 CC/C=C/COCCC(=O)OC(C)C e132bc3703fafa45248d984da8bef5da [0,2,0,0,0,0|2,0,0]=4 1761 B13R0.335 CC/C=C/COCOC(=O)CC(C)C ac617c30cb0a227d45cdca6be51de98a [0,2,0,0,0,0|0,0,0]=2 1762 B13R0.335 CC/C=C/COCOC(=O)OC(C)C 6ec306f53d225756878b5800d1dd3a59 [0,2,0,0,0,0|1,0,0]=3 1763 B13R0.335 CC/C=C\CCCOC(C)CC(C)C 8d697fce027a1aeb8f28ffc0ea9ca6e1 [0,2,0,0,0,0|1,0,1]=4 1764 B13R0.335 CC/C=C\CCNCC(=O)NC(C)C 0eb12b7a0c3f1fa847a1ea599163b7de [0,2,0,0,0,0|2,0,0]=4 1765 B13R0.335 CC/C=C\CCOCC(=O)CC(=O)O 986abf7ad954b30727801cbff31a4994 [0,2,0,0,0,0|1,0,1]=4 1766 B13R0.335 CC/C=C\CCOCC(=O)CC(C)C 26fd2c53b36c893a1809560db9f17719 [0,2,0,0,0,0|0,0,0]=2 1767 B13R0.335 CC/C=C\CCOCC(=O)NC(C)C a775fc41a33ba2f2735d091d6ec2fc57 [0,2,0,0,0,0|1,0,0]=3 1768 B13R0.335 CC/C=C\CCOCC(=O)OC(C)C 51a7b4556f8bb9ac817533d43004cdec [0,2,0,0,0,0|1,0,0]=3 1769 B13R0.335 CC/C=C\CCOCC(C)CC(C)C 5f412df298a74f8ac80d4d9f0be90bf4 [0,2,0,0,0,0|1,0,1]=4 1770 B13R0.335 CC/C=C\COCCC(=O)NC(C)C 3ddba6104bd6c4e4811be214eac15747 [0,2,0,0,0,0|2,0,0]=4 1771 B13R0.335 CC/C=C\COCCC(=O)OC(C)C 2aa6862b31b986ea0d9179d7ee3df388 [0,2,0,0,0,0|2,0,0]=4 1772 B13R0.335 CC/C=C\COCOC(=O)CC(C)C 2dec7628f93be1ef8157428e0c74cf62 [0,2,0,0,0,0|0,0,0]=2 1773 B13R0.335 CC/C=C\COCOC(=O)OC(C)C 9c183cdf8bb3ffa46d7d889cdb2b9d74 [0,2,0,0,0,0|1,0,0]=3 1774 B13R0.335 CC=C=CCCOCC(=O)CC(C)C 4cac816ea7655fd0faa127513d347452 [0,2,0,0,0,0|0,0,2]=4 1775 B13R0.335 CC=CC=CCOCC(=O)CC(C)C 9b954dcea1cfd5e171f84ce9cb0f2354 [0,2,0,0,0,0|0,0,2]=4 1776 B13R0.335 CC=CCCCOCC(=O)CC(C)C 9908c66cfef9f7ba39f566eb6cb9521c [0,2,0,0,0,0|0,0,2]=4 1777 B13R0.335 CCC#CCCOCC(=O)CC(C)C 828b1fc9d83a62b2b4fc5c76b732282d [0,2,0,0,0,0|0,0,2]=4 1778 B13R0.335 CCC#CCOCOC(=O)CC(C)C 7961668ab2f0e44fcbea55450584c0fc [0,2,0,0,0,0|0,0,2]=4 1779 B13R0.335 CCC/C=C/COCC(=O)CC(C)C d47f650abb1a4755dedc752bdb364807 [0,2,0,0,0,0|0,0,2]=4 1780 B13R0.335 CCC/C=C\CCOC(C)CC(C)C 36c4e835d2d92f7fcb73ff2393707f21 [0,2,0,0,0,0|1,0,1]=4 1781 B13R0.335 CCC/C=C\COCC(=O)CC(C)C 51de74a3e88b52f82c697442af86ecc3 [0,2,0,0,0,0|0,0,2]=4 1782 B13R0.335 CCCCCCOCC(=O)CC(C)C 1af3c8cad488da9da8ef03e201b6e227 [0,2,0,0,0,0|0,0,2]=4 1783 B13R0.335 CCCCCNCOC(=O)CC(C)C 39513e8e7f4706d75845320bd78e5130 [0,2,0,0,0,0|0,0,2]=4 1784 B13R0.335 CCCCCOCOC(=O)CC(C)C e5dded12451b316a34ec687be2e78406 [0,2,0,0,0,0|0,0,2]=4 1785 B13R0.335 CCCOCCOCC(=O)CC(C)C b105f0f4227285a81d1cc0f0f5bf853c [0,2,0,0,0,0|1,0,1]=4 1786 B13R0.335 CCCSCCOCC(=O)CC(C)C 4d26e4119e7a8e241c15a7c3b946de38 [0,2,0,0,0,0|1,0,1]=4 1787 B13R0.335 CCOCCCOCC(=O)CC(C)C 895fb251a8a0d42eadcacc6eab3ef440 [0,2,0,0,0,0|1,0,1]=4 1788 B13R0.335 CCOCCNCOC(=O)CC(C)C b00fc51beccef46654d66582a019ec9c [0,2,0,0,0,0|1,0,1]=4 1789 B13R0.335 CCOCCOCOC(=O)CC(C)C ac337049c9f67141775ca73e66adfb99 [0,2,0,0,0,0|1,0,1]=4 1790 B13R0.335 CCSCCCOCC(=O)CC(C)C e59a4addfc961822321fc4282b0a62fc [0,2,0,0,0,0|1,0,1]=4 1791 B13R0.335 CCSCCNCOC(=O)CC(C)C e2551b00c1ec86e99b431506149c05b8 [0,2,0,0,0,0|1,0,1]=4 1792 B13R0.335 CCSCCOCOC(=O)CC(C)C a250e60d743eccbc2c3ef6ffe1bb9fc5 [0,2,0,0,0,0|1,0,1]=4 1793 B13R0.340 C/C=C/C=C/COCC(=O)C(C)CC 86a46012da9ed439f01d398802f4d45a [0,2,0,0,0,0|0,0,2]=4 1794 B13R0.340 C/C=C/CCCOCC(=O)C(C)CC 0f467841da3f32b963da3df234417c68 [0,2,0,0,0,0|0,0,2]=4 1795 B13R0.340 C/C=C\CCCOCC(=O)C(C)CC bb4948f814fdefb4969ff7d9a2902253 [0,2,0,0,0,0|0,0,2]=4 1796 B13R0.340 CC/C=C/CCOCC(=O)C(=O)OC 2f42254b6d5f09a1d0a51de220ca2c3b [0,2,0,0,0,0|1,0,1]=4 1797 B13R0.340 CC/C=C/CCOCC(=O)C(C)CC 6343e628dd39caaf2cdc677be2e68180 [0,2,0,0,0,0|0,0,0]=2 1798 B13R0.340 CC/C=C/CCOCC(=O)N(C)CC 5e54f9db93c162182bb9de95b0238dc9 [0,2,0,0,0,0|1,0,0]=3 1799 B13R0.340 CC/C=C\CCNCC(=O)N(C)CC a7cdf75f483e4a44804cfa244408e0c6 [0,2,0,0,0,0|2,0,0]=4 1800 B13R0.340 CC/C=C\CCOCC(=O)C(=O)OC 77e929688f6f6cfccca2b32a29dc9116 [0,2,0,0,0,0|1,0,1]=4 1801 B13R0.340 CC/C=C\CCOCC(=O)C(C)CC 2eb75b1619d7096f04eeaab8f292988b [0,2,0,0,0,0|0,0,0]=2 1802 B13R0.340 CC/C=C\CCOCC(=O)N(C)CC ec368b255f3bec1a1ed10ce316eaad1d [0,2,0,0,0,0|1,0,0]=3 1803 B13R0.340 CC/C=C\CCOCC(C)C(S)CC 1e384f378b9bd65432d914f272738c69 [0,2,0,0,0,0|1,0,1]=4 1804 B13R0.340 CC=C=CCCOCC(=O)C(C)CC 45fabcbb6ef4e67dbe529faae6121fde [0,2,0,0,0,0|0,0,2]=4 1805 B13R0.340 CC=CC=CCOCC(=O)C(C)CC 5ffa00057a0d3e76739421dc1fc292ef [0,2,0,0,0,0|0,0,2]=4 1806 B13R0.340 CC=CCCCOCC(=O)C(C)CC 49c08949655f20daa2978f7b3c50bf3e [0,2,0,0,0,0|0,0,2]=4 1807 B13R0.340 CCC#CCCOCC(=O)C(C)CC 6dc4a2beb3ea6de26a02b04703655bad [0,2,0,0,0,0|0,0,2]=4 1808 B13R0.340 CCC/C=C/CCCC(=O)N(C)CC 31cb5834340eecdaec92bd85a978e90f [0,2,0,0,0,0|2,0,0]=4 1809 B13R0.340 CCC/C=C/COCC(=O)C(C)CC bb73a73084c37cc13cdd7f4de1488b6b [0,2,0,0,0,0|0,0,2]=4 1810 B13R0.340 CCC/C=C\COCC(=O)C(C)CC 5b092a7bbcd3b218b70d4910e715d8f5 [0,2,0,0,0,0|0,0,2]=4 1811 B13R0.340 CCCCCCOCC(=O)C(C)CC ab17286351b233c32e684794b4a24b0a [0,2,0,0,0,0|0,0,2]=4 1812 B13R0.340 CCCOCCOCC(=O)C(C)CC 4a8423a7d8bfebbdb84cda83eb4805e5 [0,2,0,0,0,0|1,0,1]=4 1813 B13R0.340 CCCSCCOCC(=O)C(C)CC b02ea0074ab6248cc1a62865e8521c51 [0,2,0,0,0,0|1,0,1]=4 1814 B13R0.340 CCOCCCOCC(=O)C(C)CC a950466463b00278f535301c869a27bb [0,2,0,0,0,0|1,0,1]=4 1815 B13R0.340 CCSCCCOCC(=O)C(C)CC bd190a6831206c4d5821e839409f3e39 [0,2,0,0,0,0|1,0,1]=4 1816 B13R0.367 CCCC(=O)CNCCC(=O)OCC e3ea57850a16cf7b9d2b7e5d291c46ef [0,2,0,0,0,0|2,0,0]=4 1817 B13R0.367 CCCC(=O)COCCC(=O)OCC 32f0c0b5d1451d0e878125224894f7ba [0,2,0,0,0,0|1,0,0]=3 1818 B13R0.367 CCCC(=O)COCCC(C)CCC 59dca3b5941eab018410211704a89284 [0,2,0,0,0,0|0,0,2]=4 1819 B13R0.367 CCCC(=O)COCCC(S)CCC b0dac7abd29043daf3e6ee6812c8f05c [0,2,0,0,0,0|0,0,2]=4 1820 B13R0.367 CCCC(=O)NCCCC(=O)OCC fba5e0da803a9ca34fb4feb328b53dfd [0,2,0,0,0,0|1,0,1]=4 1821 B13R0.367 CCCC(=O)OCCOC(C)CCC b3ed9260c1ee6add4f76b4373bffcf11 [0,2,0,0,0,0|0,0,2]=4 1822 B13R0.367 CCCC(=O)OCCOC(C)COC 8a1ce04a84d94c959b1b380170f6235f [0,2,0,0,0,0|1,0,1]=4 1823 B13R0.367 CCCC(=O)OCNCC(=O)NCC c617f3d3c854ac71d534e9ae0dc559a9 [0,2,0,0,0,0|1,0,0]=3 1824 B13R0.367 CCCC(=O)OCNCC(=O)OCC 0a6570ee9722b0ce8ed385aaea06d70e [0,2,0,0,0,0|1,0,0]=3 1825 B13R0.367 CCCC(=O)OCNCC(C)OCC 5d09ae6030571b359329064898290be1 [0,2,0,0,0,0|1,0,1]=4 1826 B13R0.367 CCCC(=O)OCNCC(O)CCC 75201328fe0f730eb6c2bf12523a1964 [0,2,0,0,0,0|0,0,2]=4 1827 B13R0.367 CCCC(=O)OCOCC(=O)NCC 70d88ba5a94b2b2151c55aed284cf583 [0,2,0,0,0,0|1,0,0]=3 1828 B13R0.367 CCCC(=O)OCOCC(=O)OCC 6539573fb335fd47d1908fb896f7c5f4 [0,2,0,0,0,0|1,0,0]=3 1829 B13R0.367 CCCC(=O)OCOCC(C)CCC b4e57a6106604869a1c05306c1fc48a1 [0,2,0,0,0,0|0,0,2]=4 1830 B13R0.367 CCCC(=O)OCOCC(C)OCC b8ba2c5e8862ab1ebc28eb4b40f9dbf2 [0,2,0,0,0,0|1,0,1]=4 1831 B13R0.367 CCCC(=S)OC/C=C/C(=O)OCC 20456fce5bf3edb2b97b107e1a0c61d3 [0,2,0,0,0,0|0,1,1]=4 1832 B13R0.367 CCCC(=S)OCC=CC(=O)OCC fb4eb6607beb3b9c8dfecb921e26788f [0,2,0,0,0,0|0,1,1]=4 1833 B13R0.367 CCCC(=S)OCCCC(=O)OCC 689bd97ae65c689831ad5bd45f0e3795 [0,2,0,0,0,0|0,1,1]=4 1834 B13R0.367 CCNC(=O)CCOCC(=O)NCC 3130e8816f68ee704503ce3051676c87 [0,2,0,0,0,0|2,0,0]=4 1835 B13R0.367 CCNC(=O)CCOCC(=O)OCC 59c2f60d2e8b52cadb3421a034ca0ed3 [0,2,0,0,0,0|2,0,0]=4 1836 B13R0.367 CCNC(=O)CNCOC(=O)OCC 454419662d071a06448244baa5df2943 [0,2,0,0,0,0|2,0,0]=4 1837 B13R0.367 CCNC(=O)CNCOC(=O)SCC 99af48160a4cbe24dfc498c3dff5e9a2 [0,2,0,0,0,0|2,0,0]=4 1838 B13R0.367 CCNC(=O)COCCC(=O)OCC f63c3a3d9dd26af0606b08014a23fb24 [0,2,0,0,0,0|2,0,0]=4 1839 B13R0.367 CCNC(=O)COCOC(=O)OCC 0c45f1b221fb2978bb8b20fdd856addc [0,2,0,0,0,0|2,0,0]=4 1840 B13R0.367 CCNC(=O)COCOC(=O)SCC cc4babbf29347a9cd705e6f6be557acb [0,2,0,0,0,0|2,0,0]=4 1841 B13R0.367 CCOC(=O)CCOCC(=O)COC 1f54ff85fdc83f48519153c3d037a00a [0,2,0,0,0,0|2,0,0]=4 1842 B13R0.367 CCOC(=O)CCOCC(=O)OCC 944920dcef0ff0d2abb46143eed47b2c [0,2,0,0,0,0|2,0,0]=4 1843 B13R0.367 CCOC(=O)CNCOC(=O)OCC 85bf8ff1bc815f4cca7e39bf9a9d2c99 [0,2,0,0,0,0|2,0,0]=4 1844 B13R0.367 CCOC(=O)CNCOC(=O)SCC 4a4481b28e6042d9e8f32fef2899ffbd [0,2,0,0,0,0|2,0,0]=4 1845 B13R0.367 CCOC(=O)COCOC(=O)OCC b83c646ab188306d4917427e6723fe09 [0,2,0,0,0,0|2,0,0]=4 1846 B13R0.367 CCOC(=O)COCOC(=O)SCC 39a90da81134dd68e4885267083450a5 [0,2,0,0,0,0|2,0,0]=4 1847 B13R0.62 C#CC(CC(C)C)OCC/C=C\CC efb20aa543bcf66f2dc02d6bc1524304 [0,2,0,0,0,0|1,0,1]=4 1848 B13R0.62 C=CC(CC(C)C)OCC/C=C\CC 01ce04b2da76eaf26af1288e6ebf21fe [0,2,0,0,0,0|1,0,1]=4 1849 B13R0.62 CC/C=C\CCOC(C#N)CC(C)C 0e54315df896c96dba28507f44ec3395 [0,2,0,0,0,0|1,0,1]=4 1850 B13R0.198 CCC(=O)COCOC(=O)CC(C)C 848a7b5cf5943bc4fc6cca27a5e1d0bc [0,2,0,0,0,0|1,0,1]=4 1851 B13R0.198 CCC(=O)NCCNC(=O)CC(C)C b4bef60593d8fb2228aa3ee3623c2108 [0,2,0,0,0,0|2,0,0]=4 1852 B13R0.198 CCC(=O)NCCNC(=O)CC(C)O 74e3de169bee582c2b24756452bab925 [0,2,0,0,0,0|2,0,0]=4 1853 B13R0.198 CCC(=O)NCCNC(=O)C[C@@H](C)O 4ed0484ac418d80ab5af7d53c4213bda [0,2,0,0,0,0|2,0,0]=4 1854 B13R0.198 CCC(=O)NCCNC(=O)C[C@H](C)O c7cb1f40f56aac445d631f0f246c21f1 [0,2,0,0,0,0|2,0,0]=4 1855 B13R0.274 CC/C=C/COCC(=O)NC(C)CC a172ffc65f4328afa728a07261be3a47 [0,2,0,0,0,0|2,0,0]=4 1856 B13R0.274 CC/C=C\CCO/C(=C/C(=O)CC)/C 59ff531e18a4d7823d9ab4373c6fee6e [0,2,0,0,0,0|1,0,1]=4 1857 B13R0.274 CC/C=C\CCOC(C)CC(C)OC d695c2d9ff98c0fbb3cc25b7adc232fe [0,2,0,0,0,0|1,0,1]=4 1858 B13R0.274 CC/C=C\COCC(=O)NC(C)CC 66235a360e5f263c8cf6f3083c9be03a [0,2,0,0,0,0|2,0,0]=4 1859 B13R0.286 CC/C=C\CCOC(C)CC(C)(C)C 115470303a822f0ca46fa2afa596ae5c [0,2,0,0,0,0|1,0,1]=4 1860 B13R0.286 CC/C=C\CCOC(C)CC(C)(C)S b3706a6b660ff6261b6e936573737e34 [0,2,0,0,0,0|1,0,1]=4 1861 B13R0.332 CCCC(=S)OCCC(=O)NC(C)C 2e935486487118c2666b1f9aaade3d9b [0,2,0,0,0,0|1,1,0]=4 1862 B13R0.332 CCCC(=S)OCCC(=O)OC(C)C ea8d23d752454f7777c002600e1a1d98 [0,2,0,0,0,0|1,1,0]=4 1863 B13R0.332 CCCC(=S)OCOC(=O)CC(C)C a2e5e25d3126371b6a9aae1c85d05146 [0,2,0,0,0,0|1,0,1]=4 1864 B13R0.332 CCOC(=O)CCNC(=O)CC(C)C f8ef9a5fa3e1722da33f189e4f2657eb [0,2,0,0,0,0|2,0,0]=4 1865 B13R0.332 CCOC(=O)CCNC(=O)CC(C)O bc885aa23d95f882876f67700d04fac8 [0,2,0,0,0,0|2,0,0]=4 1866 B13R0.332 CCOC(=O)CCNC(=O)C[C@@H](C)O 702eabfa2922265341c6103ad918fced [0,2,0,0,0,0|2,0,0]=4 1867 B13R0.332 CCOC(=O)CCNC(=O)C[C@H](C)O 5b79e1341aa33f6855da0eda062c64ac [0,2,0,0,0,0|2,0,0]=4 1868 B13R0.112 CC/C=C\CCOC(C)C(C)(C)CC 6b2efec8ce857cae0dc505403a218b6c [0,2,0,0,0,0|1,0,1]=4 1869 B13R0.112 CCCOCCOC(=O)C(C)(C)CC b63edc9ac92dc955e47da56496bc330e [0,2,0,0,0,0|1,0,1]=4 1870 B13R0.250 CCC(=O)NCCNC(=O)C(O)CC 2f954f3b898c3e16bb6c5f2f1bfc4c99 [0,2,0,0,0,0|2,0,0]=4 1871 B13R0.250 CCC(=O)NCCNC(=O)[C@@H](O)CC 15e6b6e1d7d07003035e54ee834653c7 [0,2,0,0,0,0|2,0,0]=4 1872 B13R0.250 CCC(=O)NCCNC(=O)[C@@H](S)CC b6307ed1e386a6eed13b2fde24e2a9a7 [0,2,0,0,0,0|2,0,0]=4 1873 B13R0.250 CCC(=O)NCCNC(=O)[C@H](O)CC f63690b4c0c5dbf32f028fdcf19b7961 [0,2,0,0,0,0|2,0,0]=4 1874 B13R0.277 CC/C=C\CCOC(C)C(CC)CC f524fdfddea9a55bbddafddd2b507933 [0,2,0,0,0,0|1,0,1]=4 1875 B13R0.369 CCCC(=O)CCCC(=O)N(C)CC a67f7c1e8ce9e292687e51dbe94b83d7 [0,2,0,0,0,0|2,0,0]=4 1876 B13R0.369 CCOC(=O)CCNC(=O)C(O)CC 60afe0a4754807e6b642c1c1194243ba [0,2,0,0,0,0|2,0,0]=4 1877 B13R0.369 CCOC(=O)CCNC(=O)[C@@H](O)CC d7be77ccbb61a08d9ee7392cc5d0494d [0,2,0,0,0,0|2,0,0]=4 1878 B13R0.369 CCOC(=O)CCNC(=O)[C@@H](S)CC 8afdbc2d254983340870a3b47a2bc4d1 [0,2,0,0,0,0|2,0,0]=4 1879 B13R0.369 CCOC(=O)CCNC(=O)[C@H](O)CC f974e776dbc7a95d065a10b1a07cf255 [0,2,0,0,0,0|2,0,0]=4 1880 B13R0.18 CCCC(=O)N(C)CCC(=O)OCC ca34532687f3b6e31db5e8b037dc84bf [0,2,0,0,0,0|2,0,0]=4 1881 B13R0.18 CCCC(=O)NCC(C)C(=O)OCC e19e8a3d929b102d41b6ce7e58e7455e [0,2,0,0,0,0|2,0,0]=4 1882 B13R0.1171 CC/C=C/CNC(C)C(=O)NCCC 351546b7c631751d9c864c7223ef47bb [0,2,0,0,0,0|2,0,0]=4 1883 B13R0.1171 CC/C=C/CNC(C)C(=O)OCCC 078c031bb1cad8ad383dd0ec1c4e7864 [0,2,0,0,0,0|2,0,0]=4 1884 B13R0.1171 CC/C=C/CN[C@@H](C)C(=O)OCCC 7d323d3e9256dd18cf71ab39154d89f3 [0,2,0,0,0,0|2,0,0]=4 1885 B13R0.1171 CC/C=C/COC(C)C(=O)NCCC dc4144058239889c1abad2bd904025e5 [0,2,0,0,0,0|2,0,0]=4 1886 B13R0.1171 CC/C=C/COC(C)C(=O)OCCC d444c54f6f2aeb68d6860cc6f9c75f47 [0,2,0,0,0,0|2,0,0]=4 1887 B13R0.1171 CC/C=C/CO[C@@H](C)C(=O)OCCC 842cb9bf4438ada6a89c8842df92c624 [0,2,0,0,0,0|2,0,0]=4 1888 B13R0.1171 CC/C=C\COC(C)C(=O)NCCC f17085e001c47e853613c6502ae1c2bb [0,2,0,0,0,0|2,0,0]=4 1889 B13R0.1171 CC/C=C\COC(C)C(=O)OCCC 95f9bdd97224db9fe6322ee83a2cce5d [0,2,0,0,0,0|2,0,0]=4 1890 B13R0.63 CC/C=C/CCOC(CCC)C(=O)C e097fe42553621adc2971985709599da [0,2,0,0,0,0|0,0,1]=3 1891 B13R0.63 CC/C=C/CCOC(COC)C(=O)O 45d2019d114ed24bf3a1a18af4f7f085 [0,2,0,0,0,0|1,0,1]=4 1892 B13R0.63 CC/C=C\CCNC(CCC)C(=O)O b939bc0c7bf84df27352a1bf67d8c51c [0,2,0,0,0,0|1,0,1]=4 1893 B13R0.63 CC/C=C\CCN[C@@H](CCC)C(=O)O d2f7b01fd9671e4c7914d4da458a2e9f [0,2,0,0,0,0|1,0,1]=4 1894 B13R0.63 CC/C=C\CCN[C@H](CCC)C(=O)O 6f9d47641515c23896859dcc05adbb43 [0,2,0,0,0,0|1,0,1]=4 1895 B13R0.63 CC/C=C\CCOC(CCC)C(=O)C 0ffffc6518c891d4aba94d8374755635 [0,2,0,0,0,0|0,0,1]=3 1896 B13R0.63 CC/C=C\CCOC(CCC)C(=O)N 9e80b78da6220d960a34166c6f691e5a [0,2,0,0,0,0|0,0,1]=3 1897 B13R0.63 CC/C=C\CCOC(CCC)C(=O)O 8e0d1923202dd2029826538e5cf7c266 [0,2,0,0,0,0|0,0,1]=3 1898 B13R0.63 CC/C=C\CCOC(CCC)C(C)C 2a75ee9e4ace1449b30b6dd537f14b9d [0,2,0,0,0,0|1,0,1]=4 1899 B13R0.63 CC/C=C\CCOC(COC)C(=O)O 5c9cd3a6fa869df0f26a62500e3be122 [0,2,0,0,0,0|1,0,1]=4 1900 B13R0.63 CC/C=C\CCOC(CSC)C(=O)O 8cf87be323e173a46e4dea6d6141e081 [0,2,0,0,0,0|1,0,1]=4 1901 B13R0.63 CC/C=C\CCO[C@@H](CCC)C(=O)O c1b23870017571760a0ab065f47dc560 [0,2,0,0,0,0|0,0,1]=3 1902 B13R0.63 CC/C=C\CCO[C@H](CCC)C(=O)O f3e7f6a03cf3b975f8c2882e6ca5baeb [0,2,0,0,0,0|0,0,1]=3 1903 B13R0.65 CC/C=C/CCOC(CCC)CCC f88ed5d060484ddb210fda6a60eb4d89 [0,2,0,0,0,0|1,0,1]=4 1904 B13R0.65 CC/C=C\CCOC(CCC)CCC e59bce2515fd6f37dfea5312a29d977b [0,2,0,0,0,0|1,0,1]=4 1905 B13R0.272 C#CC(CCCC)OCC/C=C\CC 9ca336b539981ce5fa7c586e98781a25 [0,2,0,0,0,0|1,0,1]=4 1906 B13R0.272 C=CC(CCCC)OCC/C=C\CC b1ff7aff6247ed5f6844244c201c0043 [0,2,0,0,0,0|1,0,1]=4 1907 B13R0.272 CC/C=C/CCOC(CC)CCCC 57afa02ae6be7b8ff124746d3a43cfb8 [0,2,0,0,0,0|1,0,1]=4 1908 B13R0.272 CC/C=C\CCOC(CC)CCCC 83188b7450efaf240fdf2921acfc0073 [0,2,0,0,0,0|1,0,1]=4 1909 B13R0.113 CCC(=O)NCCNC(=O)CCCF 9c31d88c63bbfdcd9090ae2254dde0b2 [0,2,0,0,0,0|2,0,0]=4 1910 B13R0.113 CCC(=O)NCCNC(=O)CCCS eca0d4c8bb289781fc2ed1a2b3ea9472 [0,2,0,0,0,0|2,0,0]=4 1911 B13R0.113 CCC(=O)NCCNC(=O)CCOC 30567d49cbf14c47ed27108bd4cc4276 [0,2,0,0,0,0|2,0,0]=4 1912 B13R0.113 CCC(=O)NCCNC(=O)CCSC 2b022c19c302b5827cd47a4a3752bd39 [0,2,0,0,0,0|2,0,0]=4 1913 B13R0.113 CCCCC(=O)NCCNC(=O)CC 2fb852cc3930574d479e91445154999e [0,2,0,0,0,0|2,0,0]=4 1914 B13R0.113 CCCCC(=O)OCOCC(=O)CC 41a6c9b55779b02227072f5c29127bfd [0,2,0,0,0,0|1,0,1]=4 1915 B13R0.113 CCCNC(=O)CCCNC(=O)CC 22c40dc44d26526792d67f9fc1744ce6 [0,2,0,0,0,0|2,0,0]=4 1916 B13R0.113 CCCNC(=O)NCCNC(=O)CC a806b1fd591cfff48ad4c4268db13d1c [0,2,0,0,0,0|2,0,0]=4 1917 B13R0.113 CCCOC(=O)OCOCC(=O)CC c3deccef1f91a2bae66a9311c5a43081 [0,2,0,0,0,0|1,0,1]=4 1918 B13R0.113 CCOCC(=O)NCCNC(=O)CC 5d7caf8aa161b535dcfe9f35e60668fb [0,2,0,0,0,0|2,0,0]=4 1919 B13R0.113 CCSCC(=O)NCCNC(=O)CC e768fe23aa2a3ce3c5c6c901ab9f7d66 [0,2,0,0,0,0|2,0,0]=4 1920 B13R0.119 CCCNC(=O)CNC/C=C/C(C)C ff78189189ab2b8b00b79d16ceda09ad [0,2,0,0,0,0|2,0,0]=4 1921 B13R0.154 CC/C=C/CCOC(C)CCC(C)C 7c9065f0f45a14b6640121142b3552ff [0,2,0,0,0,0|1,0,1]=4 1922 B13R0.154 CC/C=C/COCC(=O)NCC(C)C 4bbbe4826dfd770c100fd27a03a0d527 [0,2,0,0,0,0|2,0,0]=4 1923 B13R0.154 CC/C=C\CCOC(C)CCC(C)C 248a7aec7235ec7edb143683a41bfaf6 [0,2,0,0,0,0|1,0,1]=4 1924 B13R0.154 CC/C=C\CCOC(C)CCN(C)C 577be7f1f169447792456740dc763d47 [0,2,0,0,0,0|1,0,1]=4 1925 B13R0.154 CC/C=C\CCOC(C)COC(C)C 1109c6837940278586669f8a4cd29350 [0,2,0,0,0,0|1,0,1]=4 1926 B13R0.154 CC/C=C\CCO[C@@H](C)COC(C)C dd75e3d7c9dfa7107d3c4278f7548f80 [0,2,0,0,0,0|1,0,1]=4 1927 B13R0.154 CC/C=C\COCC(=O)NCC(C)C 238fc52559bec20b0d88e2bc1e2877bd [0,2,0,0,0,0|2,0,0]=4 1928 B13R0.195 CC/C=C/CN(C)CC(=O)NCCC 077e02530d1a2eb2b867c5c4171cbef9 [0,2,0,0,0,0|2,0,0]=4 1929 B13R0.338 C=CCCC[C@H](C)OCC/C=C\CC aca93cc150ecce5654fc2ee6bda5180c [0,2,0,0,0,0|1,0,1]=4 1930 B13R0.338 CC/C=C/CCOC(C)CCCCC 1259b20c027c8ce10f28081731e65e30 [0,2,0,0,0,0|1,0,1]=4 1931 B13R0.338 CC/C=C/CCO[C@@H](C)CCCCC 307ff3551427530ffdc3fe714cbe0dbc [0,2,0,0,0,0|1,0,1]=4 1932 B13R0.338 CC/C=C/CNCC(=O)NCCCC c9e16211efb7bbfb7b6a37c59767bbc5 [0,2,0,0,0,0|2,0,0]=4 1933 B13R0.338 CC/C=C/COCC(=O)CCCCC 13e110c1f0393c1279e72774b74814d2 [0,2,0,0,0,0|2,0,0]=4 1934 B13R0.338 CC/C=C/COCC(=O)NCCCC 6d19213e15749b456d9f7d5af9691cfa [0,2,0,0,0,0|2,0,0]=4 1935 B13R0.338 CC/C=C/COCC(=O)NCCOC 78c6d9c151c7bc86e36fe564b811f3ea [0,2,0,0,0,0|2,0,0]=4 1936 B13R0.338 CC/C=C/COCC(=O)OCCCC d02a5ec73097a07f61ed826a87847b2f [0,2,0,0,0,0|2,0,0]=4 1937 B13R0.338 CC/C=C/COCC(=O)OCCOC 2db35c196b2d39d10a16e99b0ece7681 [0,2,0,0,0,0|2,0,0]=4 1938 B13R0.338 CC/C=C\CCOC(C)CCCCC d3c7cde3ee37939c42a3769e8b04d69a [0,2,0,0,0,0|1,0,1]=4 1939 B13R0.338 CC/C=C\CCOC(C)COCCC 935578fbe61bd23fcf8231659bb4772c [0,2,0,0,0,0|1,0,1]=4 1940 B13R0.338 CC/C=C\CCO[C@@H](C)CCCCC 496f7e9d29b684a4b9469a5244e703e5 [0,2,0,0,0,0|1,0,1]=4 1941 B13R0.338 CC/C=C\CCO[C@H](C)CCCCC be92706479168a156b716b8a6a98d7ef [0,2,0,0,0,0|1,0,1]=4 1942 B13R0.338 CC/C=C\COCC(=O)CCCCC 46dd05ae10da4916705268cdee357b3e [0,2,0,0,0,0|2,0,0]=4 1943 B13R0.338 CC/C=C\COCC(=O)NCCCC 24376e34c662a3ea9361ac0751e4b893 [0,2,0,0,0,0|2,0,0]=4 1944 B13R0.338 CC/C=C\COCC(=O)NCCOC 94f195755f38b3285fcd602099341e05 [0,2,0,0,0,0|2,0,0]=4 1945 B13R0.338 CC/C=C\COCC(=O)OCCCC 7f975803c596361cc214875bc95c1b43 [0,2,0,0,0,0|2,0,0]=4 1946 B13R0.338 CC/C=C\COCC(=O)OCCOC 7d8efe04385cc9e1af74df953252fefb [0,2,0,0,0,0|2,0,0]=4 1947 B13R0.338 CCC#CCC(C)OCC/C=C\CC 5c9f438b637812a326a123ecb1858c6a [0,2,0,0,0,0|1,0,1]=4 1948 B13R0.89 CCCC(=O)NC(C)CC(=O)OCC 916085ab774475203359e7f2f16ea6bc [0,2,0,0,0,0|2,0,0]=4 1949 B13R0.89 CCCC(=S)OC(C)CC(=O)OCC 1a4704a93570b5a319df7a135abd0485 [0,2,0,0,0,0|1,1,0]=4 1950 B13R0.91 CCCC(=O)OCCOC(C)C(C)C 544464fe16fb8722d2c002b62e149881 [0,2,0,0,0,0|1,0,1]=4 1951 B13R0.1115 CCCC(=O)OCCOC(C=O)CC 551f78da16371a0dfcd5bc68182f21ad [0,2,0,0,0,0|1,0,1]=4 1952 B13R0.1115 CCCC(=O)OCCOC(CC)CC 81165a49508d70911ccbc236daa51252 [0,2,0,0,0,0|1,0,1]=4 1953 B13R0.21 CCCC(=O)OCCOCC(C)(C)C 438326437140e00556068b5514c5139c [0,2,0,0,0,0|1,0,1]=4 1954 B13R0.21 CCCC(=O)OCCOCC(C)(C)F ed0e7121787bfc924d0ffdc49e09d19f [0,2,0,0,0,0|1,0,1]=4 1955 B13R0.21 CCCC(=O)OCCOCC(C)(C)O 8e7634842dc50627f8495ee61045b6b4 [0,2,0,0,0,0|1,0,1]=4 1956 B13R0.21 CCCC(=O)OCCOCC(C)(F)F dfed780b97c0f458b2406a1ae0832a8c [0,2,0,0,0,0|1,0,1]=4 1957 B11R1.4 C/C=C/CCOC1CCCC1 0a6def5a8b60a42429a2046fa33bb9c0 [1,0,0,1,0,0|1,0,1]=4 1958 B11R1.4 CC/C=C/COC1CCCC1 22f1a97617cf69c83dda239e5f114c0f [1,0,0,1,0,0|1,0,1]=4 1959 B11R1.4 CC/C=C/COC1CCCO1 fcb332c7f10d2c1e2c40d9dca815d1de [1,0,0,1,0,0|0,0,2]=4 1960 B11R1.4 CC/C=C\COC1CCCC1 091a743790bd53272236b12a8a7729cc [1,0,0,1,0,0|1,0,1]=4 1961 B11R1.16 CCCC(=O)N1CC=CCC1 787b44301fda272a67fce7162c3e6048 [1,0,0,1,0,0|1,0,0]=3 1962 B11R1.16 CCCC(=O)N1CCOCC1 d2d1c1e937c47cbf76edf1360365ca7e [1,0,0,1,0,0|2,0,0]=4 1963 B11R1.16 CCCC(=O)N1CCSCC1 d071db11318b039576c8161f62ed50b9 [1,0,0,1,0,0|2,0,0]=4 1964 B11R1.16 COCC(=O)N1CC=CCC1 9c4216279a9fdfaf60b1285a48782857 [1,0,0,1,0,0|2,0,0]=4 1965 B11R1.16 CSCC(=O)N1CC=CCC1 907d03d3de2bc91fa1c29e03f14b4d29 [1,0,0,1,0,0|2,0,0]=4 1966 B11R1.16 O=C(CCF)N1CC=CCC1 0fd13afd98011b4b147cbd731c2a13d0 [1,0,0,1,0,0|2,0,0]=4 1967 B11R1.16 O=C(CCO)N1CC=CCC1 1b7e8dcaadfef1cd4dcadad19c9cd2aa [1,0,0,1,0,0|2,0,0]=4 1968 B11R1.16 O=C(CCS)N1CC=CCC1 792763d0e36a87684953ec54b69b3055 [1,0,0,1,0,0|2,0,0]=4 1969 B11R1.24 C/C=C/CN1CCCC(=O)C1 7858236552a31bd92aa134b340e08160 [1,0,0,1,0,0|2,0,0]=4 1970 B11R1.24 C/C=C\CN1CCCC(=O)C1 d08abc826a9355e74faa8533e0d283e4 [1,0,0,1,0,0|2,0,0]=4 1971 B11R1.24 CCCNC1CCCC(=O)C1 f78a901451b50e451bf018305d12a0cc [1,0,0,1,0,0|1,0,1]=4 1972 B11R1.24 CCCOC1CCCC(=O)C1 3a62b9596446c853f594c7714567c6fa [1,0,0,1,0,0|1,0,1]=4 1973 B11R1.24 CCNCC1CCCC(=O)N1 245951673b534df0bf27d890092fcdeb [1,0,0,1,0,0|2,0,0]=4 1974 B11R1.24 CCOCC1CCCC(=O)C1 59f3485ad485a6e1d97c966f04f592f9 [1,0,0,1,0,0|1,0,1]=4 1975 B11R1.24 CCOCC1CCCC(=O)N1 ae7b22866fb52b162e0bd2153c57f3fa [1,0,0,1,0,0|2,0,0]=4 1976 B11R1.24 CCOC[C@@H]1CCCC(=O)N1 e702e00726367338ffd611c3a76033db [1,0,0,1,0,0|2,0,0]=4 1977 B11R1.24 CCOC[C@H]1CCCC(=O)N1 aad994c462d12f350a0479fdd23025c1 [1,0,0,1,0,0|2,0,0]=4 1978 B11R1.30 CCCC(=O)CN1CC=CC1 e322b106c9b3a4357bc4e14e9255e236 [1,0,0,1,0,0|2,0,0]=4 1979 B11R1.30 CCCC(=O)NC1CC=CC1 87e0e96ae3493d85942678b7131efa99 [1,0,0,1,0,0|1,0,0]=3 1980 B11R1.30 CCCC(=O)NC1CCCC1 da3e432756375bd4b968b22985d71611 [1,0,0,1,0,0|1,0,1]=4 1981 B11R1.30 CCCC(=O)NC1CCOC1 6d331d9781879e4b48434b0e8b576170 [1,0,0,1,0,0|2,0,0]=4 1982 B11R1.30 CCCC(=O)NC1CCSC1 2d25a963fd9d83516c8cac9edd96e4d8 [1,0,0,1,0,0|2,0,0]=4 1983 B11R1.30 CCCC(=O)N[C@@H]1CCOC1 f49cb770913ed6e346c4aff217835a73 [1,0,0,1,0,0|2,0,0]=4 1984 B11R1.30 CCCC(=O)N[C@H]1CCOC1 385ec125cda2ad30eaa19ebd258dbb87 [1,0,0,1,0,0|2,0,0]=4 1985 B11R1.30 CCCC(=S)OC1CCCC1 3fd313e1df11825f4da5dd94540b07d3 [1,0,0,1,0,0|0,1,1]=4 1986 B11R1.30 CCCC(=S)OC1CCOC1 4eec54338eab2f8eb6a852d05c48767a [1,0,0,1,0,0|1,1,0]=4 1987 B11R1.30 CCCC(=S)O[C@@H]1CCOC1 ca7196059c240afe783d033ec46c6d9a [1,0,0,1,0,0|1,1,0]=4 1988 B11R1.30 CCCC(=S)O[C@H]1CCOC1 e9dd96c0f040e60cefa56cb3ba6a8e16 [1,0,0,1,0,0|1,1,0]=4 1989 B11R1.30 CCCC(C)OC1C=CCC1 5e0b3d75818fbd7e7ce2681ad6bef755 [1,0,0,1,0,0|1,0,1]=4 1990 B11R1.30 CCCC(C)OC1CC=CC1 00ac1f3a586e23e1e0f3f239bf4a0674 [1,0,0,1,0,0|1,0,1]=4 1991 B11R1.30 COCC(=O)NC1CC=CC1 986b4d8537f81bd02354bcd3027a6efb [1,0,0,1,0,0|2,0,0]=4 1992 B11R1.30 O=C(CCF)NC1CC=CC1 fc14231e0d77ec5ff8d473d1ee8357cd [1,0,0,1,0,0|2,0,0]=4 1993 B11R1.30 O=C(CCO)NC1CC=CC1 4be1eb2bf9cb573155c6779da5ba6ebd [1,0,0,1,0,0|2,0,0]=4 1994 B11R1.30 O=C(CCS)NC1CC=CC1 35c88a4964e0b6d17460b84242cb219d [1,0,0,1,0,0|2,0,0]=4 1995 B11R1.78 CC/C=C/COC1CC(C1)C 1b17327105ab2fe6c27c99075796a299 [1,0,0,1,0,0|1,0,1]=4 1996 B11R1.81 CCOC1CCC(=O)CC1C bbd05b28fe91bed54594e6c907dba246 [1,0,0,1,0,0|1,0,1]=4 1997 B11R1.135 CCCN1CCCC(=O)CC1 5d78a27b1115d294c02accd204f79118 [1,0,0,1,0,0|1,0,1]=4 1998 B11R1.135 CCOC1CCCC(=O)NC1 4189d64438fb7860c330be2892be390d [1,0,0,1,0,0|2,0,0]=4 1999 B11R1.180 C/C=C/COC1CCCC1=O b05d4dd01c072fe5f2192ae3c470a21f [1,0,0,1,0,0|2,0,0]=4 2000 B11R1.180 C/C=C\COC1CCCC1=O 9bd0aa6a9ea22bf465415cd6785bd665 [1,0,0,1,0,0|2,0,0]=4 2001 B11R1.180 CC=CCNC1CCCC1=O 6347166fc51cc11632bea139b771e18e [1,0,0,1,0,0|2,0,0]=4 2002 B11R1.180 CC=CCOC1CCCC1=O ab58de2a5311b318073fc2892a6900cd [1,0,0,1,0,0|2,0,0]=4 2003 B11R1.180 CCCOCC1CCCC1=O 38a6f11d54d34dd53e14f1182522173f [1,0,0,1,0,0|1,0,1]=4 2004 B11R1.180 CCNCCN1CCCC1=O 36a7b721f69f8b18b7bc5858c5b90e81 [1,0,0,1,0,0|2,0,0]=4 2005 B11R1.180 CCOCCN1CCCC1=O eec83e50d5d1cf07c9841640aebd1ba4 [1,0,0,1,0,0|2,0,0]=4 2006 B11R1.199 CCCC(=O)N1CCCC1C 8c24dc4b9058c88c58f6be94f5bfa8dc [1,0,0,1,0,0|1,0,1]=4 2007 B11R1.199 CCCC(=O)N1CCC[C@@H]1C 87bbbddbc09dd6f86d6c8e25df54a80d [1,0,0,1,0,0|1,0,1]=4 2008 B11R1.199 CCCC(=O)N1CCC[C@H]1C 1bc4022f596909465ba443478f45a3f5 [1,0,0,1,0,0|1,0,1]=4 2009 B11R1.199 CCCC(=O)N1CCSC1C f5421b9567498e6bfdf6930e25bd26df [1,0,0,1,0,0|2,0,0]=4 2010 B11R1.200 CCCC(=O)N1CCC1CC 1463a3076dd4a4f8cdaa143f1b5367da [1,0,0,1,0,0|1,0,1]=4 2011 B11R1.230 CCCOC1OC(=O)CC1C f8b98e79aad2fd39ea3dc6c840dbd841 [1,0,0,1,0,0|1,0,1]=4 2012 B11R1.265 CCC1C(=O)NCCN1CC 20cad01c24a6fd6c6dca4bb23ec63051 [1,0,0,1,0,0|2,0,0]=4 2013 B11R1.289 CCCC(=O)NCC1CCC1 5b5629fcb62edf562f55605727998243 [1,0,0,1,0,0|1,0,1]=4 2014 B11R1.289 CCCC(=O)NCC1CCO1 c88cd3184f6f7df2e7d195783849ec29 [1,0,0,1,0,0|2,0,0]=4 2015 B11R1.289 CCCC(=O)NC[C@@H]1CCO1 6ebf05f92fe3c48e393397e70ae0299f [1,0,0,1,0,0|2,0,0]=4 2016 B11R1.289 CCCC(=O)NC[C@H]1CCO1 673ab8561ba0f9f686e4c23f9923819b [1,0,0,1,0,0|2,0,0]=4 2017 B11R1.289 CCCC(=O)OCN1CCC1 7349536bcaaf6321025597a599bb215a [1,0,0,1,0,0|1,0,1]=4 2018 B11R1.289 CCCC(=S)OCC1CCC1 cb7b37bc0b934052223a44a5747503af [1,0,0,1,0,0|0,1,1]=4 2019 B11R1.289 CCCC(=S)OCC1CCO1 023ba35ad3bb53d5767bdfdf7c02f931 [1,0,0,1,0,0|1,1,0]=4 2020 B11R1.289 CCCC(=S)OC[C@@H]1CCO1 09754b0a55fab1dbd7359797d250de45 [1,0,0,1,0,0|1,1,0]=4 2021 B11R1.289 CCCC(=S)OC[C@H]1CCO1 26f3ad0afb0eef31ce5bb553d2fc5db5 [1,0,0,1,0,0|1,1,0]=4 2022 B11R1.290 CCCC(=O)NCCC1CC1 c432eda3bdde520848213d9a422afe00 [1,0,0,1,0,0|1,0,1]=4 2023 B11R1.290 CCCC(=O)NCCN1CC1 f67979bc0ed19ec538b5db02d3ec2712 [1,0,0,1,0,0|2,0,0]=4 2024 B11R1.290 CCCC(=O)OCNC1CC1 43fcec24fbfef50b224d0e27d37f28b1 [1,0,0,1,0,0|1,0,1]=4 2025 B11R1.290 CCCC(=O)OCOC1CC1 c2019d33dbebb658ce4dcad4e0c27779 [1,0,0,1,0,0|1,0,1]=4 2026 B11R1.290 CCCC(=S)OCCC1CC1 0fd9250a483414aeb9c9fab23588cdf9 [1,0,0,1,0,0|0,1,1]=4 2027 B11R1.291 CCCC(=O)NC1COC1C 2e1973fa6f5718042a0636d04efce41a [1,0,0,1,0,0|2,0,0]=4 2028 B11R1.291 CCCC(=O)N[C@@H]1CC[C@H]1C 6bfc221917be827119a6323aeb1c35ae [1,0,0,1,0,0|1,0,1]=4 2029 B11R1.291 CCCC(=O)N[C@H]1CC[C@H]1C dad3e06ac860c055e6d51faea1fe754d [1,0,0,1,0,0|1,0,1]=4 2030 B11R1.356 C/C=C/CCOC(C)C1CC1 c6b4d9af6026b86505521232ea749420 [1,0,0,1,0,0|1,0,1]=4 2031 B11R1.356 C/C=C/COCC(=O)C1CC1 aa13f0ca4f1c636026ca130f82c95d6b [1,0,0,1,0,0|2,0,0]=4 2032 B11R1.356 C/C=C\COCC(=O)C1CC1 c504e67c623308aeafb49a62e257891a [1,0,0,1,0,0|2,0,0]=4 2033 B11R1.356 CC/C=C/COC(C)C1CC1 123c6f0f2dc70bbb3c47232c1095385d [1,0,0,1,0,0|1,0,1]=4 2034 B11R1.356 CC/C=C/CO[C@@H](C)C1CC1 4ee67ab05ddff5c679e339618232042f [1,0,0,1,0,0|1,0,1]=4 2035 B11R1.356 CC/C=C/CO[C@H](C)C1CC1 bd88e828406efa8136603ae2947185d3 [1,0,0,1,0,0|1,0,1]=4 2036 B11R1.356 CC/C=C\CCN(C)C1CC1 fdd5195b14ac050b38b8f6fd7658b150 [1,0,0,1,0,0|2,0,0]=4 2037 B11R1.356 CC/C=C\COC(C)C1CC1 6b1026bba5752621617a4734fce35013 [1,0,0,1,0,0|1,0,1]=4 2038 B11R1.356 CC=CCNCC(=O)C1CC1 90d4c3a1d7a6abba5d971d1f2a2f1d06 [1,0,0,1,0,0|2,0,0]=4 2039 B11R1.356 CC=CCOCC(=O)C1CC1 eb82b32725e827d6ed301e343c0b8d28 [1,0,0,1,0,0|2,0,0]=4 2040 B11R1.356 CCCNCOC(=O)C1CC1 9103502bd22c746eb445f8a66f4b65cb [1,0,0,1,0,0|1,0,1]=4 2041 B11R1.356 CCCOCOC(=O)C1CC1 3a3923df6b28be4b17eea3ddafdc4628 [1,0,0,1,0,0|1,0,1]=4 2042 B11R1.949 CCN1CCNC(=O)CC1C e9a3a48bacb57126db7dfbcc20e26947 [1,0,0,1,0,0|2,0,0]=4 2043 B11R1.28 CCCCOC1CC=CCC1 f226528d6724a8c1c1c8e1176051e960 [1,0,0,1,0,0|0,0,1]=3 2044 B11R1.28 CCCNCC1CC=CCC1 763aa6fa8ba34f4e96e3238bdf993b89 [1,0,0,1,0,0|2,0,0]=4 2045 B11R1.28 CCCOCC1CC=CCC1 20721251404fcf4735a470d02c4ed9be [1,0,0,1,0,0|2,0,0]=4 2046 B11R1.28 CCCOC[C@@H]1CC=CCC1 5401c46850d5ee0cccb01da9f735a1b8 [1,0,0,1,0,0|2,0,0]=4 2047 B11R1.28 CCCOC[C@H]1CC=CCC1 c5113d295c67d12716c407d70ecd31a0 [1,0,0,1,0,0|2,0,0]=4 2048 B11R1.28 CCOCOC1CC=CCC1 465cfeabe804ad71944524a67da83bdb [1,0,0,1,0,0|1,0,1]=4 2049 B11R1.28 COCCOC1CC=CCC1 41914223fcc3bc65b26e4c9c9cd4f48a [1,0,0,1,0,0|1,0,1]=4 2050 B11R1.28 CSCCOC1CC=CCC1 3bdbb472946d8a3f548870c8b4cba09b [1,0,0,1,0,0|1,0,1]=4 2051 B11R1.28 FCCCOC1CC=CCC1 8080d7309a2fd4fbc0eb552c9f92d19b [1,0,0,1,0,0|1,0,1]=4 2052 B11R1.28 SCCCOC1CC=CCC1 9ff95b2f315b78f64fd8236005ad6c9d [1,0,0,1,0,0|1,0,1]=4 2053 B11R1.46 CC/C=C\CCNC1CC1C e92c4e6b06443ae942fd34079c8559ea [1,0,0,1,0,0|1,0,1]=4 2054 B11R1.47 CC/C=C/CCOC1CCC1 9a47b4bbd1bbe69ba650d40280c1411c [1,0,0,1,0,0|0,0,1]=3 2055 B11R1.47 CC/C=C/CCOC1COC1 8c6d6c5abfc05ed5dba4577c5ac403af [1,0,0,1,0,0|1,0,1]=4 2056 B11R1.47 CC/C=C\CCNC1CCC1 5d5e28d4c31214a27cb49649a75f2c3a [1,0,0,1,0,0|1,0,1]=4 2057 B11R1.47 CC/C=C\CCOC1CCC1 aff89e7de14f2f074264b9f52364134b [1,0,0,1,0,0|0,0,1]=3 2058 B11R1.47 CC/C=C\CCOC1COC1 2e583b4d60f6c7f6ea0129e294d3dae5 [1,0,0,1,0,0|1,0,1]=4 2059 B11R1.47 CC/C=C\CCOC1CSC1 5d9762b129f762503947324e93097eb4 [1,0,0,1,0,0|1,0,1]=4 2060 B11R1.99 CC/C=C/CCOCC1CC1 294b7410b3559ceb13f45999d1d632f0 [1,0,0,1,0,0|0,0,1]=3 2061 B11R1.99 CC/C=C\CCCOC1CC1 227b2bc3279ea5e4c65b1c3efd9165f5 [1,0,0,1,0,0|2,0,0]=4 2062 B11R1.99 CC/C=C\CCNCC1CC1 1ad815cda3a906ca48f48c817cca453b [1,0,0,1,0,0|1,0,1]=4 2063 B11R1.99 CC/C=C\CCOCC1CC1 1ee9fb3aed74fc375d4b46d5a41dfafc [1,0,0,1,0,0|0,0,1]=3 2064 B11R1.99 CCCNCCCC=C1CC1 438ec4f990cabe2abefdad450931d6ef [1,0,0,1,0,0|2,0,0]=4 2065 B11R1.99 CCCOCCCC=C1CC1 9dc8f486e6f26e4fac5d7f1cdb95b9cc [1,0,0,1,0,0|2,0,0]=4 2066 B11R1.203 CCCNC1CCC=CCC1 66b0fafa8f9e791c05b64af469ab8bf8 [1,0,0,1,0,0|2,0,0]=4 2067 B11R1.1 CCCOC1CCC(=O)OC1 14f68677ebd93dd79e6aff031f73ae29 [1,0,0,1,0,0|1,0,1]=4 2068 B11R1.25 CCC(=O)COC1C=CCC1 ec23246ef581bcbb6677bf3ea7c34ac7 [1,0,0,1,0,0|2,0,0]=4 2069 B11R1.25 CCC(C)OCC1C=CCC1 18175f137ce80a5663d2848bf00ac5b7 [1,0,0,1,0,0|1,0,1]=4 2070 B11R1.27 CCCNCC1CCC(=O)O1 192e1b88d26e187571243f52c87c3f25 [1,0,0,1,0,0|1,0,1]=4 2071 B11R1.27 CCCOCC1CCC(=O)O1 e9e82695e85d6e35f1d9b435b1472756 [1,0,0,1,0,0|1,0,1]=4 2072 B11R1.27 CCCOC[C@@H]1CCC(=O)O1 451cbd28723ca3d63ce2083daa5f1a8b [1,0,0,1,0,0|1,0,1]=4 2073 B11R1.27 CCCOC[C@H]1CCC(=O)O1 ba98c0589f5943fe8be2745df7bb5cb9 [1,0,0,1,0,0|1,0,1]=4 2074 B11R1.40 CCC(=O)CN1CC=CCC1 9d1ef1c7710a535ddae6c2ee5620ea48 [1,0,0,1,0,0|2,0,0]=4 2075 B11R1.40 CCC(C)OC1CC=CCC1 20447d17e84496ab3e90d88ef2611f35 [1,0,0,1,0,0|1,0,1]=4 2076 B11R1.237 CCC(=O)OCCOC1CC1 0edf8fa417b2cc16897743808c4a9552 [1,0,0,1,0,0|1,0,1]=4 2077 B13R1.6 CC/C=C/CNC1CCNC(=O)C1 b9f54517cbc503ef2e75a6545ec92da4 [0,1,0,1,0,0|2,0,0]=4 2078 B13R1.6 CC/C=C/CN[C@@H]1CCNC(=O)C1 193980b81c8521fa2cc4fd31ccc5cd0d [0,1,0,1,0,0|2,0,0]=4 2079 B13R1.6 CC/C=C/CN[C@H]1CCNC(=O)C1 6c2e666b87f306dac5c19197e8057920 [0,1,0,1,0,0|2,0,0]=4 2080 B13R1.6 CC/C=C/COC1=CC(=O)CCC1 db01b4fb09c0f9f95d9b4a8b326ca3da [0,1,0,1,0,0|1,0,1]=4 2081 B13R1.6 CC/C=C/COC1C=C(CCC1)C 4826e6b7f41b71f5b16f1bd5896882cd [0,1,0,1,0,0|2,0,0]=4 2082 B13R1.6 CC/C=C/COC1CCCC(=O)C1 de14220cc62164829777176878872799 [0,1,0,1,0,0|1,0,0]=3 2083 B13R1.6 CC/C=C/COC1CCNC(=O)C1 13dcc7f4541ae050479d7c70443636af [0,1,0,1,0,0|2,0,0]=4 2084 B13R1.6 CC/C=C/CO[C@@H]1CCNC(=O)C1 6d0ee691d436eb15d472b9e6e151d979 [0,1,0,1,0,0|2,0,0]=4 2085 B13R1.6 CC/C=C/CO[C@H]1CCNC(=O)C1 1f46ebd80380a59e0078e1158db93e11 [0,1,0,1,0,0|2,0,0]=4 2086 B13R1.6 CC/C=C\CCN1CCCC(=O)C1 ea03c05a5f788cfbe2509855df45ff09 [0,1,0,1,0,0|1,0,0]=3 2087 B13R1.6 CC/C=C\CCN1CCNC(=O)C1 82df7d1374edd89ae6c0888485b58a7b [0,1,0,1,0,0|2,0,0]=4 2088 B13R1.6 CC/C=C\CCN1CCOC(=O)C1 ad74ff5bd72829c630364da49222c058 [0,1,0,1,0,0|2,0,0]=4 2089 B13R1.6 CC/C=C\COC1CCCC(=O)C1 297590e64076add439deb56f8a286a7d [0,1,0,1,0,0|1,0,0]=3 2090 B13R1.6 CCC/C=C/CN1CCCC(=O)C1 5a08b121eb3fb54fed9cb0c44b7ac965 [0,1,0,1,0,0|2,0,0]=4 2091 B13R1.6 CCC/C=C\CN1CCCC(=O)C1 b1c0f3cde4bab18ac1bc38dc843a4c3e [0,1,0,1,0,0|2,0,0]=4 2092 B13R1.42 CCCC(=O)CNC1C=CCCC1 4eeeb236c6c89d32498bc160b11dad9e [0,1,0,1,0,0|2,0,0]=4 2093 B13R1.42 CCCC(=O)COC1C=CCCC1 6569109271af30c7f5b9701055f32167 [0,1,0,1,0,0|0,0,2]=4 2094 B13R1.42 CCCC(=O)COC1CC=CCC1 e06a2a6bd299f203b41ac2060e699977 [0,1,0,1,0,0|0,0,0]=2 2095 B13R1.42 CCCC(=O)COC1CCCCC1 c58094bed5f5492e909817d78b64cf2b [0,1,0,1,0,0|0,0,2]=4 2096 B13R1.42 CCCC(=O)COC1CCCOC1 1af5d638a645679008be71e8ffdcb105 [0,1,0,1,0,0|1,0,1]=4 2097 B13R1.42 CCCC(=O)COC1CCCSC1 092d72227365cd2dd1b17b0ac422e1da [0,1,0,1,0,0|1,0,1]=4 2098 B13R1.42 CCCC(=O)COC1CCOCC1 70cd893975c934fd7524fb643063f988 [0,1,0,1,0,0|1,0,1]=4 2099 B13R1.42 CCCC(=O)COC1CCSCC1 fb40dc889c73c6f863adfedbc7fe3fef [0,1,0,1,0,0|1,0,1]=4 2100 B13R1.42 CCCC(=O)CO[C@@H]1CCCOC1 db30755d3729a9d6b58d37ed57d7f7bf [0,1,0,1,0,0|1,0,1]=4 2101 B13R1.42 CCCC(=O)CO[C@H]1CCCOC1 2703596e68e9055a23d74ca0cf4ae37c [0,1,0,1,0,0|1,0,1]=4 2102 B13R1.42 CCCC(=O)NCC1CC=CCC1 12be34d22442fb10bd1a5ded3ba31ed7 [0,1,0,1,0,0|1,0,0]=3 2103 B13R1.42 CCCC(=O)OCN1CC=CCC1 76819435715eef14a19a83d27c03dbe6 [0,1,0,1,0,0|0,0,0]=2 2104 B13R1.42 CCCC(=O)OCN1CCCOC1 b5dae6b5822b9b89e1d1b0890a9d803f [0,1,0,1,0,0|1,0,1]=4 2105 B13R1.42 CCCC(=O)OCN1CCCSC1 0e6788b80f43cb7d34382259a5f11fbb [0,1,0,1,0,0|1,0,1]=4 2106 B13R1.42 CCCC(=O)OCN1CCOCC1 0f841d2b166e2910b3c31a8ba4824608 [0,1,0,1,0,0|1,0,1]=4 2107 B13R1.42 CCCC(=O)OCN1CCSCC1 87acf1ce4a6baae51b21e5cf02ea6c20 [0,1,0,1,0,0|1,0,1]=4 2108 B13R1.42 CCCC(=S)OCC1CC=CCC1 9cd6f68431b5a2d85edf96e088a77597 [0,1,0,1,0,0|0,1,0]=3 2109 B13R1.42 CCCC(C)COC1CC=CCC1 8e6a940dacd9703d227f1f42cb6218ec [0,1,0,1,0,0|1,0,1]=4 2110 B13R1.42 CCCC(C)OCC1CC=CCC1 7d32e83a8e0cd688414787ca7a6b242f [0,1,0,1,0,0|1,0,1]=4 2111 B13R1.42 CCCC(C)OCC1CCC=CO1 2af823598557a899f526a24f551979e1 [0,1,0,1,0,0|1,0,1]=4 2112 B13R1.42 CCCC(C)OC[C@@H]1CC=CCC1 b0f1905199147f85db5426e637c86092 [0,1,0,1,0,0|1,0,1]=4 2113 B13R1.42 CCCC(C)OC[C@H]1CC=CCC1 76fa5578b4d014ee7380ff20fb6de3c0 [0,1,0,1,0,0|1,0,1]=4 2114 B13R1.42 CCC[C@@H](C)OCC1CC=CCC1 0ba407036f44de630cd9900df6c3184a [0,1,0,1,0,0|1,0,1]=4 2115 B13R1.42 CCC[C@H](C)OCC1CC=CCC1 2292a92bb426103c5fb2de2edae83d7d [0,1,0,1,0,0|1,0,1]=4 2116 B13R1.42 CCNC(=O)CCN1CC=CCC1 56735e2ef7381dd1c3b4d62c2055cd75 [0,1,0,1,0,0|2,0,0]=4 2117 B13R1.42 CCNC(=O)COC1CC=CCC1 c5ca6a91bdbdb2d3f2c345c8945b1d6b [0,1,0,1,0,0|1,0,0]=3 2118 B13R1.42 CCOC(=O)CCN1CC=CCC1 a4e0543a5caf477e75563278366aa937 [0,1,0,1,0,0|2,0,0]=4 2119 B13R1.42 CCOC(=O)COC1CC=CCC1 e5ba72ff42ed1fee6610c4ccfc3b0896 [0,1,0,1,0,0|1,0,0]=3 2120 B13R1.42 CCOC(=O)OCN1CC=CCC1 40140bd3e7cea0bf1f7e7d7b3ecd8c50 [0,1,0,1,0,0|1,0,0]=3 2121 B13R1.42 CCSC(=O)OCN1CC=CCC1 e9898ccd86931c3ea13244b786e63590 [0,1,0,1,0,0|1,0,0]=3 2122 B13R1.42 COCC(=O)COC1CC=CCC1 9c41f758e87a6df917767127ed02de42 [0,1,0,1,0,0|1,0,0]=3 2123 B13R1.42 COCC(=O)NCC1CC=CCC1 a07d84f85cfd62c5ad7d08642b22a8b7 [0,1,0,1,0,0|2,0,0]=4 2124 B13R1.42 CSCC(=O)NCC1CC=CCC1 35c9489d88475c0bfceb25d66b8967b3 [0,1,0,1,0,0|2,0,0]=4 2125 B13R1.42 O=C(CCF)NCC1CC=CCC1 3dda6cb51d820c6e17aa51a426504f91 [0,1,0,1,0,0|2,0,0]=4 2126 B13R1.42 O=C(CCO)NCC1CC=CCC1 166566fae6d442cd82700e36eaba807c [0,1,0,1,0,0|2,0,0]=4 2127 B13R1.42 O=C(CCS)NCC1CC=CCC1 46f6c863cece325fc4d89cd3463ab5e2 [0,1,0,1,0,0|2,0,0]=4 2128 B13R1.119 CC/C=C/CCOCC1=CCCC1 10334080885f7790e9493fafcce4d13c [0,1,0,1,0,0|1,0,0]=3 2129 B13R1.119 CC/C=C/CCOCC1CCCC1 d9d4f866323b27688d46a5d0b5382956 [0,1,0,1,0,0|1,0,1]=4 2130 B13R1.119 CC/C=C/CCOCC1CCCO1 b92f55baa0ce821b6ccaac2b5aa6b1b7 [0,1,0,1,0,0|0,0,2]=4 2131 B13R1.119 CC/C=C/COCC=C1CCCC1 58a924a8eb85f141c37e64c2991d0e41 [0,1,0,1,0,0|2,0,0]=4 2132 B13R1.119 CC/C=C\CCCOC1CCCC1 a27e9cbf67717acf8c3ab5ed0880c42f [0,1,0,1,0,0|1,0,1]=4 2133 B13R1.119 CC/C=C\CCOCC1=CCCC1 b6c9e15f084958dbe3cfe667e813f199 [0,1,0,1,0,0|1,0,0]=3 2134 B13R1.119 CC/C=C\CCOCC1CCCC1 626a925f6dba193d7cbf8122e536767b [0,1,0,1,0,0|1,0,1]=4 2135 B13R1.119 CC/C=C\CCOCC1CCCO1 2f7c26c084e4b32d659d5e1b5808e05c [0,1,0,1,0,0|0,0,2]=4 2136 B13R1.119 CC/C=C\CCOCC1CCCS1 e510d83a2d7a93e5904e536fa1b61d35 [0,1,0,1,0,0|0,1,1]=4 2137 B13R1.119 CC/C=C\CCOCN1CCCC1 e5dc3edf6cf6761ac76393ec3701bd9b [0,1,0,1,0,0|2,0,0]=4 2138 B13R1.119 CC/C=C\CCOC[C@@H]1CCCO1 6f875f69cdf3f0d7b72f0b05f7c0d661 [0,1,0,1,0,0|0,0,2]=4 2139 B13R1.119 CC/C=C\CCOC[C@H]1CCCO1 06a3e5fcb9cd6388d0df79177f13195a [0,1,0,1,0,0|0,0,2]=4 2140 B13R1.119 CCC/C=C\CCOC1CCCC1 f1945c55558202a2ddcf893d6310fcd1 [0,1,0,1,0,0|1,0,1]=4 2141 B13R1.190 CC/C=C/COC1CC(=O)NC1C 4b3ab80fcee8c65b86c8188a00ccecc4 [0,1,0,1,0,0|2,0,0]=4 2142 B13R1.190 CC/C=C/COC1OC(=O)C=C1C e8548a25ba5cbd187838e9846c2dbf12 [0,1,0,1,0,0|0,0,2]=4 2143 B13R1.190 CC/C=C/COC1OC(=O)CC1C 5185c693bcad87fe875afdbc3fb42147 [0,1,0,1,0,0|0,0,0]=2 2144 B13R1.190 CC/C=C/CO[C@H]1CC(=O)N[C@H]1C a9fdd4b1c7043928c75b08fd4001c426 [0,1,0,1,0,0|2,0,0]=4 2145 B13R1.190 CC1CC(=O)OC1OCC=CC#N da945da09403a85d1f229b5b34ce6806 [0,1,0,1,0,0|1,0,1]=4 2146 B13R1.190 CCCCCOC1OC(=O)CC1C 09b76732ba0d4545bbc8eb9b3e28d202 [0,1,0,1,0,0|0,0,2]=4 2147 B13R1.190 CCOCCOC1OC(=O)CC1C 11c35ceb143d23243b7cb421c28a470b [0,1,0,1,0,0|1,0,1]=4 2148 B13R1.190 CCSCCOC1OC(=O)CC1C a5ba5cf378f47a406323b8ee9b4ff149 [0,1,0,1,0,0|1,0,1]=4 2149 B13R1.362 CC/C=C/CCOCC1CC(C1)C 5b6fbb2de3bf500aaa7cdcb9cba5ae02 [0,1,0,1,0,0|1,0,1]=4 2150 B13R1.362 CC/C=C\CCOCC1CC(C1)C 9122eaeda4fa419c28d49024e5e3288c [0,1,0,1,0,0|1,0,1]=4 2151 B13R1.362 CC/C=C\CCOC[C@H]1C[C@@H](C1)C 8eb776d2c5c795918b291fdb17ce292c [0,1,0,1,0,0|1,0,1]=4 2152 B13R1.404 CCCC(=O)COCC1C=CCC1 c8544f48ea825aa689a9884f6d449871 [0,1,0,1,0,0|0,0,0]=2 2153 B13R1.404 CCCC(=O)COCC1CC=CC1 9018533da89a162897a3c75eecdfade7 [0,1,0,1,0,0|0,0,2]=4 2154 B13R1.404 CCCC(=O)COCC1CCCC1 014602a036ec148f0dbdedbdd084ced5 [0,1,0,1,0,0|0,0,2]=4 2155 B13R1.404 CCCC(=O)COCC1CCCO1 96729f83085a65e224ff891e8e73548a [0,1,0,1,0,0|1,0,1]=4 2156 B13R1.404 CCCC(=O)COCC1CCCS1 1e20012c70e87b68cf0052c1117ee68f [0,1,0,1,0,0|1,0,1]=4 2157 B13R1.404 CCCC(=O)COCC1CCOC1 9d919d6d800393e266d38ab7b4ee6cab [0,1,0,1,0,0|1,0,1]=4 2158 B13R1.404 CCCC(=O)COC[C@@H]1CCCO1 63ce75d1afbcc9acfa42ca43ca50a916 [0,1,0,1,0,0|1,0,1]=4 2159 B13R1.404 CCCC(=O)COC[C@@H]1CCOC1 b87b07da0d606f96d97ca6298ad19ae8 [0,1,0,1,0,0|1,0,1]=4 2160 B13R1.404 CCCC(=O)COC[C@H]1CCCO1 7fa31ee888e5045f6a3b87aa71667124 [0,1,0,1,0,0|1,0,1]=4 2161 B13R1.404 CCCC(=O)COC[C@H]1CCOC1 72897d34d1f4c2f019d6fbc710660bba [0,1,0,1,0,0|1,0,1]=4 2162 B13R1.404 CCCC(=O)OCNC1CC=CC1 2adf7043313291186c87ece8b2418a84 [0,1,0,1,0,0|0,0,2]=4 2163 B13R1.404 CCCC(=O)OCNC1CCCC1 ba66bab046af6c5fafd1be60e661de95 [0,1,0,1,0,0|0,0,2]=4 2164 B13R1.404 CCCC(=O)OCNC1CCOC1 50b6fcc9c7b9aa9a3b26b743a0b9b5b3 [0,1,0,1,0,0|1,0,1]=4 2165 B13R1.404 CCCC(=O)OCNC1CCSC1 051179ec2ec1bd319409536f3dca9c53 [0,1,0,1,0,0|1,0,1]=4 2166 B13R1.404 CCCC(=O)OCN[C@@H]1CCOC1 999c8895b94f46bf26fb23bd17fb718f [0,1,0,1,0,0|1,0,1]=4 2167 B13R1.404 CCCC(=O)OCN[C@H]1CCOC1 1fc80e8044a4dde659022aa29a72b523 [0,1,0,1,0,0|1,0,1]=4 2168 B13R1.404 CCCC(=O)OCOC1C=CCC1 26a03bf05907c3159cad969173915ac3 [0,1,0,1,0,0|0,0,0]=2 2169 B13R1.404 CCCC(=O)OCOC1CC=CC1 c627f08fa61425ce7277fccb2e4cb13c [0,1,0,1,0,0|0,0,2]=4 2170 B13R1.404 CCCC(=O)OCOC1CCCC1 fb63c3af0fd99ce30af085d31ac7b519 [0,1,0,1,0,0|0,0,2]=4 2171 B13R1.404 CCCC(=O)OCOC1CCCO1 2a869c85f0d32eeafa5d8977c78f2483 [0,1,0,1,0,0|1,0,1]=4 2172 B13R1.404 CCCC(=O)OCOC1CCOC1 17f4a4bcb476dfedd71b2af21e05042c [0,1,0,1,0,0|1,0,1]=4 2173 B13R1.404 CCCC(=O)OCOC1CCSC1 efa9f590eb9adc49a3637ad58333c6b9 [0,1,0,1,0,0|1,0,1]=4 2174 B13R1.404 CCCC(=O)OCO[C@@H]1CCOC1 f82e57ff5be0f095c2fc46168fd681d0 [0,1,0,1,0,0|1,0,1]=4 2175 B13R1.404 CCCC(=O)OCO[C@@H]1CCSC1 157c4ef314545273e30bc870c1dcb8f0 [0,1,0,1,0,0|1,0,1]=4 2176 B13R1.404 CCCC(=O)OCO[C@H]1CCOC1 5a7fdf24cc7cf8c46225cdc8b416dd39 [0,1,0,1,0,0|1,0,1]=4 2177 B13R1.404 CCCC(=O)OCO[C@H]1CCSC1 b9e7b989252d8ac1c926db333653b362 [0,1,0,1,0,0|1,0,1]=4 2178 B13R1.404 CCCC(C)COCC1C=CCC1 23bb4a9ca242939626cd5bd98064b2a1 [0,1,0,1,0,0|1,0,1]=4 2179 B13R1.404 CCNC(=O)CCOC1C=CCC1 87c03caa7d63303cf9d1ca186675c35f [0,1,0,1,0,0|2,0,0]=4 2180 B13R1.404 CCNC(=O)COCC1C=CCC1 3c03d8e6a720d6aa9d505e7d3c390b2b [0,1,0,1,0,0|1,0,0]=3 2181 B13R1.404 CCOC(=O)CCOC1C=CCC1 d10b19aed6332912b5ebcffde0393512 [0,1,0,1,0,0|2,0,0]=4 2182 B13R1.404 CCOC(=O)COCC1C=CCC1 d3a3e91e77003961815e8450b4a52eee [0,1,0,1,0,0|1,0,0]=3 2183 B13R1.404 CCOC(=O)OCOC1C=CCC1 e51deb777fad58e7a28dbf1129343b64 [0,1,0,1,0,0|1,0,0]=3 2184 B13R1.404 CCSC(=O)OCOC1C=CCC1 ea4fd9c03b6b9fceeee81c357cd615ad [0,1,0,1,0,0|1,0,0]=3 2185 B13R1.404 COCC(=O)COCC1C=CCC1 c0ea97f865aa45747351512e2e18adeb [0,1,0,1,0,0|1,0,0]=3 2186 B13R1.443 CCCC(=O)CN1CC=CC1CO d13f4db9fa15632d1f0cfd3322436643 [0,1,0,1,0,0|2,0,0]=4 2187 B13R1.444 CCCC(=O)COC1CCC=C1Br d9e94bcfca9e8a342879b1dabf572188 [0,1,0,1,0,0|2,0,0]=4 2188 B13R1.444 CCCC(=O)COC1CCCC1C 4c5bb5b125221b2b70a43370f1ad3328 [0,1,0,1,0,0|0,0,2]=4 2189 B13R1.444 CCCC(=O)COC1COCC1C 46d3372cd65b20f1a0249ae591e77253 [0,1,0,1,0,0|1,0,1]=4 2190 B13R1.444 CCCC(=O)CO[C@@H]1CCC[C@@H]1C 7f3a681f7f67c84c6be6cbcd6ea71f64 [0,1,0,1,0,0|0,0,2]=4 2191 B13R1.444 CCCC(=O)CO[C@@H]1CCC[C@H]1C 45a55202526bbbccde52321f289b8714 [0,1,0,1,0,0|0,0,2]=4 2192 B13R1.444 CCCC(=O)CO[C@@H]1COC[C@@H]1C 75d6254ac9d88d849804090c38c25737 [0,1,0,1,0,0|1,0,1]=4 2193 B13R1.444 CCCC(=O)CO[C@H]1CCC[C@@H]1C fbdc0587776835cc53a7d2975758e665 [0,1,0,1,0,0|0,0,2]=4 2194 B13R1.444 CCCC(=O)CO[C@H]1CCC[C@H]1C e3976c51f0bb1dc470ec1fb7af5363b4 [0,1,0,1,0,0|0,0,2]=4 2195 B13R1.444 CCCC(=O)CO[C@H]1COC[C@@H]1C b6da4cbd2e116da855646e2c2fd82f4f [0,1,0,1,0,0|1,0,1]=4 2196 B13R1.444 CCCC(=O)CO[C@H]1COC[C@H]1C 588756ed4ce88cba69d161e6ab3b45d4 [0,1,0,1,0,0|1,0,1]=4 2197 B13R1.444 CCCC(=O)NCC1CCNC1=O 94b0295c4ca9caf0c6e5b49c7d9f509b [0,1,0,1,0,0|2,0,0]=4 2198 B13R1.444 CCCC(=O)OCN1CCCC1C 8ec4f73f00bc2401841660bac493dc4f [0,1,0,1,0,0|0,0,2]=4 2199 B13R1.444 CCCC(=O)OCN1CCC[C@@H]1C a36648f41955d08c03e7c4a2c2634618 [0,1,0,1,0,0|0,0,2]=4 2200 B13R1.444 CCCC(=O)OCN1CCC[C@H]1C 938e07ec6e070895762f4ebea35727df [0,1,0,1,0,0|0,0,2]=4 2201 B13R1.444 CCCC(=O)OCN1CCSC1C 6c8972d0432e8a64c2eb7ce7c573c81f [0,1,0,1,0,0|1,0,1]=4 2202 B13R1.445 CCCC(=O)OCN1CCC1CC f23aeac66a5892feabfe8bb671e7267b [0,1,0,1,0,0|0,0,2]=4 2203 B13R1.447 CCCC(=O)OCOCC1CC1C 3b6f0c40ec32cbd56897be818c0ebbba [0,1,0,1,0,0|0,0,2]=4 2204 B13R1.447 CCCC(=O)OCOC[C@@H]1C[C@@H]1C c56e8f0d1ee45c302d8162eb8c1177fe [0,1,0,1,0,0|0,0,2]=4 2205 B13R1.447 CCCC(=O)OCOC[C@@H]1C[C@H]1C 62255a07d5264014df070126c995321b [0,1,0,1,0,0|0,0,2]=4 2206 B13R1.447 CCCC(=O)OCOC[C@H]1C[C@@H]1C 7c6bf5c03e3b3e9e261737510eaced33 [0,1,0,1,0,0|0,0,2]=4 2207 B13R1.448 CCCC(=O)COCCC1CCC1 a6ad8af4491283e3bf83511c1f807246 [0,1,0,1,0,0|0,0,2]=4 2208 B13R1.448 CCCC(=O)COCCC1CCO1 0690ad0a0bd168931bfcea1d26c855b2 [0,1,0,1,0,0|1,0,1]=4 2209 B13R1.448 CCCC(=O)COCCN1CCC1 712007bc6b870cbf50ba80b3f94cb613 [0,1,0,1,0,0|1,0,1]=4 2210 B13R1.448 CCCC(=O)COCC[C@@H]1CCO1 b3753b8a069f4635a4db5fe7e17ebb0b [0,1,0,1,0,0|1,0,1]=4 2211 B13R1.448 CCCC(=O)COCC[C@H]1CCO1 77b173e1763751d4a65e345a0e4d25ae [0,1,0,1,0,0|1,0,1]=4 2212 B13R1.448 CCCC(=O)OCCOC1CCC1 2544bb90ca99129d49a761c0a98eedc3 [0,1,0,1,0,0|0,0,2]=4 2213 B13R1.448 CCCC(=O)OCCOC1COC1 92a747d7394e7b555b51472343da3ba7 [0,1,0,1,0,0|1,0,1]=4 2214 B13R1.448 CCCC(=O)OCNCC1CCC1 33f57cf1939f2136e511140baeb8e392 [0,1,0,1,0,0|0,0,2]=4 2215 B13R1.448 CCCC(=O)OCNCC1CCO1 0390a40a55b677fa39a14b71d2ac1848 [0,1,0,1,0,0|1,0,1]=4 2216 B13R1.448 CCCC(=O)OCNC[C@@H]1CCO1 bb4a10261d44e3d2db741b726f5a8e37 [0,1,0,1,0,0|1,0,1]=4 2217 B13R1.448 CCCC(=O)OCNC[C@H]1CCO1 dacb35dd18bf2ad5756aaf5e9f5f570c [0,1,0,1,0,0|1,0,1]=4 2218 B13R1.448 CCCC(=O)OCOCC1CCC1 a6cd8cad70ff28410be6874d07b4c5f4 [0,1,0,1,0,0|0,0,2]=4 2219 B13R1.448 CCCC(=O)OCOCC1CCO1 7ede3130cb2fe11f750d3090ce26a048 [0,1,0,1,0,0|1,0,1]=4 2220 B13R1.448 CCCC(=O)OCOC[C@@H]1CCO1 caa02e555d0e84ad5047d027cfcb10ba [0,1,0,1,0,0|1,0,1]=4 2221 B13R1.448 CCCC(=O)OCOC[C@H]1CCO1 3152c966e3f9cc80f0b6c1459ff62e26 [0,1,0,1,0,0|1,0,1]=4 2222 B13R1.453 CCCC(=O)COC/C=C/C1CC1 ece980542d35bda3bd086617caa22924 [0,1,0,1,0,0|0,0,2]=4 2223 B13R1.453 CCCC(=O)COCCCC1CC1 acc87509580ed9da2b9bbb67aef347d8 [0,1,0,1,0,0|0,0,2]=4 2224 B13R1.453 CCCC(=O)COCCOC1CC1 a7f90f3a63227237ec39d936b1727213 [0,1,0,1,0,0|1,0,1]=4 2225 B13R1.453 CCCC(=O)OCCOCC1CC1 e98d685dc705959c13e62debdc698679 [0,1,0,1,0,0|0,0,2]=4 2226 B13R1.453 CCCC(=O)OCNCCC1CC1 919531d672bd2b414943eb350d76df5f [0,1,0,1,0,0|0,0,2]=4 2227 B13R1.453 CCCC(=O)OCNCCN1CC1 8fe8e9ba194d821b46ba6b08bac0e77d [0,1,0,1,0,0|1,0,1]=4 2228 B13R1.453 CCCC(=O)OCOCCC1CC1 eeafd0ea11229f9c063d52df60a56075 [0,1,0,1,0,0|0,0,2]=4 2229 B13R1.453 CCCC(=O)OCOCCN1CC1 12725732fa22dd5312e39bfc92906a14 [0,1,0,1,0,0|1,0,1]=4 2230 B13R1.453 CCCC(=S)OCCCC=C1CC1 b98a94d6b7c5fb44bc60323100bcc3ee [0,1,0,1,0,0|0,1,0]=3 2231 B13R1.453 CCCC(C)OCCCC=C1CC1 3f8eb10cb18ab29c5fd7a9ef9e32556a [0,1,0,1,0,0|1,0,1]=4 2232 B13R1.453 CCC[C@@H](C)OCCCC=C1CC1 b0098ccf37a9dd68cde9d0912c99a0ec [0,1,0,1,0,0|1,0,1]=4 2233 B13R1.453 CCC[C@H](C)OCCCC=C1CC1 2bee51141303d505a164ddaf065e9f72 [0,1,0,1,0,0|1,0,1]=4 2234 B13R1.461 CCCC(=O)OCN[C@@H]1CC[C@H]1C 8196f4024b1a67fc6d96ff2188b77244 [0,1,0,1,0,0|0,0,2]=4 2235 B13R1.461 CCCC(=O)OCN[C@H]1CC[C@H]1C ca6b9ad187538bd9041d9d8cf779c39b [0,1,0,1,0,0|0,0,2]=4 2236 B13R1.461 CCCC(=O)OCOC1COC1C 91e30ba7ede8142e44fb4ac632c825db [0,1,0,1,0,0|1,0,1]=4 2237 B13R1.461 CCCC(=S)OCCC1CCC1=O 33016af523725356a51b070f8c3ee179 [0,1,0,1,0,0|0,1,1]=4 2238 B13R1.654 C/C=C/C=C/COC1CCCC1=O e6c395718a2bfbafafb316242286e462 [0,1,0,1,0,0|0,0,2]=4 2239 B13R1.654 C/C=C/CCCOC1CCCC1=O 142ca9b35b3b0a8a6e6a1ed80e9537e3 [0,1,0,1,0,0|0,0,2]=4 2240 B13R1.654 C/C=C\CCCOC1CCCC1=O 29116f8ede01aade72f1ae3359c12247 [0,1,0,1,0,0|0,0,2]=4 2241 B13R1.654 CC/C=C/CCOC1CCCC1=O 4239fad136752ccf63ac5801089be8f0 [0,1,0,1,0,0|0,0,0]=2 2242 B13R1.654 CC/C=C/CCOC1CCNC1=O 179409e302f30b0baa684e1d9f5058e3 [0,1,0,1,0,0|1,0,0]=3 2243 B13R1.654 CC/C=C/CCOC1CCOC1=O d9caf9c847c6540c7d9c576a6b36352c [0,1,0,1,0,0|1,0,0]=3 2244 B13R1.654 CC/C=C/CNCC1CCNC1=O b32870cdc90f09881d46f31540098ef1 [0,1,0,1,0,0|2,0,0]=4 2245 B13R1.654 CC/C=C/COCC1=CCCC1=O eb73a27d03ff07034ef0d84f87ae1bba [0,1,0,1,0,0|1,0,1]=4 2246 B13R1.654 CC/C=C/COCC1CCCC1=O 23537d3c067c36e038f04de82fbd7e8f [0,1,0,1,0,0|1,0,0]=3 2247 B13R1.654 CC/C=C/COCC1CCNC1=O 5a468d5f0cbbbff5bd868dd3c1f5975c [0,1,0,1,0,0|2,0,0]=4 2248 B13R1.654 CC/C=C/COCN1CCCC1=O a9d6113cc223e106edcee08f2bb8c95d [0,1,0,1,0,0|1,0,0]=3 2249 B13R1.654 CC/C=C\CCNC1CCNC1=O cb0e840e53ec8ad913317ba97103f9e3 [0,1,0,1,0,0|2,0,0]=4 2250 B13R1.654 CC/C=C\CCNC1CCSC1=O 8cbcdf8f94df8de7ef2393adef487607 [0,1,0,1,0,0|2,0,0]=4 2251 B13R1.654 CC/C=C\CCN[C@@H]1CCNC1=O 592c5e84a790cd524d3a9588e3a965cb [0,1,0,1,0,0|2,0,0]=4 2252 B13R1.654 CC/C=C\CCN[C@@H]1CCOC1=O 7468797e02a2b720d4a1a9771a2ed3e9 [0,1,0,1,0,0|2,0,0]=4 2253 B13R1.654 CC/C=C\CCN[C@H]1CCNC1=O cfce13f9aba2a24381418d74ac968529 [0,1,0,1,0,0|2,0,0]=4 2254 B13R1.654 CC/C=C\CCN[C@H]1CCOC1=O acf518ee4c711ecc5ef1c0376eebea30 [0,1,0,1,0,0|2,0,0]=4 2255 B13R1.654 CC/C=C\CCOC1=CCCC1=O 23ade626d789a827137b785161f97137 [0,1,0,1,0,0|0,0,1]=3 2256 B13R1.654 CC/C=C\CCOC1CCC=C1Br 1f6be629a7bd9d8ef09f1b53ca32d9e4 [0,1,0,1,0,0|1,0,1]=4 2257 B13R1.654 CC/C=C\CCOC1CCCC1=O e59ece57115cdfd8588305d191bfd9d8 [0,1,0,1,0,0|0,0,0]=2 2258 B13R1.654 CC/C=C\CCOC1CCCC1C 2b656d8b10d291c1a65ea258dd8ec0f4 [0,1,0,1,0,0|1,0,1]=4 2259 B13R1.654 CC/C=C\CCOC1CCNC1=O 1854ff71be574fb53eab21216cca9919 [0,1,0,1,0,0|1,0,0]=3 2260 B13R1.654 CC/C=C\CCOC1CCOC1=O c5b526ea939b76de88465b54b002181b [0,1,0,1,0,0|1,0,0]=3 2261 B13R1.654 CC/C=C\CCO[C@@H]1CCC[C@@H]1C 7dfd39974cb2e33a399e2d1378a84e98 [0,1,0,1,0,0|1,0,1]=4 2262 B13R1.654 CC/C=C\CCO[C@@H]1CCC[C@H]1C c4c94ba8f73060bf6eb5fb8c75c26ae6 [0,1,0,1,0,0|1,0,1]=4 2263 B13R1.654 CC/C=C\CCO[C@@H]1CCC[C@H]1F 0080b5a0e6576367471d2136e8cced14 [0,1,0,1,0,0|1,0,1]=4 2264 B13R1.654 CC/C=C\CCO[C@@H]1CCNC1=O 8402cd9bfc7bb82535319c023834cc06 [0,1,0,1,0,0|1,0,0]=3 2265 B13R1.654 CC/C=C\CCO[C@@H]1CCOC1=O 29ab8063c5616cebb9a626fe0a093255 [0,1,0,1,0,0|1,0,0]=3 2266 B13R1.654 CC/C=C\CCO[C@H]1CCC[C@@H]1C 1067887e11f4bb0855984d8170957526 [0,1,0,1,0,0|1,0,1]=4 2267 B13R1.654 CC/C=C\CCO[C@H]1CCC[C@H]1C 72f8d896c77a26acfe87952551ffb983 [0,1,0,1,0,0|1,0,1]=4 2268 B13R1.654 CC/C=C\CCO[C@H]1CCNC1=O 8faf530b666a88b8ccbb68798fcf65ab [0,1,0,1,0,0|1,0,0]=3 2269 B13R1.654 CC/C=C\CCO[C@H]1CCOC1=O 2a890484b2bd420650f60e70b769edd2 [0,1,0,1,0,0|1,0,0]=3 2270 B13R1.654 CC/C=C\COCN1CCCC1=O cc543777150faf442f35b0e5d6c49bb6 [0,1,0,1,0,0|1,0,0]=3 2271 B13R1.654 CC=C=CCCOC1CCCC1=O d6ff9fedff760d943d8ae273343dd0cb [0,1,0,1,0,0|0,0,2]=4 2272 B13R1.654 CC=CC=CCOC1CCCC1=O f24f82f7468689f52290579f026d6307 [0,1,0,1,0,0|0,0,2]=4 2273 B13R1.654 CC=CCCCOC1CCCC1=O 1bc3b570560f45264e683f251cf5bae7 [0,1,0,1,0,0|0,0,2]=4 2274 B13R1.654 CCC/C=C/COC1CCCC1=O 10b59ac57edf347a6672c4b984996ba3 [0,1,0,1,0,0|0,0,2]=4 2275 B13R1.654 CCC/C=C\COC1CCCC1=O d478358a535dce45bb8c1c6dd235a7b8 [0,1,0,1,0,0|0,0,2]=4 2276 B13R1.654 CCCCCCOC1CCCC1=O a80a907d7b308c299bf8963f1fc533f6 [0,1,0,1,0,0|0,0,2]=4 2277 B13R1.654 CCCOCCOC1CCCC1=O f375f43a90eef1795d74d5f5bbe68fe0 [0,1,0,1,0,0|1,0,1]=4 2278 B13R1.654 CCCSCCOC1CCCC1=O f625ec796c9ffe90f7175ac228942f36 [0,1,0,1,0,0|1,0,1]=4 2279 B13R1.654 CCOCCCOC1CCCC1=O ac23c3eaa7699b136b284a11ae0c019c [0,1,0,1,0,0|1,0,1]=4 2280 B13R1.654 CCSCCCOC1CCCC1=O 915da654bd6eca37377a342c2d5bd41b [0,1,0,1,0,0|1,0,1]=4 2281 B13R1.1149 CC/C=C/CN1CCCC(=O)CC1 3e4993bef59917b07afdb789a2cfb108 [0,1,0,1,0,0|1,0,0]=3 2282 B13R1.1149 CC/C=C/CN1CCNC(=O)CC1 3d5fb32f0b68cb297c738095fd985c11 [0,1,0,1,0,0|2,0,0]=4 2283 B13R1.1575 CCCC(=O)NC1CCC=CCC1 039aa238ae1319cf563c4352fd25c29e [0,1,0,1,0,0|1,0,0]=3 2284 B13R1.1575 COCC(=O)NC1CCC=CCC1 5c4c350d1b77c2c380e39416bac41b07 [0,1,0,1,0,0|2,0,0]=4 2285 B13R1.1575 O=C(CCF)NC1CCC=CCC1 032301b687b46f67c57792c1fb47be92 [0,1,0,1,0,0|2,0,0]=4 2286 B13R1.3151 C/C=C/C=C/COCC(=O)C1CC1 fef749a69e0247152717143603926c6e [0,1,0,1,0,0|0,0,2]=4 2287 B13R1.3151 C/C=C/CCCOCC(=O)C1CC1 6acc1f8f8b39e8fd018cf1e255ceb533 [0,1,0,1,0,0|0,0,2]=4 2288 B13R1.3151 C/C=C/CCOCOC(=O)C1CC1 7d82e5f88d4d044a3760e815105c79b6 [0,1,0,1,0,0|0,0,2]=4 2289 B13R1.3151 C/C=C\CCCOCC(=O)C1CC1 8ac71e4731edb762014a80ac26f43951 [0,1,0,1,0,0|0,0,2]=4 2290 B13R1.3151 CC/C=C/CCOCC(=O)C1CC1 4396fc30555f812c9bfbd18d0d1e615b [0,1,0,1,0,0|0,0,0]=2 2291 B13R1.3151 CC/C=C/COCOC(=O)C1CC1 a863a9f3cd52a256a216d877b1a5bb15 [0,1,0,1,0,0|0,0,0]=2 2292 B13R1.3151 CC/C=C\CCCOC(C)C1CC1 5be0b8a58d10900b16573adf9cf0cc62 [0,1,0,1,0,0|1,0,1]=4 2293 B13R1.3151 CC/C=C\CCOCC(=O)C1CC1 dfedf6dd765bd6d36eeab08a78564e3c [0,1,0,1,0,0|0,0,0]=2 2294 B13R1.3151 CC/C=C\CCOCC(C)C1CC1 18412f4be26dfa2cfeb69e7f0888e298 [0,1,0,1,0,0|1,0,1]=4 2295 B13R1.3151 CC/C=C\COCOC(=O)C1CC1 b8caa70784db60ab2effe5ce25308e12 [0,1,0,1,0,0|0,0,0]=2 2296 B13R1.3151 CC=C=CCCOCC(=O)C1CC1 59b47a0c44bcd5f963988085cdae7578 [0,1,0,1,0,0|0,0,2]=4 2297 B13R1.3151 CC=CC=CCOCC(=O)C1CC1 7877bdf5cdb1ca10d71d43c8d27bd607 [0,1,0,1,0,0|0,0,2]=4 2298 B13R1.3151 CC=CCCCOCC(=O)C1CC1 f648a1c8b6753885f7c8edd18af66756 [0,1,0,1,0,0|0,0,2]=4 2299 B13R1.3151 CCC#CCCOCC(=O)C1CC1 45ff8feeaa004e1dbc9a49ad460044b8 [0,1,0,1,0,0|0,0,2]=4 2300 B13R1.3151 CCC#CCOCOC(=O)C1CC1 c019f6c5d674a7d8b991e7b7552f354c [0,1,0,1,0,0|0,0,2]=4 2301 B13R1.3151 CCC/C=C/COCC(=O)C1CC1 b96786c29118409d216cf4ebe798c61f [0,1,0,1,0,0|0,0,2]=4 2302 B13R1.3151 CCC/C=C\CCOC(C)C1CC1 5ab06f3593c48b69aa07b7db7124368e [0,1,0,1,0,0|1,0,1]=4 2303 B13R1.3151 CCC/C=C\COCC(=O)C1CC1 f4f891124098b6fdf8f4809a274f44ff [0,1,0,1,0,0|0,0,2]=4 2304 B13R1.3151 CCCCCCOCC(=O)C1CC1 1cb9585a9b5e04547adc75799e511466 [0,1,0,1,0,0|0,0,2]=4 2305 B13R1.3151 CCCCCNCOC(=O)C1CC1 9620d018774a8f34b7506fd8d31ecdb5 [0,1,0,1,0,0|0,0,2]=4 2306 B13R1.3151 CCCCCOCOC(=O)C1CC1 1e5452c48815f9339963eda4ae37d827 [0,1,0,1,0,0|0,0,2]=4 2307 B13R1.3151 CCCOCCOCC(=O)C1CC1 120316ce296a1255140c506880db8799 [0,1,0,1,0,0|1,0,1]=4 2308 B13R1.3151 CCCSCCOCC(=O)C1CC1 9401d2ae9354d0c911d115127b799468 [0,1,0,1,0,0|1,0,1]=4 2309 B13R1.3151 CCOCCCOCC(=O)C1CC1 b634af61dee6b84e42262cb4c3f8d0c3 [0,1,0,1,0,0|1,0,1]=4 2310 B13R1.3151 CCOCCNCOC(=O)C1CC1 b3776ef42ea8a2668600f241007514de [0,1,0,1,0,0|1,0,1]=4 2311 B13R1.3151 CCOCCOCOC(=O)C1CC1 bd4333bc36c730c8bcc2e09fee3f4fba [0,1,0,1,0,0|1,0,1]=4 2312 B13R1.3151 CCSCCCOCC(=O)C1CC1 1fbaa0a9f350ee40a4658798e13b63b1 [0,1,0,1,0,0|1,0,1]=4 2313 B13R1.3151 CCSCCNCOC(=O)C1CC1 7fb11231f1ce98246ca9eb463437359d [0,1,0,1,0,0|1,0,1]=4 2314 B13R1.3151 CCSCCOCOC(=O)C1CC1 a12fde873304bcb31d9e116cc594a1f5 [0,1,0,1,0,0|1,0,1]=4 2315 B13R1.3151 O=C/C=C/COCOC(=O)C1CC1 f8d4ac3ddff7b3be66f5c140825cad09 [0,1,0,1,0,0|1,0,1]=4 2316 B13R1.3673 CC/C=C/CCOCC1(CCC1)C a7f489bec8024cf673f85e86199c1295 [0,1,0,1,0,0|1,0,1]=4 2317 B13R1.3673 CC/C=C\CCOCC1(CCC1)C 11182bf4e65008ad34320c67c51c7c0e [0,1,0,1,0,0|1,0,1]=4 2318 B13R1.3673 CC/C=C\CCOCC1(CCC1)F 0e4d249ce99705633185007e73445866 [0,1,0,1,0,0|1,0,1]=4 2319 B13R1.27 CC/C=C/CCOC1CCN(C1)C 7ee6b257aa8e33b2716c8b5d05697558 [0,1,0,1,0,0|1,0,1]=4 2320 B13R1.27 CC/C=C/CCOC1COC(C1)C b4f80f563583071cf06add67e92b5c0f [0,1,0,1,0,0|0,0,2]=4 2321 B13R1.27 CC/C=C/CCO[C@@H]1CCN(C1)C a4aed17f5babab48277584d3e180ee73 [0,1,0,1,0,0|1,0,1]=4 2322 B13R1.27 CC/C=C/CCO[C@H]1CCN(C1)C 46b0252d701eb1de89cf8a68aa5f939d [0,1,0,1,0,0|1,0,1]=4 2323 B13R1.27 CC/C=C\CCOC1=CC(=O)CC1 be4a5d4b951305ef144686facb6410e2 [0,1,0,1,0,0|1,0,1]=4 2324 B13R1.27 CC/C=C\CCOC1CCC(C1)C d553909a12424bcf41914b4b58b17cfa [0,1,0,1,0,0|1,0,1]=4 2325 B13R1.27 CC/C=C\CCOC1CCC(C1)F 480c6e2f3ed7f3225be9b62016660ecd [0,1,0,1,0,0|1,0,1]=4 2326 B13R1.27 CC/C=C\CCOC1CCN(C1)C fba0a7e536c2587eb80f4dd90ccd86b9 [0,1,0,1,0,0|1,0,1]=4 2327 B13R1.27 CC/C=C\CCOC1COC(C1)C a55e40700bf8ce5d83b6fa17bb850344 [0,1,0,1,0,0|0,0,2]=4 2328 B13R1.27 CC/C=C\CCO[C@@H]1CCN(C1)C 30976afae917dbb822934e3624819542 [0,1,0,1,0,0|1,0,1]=4 2329 B13R1.27 CC/C=C\CCO[C@H]1CCN(C1)C 1ba7080c36261e785706799dc8523c12 [0,1,0,1,0,0|1,0,1]=4 2330 B13R1.348 CC(C)CC(=O)CN1CC=CCC1 2ae0dceaabeb4a1990190fefc378695b [0,1,0,1,0,0|2,0,0]=4 2331 B13R1.348 CC(C)CC(C)OC1CC=CCC1 de45b0868f569d1bfb2bbdf63fff0a34 [0,1,0,1,0,0|1,0,1]=4 2332 B13R1.593 CC(C)CC(=O)COC1C=CCC1 463490cddf5a9bcc9fd967c2117ed087 [0,1,0,1,0,0|2,0,0]=4 2333 B13R1.593 CC(C)CC(C)OCC1C=CCC1 95872cac09369170fed61abb8188cf5a [0,1,0,1,0,0|1,0,1]=4 2334 B13R1.2438 CC/C=C/CCOC1CC(C1)(C)C 3ed9ec186cc89a8167583c308e46b3d2 [0,1,0,1,0,0|1,0,1]=4 2335 B13R1.2438 CC/C=C\CCOC1CC(C1)(C)C 13d41f43999fdcbb2b95bd7ad7a8aad5 [0,1,0,1,0,0|1,0,1]=4 2336 B13R1.3574 CC/C=C/CNCC(=O)NC1CC1 3a933154e3a237a16b8b0d163ad6ea3a [0,1,0,1,0,0|2,0,0]=4 2337 B13R1.3574 CC/C=C/COCC(=O)NC1CC1 5e4576b54015e5ff2e3789e237dbb40d [0,1,0,1,0,0|2,0,0]=4 2338 B13R1.3574 CC/C=C\CCOC(C)CC1CC1 3e893fc772a4873a116819130b1d4997 [0,1,0,1,0,0|1,0,1]=4 2339 B13R1.3574 CC/C=C\COCC(=O)NC1CC1 00ef997a1fb7c8998b410b602fd08f67 [0,1,0,1,0,0|2,0,0]=4 2340 B13R1.135 CCC(C)C(=O)CN1CC=CCC1 e00fe5530be30df96610a6cb44eb9101 [0,1,0,1,0,0|2,0,0]=4 2341 B13R1.554 CCC(C)C(=O)COC1C=CCC1 0eaec8c2ec33971ce9b26abbb76743e1 [0,1,0,1,0,0|2,0,0]=4 2342 B13R1.3572 CC/C=C/COCC(=O)C1CCC1 ec9c6dcbd556ac415fb7a164425d7c44 [0,1,0,1,0,0|2,0,0]=4 2343 B13R1.3572 CC/C=C/COCC(=O)N1CCC1 795a935f58b26958a10e9d717a5782b6 [0,1,0,1,0,0|2,0,0]=4 2344 B13R1.3572 CC/C=C\CCOC(C)C1CCC1 ff038fc91cbe9b4733c610d443192d49 [0,1,0,1,0,0|1,0,1]=4 2345 B13R1.3572 CC/C=C\CCOC(C)C1COC1 4117858d5f227664dc153f13a9c84c36 [0,1,0,1,0,0|1,0,1]=4 2346 B13R1.3572 CC/C=C\CCO[C@@H](C)C1CCC1 4ee7d808b3cb37c5bca09d6c95ef270c [0,1,0,1,0,0|1,0,1]=4 2347 B13R1.3572 CC/C=C\CCO[C@@H](C)C1COC1 cab9505c6baec6307ecad9316d3854ce [0,1,0,1,0,0|1,0,1]=4 2348 B13R1.3572 CC/C=C\CCO[C@H](C)C1COC1 f524823b6c98d26baa9d13e68ebc84a4 [0,1,0,1,0,0|1,0,1]=4 2349 B13R1.3572 CC/C=C\COCC(=O)C1CCC1 6a16cc099898d37b60c4bc1b71f57a94 [0,1,0,1,0,0|2,0,0]=4 2350 B13R1.3572 CC/C=C\COCC(=O)N1CCC1 312b56860629d9b6002c4e6934b45ae4 [0,1,0,1,0,0|2,0,0]=4 2351 B13R1.3573 CC/C=C/COCC(=O)C1(CC1)C 85d3cf974f58c563e4e3ac5675f58e72 [0,1,0,1,0,0|2,0,0]=4 2352 B13R1.3573 CC/C=C/COCC(=O)C1(CC1)F a05bd37c2ae4f897fd06d7925f6f830f [0,1,0,1,0,0|2,0,0]=4 2353 B13R1.3573 CC/C=C\CCOC(C)C1(CC1)C 9c2e68541fa927ab724398b66ac35bb6 [0,1,0,1,0,0|1,0,1]=4 2354 B13R1.3573 CC/C=C\COCC(=O)C1(CC1)C d35b9c83ea4d14cf7f8f5d1259986d37 [0,1,0,1,0,0|2,0,0]=4 2355 B13R1.3573 CC/C=C\COCC(=O)C1(CC1)F 8f1750439504f3d32a7a8892d3a21dde [0,1,0,1,0,0|2,0,0]=4 2356 B13R1.41 CCCC(=O)CN[C@@H]1C=C[C@@H](C1)O a82b23d76208a627922a2e87084f644d [0,1,0,1,0,0|2,0,0]=4 2357 B13R1.41 CCCC(=O)CN[C@H]1C=C[C@H](C1)O 00f33d202e46cc2d63e714f9341548ae [0,1,0,1,0,0|2,0,0]=4 2358 B13R1.41 CCCC(=O)NCC1CCC(=O)N1 d6249008a87cb6e8a2eb6e579fabb1af [0,1,0,1,0,0|2,0,0]=4 2359 B13R1.41 CCCC(=O)NC[C@@H]1CCC(=O)N1 fdd33f31a2fbd8751d4504f5e2a0ddb9 [0,1,0,1,0,0|2,0,0]=4 2360 B13R1.41 CCCC(=O)NC[C@H]1CCC(=O)N1 466b4f985fe2b9427ed44b1e8ff360f8 [0,1,0,1,0,0|2,0,0]=4 2361 B13R1.41 CCCC(=S)OCC1CCC(=O)N1 03bff68938104e96e9ef9c21abb35cf2 [0,1,0,1,0,0|1,1,0]=4 2362 B13R1.41 CCCC(=S)OCC1CCC(=O)O1 dc0da3bda80260a049033455fe175e8e [0,1,0,1,0,0|1,1,0]=4 2363 B13R1.41 CCCC(=S)OC[C@@H]1CCC(=O)N1 da55663baf45cc938cce80d280a2361a [0,1,0,1,0,0|1,1,0]=4 2364 B13R1.41 CCCC(=S)OC[C@H]1CCC(=O)N1 6db7305f656ce347684a098fbbb911fa [0,1,0,1,0,0|1,1,0]=4 2365 B13R1.153 CCCCC(C)OCC1C=CCC1 296066b07587bd1d860bf09d925fcb27 [0,1,0,1,0,0|1,0,1]=4 2366 B13R1.153 CCCNC(=O)COC1C=CCC1 b9bee50ddf5eb8e27b9d7803c103f2e3 [0,1,0,1,0,0|2,0,0]=4 2367 B13R1.153 CCCOC(=O)COC1C=CCC1 5ca67b1d71418b78c50874e637a76bdb [0,1,0,1,0,0|2,0,0]=4 2368 B13R1.153 CSCCC(=O)COC1C=CCC1 91b44b127fdd0cb4892a2d8f1d26913e [0,1,0,1,0,0|2,0,0]=4 2369 B13R1.47 CCCC(=O)C(=O)N1CC=CCC1 721211fe081125bbf07c14013cafb494 [0,1,0,1,0,0|2,0,0]=4 2370 B13R1.555 CC/C=C/CNC1CCCNC1=O a748ddcd2995bd19e605b088acfab677 [0,1,0,1,0,0|2,0,0]=4 2371 B13R1.555 CC/C=C/CN[C@@H]1CCCNC1=O 295aa79fb94d874e4a7b3a8e7e2ef9b4 [0,1,0,1,0,0|2,0,0]=4 2372 B13R1.555 CC/C=C/CN[C@H]1CCCNC1=O 55ce56e6c841262678f20a4fd7081018 [0,1,0,1,0,0|2,0,0]=4 2373 B13R1.555 CC/C=C/COC1CCCCC1=O f535ff55bb04cbcebf6af1d9dcd058d7 [0,1,0,1,0,0|2,0,0]=4 2374 B13R1.555 CC/C=C/COC1CCCNC1=O c69812e56f1728f9971f3d8ebb8e6301 [0,1,0,1,0,0|2,0,0]=4 2375 B13R1.555 CC/C=C/COC1CCCOC1=O 7a64c15b58f71e93ee4475e848203af2 [0,1,0,1,0,0|2,0,0]=4 2376 B13R1.555 CC/C=C/COC1COCCC1=O 1850cf3a49c50a661aa3bd0b7ff3544b [0,1,0,1,0,0|2,0,0]=4 2377 B13R1.555 CC/C=C/COC1SCCCC1=O d7ebe5fe2cf1c45282eb87d40c25ae61 [0,1,0,1,0,0|2,0,0]=4 2378 B13R1.555 CC/C=C/CO[C@@H]1CCCNC1=O a9152ad80a5f2b06cfc40b50009ee9e0 [0,1,0,1,0,0|2,0,0]=4 2379 B13R1.555 CC/C=C/CO[C@H]1CCCNC1=O 19bc3ffb326e640942993d0e95e90b16 [0,1,0,1,0,0|2,0,0]=4 2380 B13R1.555 CC/C=C\COC1CCCCC1=O 26f0beb87eec4d333cb7abf1b68b1224 [0,1,0,1,0,0|2,0,0]=4 2381 B13R1.555 CC/C=C\COC1CCCNC1=O c7eb69d23ab9ae43ea93f241f479761b [0,1,0,1,0,0|2,0,0]=4 2382 B13R1.555 CC/C=C\COC1COCCC1=O 50bc4aa538e01eda312bb3c2f48bd73a [0,1,0,1,0,0|2,0,0]=4 2383 B13R1.555 CC/C=C\COC1SCCCC1=O fb134414c0b643560b21bad1a29f81ad [0,1,0,1,0,0|2,0,0]=4 2384 B13R1.1313 CC/C=C/COC(C)C(=O)C1CC1 89a0dd6c8d6f0bbbf2d3a6c9d0b9663f [0,1,0,1,0,0|2,0,0]=4 2385 B13R1.1313 CC/C=C\COC(C)C(=O)C1CC1 b41fd30be4ae538a5de2f98978cf09e7 [0,1,0,1,0,0|2,0,0]=4 2386 B13R1.28 CC/C=C/CCOC1C=CCCC1 abaf18c0e304349d409bb178f20442b2 [0,1,0,1,0,0|1,0,1]=4 2387 B13R1.28 CC/C=C/CCOC1CCCCC1 9ca622c45283076ac83fd0d2dfe9b2dd [0,1,0,1,0,0|1,0,1]=4 2388 B13R1.28 CC/C=C/CCOC1CCCCO1 0e848e76743fb3be9d3a37dab34a4b2e [0,1,0,1,0,0|0,0,2]=4 2389 B13R1.28 CC/C=C/CCOC1CCCOC1 1fcab7c42c780871352fb28f85ac1f8a [0,1,0,1,0,0|0,0,2]=4 2390 B13R1.28 CC/C=C/CCOC1CCOCC1 0518ab7832732d580f6cac7e6b716f08 [0,1,0,1,0,0|1,0,1]=4 2391 B13R1.28 CC/C=C/CCOC1CCSCC1 9577d000fcd7605a9f2befea57bc1a18 [0,1,0,1,0,0|1,0,1]=4 2392 B13R1.28 CC/C=C\CCOC1C=CCCC1 d8e0e38b7cd6353ca3bb570ce27b8545 [0,1,0,1,0,0|1,0,1]=4 2393 B13R1.28 CC/C=C\CCOC1CCCCC1 1d54da448c1d69c18b60ff08d119517d [0,1,0,1,0,0|1,0,1]=4 2394 B13R1.28 CC/C=C\CCOC1CCCCO1 cf6b4f2157e5b8b0c96521bf05251e98 [0,1,0,1,0,0|0,0,2]=4 2395 B13R1.28 CC/C=C\CCOC1CCCOC1 d0075f04ed3a7677f879625296b3d1d3 [0,1,0,1,0,0|0,0,2]=4 2396 B13R1.28 CC/C=C\CCOC1CCCSC1 44affacaf556dd6e835c272c27b28428 [0,1,0,1,0,0|0,1,1]=4 2397 B13R1.28 CC/C=C\CCOC1CCOCC1 f0f4c9e3719627bc8d5055f635517068 [0,1,0,1,0,0|1,0,1]=4 2398 B13R1.28 CC/C=C\CCOC1CCSCC1 a08b69b286a11227b3087a4badeaaee4 [0,1,0,1,0,0|1,0,1]=4 2399 B13R1.28 CC/C=C\CCO[C@@H]1CCCOC1 39bcaa9f037b229ed3c0826d70831af7 [0,1,0,1,0,0|0,0,2]=4 2400 B13R1.28 CC/C=C\CCO[C@H]1CCCOC1 a4e501cb034d6474b5a6f39823e52c37 [0,1,0,1,0,0|0,0,2]=4 2401 B13R1.79 CCCC(CC)OC1CC=CCC1 fc7154f48b8038a669f7ea0b1aa21067 [0,1,0,1,0,0|1,0,1]=4 2402 B13R1.694 CCCC(CC)OCC1C=CCC1 cc09f85eb50dfaaca6201e5ac7c20c73 [0,1,0,1,0,0|1,0,1]=4 2403 B13R1.1138 CC/C=C\CCOC(C#N)C1CC1 606c397d13d14d99ac3b4992d53cba00 [0,1,0,1,0,0|1,0,1]=4 2404 B13R1.1138 CC/C=C\CCOC(CC)C1CC1 f33b7cf0efc736c76ac065df23c6d108 [0,1,0,1,0,0|1,0,1]=4 2405 B13R1.44 CCCCC(C)OC1CC=CCC1 085ea3f3c58a11bcd98e21cf795309f5 [0,1,0,1,0,0|1,0,1]=4 2406 B13R1.44 CCCNC(=O)CN1CC=CCC1 48e1913efef855e943f4271761358ce4 [0,1,0,1,0,0|2,0,0]=4 2407 B13R1.44 CCCOC(=O)CN1CC=CCC1 2bd04eb53826bf21e1f2838a50ec9faf [0,1,0,1,0,0|2,0,0]=4 2408 B13R1.44 CSCCC(=O)CN1CC=CCC1 1c8266870e47e866a5a6447fa2b7aa95 [0,1,0,1,0,0|2,0,0]=4 2409 B13R1.656 CC/C=C/CN1CC(=O)NCC1C 36b851c2cafbd7e2ee7d492ac84a12f2 [0,1,0,1,0,0|2,0,0]=4 2410 B13R1.656 CC/C=C/CN1CC(=O)NC[C@@H]1C aa7372389f3d5e1db1667e6f2bf4c609 [0,1,0,1,0,0|2,0,0]=4 2411 B13R1.656 CC/C=C/CN1CC(=O)NC[C@H]1C a475ca689eb01de169114171c3120daf [0,1,0,1,0,0|2,0,0]=4 2412 B13R1.1133 CC/C=C/COC1=C(CCC1=O)C d4c653806ae7a13420375d2035aa866b [0,1,0,1,0,0|2,0,0]=4 2413 B13R1.1148 CC/C=C/CN1CCCNC(=O)C1 c5377d0fddf8ebdda93a4d1fb11cf823 [0,1,0,1,0,0|2,0,0]=4 2414 B13R1.2439 CC/C=C/CCOC1CC(C1)OC ad8b9ac613ffae9958e9cefd423f8134 [0,1,0,1,0,0|1,0,1]=4 2415 B13R1.2439 CC/C=C/CCO[C@H]1C[C@@H](C1)OC 990e79d4c68804b23ab43a90caba692a [0,1,0,1,0,0|1,0,1]=4 2416 B13R1.2439 CC/C=C\CCOC1CC(C1)OC be917767c1e3dd78b997d84ce67b23f4 [0,1,0,1,0,0|1,0,1]=4 2417 B13R1.2439 CC/C=C\CCOC1CN(C1)CC 25cc99de714c05465adf272dab3aa918 [0,1,0,1,0,0|1,0,1]=4 2418 B13R1.2439 CC/C=C\CCO[C@H]1C[C@@H](C1)OC b80171923f6b1b31afb8ac022ea08e82 [0,1,0,1,0,0|1,0,1]=4 2419 B13R1.2439 CC/C=C\CCO[C@H]1C[C@H](C1)CF f3310011f1e8a6f1c70bf21941345e20 [0,1,0,1,0,0|1,0,1]=4 2420 B13R1.2439 CC/C=C\CCO[C@H]1C[C@H](C1)OC 7971efb5687cc2618db1350172c3e4b9 [0,1,0,1,0,0|1,0,1]=4 2421 B13R1.20 CCCC(=O)CN1CC=CC(C1)O 04bc833b7e31bc50f3df86401f96863d [0,1,0,1,0,0|2,0,0]=4 2422 B13R1.20 CCCC(=O)NC1CCNC(=O)C1 bbddc45a0c3ed996603ae69b3fe152c4 [0,1,0,1,0,0|2,0,0]=4 2423 B13R1.20 CCCC(=O)N[C@@H]1CCNC(=O)C1 2dd72f8e2844d498f0737f531ff36ae8 [0,1,0,1,0,0|2,0,0]=4 2424 B13R1.20 CCCC(=O)N[C@H]1CCNC(=O)C1 dcb2c6e61481a619b2cc1507be9a7695 [0,1,0,1,0,0|2,0,0]=4 2425 B13R1.20 CCCC(=S)OC1CCCC(=O)C1 1884fda65d62053a5c662a840a7e2425 [0,1,0,1,0,0|0,1,1]=4 2426 B13R1.12 CCCC(=O)N1CCNC(=O)C1C 03ac5e14b1602f6540183cd6d0a05fe3 [0,1,0,1,0,0|2,0,0]=4 2427 B13R1.12 CCCC(=O)N1CCNC(=O)[C@@H]1C e4515dbec17f3ba2845365683da699d3 [0,1,0,1,0,0|2,0,0]=4 2428 B13R1.12 CCCC(=O)N1CCNC(=O)[C@H]1C 816ae5a15c976b023ee1ef1fb5eeac81 [0,1,0,1,0,0|2,0,0]=4 2429 B13R1.15 CCC(=O)NCC1CCCC(=O)N1 dfc81ecccc1f53b1f568249c9fec31ab [0,1,0,1,0,0|2,0,0]=4 2430 B13R1.19 CCCC(=O)CN1CC=C(CC1)Br d2c820e059a319b24afd11aaef8154c6 [0,1,0,1,0,0|2,0,0]=4 2431 B13R1.19 CCCC(=O)NC1CCC(=O)NC1 f406f647c211279846b15314b35621a5 [0,1,0,1,0,0|2,0,0]=4 2432 B13R1.19 CCCC(=O)N[C@@H]1CCC(=O)NC1 245f647a29514cd8ce8e640f55962a47 [0,1,0,1,0,0|2,0,0]=4 2433 B13R1.19 CCCC(=O)N[C@H]1CCC(=O)NC1 eafbe5377627eaf9daf727156fdb5861 [0,1,0,1,0,0|2,0,0]=4 2434 B13R1.19 CCCC(=S)OC1CCC(=O)CC1 74376d0fb7e21f49c62daa2741f851d5 [0,1,0,1,0,0|0,1,1]=4 2435 B13R1.19 CCCC(C)OC1CC=C(CC1)Br 731b87d601196f5ec9de8df749e0aeb8 [0,1,0,1,0,0|1,0,1]=4 2436 B13R1.107 CCC(=O)N1CCNC(=O)C1CC 8889f25f853052f237fec8922349f49c [0,1,0,1,0,0|2,0,0]=4 2437 B13R1.596 C=C(CC)COC1OC(=O)CC1C 0bb3a08a2269efd978aab4f7ccb4af43 [0,1,0,1,0,0|1,0,1]=4 2438 B13R1.596 CCC(=O)COC1OC(=O)CC1C 467a06796a19fa5e1e7358205f53d4ca [0,1,0,1,0,0|1,0,1]=4 2439 B13R1.599 CCC(=O)NCCN1CCCC1=O 44bf2332e88e369a269e4aeea96e7f49 [0,1,0,1,0,0|2,0,0]=4 2440 B13R1.1463 CCCC(=O)N1CCCC(=O)CC1 0f1fedfb7e9735b697379c9f7cf2e6e0 [0,1,0,1,0,0|1,0,1]=4 2441 B13R1.1463 CCCC(=O)N1CCNC(=O)CC1 5a7b488ed1aa7af09dc66d80c831c87f [0,1,0,1,0,0|2,0,0]=4 2442 B13R1.1734 CCC(=O)COCOC(=O)C1CC1 cc17a5cdfcadcbab401480c5f2e98dac [0,1,0,1,0,0|1,0,1]=4 2443 B13R1.4647 CCC(=O)N1CCNC(=O)CC1C 081905ed7bc6237c4ca88ffcee8310ca [0,1,0,1,0,0|2,0,0]=4 2444 B13R1.149 CC(C)/C=C/CN1CCCC(=O)C1 38dba5a4967f60e74d7f1ae614b75281 [0,1,0,1,0,0|2,0,0]=4 2445 B13R1.167 CC(C)/C=C/COC1CCCC1=O 897316952d9421381f92de4f0281fadd [0,1,0,1,0,0|2,0,0]=4 2446 B13R1.1080 CC(C)/C=C/COCC(=O)C1CC1 f5c352881be588153bd7eb0d378c6729 [0,1,0,1,0,0|2,0,0]=4 2447 B13R1.1496 CCCC(=S)OCOC(=O)C1CC1 625809aac730fea16b3bfb7679b2c020 [0,1,0,1,0,0|1,0,1]=4 2448 B13R2.64 C1=CCC(CC1)OC2CCCC2 64b4f8feb33aafd5106616c5da632e5d [0,0,0,2,0,0|1,0,1]=4 2449 B13R2.444 CC(OC1CC=CCC1)C2CC2 3c9f62e0c5f4abcad8978bc9225d6a88 [0,0,0,2,0,0|1,0,1]=4 2450 B13R2.444 O=C(CN1CC=CCC1)C2CC2 3b21aa5037618e68b93f5293980f086e [0,0,0,2,0,0|2,0,0]=4 2451 B13R2.183 C1=CC(CC1)COC2CCCC2 7f0380da20341275f000d8f78d185200 [0,0,0,2,0,0|1,0,1]=4 2452 B13R2.856 CCCC(=O)N1CC2C=CC1C2 c9beff9a89fa2615a2745f2b07784568 [0,0,0,2,0,0|1,0,0]=3 2453 B13R2.856 CCCC(=O)N1C[C@H]2C=C[C@@H]1C2 1877c018eb22e79a3f8bac5e7335677a [0,0,0,2,0,0|1,0,0]=3 2454 B13R2.856 COCC(=O)N1CC2C=CC1C2 96fea3ac7965573cf15a3239fdf40ca8 [0,0,0,2,0,0|2,0,0]=4 2455 B13R2.856 COCC(=O)N1C[C@H]2C=C[C@@H]1C2 677429f8ec4c1f1f220845ee2b2da2be [0,0,0,2,0,0|2,0,0]=4 2456 B13R2.856 CSCC(=O)N1CC2C=CC1C2 87b063a8230b2a228d4456ee73800a58 [0,0,0,2,0,0|2,0,0]=4 2457 B13R2.856 CSCC(=O)N1C[C@H]2C=C[C@@H]1C2 7f0cceebb1748d6051866e6800acd6f8 [0,0,0,2,0,0|2,0,0]=4 2458 B13R2.856 O=C(CCF)N1CC2C=CC1C2 cdf19b0f65f2d9b72a80ab1679703e82 [0,0,0,2,0,0|2,0,0]=4 2459 B13R2.856 O=C(CCF)N1C[C@H]2C=C[C@@H]1C2 2ec9c8dd9b23d06d6b8c1587712473cd [0,0,0,2,0,0|2,0,0]=4 2460 B13R2.856 O=C(CCO)N1CC2C=CC1C2 5a9be4ba2a27b9223d7a59529db75d9e [0,0,0,2,0,0|2,0,0]=4 2461 B13R2.856 O=C(CCO)N1C[C@H]2C=C[C@@H]1C2 d21cfda1cca38e394c02522866b79558 [0,0,0,2,0,0|2,0,0]=4 2462 B13R2.856 O=C(CCS)N1CC2C=CC1C2 6c28c90d65684fee993a757278896d36 [0,0,0,2,0,0|2,0,0]=4 2463 B13R2.856 O=C(CCS)N1C[C@H]2C=C[C@@H]1C2 1183a6701fa6537969cd4770e9029810 [0,0,0,2,0,0|2,0,0]=4 2464 B13R2.6970 CC(OCC1C=CCC1)C2CC2 98a8571d765142f8ce6f5fa54758b653 [0,0,0,2,0,0|1,0,1]=4 2465 B13R2.6970 O=C(COC1C=CCC1)C2CC2 4ba6f733def94055c9b570abe0b3f163 [0,0,0,2,0,0|2,0,0]=4 2466 B13R2.8049 CCCN1CCOC(=O)C12CC2 1d935418ca7afe0b1e5a6a91c2f227ba [0,0,0,2,0,0|1,0,1]=4