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B11R0.3 CC=CCNCCCCCCC 7008f5a91daa02e914ed344aafa7e9d0 [0,0,0,0,0,0|2,0,2]=4 145 B11R0.3 CC=CCOCCCCCCC 46a2177b7fee8ebd05148c40489b256d [0,0,0,0,0,0|2,0,2]=4 146 B11R0.3 CCC#CCCOC/C=C/CC 8414890b81f8126435d2f7008dc95453 [0,0,0,0,0,0|2,0,2]=4 147 B11R0.3 CCC#CCCOCCCCC ea61c9e9f51ccb19ef08c5d6ca6a7377 [0,0,0,0,0,0|2,0,2]=4 148 B11R0.3 CCC#CCNCCCCCC 0e5483b41653e63137eb42e7d9552a55 [0,0,0,0,0,0|2,0,2]=4 149 B11R0.3 CCC#CCOCC/C=C/CC 2bf7dec6d1acfb68134ee2c8ac97ce4a [0,0,0,0,0,0|2,0,2]=4 150 B11R0.3 CCC#CCOCC/C=C\CC 05026b7f910f127b0b3699727a003e4f [0,0,0,0,0,0|2,0,2]=4 151 B11R0.3 CCC#CCOCCCCCC 2489a158ff607aa0b713ab2111e23770 [0,0,0,0,0,0|2,0,2]=4 152 B11R0.3 CCC/C=C/CCCOCCC dae1775eca5913317c5cd584ee8751c6 [0,0,0,0,0,0|2,0,2]=4 153 B11R0.3 CCC/C=C/CNCCCCC 220ba6cf6d3871bb7347038a1b74977c [0,0,0,0,0,0|2,0,2]=4 154 B11R0.3 CCC/C=C/COCCCCC 376fd1605555eb7afa40e728bdf19f2d [0,0,0,0,0,0|2,0,2]=4 155 B11R0.3 CCC/C=C\CCCOCCC 9d2652818f4292c6bd7658d96bf7fce0 [0,0,0,0,0,0|2,0,2]=4 156 B11R0.3 CCC/C=C\CCOCCCC 9e74787723b6c36b8e5fff0d11977396 [0,0,0,0,0,0|2,0,2]=4 157 B11R0.3 CCC/C=C\CNCCCCC 019a7c473a2da7ebbb424bd7efd3e588 [0,0,0,0,0,0|2,0,2]=4 158 B11R0.3 CCC/C=C\COCCCCC d379d1a8be0c42f6be0ab331a41b2209 [0,0,0,0,0,0|2,0,2]=4 159 B11R0.3 CCC=CCC=CCCOCC 9a13a64b7d3d7370cd56239069c00d81 [0,0,0,0,0,0|2,0,2]=4 160 B11R0.3 CCC=CCCC=CCOCC 002eeb171ac1bc76c2fb1e09fb71288f [0,0,0,0,0,0|2,0,2]=4 161 B11R0.3 CCC=CCCCCCOCC acb4ebc5d4b9da3999d78f72f192ac9b [0,0,0,0,0,0|2,0,0]=2 162 B11R0.3 CCC=CCCCCCOCF 7054466c0b0826d0be66743ec1db0063 [0,0,0,0,0,0|3,0,0]=3 163 B11R0.3 CCCCCCCCCNC#N 6b046d3912028b93959cb4e452afd1ae [0,0,0,0,0,0|2,0,2]=4 164 B11R0.3 CCCCCCCCCNC=O 450ec7c17222bfa50b1bec9a4e76d3ac [0,0,0,0,0,0|1,0,3]=4 165 B11R0.3 CCCCCCCCCNCC b6539dc308d63bc638f757291d8ebf84 [0,0,0,0,0,0|2,0,1]=3 166 B11R0.3 CCCCCCCCCNCF 43bd644c8c480de2fb259821f0ab90b3 [0,0,0,0,0,0|2,0,1]=3 167 B11R0.3 CCCCCCCCCNCO cabb056dd32239ed577df722d85b0dd4 [0,0,0,0,0,0|1,0,1]=2 168 B11R0.3 CCCCCCCCCOCC 2da72f808296172141d037a9a0e922cc [0,0,0,0,0,0|2,0,1]=3 169 B11R0.3 CCCCCCCCCOCF c4f834bdcd233b73d7c8d340364a980d [0,0,0,0,0,0|2,0,1]=3 170 B11R0.3 CCCCCCCCNCC#N e1e1fda8b8bfebd20bf6e7275805690a [0,0,0,0,0,0|2,0,2]=4 171 B11R0.3 CCCCCCCCNCC=O d9ced648acece07efb5d33c320d8dadf [0,0,0,0,0,0|1,0,3]=4 172 B11R0.3 CCCCCCCCNCCBr 124dad0af09f96099c60b552aee5a73e [0,0,0,0,0,0|2,0,1]=3 173 B11R0.3 CCCCCCCCNCCC 5c5d2b2d5b77701c078b7890315f6ed4 [0,0,0,0,0,0|2,0,1]=3 174 B11R0.3 CCCCCCCCNCCF 2e0818a402ab846cf4daf1ebdd30c4d5 [0,0,0,0,0,0|2,0,1]=3 175 B11R0.3 CCCCCCCCNCCI f2e870159bc574809ce3c7c46c194254 [0,0,0,0,0,0|2,0,1]=3 176 B11R0.3 CCCCCCCCNCCO 66f15a321d735f67e99bb8bf0677de73 [0,0,0,0,0,0|1,0,1]=2 177 B11R0.3 CCCCCCCCNCCS 9963fd311d7de210a2e1fa6fd8d2fe1f [0,0,0,0,0,0|1,1,1]=3 178 B11R0.3 CCCCCCCCNCOC e4b94b479e34a7870530ff5432c0561c [0,0,0,0,0,0|3,0,1]=4 179 B11R0.3 CCCCCCCCNCSC 362d682105cf82dab99b537514fd044b [0,0,0,0,0,0|3,0,1]=4 180 B11R0.3 CCCCCCCCOCC#N 34434fafb1978e779020a7eb19fa5664 [0,0,0,0,0,0|2,0,2]=4 181 B11R0.3 CCCCCCCCOCC=O 4b7128d965398d7a6aa7d6d1f071599b [0,0,0,0,0,0|1,0,3]=4 182 B11R0.3 CCCCCCCCOCCC 5c55f182a5e0d29dd20e8f79767e7a77 [0,0,0,0,0,0|2,0,1]=3 183 B11R0.3 CCCCCCCCOCCF e0dea6108899e149ace708160dd5e19a [0,0,0,0,0,0|2,0,1]=3 184 B11R0.3 CCCCCCCCOCCS 51f3fbaf4c38beeef65f454daef36ed1 [0,0,0,0,0,0|1,1,1]=3 185 B11R0.3 CCCCCCCCOCOC 7ef1d4d105bdb76da628aa577a4e9370 [0,0,0,0,0,0|3,0,1]=4 186 B11R0.3 CCCCCCCCOCSC d725b23a00487d8000b0509a053a76b7 [0,0,0,0,0,0|3,0,1]=4 187 B11R0.3 CCCCCCCNC/C=C/Cl 637e7cc26c94edd1a7a07e5f341a649f [0,0,0,0,0,0|2,0,2]=4 188 B11R0.3 CCCCCCCNC/C=C\Cl fceca85c8e58a288d7d9b590362e2068 [0,0,0,0,0,0|2,0,2]=4 189 B11R0.3 CCCCCCCNC/C=C\O 68625962180e5c7cd6474c4bc6a5cb81 [0,0,0,0,0,0|1,0,2]=3 190 B11R0.3 CCCCCCCNCCCC 36a5fecc81cda5ee533584053ef52c12 [0,0,0,0,0,0|2,0,2]=4 191 B11R0.3 CCCCCCCNCCCCl f8ee8ff116da89d7af5396839da83b0c [0,0,0,0,0,0|2,0,2]=4 192 B11R0.3 CCCCCCCNCCCF 906b08ea9b84bc278513d70a1bf0318f [0,0,0,0,0,0|2,0,2]=4 193 B11R0.3 CCCCCCCNCCCO 15d41c00a29a7860828561fb02e66224 [0,0,0,0,0,0|1,0,2]=3 194 B11R0.3 CCCCCCCNCCCS ecfb391744e4cf619ddb1431239249a3 [0,0,0,0,0,0|1,1,2]=4 195 B11R0.3 CCCCCCCNCOCC 6085cc928a8612c71e1d4d6b1a7edbd3 [0,0,0,0,0,0|3,0,1]=4 196 B11R0.3 CCCCCCCOC/C=C/Cl dffe18752c234ea481b343adb229ea78 [0,0,0,0,0,0|2,0,2]=4 197 B11R0.3 CCCCCCCOC/C=C\Cl c43cba169af3591ad88223be073855c8 [0,0,0,0,0,0|2,0,2]=4 198 B11R0.3 CCCCCCCOCC=CCl a695a2b133c28c6337341b52e4d6b842 [0,0,0,0,0,0|2,0,2]=4 199 B11R0.3 CCCCCCCOCCCC fa9669fb11a16db471e00134e33ec65d [0,0,0,0,0,0|2,0,2]=4 200 B11R0.3 CCCCCCCOCCCF dc30ed190709942ca9892214ca06d346 [0,0,0,0,0,0|2,0,2]=4 201 B11R0.3 CCCCCCCOCCCS 94ae84f911d880b1b60e67d5fe9456f9 [0,0,0,0,0,0|1,1,2]=4 202 B11R0.3 CCCCCCCOCOCC 79bd364aab6610fe1fe6d0e85e5d8630 [0,0,0,0,0,0|3,0,1]=4 203 B11R0.3 CCCCCCNCC#CCO 2fb41be1cd187e5757a836763c6927e8 [0,0,0,0,0,0|1,0,2]=3 204 B11R0.3 CCCCCCNCC=CC#N 588c0eb66da23643e56418e0f2982366 [0,0,0,0,0,0|2,0,1]=3 205 B11R0.3 CCCCCCNCCCCC 49296b0c254283861aea5ee041198391 [0,0,0,0,0,0|2,0,2]=4 206 B11R0.3 CCCCCCNCCCCCl c3c1177d24b9e0eb9ac340c3d5d2e01b [0,0,0,0,0,0|2,0,2]=4 207 B11R0.3 CCCCCCNCCCCF 848e11d8bf36fce980201576831556b2 [0,0,0,0,0,0|2,0,2]=4 208 B11R0.3 CCCCCCNCCCCO 5685819b9fdb19d77b1eb89b122e386d [0,0,0,0,0,0|1,0,2]=3 209 B11R0.3 CCCCCCNCCCCS 7732486ecc35b82a80124c607ae7d41e [0,0,0,0,0,0|1,1,2]=4 210 B11R0.3 CCCCCCNCCOCC 742e1d719e7bb4c2babe34eeefcd2441 [0,0,0,0,0,0|3,0,1]=4 211 B11R0.3 CCCCCCNCCSCC 0a52927d0b06e6fdc29929d5c3f1e34e [0,0,0,0,0,0|3,0,1]=4 212 B11R0.3 CCCCCCOC/C=C/C=O 9cadfea2bf1cb801e0e16e78abb3d717 [0,0,0,0,0,0|1,0,2]=3 213 B11R0.3 CCCCCCOCC=CC#N 77082a1040267070c62448285a75f989 [0,0,0,0,0,0|2,0,1]=3 214 B11R0.3 CCCCCCOCCCCC b4a731a4f44998aaa50eb10174d909fa [0,0,0,0,0,0|2,0,2]=4 215 B11R0.3 CCCCCCOCCCCF 3b92ad47d9a4134451da9c78fd137d31 [0,0,0,0,0,0|2,0,2]=4 216 B11R0.3 CCCCCCOCCCCS 50e196097c995a826b03c4a2c09a8f26 [0,0,0,0,0,0|1,1,2]=4 217 B11R0.3 CCCCCCOCCOCC b30cb0c340af407e0ea99dea3465c010 [0,0,0,0,0,0|3,0,1]=4 218 B11R0.3 CCCCCCOCCOCF 0b35ab31df5814af01719c9472e98535 [0,0,0,0,0,0|3,0,1]=4 219 B11R0.3 CCCCCCOCCSCC 372c890bd26b1016f7be8971144c7fa4 [0,0,0,0,0,0|3,0,1]=4 220 B11R0.3 CCCCCNCCCCCCl 8783a25d6d8306abaf43939f196da13e [0,0,0,0,0,0|2,0,2]=4 221 B11R0.3 CCCCCNCCCCCF 13994f1eacfc3326220fe95f954366d9 [0,0,0,0,0,0|2,0,2]=4 222 B11R0.3 CCCCCNCCCCCO 25d0eeb8faa7e77d0c7bc79c155084c3 [0,0,0,0,0,0|1,0,2]=3 223 B11R0.3 CCCCCNCCCOCC a1b38d8814819ddd88ad7e357f0539ab [0,0,0,0,0,0|3,0,1]=4 224 B11R0.3 CCCCCNCCCSCC 6880dfdd42608112a8766448c64b5d7f [0,0,0,0,0,0|3,0,1]=4 225 B11R0.3 CCCCCNCCOCCC 6590964a411046132458fdf2cb5c7ecf [0,0,0,0,0,0|3,0,1]=4 226 B11R0.3 CCCCCNCCOCCO fe9162f54b5101a557bba86a31ce07e5 [0,0,0,0,0,0|2,0,1]=3 227 B11R0.3 CCCCCNCCOCCS 52a6f8a0f3dadcc0d16bdf1fe0b53a2a [0,0,0,0,0,0|2,1,1]=4 228 B11R0.3 CCCCCNCCSCCO 7d0503daebc22b82247020334837979c [0,0,0,0,0,0|2,0,1]=3 229 B11R0.3 CCCCCOCCCCCF 755ae0a673d39bfc480773c3054368e3 [0,0,0,0,0,0|2,0,2]=4 230 B11R0.3 CCCCCOCCCOCC 8f415b136edee3dd18226f52cdfec746 [0,0,0,0,0,0|3,0,1]=4 231 B11R0.3 CCCCCOCCCOCF c33bd518a5f215807b3b35c7ab0d2ca8 [0,0,0,0,0,0|3,0,1]=4 232 B11R0.3 CCCCCOCCCSCC d152f0f24c87dfe3226edda7a393a099 [0,0,0,0,0,0|3,0,1]=4 233 B11R0.3 CCCCCOCCOCCC d4de75a36e1b8e5b9990549c6c49ae3d [0,0,0,0,0,0|3,0,1]=4 234 B11R0.3 CCCCCOCCOCCF d790705a0911d720a268deceea2719d3 [0,0,0,0,0,0|3,0,1]=4 235 B11R0.3 CCCCCOCCOCCS 7f0c3084b1dfb5c617457c70637aba0b [0,0,0,0,0,0|2,1,1]=4 236 B11R0.3 CCCCCOCCSCCC 21bdcee15ce66355f7e953e9a5281f3b [0,0,0,0,0,0|3,0,1]=4 237 B11R0.3 CCCCNCCCCCCCl 3bdcfd90cd17bd199a4e9bcc6247866f [0,0,0,0,0,0|2,0,2]=4 238 B11R0.3 CCCCNCCCCCCF 792221cff14901f03892dd5847f325ff [0,0,0,0,0,0|2,0,2]=4 239 B11R0.3 CCCCNCCCCCCO 18d6e73a0410fdb75fe54fc241b9d145 [0,0,0,0,0,0|1,0,2]=3 240 B11R0.3 CCCCNCCCCSCC d8057eb68ff4e6b1bad58785e39559a5 [0,0,0,0,0,0|3,0,1]=4 241 B11R0.3 CCCCNCCCOCCC a8e094ffbc04acf2b37fcc10a222ad6f [0,0,0,0,0,0|3,0,1]=4 242 B11R0.3 CCCCNCCCOCCO 32850fa71b14884181218189c49377fe [0,0,0,0,0,0|2,0,1]=3 243 B11R0.3 CCCCNCCOCCCO eab03d027dc4b54efeffdb94ff865b0b [0,0,0,0,0,0|2,0,2]=4 244 B11R0.3 CCCCNCCSSCCO 4d885374aa42249993a9c2a9851be368 [0,0,0,0,0,0|3,0,1]=4 245 B11R0.3 CCCCOCCCCCCF e6318e3fdcb569518cd3fe082761a6a1 [0,0,0,0,0,0|2,0,2]=4 246 B11R0.3 CCCCOCCCCCCS fa2178b537fd8baeb81a0372c65e968c [0,0,0,0,0,0|1,1,2]=4 247 B11R0.3 CCCCOCCCNCCC eec5f12f47b8d62e22170a01b43a0a36 [0,0,0,0,0,0|3,0,1]=4 248 B11R0.3 CCCCOCCCNCCF fc3ee668f79739b27fa11ac840921091 [0,0,0,0,0,0|3,0,1]=4 249 B11R0.3 CCCCOCCCNCCO 1b728ab01da5a5273aeb7ba49c7ed3e1 [0,0,0,0,0,0|2,0,1]=3 250 B11R0.3 CCCCOCCCNCCS e6c9cca9157bb6e9111d463275ea145e [0,0,0,0,0,0|2,1,1]=4 251 B11R0.3 CCCCOCCCOCCC 0e267ba7f302ce88de7473ef8eb67ac5 [0,0,0,0,0,0|3,0,1]=4 252 B11R0.3 CCCCOCCCOCCF 475b892af5ff9e41110c151d7802e1dc [0,0,0,0,0,0|3,0,1]=4 253 B11R0.3 CCCCOCCCOCCS ae5d9247445e5789d7d69b591a7f9ea9 [0,0,0,0,0,0|2,1,1]=4 254 B11R0.3 CCCCOCCNC/C=C\O 000a296b7b08a321d5a8503d9f08c47e [0,0,0,0,0,0|2,0,2]=4 255 B11R0.3 CCCCOCCNCCCO 5340adda7912922acbc1b94ebf3c67dd [0,0,0,0,0,0|2,0,2]=4 256 B11R0.3 CCCCOCNCC#CCO da2163e50e4ac80b4d000593f251e504 [0,0,0,0,0,0|2,0,2]=4 257 B11R0.3 CCCCOCNCCCCO 70ef0ffa58df078c8e0d364ca5d503e8 [0,0,0,0,0,0|2,0,2]=4 258 B11R0.3 CCCCOCOC/C=C/C=O f38ba852e75c3d6462c0adc536260251 [0,0,0,0,0,0|2,0,2]=4 259 B11R0.3 CCCNCCCCCCCO b9bdd5d4ba49cb40d08e76ab3ff5907d [0,0,0,0,0,0|1,0,2]=3 260 B11R0.3 CCCNCCCCCCOC 4cc724ecdc92cad169e909d861e0a8d7 [0,0,0,0,0,0|3,0,1]=4 261 B11R0.3 CCCNCCCCSCCC 1bd349d17770da69cd8537cdf810b463 [0,0,0,0,0,0|3,0,1]=4 262 B11R0.3 CCCNCCCCSCCO d04bddeaa2a1cf092556151ae569625c [0,0,0,0,0,0|2,0,1]=3 263 B11R0.3 CCCNCCCOCCCO cc7c88677b085dca732d7c038ed7b397 [0,0,0,0,0,0|2,0,2]=4 264 B11R0.3 CCCOCCCCCCOC d862a222b60c44ec0327d3c88d0db06b [0,0,0,0,0,0|3,0,1]=4 265 B11R0.3 CCCOCCCNC/C=C\O 34e752d65f81567e611efdb847533055 [0,0,0,0,0,0|2,0,2]=4 266 B11R0.3 CCCOCCCNCCCO 9d72e4e1d93e2950c3cbfe802f41f5a8 [0,0,0,0,0,0|2,0,2]=4 267 B11R0.3 CCCOCCNCC#CCO c51cace53fc7415aed7b3ac7c231d7a9 [0,0,0,0,0,0|2,0,2]=4 268 B11R0.3 CCCOCCNCC=CC#N a9cedf07e02b96fac96f4ddfbe9ade38 [0,0,0,0,0,0|3,0,1]=4 269 B11R0.3 CCCOCCNCCCCO 70b00fa7cf8b30f826b13f431dd86bf5 [0,0,0,0,0,0|2,0,2]=4 270 B11R0.3 CCCOCCOC/C=C/C=O 69657be0bebb41fd02bdb5d0c7c76e6d [0,0,0,0,0,0|2,0,2]=4 271 B11R0.3 CCCOCCOCC=CC#N 1092a6b63125fd36ebf1928d57b933a3 [0,0,0,0,0,0|3,0,1]=4 272 B11R0.3 CCCSCCCCNCCF af91762c76d0fd7db6e68eef4ebc6cfa [0,0,0,0,0,0|3,0,1]=4 273 B11R0.3 CCCSCCCCNCCO 3b0b75358eae887295526550355e7be4 [0,0,0,0,0,0|2,0,1]=3 274 B11R0.3 CCCSCCCCNCCS 9d655333043426788303b5a0cf5a4883 [0,0,0,0,0,0|2,1,1]=4 275 B11R0.3 CCCSCCOCC=CC#N c5f52fcbbfa48f392dea767d9088e77a [0,0,0,0,0,0|3,0,1]=4 276 B11R0.3 CCNCCCCCCCCO c4c346164b321e06a97af679d071f408 [0,0,0,0,0,0|1,0,2]=3 277 B11R0.3 CCNCCOCCOCCO 18283c7c776bf848293f2c6f0ee76794 [0,0,0,0,0,0|3,0,1]=4 278 B11R0.3 CCOCCCNCC#CCO 9b2a3a42b1e107edf651d5cf2b77de9a [0,0,0,0,0,0|2,0,2]=4 279 B11R0.3 CCOCCCNCC=CC#N 60c68f4aaae15bdcb559a7cce14c1b77 [0,0,0,0,0,0|3,0,1]=4 280 B11R0.3 CCOCCCNCCCCO 5344e4c8236b7eda1a4068b527b5b268 [0,0,0,0,0,0|2,0,2]=4 281 B11R0.3 CCOCCCOC/C=C/C=O 7de42507e70ef3cc82cee413a91fb7a4 [0,0,0,0,0,0|2,0,2]=4 282 B11R0.3 CCOCCCOCC=CC#N 6b294412c4d91b43e789bf8d7e53ad0d [0,0,0,0,0,0|3,0,1]=4 283 B11R0.3 CCOCCNCCCCCO 27b36f1102de2cdc4a6ba0f3ebe9da1f [0,0,0,0,0,0|2,0,2]=4 284 B11R0.3 CCOCCNCCOCCO 8bc1e5bb9969b577b4b49921e8ee345d [0,0,0,0,0,0|3,0,1]=4 285 B11R0.3 CCOCCNCCSCCO 7298151a296c100ce5b9f5e57ceeebb9 [0,0,0,0,0,0|3,0,1]=4 286 B11R0.3 CCOCCOCCNCCO 87b75d27129c9aace282c7eed254fa19 [0,0,0,0,0,0|3,0,1]=4 287 B11R0.3 CCOCNCCCCCCO 4835c13118ef3e10b732a77116c06de2 [0,0,0,0,0,0|2,0,2]=4 288 B11R0.3 CCOCNCCCOCCO 8ce231c0bb79b38c38ca2ae26362ee07 [0,0,0,0,0,0|3,0,1]=4 289 B11R0.3 CCSCCCCNC/C=C\O a875034cc07879cc833f4f959ce838ee [0,0,0,0,0,0|2,0,2]=4 290 B11R0.3 CCSCCCCNCCCO 5108aa514b949963955e6eabedae88db [0,0,0,0,0,0|2,0,2]=4 291 B11R0.3 CCSCCCNCC#CCO 0ee5ca0474ca01c7a19aa7e01f1233cd [0,0,0,0,0,0|2,0,2]=4 292 B11R0.3 CCSCCCNCCCCO 3f45715406f57e5f60f30a201316f03c [0,0,0,0,0,0|2,0,2]=4 293 B11R0.3 CCSCCCOC/C=C/C=O e0f9928cec0dc5832b2336771d3b5777 [0,0,0,0,0,0|2,0,2]=4 294 B11R0.3 CCSCCCOCC=CC#N d16e874b893d81eb47ceb3093ac263b8 [0,0,0,0,0,0|3,0,1]=4 295 B11R0.3 CCSCCNCCCCCO c237c5e88849ade6744fbc610974bc9c [0,0,0,0,0,0|2,0,2]=4 296 B11R0.3 CCSCCNCCOCCO 88d133afa277b61df3c13ddb7aa094da [0,0,0,0,0,0|3,0,1]=4 297 B11R0.3 CCSCCNCCSCCO 4568bcac9c4204a71fc0d3d8257a66d0 [0,0,0,0,0,0|3,0,1]=4 298 B11R0.3 COCCCCCCNCCBr 086e4cef0bb60111a718996f4b1c7979 [0,0,0,0,0,0|3,0,1]=4 299 B11R0.3 COCCCCCCNCCF f820df48575d617cde70ec0ab3e8fac8 [0,0,0,0,0,0|3,0,1]=4 300 B11R0.3 COCCCCCCNCCI bedf8cbe397828764ba0c38c4b1bbd45 [0,0,0,0,0,0|3,0,1]=4 301 B11R0.3 COCCCCCCNCCO dc0846fae655ca426b0f0faf9c3bd2cb [0,0,0,0,0,0|2,0,1]=3 302 B11R0.3 COCCCCCCNCCS d266b24707412722b9116b45b726de82 [0,0,0,0,0,0|2,1,1]=4 303 B11R0.3 COCCCCCCOCCF 926dfd4d23a90e9f4d09925353f205ce [0,0,0,0,0,0|3,0,1]=4 304 B11R0.3 COCCCCCCOCCS 53553bdfabf38e0812614173f739cc28 [0,0,0,0,0,0|2,1,1]=4 305 B11R0.3 COCCCCCNC/C=C\O 9093ca0b468fc86ae6f7741ef641e2bf [0,0,0,0,0,0|2,0,2]=4 306 B11R0.3 COCCCCCNCCCO fbd1ff608f55b41ca56f5aac36b457c4 [0,0,0,0,0,0|2,0,2]=4 307 B11R0.3 COCCCCNCC#CCO c8a80871a31586d1a4dbe012ee7117ad [0,0,0,0,0,0|2,0,2]=4 308 B11R0.3 COCCCCNCC=CC#N 913a06bbf60fc910bc86266bfdbd211d [0,0,0,0,0,0|3,0,1]=4 309 B11R0.3 COCCCCNCCCCO 26d966c5b17e730d4323185dce89b754 [0,0,0,0,0,0|2,0,2]=4 310 B11R0.3 COCCCCOC/C=C/C=O b42d837d710745c9c5f764aaf1b76378 [0,0,0,0,0,0|2,0,2]=4 311 B11R0.3 COCCCCOCC=CC#N ddb9d7759347f8d0c7a628a3e47186d4 [0,0,0,0,0,0|3,0,1]=4 312 B11R0.3 COCCCNCCCCCO c903e9482376dcb34b33b629df4bc140 [0,0,0,0,0,0|2,0,2]=4 313 B11R0.3 COCCCNCCOCCO a5c00f271146bed3cc2171d2535699dc [0,0,0,0,0,0|3,0,1]=4 314 B11R0.3 COCCCNCCSCCO b173e28afb6b56188f37cfc0cc631ef5 [0,0,0,0,0,0|3,0,1]=4 315 B11R0.3 COCCNCCCCCCO 67b29718a05c587fececfbf75e6878e5 [0,0,0,0,0,0|2,0,2]=4 316 B11R0.3 COCCNCCCOCCO da83a4169b265cf05b4075f3eb38a991 [0,0,0,0,0,0|3,0,1]=4 317 B11R0.3 COCCOCCCCNCO b886c367e13390dc3a51b360c62b0154 [0,0,0,0,0,0|3,0,1]=4 318 B11R0.3 COCCOCCCNCCO ca3b6902a11e1dd8292896309d8871b8 [0,0,0,0,0,0|3,0,1]=4 319 B11R0.3 COCNCCCCCCCO e800d535ea51f07a03291d8a1e306e8b [0,0,0,0,0,0|2,0,2]=4 320 B11R0.3 COCNCCCCSCCO 8e549e2ad51d3adb304e77a4c3570834 [0,0,0,0,0,0|3,0,1]=4 321 B11R0.3 CSCCCCNCC=CC#N b005723e1f9cf6b63be12f30c60aa689 [0,0,0,0,0,0|3,0,1]=4 322 B11R0.3 CSCCCCNCCCCO 7d5faf407297d4593213b3157ce5c772 [0,0,0,0,0,0|2,0,2]=4 323 B11R0.3 CSCCCCOCC=CC#N d789909bcc12728f2fa8231bd994e140 [0,0,0,0,0,0|3,0,1]=4 324 B11R0.3 CSCCCNCCCCCO 8058bc5d242d8649b080d2dc4ab6b9c0 [0,0,0,0,0,0|2,0,2]=4 325 B11R0.3 CSCCCNCCOCCO 04f30fd2b64b5fccace945abc634d38e [0,0,0,0,0,0|3,0,1]=4 326 B11R0.3 CSCCCNCCSCCO 2e243ea1949cc389138db12bbe857fd7 [0,0,0,0,0,0|3,0,1]=4 327 B11R0.3 CSCCNCCCCCCO 95f4b666b2e83bf0f2463dd55512f7de [0,0,0,0,0,0|2,0,2]=4 328 B11R0.3 CSCCNCCCOCCO b3ddee309c5d1ad4f063e7404a8f1ab8 [0,0,0,0,0,0|3,0,1]=4 329 B11R0.3 CSCCOCCCNCCO 8093ccde24df191eb9310bf31204ae4a [0,0,0,0,0,0|3,0,1]=4 330 B11R0.3 CSCNCCCCCCCO 89cf90ea90f8f14f163e4e4086945c39 [0,0,0,0,0,0|2,0,2]=4 331 B11R0.3 CSCNCCCCSCCO ef53cf7df27704c36abb2a6b53f26590 [0,0,0,0,0,0|3,0,1]=4 332 B11R0.3 N#CC=CCNCCCCCCl 9885247921450e1b1a9c84c5eaf5bcff [0,0,0,0,0,0|3,0,1]=4 333 B11R0.3 N#CC=CCNCCCCCO 24f5b1790d30325717a7d79d4f00eadf [0,0,0,0,0,0|3,0,1]=4 334 B11R0.3 N#CCCCCCCNCCO 1017059008a04fab526b2bf8d105bad8 [0,0,0,0,0,0|2,0,2]=4 335 B11R0.3 O/C=C\CNCCCCCCCl 6479459ac892c8c5878f4be53e9fac9a [0,0,0,0,0,0|2,0,2]=4 336 B11R0.3 O/C=C\CNCCCCCCO e22278558a26781b0a28cfb685e5339a [0,0,0,0,0,0|2,0,2]=4 337 B11R0.3 O=C/C=C/COCCCCCF 032171ddaec7f3023dedfc4774b9d043 [0,0,0,0,0,0|2,0,2]=4 338 B11R0.3 O=CCCCCCCNCCO 4563f4506bdfa0337439838ef55d1213 [0,0,0,0,0,0|2,0,2]=4 339 B11R0.3 OCC#CCNCCCCCF 9db87baf0ed92d181f3fc646b3361383 [0,0,0,0,0,0|2,0,2]=4 340 B11R0.3 OCC#CCNCCCCCO 246c550f0e26386e8ba057b084be17df [0,0,0,0,0,0|2,0,2]=4 341 B11R0.3 OCCCCCCCCNCF 0d872b98b2a95c92875278182a108b5b [0,0,0,0,0,0|2,0,2]=4 342 B11R0.3 OCCCCCCCCNCO 06ea9db5cc8e1a7686a5ffeb8c34217c [0,0,0,0,0,0|2,0,1]=3 343 B11R0.3 OCCCCCCCNCCBr 5611383d2817db033c2a42ecf3109ca3 [0,0,0,0,0,0|2,0,2]=4 344 B11R0.3 OCCCCCCCNCCF 588f628bb4b6ff12f54feab307c9e507 [0,0,0,0,0,0|2,0,2]=4 345 B11R0.3 OCCCCCCCNCCI 93735c976611dbc665ceec62cf2a2558 [0,0,0,0,0,0|2,0,2]=4 346 B11R0.3 OCCCCCCCNCCO 302bd45cae4e6eb65d2fde13385cf644 [0,0,0,0,0,0|2,0,1]=3 347 B11R0.3 OCCCCCCCNCCS e8c395c63130862d2a8b782bb312c8a7 [0,0,0,0,0,0|2,0,2]=4 348 B11R0.3 OCCCCCCNCCCCl 23d295f39ea25d0bdc260c4e1006bd41 [0,0,0,0,0,0|2,0,2]=4 349 B11R0.3 OCCCCCCNCCCF da44f47d03b2652ab4412e2f352645ad [0,0,0,0,0,0|2,0,2]=4 350 B11R0.3 OCCCCCCNCCCO e12ee56ee8434bc57b960b5baf0d446a [0,0,0,0,0,0|2,0,2]=4 351 B11R0.3 OCCCCCCNCCCS 4bf30050fb3735094c8d990b216227bd [0,0,0,0,0,0|2,0,2]=4 352 B11R0.3 OCCCCCNCCCCCl 8127214bbb3398b72b02fc719e3caff7 [0,0,0,0,0,0|2,0,2]=4 353 B11R0.3 OCCCCCNCCCCF 5b53447ba67bb20b7fe6faa9cbcbc1b3 [0,0,0,0,0,0|2,0,2]=4 354 B11R0.3 OCCCCCNCCCCO 2cec7b546a19f647fa8f919c7f56a16f [0,0,0,0,0,0|2,0,2]=4 355 B11R0.3 OCCCCCNCCCCS 2131849f28716e0ebdf5c0664c87c6d4 [0,0,0,0,0,0|2,0,2]=4 356 B11R0.3 OCCCCNCCCCCCl 0f0f19f6f26da1ba278dd2a9e2523412 [0,0,0,0,0,0|2,0,2]=4 357 B11R0.3 OCCCCNCCCCCF 34c6a656754cccefee3315dd9f216833 [0,0,0,0,0,0|2,0,2]=4 358 B11R0.3 OCCCCNCCOCCO f24a21ab6aae71b9a259b45a29057e85 [0,0,0,0,0,0|3,0,1]=4 359 B11R0.3 OCCCCNCCSCCO d354afd97ed9a277e579f0e522f68500 [0,0,0,0,0,0|3,0,1]=4 360 B11R0.3 OCCCNCCCCCCCl 9a9e2739daba9096f745b79fbe0e7ffc [0,0,0,0,0,0|2,0,2]=4 361 B11R0.3 OCCCNCCCCCCF 7a0ff36abe9facd5d6f6591b47f70472 [0,0,0,0,0,0|2,0,2]=4 362 B11R0.3 OCCCNCCCOCCO dc9b9099ef237801105438bc55533422 [0,0,0,0,0,0|3,0,1]=4 363 B11R0.3 OCCCOCCCNCCO b959e5e46a857ff4c84fee347fedfd6c [0,0,0,0,0,0|3,0,1]=4 364 B11R0.3 OCCNCCCCSCCO 703cb36484df0f00ed0aff3c8011cf87 [0,0,0,0,0,0|3,0,1]=4 365 B11R0.3 OCCOCCCNCCCF 5873cf297f4ec030d97182a306d8ca0a [0,0,0,0,0,0|3,0,1]=4 366 B11R0.3 OCCOCCCNCCCS 53a7d0a5e9cd774cbc81225a15473019 [0,0,0,0,0,0|3,0,1]=4 367 B11R0.3 OCCOCCNCCCCCl c1d51b75972152aaa31342a611568735 [0,0,0,0,0,0|3,0,1]=4 368 B11R0.3 OCCOCCNCCCCF 420a8c294517dc6742683104faa1a442 [0,0,0,0,0,0|3,0,1]=4 369 B11R0.3 OCCOCCNCCCCS 410d8fe4bf1e6beba43a457738ffbae5 [0,0,0,0,0,0|3,0,1]=4 370 B11R0.3 OCCSCCCCNCCF bcf4f26deec2b7c0db6171e2546d7c0a [0,0,0,0,0,0|3,0,1]=4 371 B11R0.3 OCCSCCCCNCCS 573741b3d80f7f60d481a64f8b6ba497 [0,0,0,0,0,0|3,0,1]=4 372 B11R0.3 OCCSCCNCCCCF 26471c381bcde5487f4440a169746abb [0,0,0,0,0,0|3,0,1]=4 373 B10R0.71 C#CCCCCCCNCO 6ed842aecd6996ee24204f85f77ebfea [1,0,0,0,0,0|1,0,2]=4 374 B10R0.71 C#CCCCCNC/C=C/C bf7bd7bc5676606ed47552af6553e790 [1,0,0,0,0,0|1,0,2]=4 375 B10R0.71 C#CCCCCNC/C=C\C 6e1d6cc4074f420a50e28a7e8acab1bb [1,0,0,0,0,0|1,0,2]=4 376 B10R0.71 C#CCCCCNC/C=C\O b2e3d22718826ed537c499a0006d29ef [1,0,0,0,0,0|1,0,2]=4 377 B10R0.71 C#CCCCCNCC=CC bd4d2cada219d16f147d3f09ec604c6e [1,0,0,0,0,0|1,0,2]=4 378 B10R0.71 C#CCCCCOC/C=C/C 2ef6b84059a4467ffcd80a9a9f53399e [1,0,0,0,0,0|1,0,2]=4 379 B10R0.71 C#CCCCCOC/C=C\C abe53c02b7d7a8a5d0fcb8dc6de53b6f [1,0,0,0,0,0|1,0,2]=4 380 B10R0.71 C#CCCCCOCC=CC 07f55eea123acfb2d9ec662b39f93d19 [1,0,0,0,0,0|1,0,2]=4 381 B10R0.71 C#CCCCOCC/C=C/C 5d07e115dec74c105b743f354c372f15 [1,0,0,0,0,0|1,0,2]=4 382 B10R0.71 C#CCCNCCC/C=C\C cf80c7a2c08d0af2d57ad11844a67087 [1,0,0,0,0,0|1,0,2]=4 383 B10R0.71 C#CCCOCCC/C=C/C 7e01fdb79b549ea27df579658fa2acfb [1,0,0,0,0,0|1,0,2]=4 384 B10R0.71 C#CCCOCCC/C=C\C 0137607a1924624378c9cf10e16b8cbf [1,0,0,0,0,0|1,0,2]=4 385 B10R0.71 C#CCCOCCCC=CC c4997b2d216ed821f709c1477036898b [1,0,0,0,0,0|1,0,2]=4 386 B10R0.71 C/C=C/C=C/COCCCC 5be7c2b1277a2751ff6b685b75a09aa7 [1,0,0,0,0,0|1,0,2]=4 387 B10R0.71 C/C=C/CCCOC/C=C/C b22880ee5111e1cd84b0e058581c0302 [1,0,0,0,0,0|1,0,2]=4 388 B10R0.71 C/C=C/CCCOCCC#N d39568288ac52f06aabaa2eba187f385 [1,0,0,0,0,0|2,0,1]=4 389 B10R0.71 C/C=C/CCCOCCC=O 099c08e5c9575bdb23438e08c620b76f [1,0,0,0,0,0|2,0,1]=4 390 B10R0.71 C/C=C/CCCOCCCC 80f6cb269c0f24c47f7493f0858d135b [1,0,0,0,0,0|1,0,0]=2 391 B10R0.71 C/C=C/CCCOCCCF 860d38725f92fcb5525d17d1c33dfae2 [1,0,0,0,0,0|2,0,0]=3 392 B10R0.71 C/C=C/CCCOCCCS e1d9a71470800c85d2df328b331c667d [1,0,0,0,0,0|2,0,0]=3 393 B10R0.71 C/C=C/CCCOCCOC c3d416ed6793148edba090796b3cf549 [1,0,0,0,0,0|2,0,0]=3 394 B10R0.71 C/C=C/CCCOCCSC 5061d76d70a1e69d151bb6055a67f633 [1,0,0,0,0,0|2,0,0]=3 395 B10R0.71 C/C=C/CCCOCOCC c8184d7b4548963f9062cef2db6089de [1,0,0,0,0,0|2,0,0]=3 396 B10R0.71 C/C=C/CCOC/C=C/CC e4190e5579cc4bbd37a8ecb61d625d33 [1,0,0,0,0,0|1,0,2]=4 397 B10R0.71 C/C=C/CCOCC#CCC 13ac1dd5a6635d877f879d23886a0d5d [1,0,0,0,0,0|1,0,2]=4 398 B10R0.71 C/C=C/CCOCCCC#N 687a11247977cd606cf168d663cf1b14 [1,0,0,0,0,0|2,0,1]=4 399 B10R0.71 C/C=C/CCOCCCC=O 46be8a5f234e47ed5f7141f11d130e36 [1,0,0,0,0,0|2,0,1]=4 400 B10R0.71 C/C=C/CCOCCCCC b01a3aac6d31bf1181d3412f98b352d1 [1,0,0,0,0,0|1,0,0]=2 401 B10R0.71 C/C=C/CCOCCCCF 0926564ddf9384633163943d107dc266 [1,0,0,0,0,0|2,0,0]=3 402 B10R0.71 C/C=C/CCOCCCOC e143401afb4a42af7a2b5b3da7333c58 [1,0,0,0,0,0|2,0,0]=3 403 B10R0.71 C/C=C/CCOCCCSC 7168c1bf70af6e8509d8357b12ea7a20 [1,0,0,0,0,0|2,0,0]=3 404 B10R0.71 C/C=C/CCOCCOCC 2dc32af9d28d7709b9788abfcda74b3a [1,0,0,0,0,0|2,0,0]=3 405 B10R0.71 C/C=C/CCOCCSCC 5937bb27e6bb3ee7337ee58bf6558520 [1,0,0,0,0,0|2,0,0]=3 406 B10R0.71 C/C=C/CNCCCCC#N c44315c4bb375e64e9a65aa48138a113 [1,0,0,0,0,0|2,0,1]=4 407 B10R0.71 C/C=C/CNCCCCCC 23f0bb0d5026d859ab84031e8dc94320 [1,0,0,0,0,0|1,0,0]=2 408 B10R0.71 C/C=C/CNCCCCCCl 34e70a909abc8bd65eef5aac97369efb [1,0,0,0,0,0|2,0,0]=3 409 B10R0.71 C/C=C/CNCCCCCO 3b414ec002c02d5801962f69c7be7167 [1,0,0,0,0,0|2,0,0]=3 410 B10R0.71 C/C=C/CNCCCCOC 8a882d2cc6fecdc9e92df011cc25ce61 [1,0,0,0,0,0|2,0,0]=3 411 B10R0.71 C/C=C/CNCCCCSC 09584e236987e88944071721017cb316 [1,0,0,0,0,0|2,0,0]=3 412 B10R0.71 C/C=C/CNCCCOCC 57760dbec41e9af0da4748a5ceae0a38 [1,0,0,0,0,0|2,0,0]=3 413 B10R0.71 C/C=C/CNCCOCCC d0706b3c3394af70d1b5d14cef3a1bef [1,0,0,0,0,0|2,0,0]=3 414 B10R0.71 C/C=C/CNCCOCCO aea84fbc85bde94f4237850d4a40f1b2 [1,0,0,0,0,0|3,0,0]=4 415 B10R0.71 C/C=C/CNCCOCCS 4ca3f61f068c100b1ef18c50ebe4e15b [1,0,0,0,0,0|3,0,0]=4 416 B10R0.71 C/C=C/CNCCSCCO 287c8c01ac1f6abe1cd9743fea122fb6 [1,0,0,0,0,0|3,0,0]=4 417 B10R0.71 C/C=C/COC/C=C/CCC 57cb9616d038242c596e63556060f1bb [1,0,0,0,0,0|1,0,2]=4 418 B10R0.71 C/C=C/COC/C=C\CCC 216089930dd8063fa13c3b333c2ffb89 [1,0,0,0,0,0|1,0,2]=4 419 B10R0.71 C/C=C/COCC#CCCC 48c560c0dd76c4ea0dae08e43f1bdf7d [1,0,0,0,0,0|1,0,2]=4 420 B10R0.71 C/C=C/COCC/C=C/CC b64b9773fa341b27d9d1567b3b462587 [1,0,0,0,0,0|1,0,2]=4 421 B10R0.71 C/C=C/COCC/C=C\CC 67fa2a7eeebb12d9123f78d838c34e53 [1,0,0,0,0,0|1,0,2]=4 422 B10R0.71 C/C=C/COCCC#CCC 57c5eee3eb69cb08bcb0cf989d4e015f [1,0,0,0,0,0|1,0,2]=4 423 B10R0.71 C/C=C/COCCCCC#N c60fdf35137ef4559f3f7e821911b8ba [1,0,0,0,0,0|2,0,1]=4 424 B10R0.71 C/C=C/COCCCCC=O c69191768fd3a5cdc75c8954e68658dc [1,0,0,0,0,0|2,0,1]=4 425 B10R0.71 C/C=C/COCCCCCC 2cc86534d43c03349a69990f00a712f1 [1,0,0,0,0,0|1,0,0]=2 426 B10R0.71 C/C=C/COCCCCCF 0839263b90062d2b31329bb22f78d661 [1,0,0,0,0,0|2,0,0]=3 427 B10R0.71 C/C=C/COCCCCOC 647600d3cae3ad1ea3eb414f52958747 [1,0,0,0,0,0|2,0,0]=3 428 B10R0.71 C/C=C/COCCCCSC fa2908a33ce56cd88e2db034715fd755 [1,0,0,0,0,0|2,0,0]=3 429 B10R0.71 C/C=C/COCCCOCC c775e3e559fd35f23bc78a0f67a19527 [1,0,0,0,0,0|2,0,0]=3 430 B10R0.71 C/C=C/COCCCSCC 035c9004f7e5fe7c4fab47d56323f2f0 [1,0,0,0,0,0|2,0,0]=3 431 B10R0.71 C/C=C/COCCOCCC a4562113d36185b2eea5cd5845cf1413 [1,0,0,0,0,0|2,0,0]=3 432 B10R0.71 C/C=C/COCCOCCF db707205309d363b3edd69431f0bc195 [1,0,0,0,0,0|3,0,0]=4 433 B10R0.71 C/C=C/COCCOCCS 1255ffeb889f8e7471a0b1af0c55d4f1 [1,0,0,0,0,0|3,0,0]=4 434 B10R0.71 C/C=C/COCCOCOC 7ebf643d14770e99d221f9a947de4a2d [1,0,0,0,0,0|3,0,0]=4 435 B10R0.71 C/C=C/COCCSCCC f6b494e214d8ce6b7ca5c21fbf8fb5bd [1,0,0,0,0,0|2,0,0]=3 436 B10R0.71 C/C=C/COCOCCCC a891d38c7ee33010559a8d8c85a3553a [1,0,0,0,0,0|2,0,0]=3 437 B10R0.71 C/C=C/COCOCCOC f5e674eac498a1e94ec91b3f6e5645cf [1,0,0,0,0,0|3,0,0]=4 438 B10R0.71 C/C=C\CCCNCCC#N ff4b6708a314108557aa29fc2a88cd16 [1,0,0,0,0,0|2,0,1]=4 439 B10R0.71 C/C=C\CCCNCCCC a73db25df80dfe021f7d70c1fcec0182 [1,0,0,0,0,0|1,0,0]=2 440 B10R0.71 C/C=C\CCCNCCCCl c71523e2f6ff3b899850d180eb919e28 [1,0,0,0,0,0|2,0,0]=3 441 B10R0.71 C/C=C\CCCNCCCO b4531ab51d48c8a5bc8f6e2202d71e52 [1,0,0,0,0,0|2,0,0]=3 442 B10R0.71 C/C=C\CCCNCCOC 4103bc3c54d734beb60732c7d8b40941 [1,0,0,0,0,0|2,0,0]=3 443 B10R0.71 C/C=C\CCCNCCON 9e6c3662b4178bf3ca22d2db0c04441e [1,0,0,0,0,0|3,0,0]=4 444 B10R0.71 C/C=C\CCCNCCSC 13260e8164958487bf6cf5025d823041 [1,0,0,0,0,0|2,0,0]=3 445 B10R0.71 C/C=C\CCCOC/C=C/C 17435a6ec8766b0dc8bd38bcdfd7cfff [1,0,0,0,0,0|1,0,2]=4 446 B10R0.71 C/C=C\CCCOC/C=C\C 8759c88f44c7fa309b08382516bade26 [1,0,0,0,0,0|1,0,2]=4 447 B10R0.71 C/C=C\CCCOCCC#N a71a343bf023feb878409d438876f8a8 [1,0,0,0,0,0|2,0,1]=4 448 B10R0.71 C/C=C\CCCOCCC=O ab415cdd81ed9ccdd379943059deca49 [1,0,0,0,0,0|2,0,1]=4 449 B10R0.71 C/C=C\CCCOCCCC fe2923e9d84b92616f7a73a5334d712d [1,0,0,0,0,0|1,0,0]=2 450 B10R0.71 C/C=C\CCCOCCCF 0263f556249485aeea7c758772f520f9 [1,0,0,0,0,0|2,0,0]=3 451 B10R0.71 C/C=C\CCCOCCCS 2447fbb80278e5f02f7f2115db273409 [1,0,0,0,0,0|2,0,0]=3 452 B10R0.71 C/C=C\CCCOCCOC c600550e0f5b1e43c4ba3c75c0fe0720 [1,0,0,0,0,0|2,0,0]=3 453 B10R0.71 C/C=C\CCCOCCSC 009f2b2c34ac901f15f8a4f4ea054ac4 [1,0,0,0,0,0|2,0,0]=3 454 B10R0.71 C/C=C\CCCOCOCC 3318dde6af5b79793554ee1cabba701f [1,0,0,0,0,0|2,0,0]=3 455 B10R0.71 C/C=C\CNCCCCC#N d534df48f6a2909d3fc21d2ba335b080 [1,0,0,0,0,0|2,0,1]=4 456 B10R0.71 C/C=C\CNCCCCCC 51c50a34f77d344a6f9e8db0e46ec177 [1,0,0,0,0,0|1,0,0]=2 457 B10R0.71 C/C=C\CNCCCCCCl fa60a898021a1faa683c1d511e414e36 [1,0,0,0,0,0|2,0,0]=3 458 B10R0.71 C/C=C\CNCCCCCO c6fef37b7d5f10483fd2df1e41d5d167 [1,0,0,0,0,0|2,0,0]=3 459 B10R0.71 C/C=C\CNCCCCOC 2ba7332b31d9be2d0e9a0d2317c4cc11 [1,0,0,0,0,0|2,0,0]=3 460 B10R0.71 C/C=C\CNCCCCSC e6bc056f32de43c8ee6a2bf96d14ace5 [1,0,0,0,0,0|2,0,0]=3 461 B10R0.71 C/C=C\CNCCCOCC d9a510019b5f98d8bb8995c6efc5f861 [1,0,0,0,0,0|2,0,0]=3 462 B10R0.71 C/C=C\CNCCOCCC 6dd38e0ce7e15599c03ad6795c3d2e9a [1,0,0,0,0,0|2,0,0]=3 463 B10R0.71 C/C=C\CNCCOCCO fd887ddbd304f32a5e4fae501b45a1ef [1,0,0,0,0,0|3,0,0]=4 464 B10R0.71 C/C=C\CNCCOCCS 3ebe2b22972758d436980f6a305447df [1,0,0,0,0,0|3,0,0]=4 465 B10R0.71 C/C=C\CNCCSCCO 55221819f26bf7e2fe4316ee27e30660 [1,0,0,0,0,0|3,0,0]=4 466 B10R0.71 C/C=C\COC/C=C/CCC 96c0099f2a824f5519d5ae82b7741135 [1,0,0,0,0,0|1,0,2]=4 467 B10R0.71 C/C=C\COC/C=C\CCC 743769f6ab388708cea124d864b9b1e4 [1,0,0,0,0,0|1,0,2]=4 468 B10R0.71 C/C=C\COCC#CCCC 1cfbd7653ea28524868fb46a3be05999 [1,0,0,0,0,0|1,0,2]=4 469 B10R0.71 C/C=C\COCC/C=C/CC 1d0dedc0b89be954edd17fb1cb04b1e7 [1,0,0,0,0,0|1,0,2]=4 470 B10R0.71 C/C=C\COCC/C=C\CC e69c55870a373fdf3f38e626544c4bc2 [1,0,0,0,0,0|1,0,2]=4 471 B10R0.71 C/C=C\COCCC#CCC 581872fc7255212b999e037bbdbafbe2 [1,0,0,0,0,0|1,0,2]=4 472 B10R0.71 C/C=C\COCCC/C=C/C 440cd13fe742beeb4aec0e62675436cd [1,0,0,0,0,0|1,0,2]=4 473 B10R0.71 C/C=C\COCCCCC#N 90d89d77138bb8a4d83300661b3c98c2 [1,0,0,0,0,0|2,0,1]=4 474 B10R0.71 C/C=C\COCCCCC=O 24a162bb69ad155abd28d7f92eba7dd3 [1,0,0,0,0,0|2,0,1]=4 475 B10R0.71 C/C=C\COCCCCCC c3215f168781748ebc00617e7f23375f [1,0,0,0,0,0|1,0,0]=2 476 B10R0.71 C/C=C\COCCCCCF b78f77597136d143decfd1b9249c153d [1,0,0,0,0,0|2,0,0]=3 477 B10R0.71 C/C=C\COCCCCOC 8ed46d736ed818ee0c7887ce39dd85c2 [1,0,0,0,0,0|2,0,0]=3 478 B10R0.71 C/C=C\COCCCCSC 7ee410e9047c8f71cd50248563785f04 [1,0,0,0,0,0|2,0,0]=3 479 B10R0.71 C/C=C\COCCCOCC 1a22a083c5cc278ba0e1118e2308ca3d [1,0,0,0,0,0|2,0,0]=3 480 B10R0.71 C/C=C\COCCCSCC 6cbdf18516c37475609aec53be04f4db [1,0,0,0,0,0|2,0,0]=3 481 B10R0.71 C/C=C\COCCOCCC 4927ace517bafc274332a53d7d33d032 [1,0,0,0,0,0|2,0,0]=3 482 B10R0.71 C/C=C\COCCOCCF 1bcb5c3682fe4e75715f7097bc795537 [1,0,0,0,0,0|3,0,0]=4 483 B10R0.71 C/C=C\COCCOCCS 837b44a7be0294dd4e2de81fe470b8a9 [1,0,0,0,0,0|3,0,0]=4 484 B10R0.71 C/C=C\COCCOCOC 747e42f0f95df4725dffeac8bf992494 [1,0,0,0,0,0|3,0,0]=4 485 B10R0.71 C/C=C\COCCSCCC f07a0ea09d73da2e3440df0d7c9e421a [1,0,0,0,0,0|2,0,0]=3 486 B10R0.71 C/C=C\COCOCCCC 4400dcff9a6e7ad41ae5596a1f927712 [1,0,0,0,0,0|2,0,0]=3 487 B10R0.71 C/C=C\COCOCCOC 0f8e3ae8d1c15f2464f1cb0d95749d75 [1,0,0,0,0,0|3,0,0]=4 488 B10R0.71 C=C/C=C/CCNCCCC 7b723689d9dff35eae75be2429e9c7d8 [1,0,0,0,0,0|1,0,2]=4 489 B10R0.71 C=C=CCCOCCCCC 366b3b4bef56df509ebbeba1df57ca9c [1,0,0,0,0,0|1,0,2]=4 490 B10R0.71 C=CCCCCCCOCC 6dbc32c9d3b20eeb8cee0cf24e365bb6 [1,0,0,0,0,0|1,0,2]=4 491 B10R0.71 C=CCCCCCNCCC 10e6b327fcac81e127610491b239e591 [1,0,0,0,0,0|1,0,2]=4 492 B10R0.71 C=CCCCCCOCCC c368b69977ea0df80586838beccded89 [1,0,0,0,0,0|1,0,2]=4 493 B10R0.71 C=CCCCCNC/C=C/C b187f5daabcb7717f4009e5f5891f787 [1,0,0,0,0,0|1,0,2]=4 494 B10R0.71 C=CCCCCNC/C=C\C 4427ba864a032953578f9b062980a646 [1,0,0,0,0,0|1,0,2]=4 495 B10R0.71 C=CCCCCNC/C=C\O a271498d175f0cdef658f238d3e45b81 [1,0,0,0,0,0|1,0,2]=4 496 B10R0.71 C=CCCCCNCC=CC cc17eb739dc6d917aa61240a870edff9 [1,0,0,0,0,0|1,0,2]=4 497 B10R0.71 C=CCCCCNCCCC 70afaf74cdc590f950a8db01489534df [1,0,0,0,0,0|1,0,2]=4 498 B10R0.71 C=CCCCCOC/C=C/C 8c165375cd561db84918789b359f451f [1,0,0,0,0,0|1,0,2]=4 499 B10R0.71 C=CCCCCOC/C=C\C f91cc334e33c429e7b12087f94beaccf [1,0,0,0,0,0|1,0,2]=4 500 B10R0.71 C=CCCCCOCC=CC ad9bd00385f76ac9e6759fecfe40079c [1,0,0,0,0,0|1,0,2]=4 501 B10R0.71 C=CCCCCOCCCC eb8efda51eb20afeb995d9abe3ad7654 [1,0,0,0,0,0|1,0,2]=4 502 B10R0.71 C=CCCCNCCCCC 4a774e72e8691531f796e4ee77ce73c0 [1,0,0,0,0,0|1,0,2]=4 503 B10R0.71 C=CCCCOCC/C=C/C 916dde146cf16e6009a56ecc85109198 [1,0,0,0,0,0|1,0,2]=4 504 B10R0.71 C=CCCCOCCCCC 63a6d257d062f7533d7c287ac671b0fd [1,0,0,0,0,0|1,0,2]=4 505 B10R0.71 C=CCCNCCC/C=C\C 4d51b8d3651c5b1333eaa2e9aad13940 [1,0,0,0,0,0|1,0,2]=4 506 B10R0.71 C=CCCNCCCCCC 76e5dd4d3273056eb014515e2136d33d [1,0,0,0,0,0|1,0,2]=4 507 B10R0.71 C=CCCOCCC/C=C/C 366adcae3df75a7151ff9428c4c5c140 [1,0,0,0,0,0|1,0,2]=4 508 B10R0.71 C=CCCOCCC/C=C\C 6f6ba2c3652beccce2db6344401ac97b [1,0,0,0,0,0|1,0,2]=4 509 B10R0.71 C=CCCOCCCC=CC ae9a837aec567c1fa3fbc294bf721a77 [1,0,0,0,0,0|1,0,2]=4 510 B10R0.71 C=CCCOCCCCCC 8814dfd80f4d64b7d70e638ca2c0b882 [1,0,0,0,0,0|1,0,2]=4 511 B10R0.71 C=CCNCCCCCCC 2a2fd85d2768fa551513c1f6e6f4458d [1,0,0,0,0,0|1,0,2]=4 512 B10R0.71 C=CCOCCCCCCC 817dc73f818a9c2b13aa69014917ad92 [1,0,0,0,0,0|1,0,2]=4 513 B10R0.71 C=COCCCCOCCC acdc1c9c66ac69f67b0b371a301168b2 [1,0,0,0,0,0|2,0,1]=4 514 B10R0.71 C=COCCCNCCCC 966b6b85202649a3e5dbe59bfd7541e2 [1,0,0,0,0,0|2,0,1]=4 515 B10R0.71 C=COCCNCCCCC 38c3a227ee0b31b1e34558e1e2def1c6 [1,0,0,0,0,0|2,0,1]=4 516 B10R0.71 C=COCCOCCCCC 30fae63f28005e24e70d255fb5a94d91 [1,0,0,0,0,0|2,0,1]=4 517 B10R0.71 CC#CCCCNCC=CC 6a6746abcf691bd75ac0c8bf74f4a628 [1,0,0,0,0,0|1,0,2]=4 518 B10R0.71 CC#CCCCOC/C=C/C bcf0b8f0ff380820f0c5504387059c34 [1,0,0,0,0,0|1,0,2]=4 519 B10R0.71 CC#CCCCOC/C=C\C f4017ec446e833a630d4cb13c0356c6b [1,0,0,0,0,0|1,0,2]=4 520 B10R0.71 CC#CCCCOCC=CC 380e226b37a8df55388c4e12e3ad1ecf [1,0,0,0,0,0|1,0,2]=4 521 B10R0.71 CC#CCCCOCCCC 0cd09975349b87add68248cd144b30c2 [1,0,0,0,0,0|1,0,2]=4 522 B10R0.71 CC#CCCOCCCCC b5ed7155c2adc6b90ea378c870b7c568 [1,0,0,0,0,0|1,0,2]=4 523 B10R0.71 CC#CCNCCC/C=C\C 1fa6dd07f3cf04af5233f66080fca9c5 [1,0,0,0,0,0|1,0,2]=4 524 B10R0.71 CC#CCNCCCCCC f59c0ab09e3e7e94730db0a687976215 [1,0,0,0,0,0|1,0,2]=4 525 B10R0.71 CC#CCOCCC/C=C/C 9a5ccdff479173ea3e9a0c37986954ae [1,0,0,0,0,0|1,0,2]=4 526 B10R0.71 CC#CCOCCC/C=C\C 1128316ce3066c5c94e3b1e6779418d2 [1,0,0,0,0,0|1,0,2]=4 527 B10R0.71 CC#CCOCCCC=CC 90726e8b0b6ceefe052823ea37f19048 [1,0,0,0,0,0|1,0,2]=4 528 B10R0.71 CC#CCOCCCCCC ca5f1de5554f737f5c88d67d2baa3847 [1,0,0,0,0,0|1,0,2]=4 529 B10R0.71 CC/C=C/CCOCCCC c8bbe4a116e9837c5acb0bd130d88747 [1,0,0,0,0,0|2,0,0]=3 530 B10R0.71 CC/C=C/CCOCCCF 88ecb959ca18d6af5da622832f1b87e9 [1,0,0,0,0,0|3,0,0]=4 531 B10R0.71 CC/C=C/CCOCCCS 2d2a5e2c573307f1405dd0f398018841 [1,0,0,0,0,0|3,0,0]=4 532 B10R0.71 CC/C=C/CCOCCOC 357931dbf492ba690ab5ab15f3f25efc [1,0,0,0,0,0|3,0,0]=4 533 B10R0.71 CC/C=C/CCOCCSC 27ca4bac73680406675dffc3e2b09158 [1,0,0,0,0,0|3,0,0]=4 534 B10R0.71 CC/C=C/CCOCOCC 5bbf3b2e62d730268265b4908a34cbee [1,0,0,0,0,0|3,0,0]=4 535 B10R0.71 CC/C=C/CNCCCCC 396ae7fd2aad2d3062225091f1ed8121 [1,0,0,0,0,0|2,0,0]=3 536 B10R0.71 CC/C=C/CNCCCCCl b42c2c34e27433fc2354da416eb9469c [1,0,0,0,0,0|3,0,0]=4 537 B10R0.71 CC/C=C/CNCCCCO 30e9e1d97d59f6d1e084daccf819227a [1,0,0,0,0,0|3,0,0]=4 538 B10R0.71 CC/C=C/CNCCCCS 86ba226c0d5f01c0e9f63d09ca7eb4f3 [1,0,0,0,0,0|3,0,0]=4 539 B10R0.71 CC/C=C/CNCCCOC 89084ae6baa3dcc2210a4bb5cb58fb9e [1,0,0,0,0,0|3,0,0]=4 540 B10R0.71 CC/C=C/CNCCCSC abed8c05e1d5942be751db3d23883d85 [1,0,0,0,0,0|3,0,0]=4 541 B10R0.71 CC/C=C/CNCCOCC 66cc2c7e3860239ceb96479968ac55f1 [1,0,0,0,0,0|3,0,0]=4 542 B10R0.71 CC/C=C/CNCCSCC bd4236c4231b6d05bb3c27618d566cdf [1,0,0,0,0,0|3,0,0]=4 543 B10R0.71 CC/C=C/COCCCCC 4244476ee625bb91d4c75005fa57b26a [1,0,0,0,0,0|2,0,0]=3 544 B10R0.71 CC/C=C/COCCCCF 1dc81d22ea6c57418304e0917a0631f2 [1,0,0,0,0,0|3,0,0]=4 545 B10R0.71 CC/C=C/COCCCCS 07e5800718cf1f4b5355166f60667667 [1,0,0,0,0,0|3,0,0]=4 546 B10R0.71 CC/C=C/COCCCOC da9a60c9a4f386a7d1a509a02b8e1091 [1,0,0,0,0,0|3,0,0]=4 547 B10R0.71 CC/C=C/COCCCSC 554c810278825b7f95800a92c8ae421b [1,0,0,0,0,0|3,0,0]=4 548 B10R0.71 CC/C=C/COCCOCC 9a5afd7f01e126d7e19bfb079674ce6a [1,0,0,0,0,0|3,0,0]=4 549 B10R0.71 CC/C=C/COCCSCC a16cb8768dc153c0d5da120184491196 [1,0,0,0,0,0|3,0,0]=4 550 B10R0.71 CC/C=C\CCCCOCC 6f672bd2ab358cb454803e83d5c0e284 [1,0,0,0,0,0|2,0,0]=3 551 B10R0.71 CC/C=C\CCCCOCF 0dfb6757c3e7d01b47aa75f03e28a2ec [1,0,0,0,0,0|3,0,0]=4 552 B10R0.71 CC/C=C\CCCOCCC 7fa768d31f02c71335efb28537f1ed87 [1,0,0,0,0,0|2,0,0]=3 553 B10R0.71 CC/C=C\CCCOCCF 658a9ea094f43dddd25b292c6dad7039 [1,0,0,0,0,0|3,0,0]=4 554 B10R0.71 CC/C=C\CCCOCCS 1514e3b49942a76ee0a62089e52656bf [1,0,0,0,0,0|3,0,0]=4 555 B10R0.71 CC/C=C\CCCOCOC 91c800ab417e820667e507a61cd92b15 [1,0,0,0,0,0|3,0,0]=4 556 B10R0.71 CC/C=C\CCCOCSC 499c8ff2bc650384a31a8ed4ececed9a [1,0,0,0,0,0|3,0,0]=4 557 B10R0.71 CC/C=C\CCNCCCC c4f059f6ebacdc59905230714b6eff68 [1,0,0,0,0,0|2,0,0]=3 558 B10R0.71 CC/C=C\CCNCCCCl 51cddba674b0299a3a928cf64999c244 [1,0,0,0,0,0|3,0,0]=4 559 B10R0.71 CC/C=C\CCNCCCO 289e512a3da0d8201ff3b6a7f6c8a4e6 [1,0,0,0,0,0|3,0,0]=4 560 B10R0.71 CC/C=C\CCNCCOC 898274d4166e713a95b39d4ba4ddea68 [1,0,0,0,0,0|3,0,0]=4 561 B10R0.71 CC/C=C\CCNCCSC 15772fe2a7784e8cbd0582b1e3089109 [1,0,0,0,0,0|3,0,0]=4 562 B10R0.71 CC/C=C\CCOCCCC 8e83903dc8b2dc055f80be84ab4a3d9c [1,0,0,0,0,0|2,0,0]=3 563 B10R0.71 CC/C=C\CCOCCCF 4430bc766f9eb0d9c26980dd0840755d [1,0,0,0,0,0|3,0,0]=4 564 B10R0.71 CC/C=C\CCOCCCS a1e1396ab724ae1f920f1f57a0489d4e [1,0,0,0,0,0|3,0,0]=4 565 B10R0.71 CC/C=C\CCOCCOC 1a6120bf2aea14ad94a33580626ee6c2 [1,0,0,0,0,0|3,0,0]=4 566 B10R0.71 CC/C=C\CCOCCSC 035739549145efd9748ebd13a7349bf7 [1,0,0,0,0,0|3,0,0]=4 567 B10R0.71 CC/C=C\CCOCOCC 0feba21b91979670cd9ecf6b8a0bbf3f [1,0,0,0,0,0|3,0,0]=4 568 B10R0.71 CC/C=C\COCCCCC 273210e5829d96509e829e222979bc8b [1,0,0,0,0,0|2,0,0]=3 569 B10R0.71 CC/C=C\COCCCCF cceb6301c3fc703ee59d20a210d8e3fb [1,0,0,0,0,0|3,0,0]=4 570 B10R0.71 CC/C=C\COCCCOC 2778db8b130f5c046c26bb8e26950712 [1,0,0,0,0,0|3,0,0]=4 571 B10R0.71 CC/C=C\COCCCSC ffcfb2f3c5f9bdd080c465251703b682 [1,0,0,0,0,0|3,0,0]=4 572 B10R0.71 CC/C=C\COCCOCC 1548c7429369ffcb40b777378cae9d6b [1,0,0,0,0,0|3,0,0]=4 573 B10R0.71 CC/C=C\COCCSCC bf420840e62c6002d6099f83c76d210d [1,0,0,0,0,0|3,0,0]=4 574 B10R0.71 CC=C=CCCOCCCC 49a0b70400a78c3414989a3230bb7ded [1,0,0,0,0,0|1,0,2]=4 575 B10R0.71 CC=CC#CCCOCCC 2fe89f750339accaa9bee2bbc67b9157 [1,0,0,0,0,0|1,0,2]=4 576 B10R0.71 CC=CC=CCOCCCC b2db690d4b1d749e1abe5e187adedbf9 [1,0,0,0,0,0|1,0,2]=4 577 B10R0.71 CC=CCCCOC/C=C/C 2eebedf1194de72259e07cecc44bebee [1,0,0,0,0,0|1,0,2]=4 578 B10R0.71 CC=CCCCOC/C=C\C 75d2a1890ba6a26f778e9e505819af81 [1,0,0,0,0,0|1,0,2]=4 579 B10R0.71 CC=CCCCOCCC#N 777a44645733848135c646602a37d932 [1,0,0,0,0,0|2,0,1]=4 580 B10R0.71 CC=CCCCOCCC=O 97c9f6fdd6a4de3b92d2d85ba134118f [1,0,0,0,0,0|2,0,1]=4 581 B10R0.71 CC=CCCCOCCCC b937b4ad4c5d1a608e7129c714e871ac [1,0,0,0,0,0|1,0,0]=2 582 B10R0.71 CC=CCCCOCCCF 16d9fe65fb329901984b9f5ccb0df9f5 [1,0,0,0,0,0|2,0,0]=3 583 B10R0.71 CC=CCCCOCCCS 6f970c0dec99fbeb2e03ddd053bf02bf [1,0,0,0,0,0|2,0,0]=3 584 B10R0.71 CC=CCCCOCCOC b4e1f8e3e62e736ff84994d5db86edfd [1,0,0,0,0,0|2,0,0]=3 585 B10R0.71 CC=CCCCOCCSC 82a74332ea20677632c9a5f3968ca0df [1,0,0,0,0,0|2,0,0]=3 586 B10R0.71 CC=CCCCOCOCC ce18cc2f8305789fea2ff09deb10f66d [1,0,0,0,0,0|2,0,0]=3 587 B10R0.71 CC=CCNC/C=C/CCC 6f1205cea7c0bd428ca3d98989f4beed [1,0,0,0,0,0|1,0,2]=4 588 B10R0.71 CC=CCNC/C=C\CCC d8bed24c2aac3eaa35ce3880f32b4fc0 [1,0,0,0,0,0|1,0,2]=4 589 B10R0.71 CC=CCNCC/C=C\CC aa007ba5b3e9d3ae8b6b2f3bdaaaa3d6 [1,0,0,0,0,0|1,0,2]=4 590 B10R0.71 CC=CCNCCC/C=C\C 0ceac737ee06c873eed62812f0c90f77 [1,0,0,0,0,0|1,0,2]=4 591 B10R0.71 CC=CCNCCCCC#N 9dc8e8e291a1375bdeb2ddca277969d6 [1,0,0,0,0,0|2,0,1]=4 592 B10R0.71 CC=CCNCCCCC=O d8b092d9ef5e9f30b928b9bc7ef62f08 [1,0,0,0,0,0|2,0,1]=4 593 B10R0.71 CC=CCNCCCCCC a2b3321184d80eccc150605d97b3fa96 [1,0,0,0,0,0|1,0,0]=2 594 B10R0.71 CC=CCNCCCCCF 2fc90548617a46c38dd4ce75727541b5 [1,0,0,0,0,0|2,0,0]=3 595 B10R0.71 CC=CCNCCCCCO f0a11ba6218259a4b6b28ec12dc6ddff [1,0,0,0,0,0|2,0,0]=3 596 B10R0.71 CC=CCNCCCCOC 52529efcf532914f69d46c6f4b0d9a15 [1,0,0,0,0,0|2,0,0]=3 597 B10R0.71 CC=CCNCCCCON 2df4852a9eb88fc9a54cb54b3af32f24 [1,0,0,0,0,0|3,0,0]=4 598 B10R0.71 CC=CCNCCCOCC 962cbe1d82aec2012d8ab8054a0d8443 [1,0,0,0,0,0|2,0,0]=3 599 B10R0.71 CC=CCNCCCSCC 78e2cb135e9bffe539deb2c9e761eeca [1,0,0,0,0,0|2,0,0]=3 600 B10R0.71 CC=CCNCCOCCC bb799165fcac71998a32b741f73b3b5d [1,0,0,0,0,0|2,0,0]=3 601 B10R0.71 CC=CCNCCOCCO 0cec8d249abba8d5cfc026cc1a2c134f [1,0,0,0,0,0|3,0,0]=4 602 B10R0.71 CC=CCNCCOCOC 0c215a0dc2c96fda4d059dccf9f5b0ba [1,0,0,0,0,0|3,0,0]=4 603 B10R0.71 CC=CCNCOCCCC 7c162e9cfd7fdcb232db84370f057f40 [1,0,0,0,0,0|2,0,0]=3 604 B10R0.71 CC=CCNCOCCOC fd71c2b64b0743cf6e463c2b3fde6792 [1,0,0,0,0,0|3,0,0]=4 605 B10R0.71 CC=CCOC/C=C/CCC 801068839f22d81f67bd3c12763d82f0 [1,0,0,0,0,0|1,0,2]=4 606 B10R0.71 CC=CCOC/C=C\CCC 55db526c1c08b156db9bcd25848ea09f [1,0,0,0,0,0|1,0,2]=4 607 B10R0.71 CC=CCOCC/C=C\CC 75e1755252a27204ec39b2f227ebda40 [1,0,0,0,0,0|1,0,2]=4 608 B10R0.71 CC=CCOCCC/C=C\C 852e14b23b4dd3523a19472f8f7c57f8 [1,0,0,0,0,0|1,0,2]=4 609 B10R0.71 CC=CCOCCCCC#N e99a2c6b1488870bf647bcd7f9eb01b2 [1,0,0,0,0,0|2,0,1]=4 610 B10R0.71 CC=CCOCCCCC=O 85eab19089cebb2153fb1e7f93e60c1a [1,0,0,0,0,0|2,0,1]=4 611 B10R0.71 CC=CCOCCCCCC a58ad78e13367fd9a0795b0d0efdc386 [1,0,0,0,0,0|1,0,0]=2 612 B10R0.71 CC=CCOCCCCCF dac1e20b68e93275e9f1b17164a54aea [1,0,0,0,0,0|2,0,0]=3 613 B10R0.71 CC=CCOCCCCOC f4387a5dfc7c4479aeab4e78309c2494 [1,0,0,0,0,0|2,0,0]=3 614 B10R0.71 CC=CCOCCCOCC 0d0be3941202e60c262ecb35ae7eef67 [1,0,0,0,0,0|2,0,0]=3 615 B10R0.71 CC=CCOCCCSCC 91a74a7d47ada80b0fcbc3c2e16532be [1,0,0,0,0,0|2,0,0]=3 616 B10R0.71 CC=CCOCCOCCC 08b2fc5f7782946755848f7c7e2bbdf9 [1,0,0,0,0,0|2,0,0]=3 617 B10R0.71 CC=CCOCCOCOC 189d25525f5574b2bfdf617aca463626 [1,0,0,0,0,0|3,0,0]=4 618 B10R0.71 CC=CCOCOCCCC 4327f43764c0dd6de09e0f8936c04f80 [1,0,0,0,0,0|2,0,0]=3 619 B10R0.71 CC=CCOCOCCOC 4fbd6ce8ee670a21cee95acc7d93ac37 [1,0,0,0,0,0|3,0,0]=4 620 B10R0.71 CCCCCCCCNC#N 7445c948f6631b9d7692f2c79595c0b8 [1,0,0,0,0,0|2,0,1]=4 621 B10R0.71 CCCCCCCCNC=O bc03f137b33aec3f705c81e5d5bac7bb [1,0,0,0,0,0|1,0,1]=3 622 B10R0.71 CCCCCCCCNCC f45798325e076f51813ed9475990e935 [1,0,0,0,0,0|1,0,1]=3 623 B10R0.71 CCCCCCCCNCF eba3784a27d0163aaddd6d4d0640d8cb [1,0,0,0,0,0|2,0,0]=3 624 B10R0.71 CCCCCCCCNCO 62a2dae03ae16e5c5d74011b3e38bc6b [1,0,0,0,0,0|1,0,0]=2 625 B10R0.71 CCCCCCCCOCC fdf9c57b26dc59eebf4df9f9dff7ab11 [1,0,0,0,0,0|1,0,1]=3 626 B10R0.71 CCCCCCCCOCF 7d6ea1593b941dac758ff903c420f174 [1,0,0,0,0,0|2,0,0]=3 627 B10R0.71 CCCCCCCNCC=O bfb56bc7341eb925b4f8d6df80cbc0e0 [1,0,0,0,0,0|1,0,2]=4 628 B10R0.71 CCCCCCCNCCBr 153a3c6e2c01a151374cf28481aa6eb9 [1,0,0,0,0,0|2,0,1]=4 629 B10R0.71 CCCCCCCNCCC 8f428c22239379f79b42eeff6f848027 [1,0,0,0,0,0|1,0,2]=4 630 B10R0.71 CCCCCCCNCCF 0cbe21085ad34c7f5a2177d0ffae2a78 [1,0,0,0,0,0|2,0,1]=4 631 B10R0.71 CCCCCCCNCCI b568dedc350f2457598188b0074522f8 [1,0,0,0,0,0|2,0,1]=4 632 B10R0.71 CCCCCCCNCCO b00594b2eda448f3d37260fcc9ae8d77 [1,0,0,0,0,0|1,0,1]=3 633 B10R0.71 CCCCCCCNCCS 83786bb22ec9056731e6cce6fe301f14 [1,0,0,0,0,0|1,1,1]=4 634 B10R0.71 CCCCCCCNCOC f2d51f45d743c2c6bb60d201a5c48204 [1,0,0,0,0,0|2,0,1]=4 635 B10R0.71 CCCCCCCNCSC 2214e2f762d7beb04324a118c724f12c [1,0,0,0,0,0|2,0,1]=4 636 B10R0.71 CCCCCCCOCC=O 85a03949435365a6a1fdeda7013cb46a [1,0,0,0,0,0|1,0,2]=4 637 B10R0.71 CCCCCCCOCCC 2dbba9d2fa88b26583f5d2ac3d741b24 [1,0,0,0,0,0|1,0,2]=4 638 B10R0.71 CCCCCCCOCCF 2e8dd6a0af3d2b30f6f325a750e2f8e8 [1,0,0,0,0,0|2,0,1]=4 639 B10R0.71 CCCCCCCOCCS d905d762a9b7d322c87213c7c56ba37f [1,0,0,0,0,0|1,1,1]=4 640 B10R0.71 CCCCCCCOCOC 5ce19ed9c6e4108e173e3dc063eaeb4e [1,0,0,0,0,0|2,0,1]=4 641 B10R0.71 CCCCCCCOCSC 08ad92cc4f51e014a7301f82e1b9552e [1,0,0,0,0,0|2,0,1]=4 642 B10R0.71 CCCCCCNC/C=C/Cl a434be9488fb4e5f67e78ecb14455099 [1,0,0,0,0,0|2,0,0]=3 643 B10R0.71 CCCCCCNC/C=C\Cl f568565a0a16d34d673b3191da6e715f [1,0,0,0,0,0|2,0,0]=3 644 B10R0.71 CCCCCCNC/C=C\O 6d75b641deaa8953d1d240b2b8f20ca8 [1,0,0,0,0,0|1,0,0]=2 645 B10R0.71 CCCCCCNCCC=O 7011a6760ad05bee90b4b5fe1ddade10 [1,0,0,0,0,0|1,0,2]=4 646 B10R0.71 CCCCCCNCCCC 20be2e0525a624157bc2fad46d2186d5 [1,0,0,0,0,0|1,0,2]=4 647 B10R0.71 CCCCCCNCCCCl 798c3b78fda1b44bfc2a5866fd849b4a [1,0,0,0,0,0|2,0,1]=4 648 B10R0.71 CCCCCCNCCCF ec8ad93e9495e1afdc7ceb0355e5c789 [1,0,0,0,0,0|2,0,1]=4 649 B10R0.71 CCCCCCNCCCO 5bc4d9addd0075b9ea454b7e30b2b20c [1,0,0,0,0,0|1,0,1]=3 650 B10R0.71 CCCCCCNCCCS 8c1aea017c53a004a3a57f13df4016f5 [1,0,0,0,0,0|1,1,1]=4 651 B10R0.71 CCCCCCNCCOC d8a9b2ae4f4d1a2408c43a2120d332fc [1,0,0,0,0,0|2,0,1]=4 652 B10R0.71 CCCCCCNCCSC 03f05656133e75b7ef05cf7e7a9686cd [1,0,0,0,0,0|2,0,1]=4 653 B10R0.71 CCCCCCNCOCC 0b2dadfdd556d2bf502aa4112d950603 [1,0,0,0,0,0|2,0,1]=4 654 B10R0.71 CCCCCCOC/C=C/Cl 9b845a9faee5eb30dccd92e1d125045d [1,0,0,0,0,0|2,0,0]=3 655 B10R0.71 CCCCCCOC/C=C\Cl 6c622b8755434309310cd777f350ff13 [1,0,0,0,0,0|2,0,0]=3 656 B10R0.71 CCCCCCOCC=CCl f46dbeda2bf4ea0706f085cbc02d1831 [1,0,0,0,0,0|2,0,0]=3 657 B10R0.71 CCCCCCOCCC=O 52e11fbfda6e705332503dbf6ca57c21 [1,0,0,0,0,0|1,0,2]=4 658 B10R0.71 CCCCCCOCCCC 938d0ec0b6adc0f1b39dbfc036e22e02 [1,0,0,0,0,0|1,0,2]=4 659 B10R0.71 CCCCCCOCCCF 96181b976d7354be2077b197619bb942 [1,0,0,0,0,0|2,0,1]=4 660 B10R0.71 CCCCCCOCCCS 5fa58b5367e16182182d2f61e5d955a0 [1,0,0,0,0,0|1,1,1]=4 661 B10R0.71 CCCCCCOCCOC 498c1d974b36c5798a5345f99389e8d2 [1,0,0,0,0,0|2,0,1]=4 662 B10R0.71 CCCCCCOCCSC a2fa5d10e923435988e5eb6eaf926cde [1,0,0,0,0,0|2,0,1]=4 663 B10R0.71 CCCCCCOCOCC de7091207636fc19f355a981992b8eb3 [1,0,0,0,0,0|2,0,1]=4 664 B10R0.71 CCCCCNCC#CCO 23116c6c38a6f4605bbabd713d286c57 [1,0,0,0,0,0|1,0,2]=4 665 B10R0.71 CCCCCNCC=CC#N 6a9a26c19bdd0ee62741d0f4e3257cee [1,0,0,0,0,0|2,0,1]=4 666 B10R0.71 CCCCCNCCCC=O 6680464fa50f8e11fa1a82d02cb758f7 [1,0,0,0,0,0|1,0,2]=4 667 B10R0.71 CCCCCNCCCCC fc6b1fbee2ae20e668586a93426dce7b [1,0,0,0,0,0|1,0,2]=4 668 B10R0.71 CCCCCNCCCCCl c701e49df4eef1470e682606de3ca8f1 [1,0,0,0,0,0|2,0,1]=4 669 B10R0.71 CCCCCNCCCCF d279fc520ee48aeaa07407924d2d74d7 [1,0,0,0,0,0|2,0,1]=4 670 B10R0.71 CCCCCNCCCCO 379ab0235e165758d05e13f64b0667e2 [1,0,0,0,0,0|1,0,1]=3 671 B10R0.71 CCCCCNCCCCS d84e183bdfafbaad537c0d200ed48999 [1,0,0,0,0,0|1,1,1]=4 672 B10R0.71 CCCCCNCCCOC 59c794b1fdced6fe10e73b7eec0b61f4 [1,0,0,0,0,0|2,0,1]=4 673 B10R0.71 CCCCCNCCCSC 1a943155b12e5db9b108db3f8ef5622d [1,0,0,0,0,0|2,0,1]=4 674 B10R0.71 CCCCCNCCOCC b302026487b9f6fc9da1041bec3b940f [1,0,0,0,0,0|2,0,1]=4 675 B10R0.71 CCCCCNCCSCC d4e4b88649a7d41376228d32433581ea [1,0,0,0,0,0|2,0,1]=4 676 B10R0.71 CCCCCOC/C=C/C=O dd701f6f2acb2f0b3775b86bb7a39725 [1,0,0,0,0,0|1,0,2]=4 677 B10R0.71 CCCCCOCC=CC#N 74b69457886f8409891578b422921ba2 [1,0,0,0,0,0|2,0,1]=4 678 B10R0.71 CCCCCOCCCC=O 37cad7ef5e51a341a4958cbb40245746 [1,0,0,0,0,0|1,0,2]=4 679 B10R0.71 CCCCCOCCCCC 6be65cbda65609b70fc256077c9081b0 [1,0,0,0,0,0|1,0,2]=4 680 B10R0.71 CCCCCOCCCCF 1e52934387d4e6196e1ae9a21a139f63 [1,0,0,0,0,0|2,0,1]=4 681 B10R0.71 CCCCCOCCCCS 0279225295d1c82256f6e5c11abe7674 [1,0,0,0,0,0|1,1,1]=4 682 B10R0.71 CCCCCOCCCOC 35a4ac119007b84148d4ce463e8bfcd6 [1,0,0,0,0,0|2,0,1]=4 683 B10R0.71 CCCCCOCCCSC 83f486b530f56d8364c21230e353c7ad [1,0,0,0,0,0|2,0,1]=4 684 B10R0.71 CCCCCOCCNC=O 11bc3670960456d027b99f450c9cd405 [1,0,0,0,0,0|2,0,1]=4 685 B10R0.71 CCCCCOCCOC=O f65c1673d6dd413a755f7700c7d8cf80 [1,0,0,0,0,0|2,0,1]=4 686 B10R0.71 CCCCCOCCOCC c8f98ba5fde1bc4c3459e40764f14618 [1,0,0,0,0,0|2,0,1]=4 687 B10R0.71 CCCCCOCCOCF 4eb1d0a205c12d08a71774261d9303c6 [1,0,0,0,0,0|3,0,0]=4 688 B10R0.71 CCCCCOCCSCC 8e2ce49f0c9b939f61ef427ccb831b7d [1,0,0,0,0,0|2,0,1]=4 689 B10R0.71 CCCCNCCCCC=O dbb1efb0684adf2cb0a6d780179e9b96 [1,0,0,0,0,0|1,0,2]=4 690 B10R0.71 CCCCNCCCCCCl 17907e10bc8ae216fc19d4f50e0355d8 [1,0,0,0,0,0|2,0,1]=4 691 B10R0.71 CCCCNCCCCCF ecb524fdab50cb363fd9220f41e81b56 [1,0,0,0,0,0|2,0,1]=4 692 B10R0.71 CCCCNCCCCCO a568cb73440f8b5eb1a832482c6c8aa1 [1,0,0,0,0,0|1,0,1]=3 693 B10R0.71 CCCCNCCCCOC 8a51345137a99f78ee92600b49d2fddb [1,0,0,0,0,0|2,0,1]=4 694 B10R0.71 CCCCNCCCCSC 834064ffffe2ca860260d790d8b507c6 [1,0,0,0,0,0|2,0,1]=4 695 B10R0.71 CCCCNCCCOCC 4567bf18693d1425b182776ab5d89ce7 [1,0,0,0,0,0|2,0,1]=4 696 B10R0.71 CCCCNCCCSCC 63db814ee76aaab4513ac3ae6b0470e2 [1,0,0,0,0,0|2,0,1]=4 697 B10R0.71 CCCCNCCOCCO 80115239ef9f78352b2ee441d10a1b65 [1,0,0,0,0,0|2,0,1]=4 698 B10R0.71 CCCCNCCSCCO 0347ac7aaf85116de46287a5ecc74d9a [1,0,0,0,0,0|2,0,1]=4 699 B10R0.71 CCCCOCCCCC=O 87caad785ee1de0ab8952b818b81a155 [1,0,0,0,0,0|1,0,2]=4 700 B10R0.71 CCCCOCCCCCF aead05b2f46a954a77fb9b0d46a831a1 [1,0,0,0,0,0|2,0,1]=4 701 B10R0.71 CCCCOCCCCOC 1c665f9a80dbcc19a2506b93b11eeab3 [1,0,0,0,0,0|2,0,1]=4 702 B10R0.71 CCCCOCCCCSC 7e846181e45c3a440b01cd8ef8df47c8 [1,0,0,0,0,0|2,0,1]=4 703 B10R0.71 CCCCOCCCNC=O 1df83f1971a73005dd333cd8848e6b5c [1,0,0,0,0,0|2,0,1]=4 704 B10R0.71 CCCCOCCCNCC 010734c4fdc877ac094389f744441162 [1,0,0,0,0,0|2,0,1]=4 705 B10R0.71 CCCCOCCCNCF fbaf21f03ebc1c1e24106466ca45cf49 [1,0,0,0,0,0|3,0,0]=4 706 B10R0.71 CCCCOCCCNCO 02310b457d19aea630613cfc6ae43a82 [1,0,0,0,0,0|2,0,0]=3 707 B10R0.71 CCCCOCCCOCC 1158a02552cfd2177bf76faa90c6df77 [1,0,0,0,0,0|2,0,1]=4 708 B10R0.71 CCCCOCCCOCF 5e73e928453faa57e5da7ba81a05056a [1,0,0,0,0,0|3,0,0]=4 709 B10R0.71 CCCCOCCCSCC e04cab22dc6501876d38fc7fb5563829 [1,0,0,0,0,0|2,0,1]=4 710 B10R0.71 CCCCOCCNCCO cd255df0d112d9e8c8ef0cac0591fd4e [1,0,0,0,0,0|2,0,1]=4 711 B10R0.71 CCCCOCNCCCO d649bca14d69eef2b8a68b32f4a61d75 [1,0,0,0,0,0|2,0,1]=4 712 B10R0.71 CCCCOCOC/C=C/Cl db4e9cb455885bfe1f151feca70b11bf [1,0,0,0,0,0|3,0,0]=4 713 B10R0.71 CCCCOCOCC=CCl 1aaf26d837de4f64738787d0d9128252 [1,0,0,0,0,0|3,0,0]=4 714 B10R0.71 CCCNCCCCCC=O ea13b9738fa632ac5ce864b8fef8c315 [1,0,0,0,0,0|1,0,2]=4 715 B10R0.71 CCCNCCCCCCCl d9d02325ceabb1236feca69f9d260e06 [1,0,0,0,0,0|2,0,1]=4 716 B10R0.71 CCCNCCCCCCF 47bd30d6c6ebb4154ccfd3d84e3dd907 [1,0,0,0,0,0|2,0,1]=4 717 B10R0.71 CCCNCCCCCCO 957198384cd9904d687345e1f1a839fe [1,0,0,0,0,0|1,0,1]=3 718 B10R0.71 CCCNCCCCCOC fbe0af6a29e7bb390546dc0f24f036df [1,0,0,0,0,0|2,0,1]=4 719 B10R0.71 CCCNCCCCSCC 4fbccce5329f8a22f7d198bd04134133 [1,0,0,0,0,0|2,0,1]=4 720 B10R0.71 CCCNCCCOCCO 85649ddd4b7bb8ea6cc1e32801747e8c [1,0,0,0,0,0|2,0,1]=4 721 B10R0.71 CCCNCCOCCCO ce755d26bb38d7d0db74dd93ed4f675f [1,0,0,0,0,0|2,0,1]=4 722 B10R0.71 CCCOCCCCCC=O f9a394720b00a6dd92dae6c05c91a7d4 [1,0,0,0,0,0|1,0,2]=4 723 B10R0.71 CCCOCCCCCCF 72ffe3589386c933c936da7caa3f7256 [1,0,0,0,0,0|2,0,1]=4 724 B10R0.71 CCCOCCCCCCS 9237106df74f11c16d22d77a5b29e426 [1,0,0,0,0,0|1,1,1]=4 725 B10R0.71 CCCOCCCCCOC f0f1181da96b58975534715e6947023c [1,0,0,0,0,0|2,0,1]=4 726 B10R0.71 CCCOCCCNCCO 0a8b4b1c66e483def5426f3f2c79fc1b [1,0,0,0,0,0|2,0,1]=4 727 B10R0.71 CCCOCCNC/C=C/Cl 760cf0892442551c70123ffcb2a37d66 [1,0,0,0,0,0|3,0,0]=4 728 B10R0.71 CCCOCCNC/C=C\Cl 4b6061392b3d807de3e585b238552374 [1,0,0,0,0,0|3,0,0]=4 729 B10R0.71 CCCOCCNC/C=C\O 24f540f0543cc566be8fba3667e5ba87 [1,0,0,0,0,0|2,0,0]=3 730 B10R0.71 CCCOCCNCCCO e044842af3e92ff7eb92db45482811f4 [1,0,0,0,0,0|2,0,1]=4 731 B10R0.71 CCCOCCOC/C=C/Cl b98bc8d5da5b6807c34728135099e635 [1,0,0,0,0,0|3,0,0]=4 732 B10R0.71 CCCOCCOC/C=C\Cl 1c014a50797f65c3aab992ce0ed48a72 [1,0,0,0,0,0|3,0,0]=4 733 B10R0.71 CCCOCCOCC=CCl 5e534ea20934e6c885e43485c197e629 [1,0,0,0,0,0|3,0,0]=4 734 B10R0.71 CCCSCCCCNC=O cdfb35b8e32d72964621f5e08adec4c6 [1,0,0,0,0,0|2,0,1]=4 735 B10R0.71 CCCSCCCCNCC 19a2007b09e5e2f3826f2c9805957fbb [1,0,0,0,0,0|2,0,1]=4 736 B10R0.71 CCCSCCCCNCF 8cc325ea244af6b4ced7218087c95acc [1,0,0,0,0,0|3,0,0]=4 737 B10R0.71 CCCSCCCCNCO d64656b2ed2aecb983e9bf8bbe18d3d1 [1,0,0,0,0,0|2,0,0]=3 738 B10R0.71 CCCSCCOC/C=C/Cl 731b9ca954d4ecff57b88c90bbc83d8e [1,0,0,0,0,0|3,0,0]=4 739 B10R0.71 CCCSCCOC/C=C\Cl 98971d591fe65272b56a8f1c654c06bb [1,0,0,0,0,0|3,0,0]=4 740 B10R0.71 CCNCCCCCCCO fc9b8a8b51004dd7f2bdc1e19b84756b [1,0,0,0,0,0|1,0,1]=3 741 B10R0.71 CCNCCCCSCCO 9cc3bb61eaf41c8a4923a6db1250aa82 [1,0,0,0,0,0|2,0,1]=4 742 B10R0.71 CCNCCCOCCCO 47d0e11f0fe7477fa63a8b913e01e66b [1,0,0,0,0,0|2,0,1]=4 743 B10R0.71 CCOCCCCCCOC 4054b0cb119b3fa57bc1a0eeb14de41e [1,0,0,0,0,0|2,0,1]=4 744 B10R0.71 CCOCCCNC/C=C/Cl 71628b16fbc96044dca5dcafc0e4f7a9 [1,0,0,0,0,0|3,0,0]=4 745 B10R0.71 CCOCCCNC/C=C\Cl 002f27e821c2f5ed2be5dfe198374ccc [1,0,0,0,0,0|3,0,0]=4 746 B10R0.71 CCOCCCNC/C=C\O e644c1e517867eced6d3547252ec6cf9 [1,0,0,0,0,0|2,0,0]=3 747 B10R0.71 CCOCCCNCCCO b075d31a0576ac4ce5af21cb018680ed [1,0,0,0,0,0|2,0,1]=4 748 B10R0.71 CCOCCCOC/C=C/Cl 5da8cb0ef22ee7d12d5b048aaabac0aa [1,0,0,0,0,0|3,0,0]=4 749 B10R0.71 CCOCCCOC/C=C\Cl cfc44f635eef478f1e17396fceb62b76 [1,0,0,0,0,0|3,0,0]=4 750 B10R0.71 CCOCCCOCC=CCl 89ad27a37a9bfb25619279ab7d7c0833 [1,0,0,0,0,0|3,0,0]=4 751 B10R0.71 CCOCCNCCCCO c2765a5f377f959beb3e3c80dc514c5d [1,0,0,0,0,0|2,0,1]=4 752 B10R0.71 CCOCCOCCNCO 4afd5865edd57d5fd6684959ad20dd26 [1,0,0,0,0,0|3,0,0]=4 753 B10R0.71 CCOCNCCCCCO 342967161ee32ea30677a794bea2e604 [1,0,0,0,0,0|2,0,1]=4 754 B10R0.71 CCSCCCCNCCO d49169998c95c8ac05194e3d506507c0 [1,0,0,0,0,0|2,0,1]=4 755 B10R0.71 CCSCCCNCCCO 47d2735b827a9b180dc3f69415f85455 [1,0,0,0,0,0|2,0,1]=4 756 B10R0.71 CCSCCCOC/C=C/Cl abbf41a31a937dc8ae56bd875c8bae84 [1,0,0,0,0,0|3,0,0]=4 757 B10R0.71 CCSCCCOC/C=C\Cl 90c46f4e217f8fcc45f2f5357cbbf4e4 [1,0,0,0,0,0|3,0,0]=4 758 B10R0.71 CCSCCCOCC=CCl 027a6cca82d4b3071c1258258d7da5e5 [1,0,0,0,0,0|3,0,0]=4 759 B10R0.71 CCSCCNCCCCO 193cb6b252a8317350402e130583726e [1,0,0,0,0,0|2,0,1]=4 760 B10R0.71 COCCCCCCOCF 5bc07591ce5eedb6d096a50f252dd1bf [1,0,0,0,0,0|3,0,0]=4 761 B10R0.71 COCCCCCNCCO a4e90d1195ad0a2e045d4e3da7d08436 [1,0,0,0,0,0|2,0,1]=4 762 B10R0.71 COCCCCNC/C=C/Cl a6b1ee94dd382a30afda2ced86e9b9ec [1,0,0,0,0,0|3,0,0]=4 763 B10R0.71 COCCCCNC/C=C\Cl f93434eb7e5add7c586563084a1a70c9 [1,0,0,0,0,0|3,0,0]=4 764 B10R0.71 COCCCCNC/C=C\O 9b5ffee0b3db29abff14105c3d5aff3a [1,0,0,0,0,0|2,0,0]=3 765 B10R0.71 COCCCCNCCCO e680b9774f4f9b4a017e9897fb0e030c [1,0,0,0,0,0|2,0,1]=4 766 B10R0.71 COCCCCOC/C=C/Cl eb2901f2723b25e94db1d31db0c03efc [1,0,0,0,0,0|3,0,0]=4 767 B10R0.71 COCCCCOC/C=C\Cl 367b27e22df966a4b0f76582ed007279 [1,0,0,0,0,0|3,0,0]=4 768 B10R0.71 COCCCCOCC=CCl 1e80700b4420b63003bc78e54b241640 [1,0,0,0,0,0|3,0,0]=4 769 B10R0.71 COCCCNCCCCO bbb0a0cab4d8bfd8f0a4628529389dc7 [1,0,0,0,0,0|2,0,1]=4 770 B10R0.71 COCCNCCCCCO 9c9ec868dcc297038561eacd64e4095b [1,0,0,0,0,0|2,0,1]=4 771 B10R0.71 COCCOCCCNCO fa9eea6b2d69aee72c08770e8cbfd184 [1,0,0,0,0,0|3,0,0]=4 772 B10R0.71 COCNCCCCCCO f2859e933bab15050a7e0cdf65c99b0d [1,0,0,0,0,0|2,0,1]=4 773 B10R0.71 CSCCCCNC/C=C/Cl 280dbdf3c6ec1040f8bd1ee7602cb5c6 [1,0,0,0,0,0|3,0,0]=4 774 B10R0.71 CSCCCCNC/C=C\Cl d8d06ddf84b38cbad68179ee4c85bbe1 [1,0,0,0,0,0|3,0,0]=4 775 B10R0.71 CSCCCCNC/C=C\O 3991566fa0546ff31ab1d79ccc76a7f5 [1,0,0,0,0,0|2,0,0]=3 776 B10R0.71 CSCCCCNCCCO 536a2256947d5d7bf96225f7139cf4a5 [1,0,0,0,0,0|2,0,1]=4 777 B10R0.71 CSCCCCOC/C=C/Cl 6ab4f37d60633555dbb1d04277ac8eba [1,0,0,0,0,0|3,0,0]=4 778 B10R0.71 CSCCCCOC/C=C\Cl 1b3bae9f6e0d350633d714e350a3d3e4 [1,0,0,0,0,0|3,0,0]=4 779 B10R0.71 CSCCCNCCCCO 5f679e72bf6dab4f5df47d48b627fed0 [1,0,0,0,0,0|2,0,1]=4 780 B10R0.71 CSCCNCCCCCO fba793a3b8c32572b1d4ce0517f57c72 [1,0,0,0,0,0|2,0,1]=4 781 B10R0.71 CSCCOCCCNCO 827ef42eb298dd1f846631ac15c3909e [1,0,0,0,0,0|3,0,0]=4 782 B10R0.71 CSCNCCCCCCO 2c18020d880691af439100daf483c0d4 [1,0,0,0,0,0|2,0,1]=4 783 B10R0.71 Cl/C=C/CNCCCCCCl 813b5ed1fdffdb790b2cf548ed2e3591 [1,0,0,0,0,0|3,0,0]=4 784 B10R0.71 Cl/C=C\CNCCCCCCl 09ed5a8c05ad63a8024933cffd619cf8 [1,0,0,0,0,0|3,0,0]=4 785 B10R0.71 FCCCCCOC/C=C/Cl af5092c1264c440a986c63d966510681 [1,0,0,0,0,0|3,0,0]=4 786 B10R0.71 FCCCCCOCC=CCl 079af7f8db28dd301d9dceffabe455c6 [1,0,0,0,0,0|3,0,0]=4 787 B10R0.71 N#CCCCCNC/C=C\O 0d198b8601083e1d99a4c56992b7cf43 [1,0,0,0,0,0|2,0,1]=4 788 B10R0.71 O/C=C\CNCCCCCCl 4080c042f08c12e403ba179332a3d05e [1,0,0,0,0,0|2,0,0]=3 789 B10R0.71 O/C=C\CNCCCCCO 3b4ac709cf4268b2b7162e6f3b44dbc9 [1,0,0,0,0,0|2,0,0]=3 790 B10R0.71 O/C=C\CNCCOCCO c48e58a3b1448b53496ceccce39ba1da [1,0,0,0,0,0|3,0,0]=4 791 B10R0.71 O/C=C\CNCCOCCS 50a02a5032c9e48810a2954c0e571fcf [1,0,0,0,0,0|3,0,0]=4 792 B10R0.71 O/C=C\CNCCSCCO cb66baf9c6e137bff3710bc1df860bb9 [1,0,0,0,0,0|3,0,0]=4 793 B10R0.71 O=CNCCCCCCCO 862a670259a59d4910de7b21ab417c1e [1,0,0,0,0,0|2,0,1]=4 794 B10R0.71 OCCCCCCCNCF 89e09816a55bae9b6b856648bab51c48 [1,0,0,0,0,0|2,0,1]=4 795 B10R0.71 OCCCCCCCNCO 80fccc105e20af1e1af9a49c91f16cd0 [1,0,0,0,0,0|2,0,0]=3 796 B10R0.71 OCCCCCCNCCBr 553fecb754e159e2bd5c0d5b2932c876 [1,0,0,0,0,0|2,0,1]=4 797 B10R0.71 OCCCCCCNCCF 1b169bdfb80ba61c6714c95c8b3d6768 [1,0,0,0,0,0|2,0,1]=4 798 B10R0.71 OCCCCCCNCCI be84ca9424a4ae6dece3ab323db6b0c1 [1,0,0,0,0,0|2,0,1]=4 799 B10R0.71 OCCCCCCNCCO 273922bfa3fe4a4663e43f7e307f9ceb [1,0,0,0,0,0|2,0,1]=4 800 B10R0.71 OCCCCCCNCCS 93e1cd94d9ee12dd07b8e4136f52d11f [1,0,0,0,0,0|2,0,1]=4 801 B10R0.71 OCCCCCNC/C=C/Cl e588cfbaf3c6481e3805662851005e73 [1,0,0,0,0,0|3,0,0]=4 802 B10R0.71 OCCCCCNC/C=C\Cl a8679279611f15ee768299f3b88bf842 [1,0,0,0,0,0|3,0,0]=4 803 B10R0.71 OCCCCCNCCCCl a66c64e785b6ff44ef42d7160e14c2a5 [1,0,0,0,0,0|2,0,1]=4 804 B10R0.71 OCCCCCNCCCF 50b3a9c0d03a8801f4e3adb3a3fcccb2 [1,0,0,0,0,0|2,0,1]=4 805 B10R0.71 OCCCCCNCCCO 072a5f4ea609bc4de4e53ba65e8ed45e [1,0,0,0,0,0|2,0,1]=4 806 B10R0.71 OCCCCCNCCCS ac447f37d9369f6412bbe09cfcfad84a [1,0,0,0,0,0|2,0,1]=4 807 B10R0.71 OCCCCNCCCCCl 7bd505d159c87c5f4f67443650980998 [1,0,0,0,0,0|2,0,1]=4 808 B10R0.71 OCCCCNCCCCF f5b849efef169df539bb8cf3c5e3f705 [1,0,0,0,0,0|2,0,1]=4 809 B10R0.71 OCCCCNCCCCO 54c7baa1496a0472a98a5aa5b31fc6d8 [1,0,0,0,0,0|2,0,1]=4 810 B10R0.71 OCCCCNCCCCS 3aa32fca5ab0eb9e1356e36b637eed09 [1,0,0,0,0,0|2,0,1]=4 811 B10R0.71 OCCCNCCCCCCl d945c080f090736cd2679661c70ad929 [1,0,0,0,0,0|2,0,1]=4 812 B10R0.71 OCCCNCCCCCF 0160daefb48a996acb910c63c049dc11 [1,0,0,0,0,0|2,0,1]=4 813 B10R0.71 OCCCOCCCNCO faa15dc3f2149e0df94a7022b21fce7c [1,0,0,0,0,0|3,0,0]=4 814 B10R0.71 OCCNCCCCCCCl 79b9a5a7709c9484ebb57666642b4ad2 [1,0,0,0,0,0|2,0,1]=4 815 B10R0.71 OCCNCCCCCCF 2d1a46b71da8cc78f8a4b65137161bb5 [1,0,0,0,0,0|2,0,1]=4 816 B10R0.71 OCCSCCCCNCO 1e9e7ef077d6aa1ba00654dd49fda346 [1,0,0,0,0,0|3,0,0]=4 817 B12R0.1 C/C=C/C(=O)NCCCCCCC 143aedf4a24336379d4af9ae7f8e7244 [0,1,0,0,0,0|2,0,1]=4 818 B12R0.1 C=C/C=C/CCNCC(C)CCC af8f52c37bbc1cae88822fc339a14f77 [0,1,0,0,0,0|2,0,1]=4 819 B12R0.1 CC/C=C/CCOCC(=O)CCC 41317b7200754cb3bcb4d021be103013 [0,1,0,0,0,0|2,0,1]=4 820 B12R0.1 CC/C=C/CCOCC(C)CCC e77527eedeb493fdf856af5502965e55 [0,1,0,0,0,0|2,0,0]=3 821 B12R0.1 CC/C=C/CCOC[C@@H](O)CCO 9948dd4478cc90b390862874d8bbd99e [0,1,0,0,0,0|3,0,0]=4 822 B12R0.1 CC/C=C/COCCC(C)CCC 1566a93ff2f3a24a1a851735f7cf20e9 [0,1,0,0,0,0|2,0,0]=3 823 B12R0.1 CC/C=C/COCCC(S)CCC bea497176eb523581a7a127bbdaa6c56 [0,1,0,0,0,0|2,0,0]=3 824 B12R0.1 CC/C=C\CCCOC(C)CCC 5ef7e519bbdffd066a6111c99b3e12a5 [0,1,0,0,0,0|2,0,0]=3 825 B12R0.1 CC/C=C\CCCOC(C)COC a2098f1b91c41d015b40807babc246a7 [0,1,0,0,0,0|3,0,0]=4 826 B12R0.1 CC/C=C\CCNCC(C)CCO 81dfa37c04726ab2c5a03582b5ac9d00 [0,1,0,0,0,0|3,0,0]=4 827 B12R0.1 CC/C=C\CCNCC(C)OCC 3219e23fab6c94ef4df9bd348a7391a6 [0,1,0,0,0,0|3,0,0]=4 828 B12R0.1 CC/C=C\CCNCC(O)CCC 08eb8a2018875c6fddc17f6ac92fb263 [0,1,0,0,0,0|2,0,0]=3 829 B12R0.1 CC/C=C\CCNCC(O)COC 21522f39db1a034573c6f4bddc4ea437 [0,1,0,0,0,0|3,0,0]=4 830 B12R0.1 CC/C=C\CCNC[C@H](O)COC 43df8619a2af02d5eda68caf6661e015 [0,1,0,0,0,0|3,0,0]=4 831 B12R0.1 CC/C=C\CCOCC(=O)CCC e77a99429b63562e524ba646f33af3e8 [0,1,0,0,0,0|2,0,1]=4 832 B12R0.1 CC/C=C\CCOCC(C)CCC 10f5057994ff4002418b173c9a8ffaba [0,1,0,0,0,0|2,0,0]=3 833 B12R0.1 CC/C=C\CCOCC(C)COC 1a3dc3f44a4b0438a18896bb02c14606 [0,1,0,0,0,0|3,0,0]=4 834 B12R0.1 CC/C=C\CCOCC(C)OCC 22abfcd68d8a7f4a1d66fc883c919d14 [0,1,0,0,0,0|3,0,0]=4 835 B12R0.1 CC/C=C\CCOC[C@@H](C)COC 8f49f7a7ab314e7de1187a8feda277b1 [0,1,0,0,0,0|3,0,0]=4 836 B12R0.1 CC/C=C\CCOC[C@@H](O)CCO b169ccbc48e91cfeed7bb53c821dc592 [0,1,0,0,0,0|3,0,0]=4 837 B12R0.1 CCCC(C)CCOCC=CC#N 46f08e79fbee1f636eb0dda8e7e8889a [0,1,0,0,0,0|2,0,1]=4 838 B12R0.1 CCCC(C)CNCCCCCO 5df12255b4a30d667ef971daf7b3d7ff [0,1,0,0,0,0|1,0,2]=4 839 B12R0.1 CCCC(C)CNCCOCCO b8a5bd598b3921004799d2e6aa9d22c3 [0,1,0,0,0,0|2,0,1]=4 840 B12R0.1 CCCC(C)CNCCSCCO 1f0753b8fd0f71c148dded761fa787a7 [0,1,0,0,0,0|2,0,1]=4 841 B12R0.1 CCCC(C)NCCCCCCO 75794d8dc5b71a4fdee70086adc69570 [0,1,0,0,0,0|1,0,2]=4 842 B12R0.1 CCCC(C)NCCCOCCO e0f3bdc9fa58da93e2377c84e104b4d0 [0,1,0,0,0,0|2,0,1]=4 843 B12R0.1 CCCC(O)CNCCCCCO 7c2990106789a1ca386292ed88508bdd [0,1,0,0,0,0|1,0,2]=4 844 B12R0.1 CCCC(O)CNCCOCCO 9103c6448f42b4b4e43ab99608ad4570 [0,1,0,0,0,0|2,0,1]=4 845 B12R0.1 CCCC(S)CCOCC=CC#N 11b4f703ac7e2be19a4528b2d2c2744d [0,1,0,0,0,0|2,0,1]=4 846 B12R0.1 CCCCCCCCC(=O)NC#N 500b4cd570b8cde18d217911332f4208 [0,1,0,0,0,0|2,0,1]=4 847 B12R0.1 CCCCCCCCC(C)NCC 9cf8c708bd24243b96bfa499e80164f5 [0,1,0,0,0,0|2,0,1]=4 848 B12R0.1 CCCCCCCCC(C)NCF d7ddfc865c0f7d2290353448024dd8e9 [0,1,0,0,0,0|2,0,1]=4 849 B12R0.1 CCCCCCCCC(C)NCO 00026d24cbe55d5171e3df94cac53a27 [0,1,0,0,0,0|1,0,1]=3 850 B12R0.1 CCCCCCCCC(C)OCC 77ed06188ab0ca6947fe4792f39ea47c [0,1,0,0,0,0|2,0,1]=4 851 B12R0.1 CCCCCCCCC(C)OCF 30709e933e023528433d3f7445aed5cc [0,1,0,0,0,0|2,0,1]=4 852 B12R0.1 CCCCCCCCN(C)CCC 37622b17b58790a9bf99efb7ab5f0656 [0,1,0,0,0,0|2,0,1]=4 853 B12R0.1 CCCCCCCCN(C)CCF 5602dbc15dd796403d1d9975ef5a9850 [0,1,0,0,0,0|2,0,1]=4 854 B12R0.1 CCCCCCCCN(C)CCO bcf4dd650ff57635e17d72990910760f [0,1,0,0,0,0|1,0,1]=3 855 B12R0.1 CCCCCCCCN(C)CCS 030b2efeeff76c383fd259380261a8fa [0,1,0,0,0,0|1,1,1]=4 856 B12R0.1 CCCCCCCC[C@@H](C)OCC 5c5fa613b6e0aaf4c2d180300ed92351 [0,1,0,0,0,0|2,0,1]=4 857 B12R0.1 CCCCCCCC[C@@H](C)OCF a5cf7311d6352b794d07a0f6593956a5 [0,1,0,0,0,0|2,0,1]=4 858 B12R0.1 CCCCCCCNC(=O)/C=C/Br c102ce5332667e909b593fed21afa6d9 [0,1,0,0,0,0|2,0,1]=4 859 B12R0.1 CCCCCCCNC(=O)/C=C/Cl dbac5a2697cfb507ea5729a9bc6f98f2 [0,1,0,0,0,0|2,0,1]=4 860 B12R0.1 CCCCCCCNC(=O)/C=C/I bc4654a30475fbacf957ee481607f5e0 [0,1,0,0,0,0|2,0,1]=4 861 B12R0.1 CCCCCCCNC(=O)/C=C\Br f9367246b21b840ad3179df4392b4084 [0,1,0,0,0,0|2,0,1]=4 862 B12R0.1 CCCCCCCNC(=O)/C=C\Cl 7c3cb0634e79afe88fbf61664dbd398b [0,1,0,0,0,0|2,0,1]=4 863 B12R0.1 CCCCCCCNC(=O)/C=C\I 62e50705b15e04ab413b39678d0740e9 [0,1,0,0,0,0|2,0,1]=4 864 B12R0.1 CCCCCCCNC(=O)C=CBr d4c471ed676db1a4297b5b278002509d [0,1,0,0,0,0|2,0,1]=4 865 B12R0.1 CCCCCCCNC(=O)C=CI d4d39e5881aa847130ee42973cb70dc7 [0,1,0,0,0,0|2,0,1]=4 866 B12R0.1 CCCCCCCNC(=O)CCC cc2f9bb62ae47c3d56fe2447919a6820 [0,1,0,0,0,0|2,0,1]=4 867 B12R0.1 CCCCCCCNC(=O)CCF fa0b05635b6bfb27486c6422091cb933 [0,1,0,0,0,0|2,0,1]=4 868 B12R0.1 CCCCCCCNC(=O)CCO 343037cb27d2431bfada229e8eb220ca [0,1,0,0,0,0|1,0,1]=3 869 B12R0.1 CCCCCCCNC(=O)CCS e56e6d944e0a2c16d5f7d697345a11f7 [0,1,0,0,0,0|1,1,1]=4 870 B12R0.1 CCCCCCCNC(C)CCO 96a53c51cfe7aa418d0a9243749671e0 [0,1,0,0,0,0|1,0,2]=4 871 B12R0.1 CCCCCCCN[C@@H](C)CCO 05747fd49204b2a0163970d5167e234f [0,1,0,0,0,0|1,0,2]=4 872 B12R0.1 CCCCCCCN[C@H](C)CCO 18e0873f9cac30812f01bb17f5cebe0e [0,1,0,0,0,0|1,0,2]=4 873 B12R0.1 CCCCCCCOC(=S)CCC 17e54af622772a12df7cd6ce21f2e4c6 [0,1,0,0,0,0|2,0,1]=4 874 B12R0.1 CCCCCCNCC(=O)CCC f47dda3d1f83759950f26c4f3e9b6cda [0,1,0,0,0,0|2,0,1]=4 875 B12R0.1 CCCCCCNCC(=O)NCC 9289ae5a2cd52bef677cbf2896aad3e1 [0,1,0,0,0,0|3,0,0]=4 876 B12R0.1 CCCCCCNCC(=O)NCO 98a14368a8997b39c86f3cfc4e54affb [0,1,0,0,0,0|2,0,0]=3 877 B12R0.1 CCCCCCNCC(=O)OCC 6be77b6d291e5bcb1b5ee543218d2829 [0,1,0,0,0,0|3,0,0]=4 878 B12R0.1 CCCCCCNCC(C)CCO b434f26f467b0dd344eaea56b7858c25 [0,1,0,0,0,0|1,0,2]=4 879 B12R0.1 CCCCCCNC[C@@H](O)CCO 6fb9e072c24ce18525e02ec4be5e8010 [0,1,0,0,0,0|1,0,2]=4 880 B12R0.1 CCCCCCOCC(=O)CCC a26767bbedda544e6a69ee985b0c3dee [0,1,0,0,0,0|2,0,1]=4 881 B12R0.1 CCCCCCOCC(=O)NCC b3fb8ad45dd10df9af353f6793a9e4c8 [0,1,0,0,0,0|3,0,0]=4 882 B12R0.1 CCCCCCOCC(=O)OCC bbe6630c73c21fc02210547f28d8da58 [0,1,0,0,0,0|3,0,0]=4 883 B12R0.1 CCCCCCOC[C@@H](O)CCO c8c5c985fd585406f9cd3262a190ad3c [0,1,0,0,0,0|1,0,2]=4 884 B12R0.1 CCCCCNCCC(=O)NCC 840cb981c464203bed8cd4d8bd5a75b9 [0,1,0,0,0,0|3,0,0]=4 885 B12R0.1 CCCCCNCCC(=O)OCC ccfebc809b095b1cf38f2ca180de6861 [0,1,0,0,0,0|3,0,0]=4 886 B12R0.1 CCCCCNCCN(C)CCO 400bac68fcb7fe8a613e79dc71294215 [0,1,0,0,0,0|2,0,1]=4 887 B12R0.1 CCCCCOCCC(=O)NCC 8d86d4085f1914474d4def8476302536 [0,1,0,0,0,0|3,0,0]=4 888 B12R0.1 CCCCCOCCC(=O)OCC 0e8d283a882f47cc8cf67da5cc42052f [0,1,0,0,0,0|3,0,0]=4 889 B12R0.1 CCCCNCCCC(=O)OCC 8b28206bbb47bf0a96f03d9b954c92cc [0,1,0,0,0,0|3,0,0]=4 890 B12R0.1 CCCCNCCCN(C)CCO e90588df472585d0202d5f426331d939 [0,1,0,0,0,0|2,0,1]=4 891 B12R0.1 CCCCOCCCC(=O)OCC 911ef1f6024850e2650d76a8173e5556 [0,1,0,0,0,0|3,0,0]=4 892 B12R0.1 CCCCOCCNC(=O)CCO 58d7c66de8e0ffedd6b2b5988f93e74c [0,1,0,0,0,0|2,0,1]=4 893 B12R0.1 CCCN(C)CCCCCCCO 58131988426b25a8d93653d902866be0 [0,1,0,0,0,0|1,0,2]=4 894 B12R0.1 CCCNCCCCC(=O)OCC af859276231b6944d66e75bb032a0322 [0,1,0,0,0,0|3,0,0]=4 895 B12R0.1 CCCNCCCCS(=O)CCO 92c5ebedbf8ede0b42ab35563d9927db [0,1,0,0,0,0|2,0,1]=4 896 B12R0.1 CCCOCCCCC(=O)OCC 51d78253f7b52ee9e7147bf25348aaba [0,1,0,0,0,0|3,0,0]=4 897 B12R0.1 CCCOCCCNC(=O)CCO 864cd4e100d0aab1df4fcd6ad39a71b2 [0,1,0,0,0,0|2,0,1]=4 898 B12R0.1 CCCOCCNCC(=O)NCO 900dca6300544ccedd239b571201ecfb [0,1,0,0,0,0|3,0,0]=4 899 B12R0.1 CCC[C@H](C)NCCCCCCO 95cf150ebeaa740ee7c0fa733b24a938 [0,1,0,0,0,0|1,0,2]=4 900 B12R0.1 CCNCCCCCC(=O)OCC 3082b4e9c515f8b8be859ad9fb770d19 [0,1,0,0,0,0|3,0,0]=4 901 B12R0.1 CCOCCCCCC(=O)OCC 776de740a04afd55ce4174c29edf7765 [0,1,0,0,0,0|3,0,0]=4 902 B12R0.1 CCOCCCNCC(=O)NCO 465c1d757eec38ea92ad80ab30b4ff61 [0,1,0,0,0,0|3,0,0]=4 903 B12R0.1 CCSCCCCNC(=O)CCO 8881d63e3c7a599a4d3d355f7d2c721e [0,1,0,0,0,0|2,0,1]=4 904 B12R0.1 CN(CCO)CCCCCCCO a63935538bd0fb226ca9065b38949e0a [0,1,0,0,0,0|2,0,1]=4 905 B12R0.1 COCCCCCCN(C)CCO 8e33072983f0d67b1664c237443d6b5b [0,1,0,0,0,0|2,0,1]=4 906 B12R0.1 COCCCCCNC(=O)CCO abc24b099a0d13686849252390c74130 [0,1,0,0,0,0|2,0,1]=4 907 B12R0.1 COCCCCNCC(=O)NCO a4420fbc17100d8c44524d70c5e0c8b6 [0,1,0,0,0,0|3,0,0]=4 908 B12R0.1 CSCCCCNCC(=O)NCO 56da4e4166ba53d306e9eeabc1604378 [0,1,0,0,0,0|3,0,0]=4 909 B12R0.1 O=C(CCO)NCCCCCCCl 717871a073ce683895d250ac529eb3ed [0,1,0,0,0,0|2,0,1]=4 910 B12R0.1 O=C(CCO)NCCCCCCO ce4e1d63f68c93347b59610baa8af262 [0,1,0,0,0,0|2,0,1]=4 911 B12R0.1 O=C(CNCCCCCCl)NCO f5ce844090d4b4d6e1de8fe9f526a746 [0,1,0,0,0,0|3,0,0]=4 912 B12R0.1 O=C(CNCCCCCO)NCO 5731c90bddc6f4702106145d4c5c542a [0,1,0,0,0,0|3,0,0]=4 913 B12R0.5 C#CCCCCCCCCNCO 441c4d67930e6b34603636c2a1a4f968 [0,1,0,0,0,0|1,0,2]=4 914 B12R0.5 C#CCCCCCCCNCCO 3d85eab759ae05c171acea25374f6e45 [0,1,0,0,0,0|1,0,2]=4 915 B12R0.5 C#CCCCCCNC/C=C/CC 3f943f98ffe79bcf7ac2cb827c16553b [0,1,0,0,0,0|1,0,2]=4 916 B12R0.5 C#CCCCCCOC/C=C/CC eb68f7716ace8b6df51ec62e593b40fd [0,1,0,0,0,0|1,0,2]=4 917 B12R0.5 C#CCCCCCOC/C=C\CC b9c6ee664054706d314527bdd10b861e [0,1,0,0,0,0|1,0,2]=4 918 B12R0.5 C#CCCCCNCC/C=C\CC 7179518e700d69d56345caad39e5ed07 [0,1,0,0,0,0|1,0,2]=4 919 B12R0.5 C#CCCCCOCC/C=C/CC c383c25d19ec73e4380b5d69abb69453 [0,1,0,0,0,0|1,0,2]=4 920 B12R0.5 C#CCCCCOCC/C=C\CC fcbdf598fb174ea504deeac24f7502de [0,1,0,0,0,0|1,0,2]=4 921 B12R0.5 C#CCCCOCCC/C=C\CC d8fb6a4305d3a52826dd9401c399cfb7 [0,1,0,0,0,0|1,0,2]=4 922 B12R0.5 C#CCCNCCCCCCCC 9856af9f07b5257367b38b660c40b41c [0,1,0,0,0,0|2,0,1]=4 923 B12R0.5 C#CCCOCCCC/C=C\CC d738fdfa9d7205052350688715a813fe [0,1,0,0,0,0|1,0,2]=4 924 B12R0.5 C#CCCOCCCCCCCC d904e2e63ec36d304f1a90f6e82eef2a [0,1,0,0,0,0|2,0,1]=4 925 B12R0.5 C#CCNCCCCC/C=C\CC 07de6b64c2d70cbebbadd72d2b87dd2a [0,1,0,0,0,0|1,0,2]=4 926 B12R0.5 C#CCNCCCCCCCCC 03bfa53682a046dd2c66ae474fa52a3d [0,1,0,0,0,0|2,0,1]=4 927 B12R0.5 C#CCOCCCCC/C=C\CC b118e1ba7ed5b09a5812e62bb1aa9de2 [0,1,0,0,0,0|1,0,2]=4 928 B12R0.5 C#CCOCCCCCC=CCC 0cab56a5c5577bd1105bc5383247d4f4 [0,1,0,0,0,0|1,0,2]=4 929 B12R0.5 C#CCOCCCCCCCCC cc7480582143a99926ec59e3c77a08d6 [0,1,0,0,0,0|2,0,1]=4 930 B12R0.5 C/C=C/C=C/COCCCCCC 1e6e4fe67a418f81c59fcbc618aab5a4 [0,1,0,0,0,0|1,0,2]=4 931 B12R0.5 C/C=C/CCCOCC/C=C\CC 7522599b4b16d657cbbe2088b07fbaac [0,1,0,0,0,0|1,0,2]=4 932 B12R0.5 C/C=C/CCCOCCCCCC 498e1c5b2ea3884e87b93ba83c83456e [0,1,0,0,0,0|1,0,2]=4 933 B12R0.5 C/C=C/CCOCCCCCCC 10991b3ad6fb5ed75a824d4f3ca0285c [0,1,0,0,0,0|1,0,2]=4 934 B12R0.5 C/C=C/CNCCCCCCCC 426d49f9912e6049ca6373c269231bd7 [0,1,0,0,0,0|1,0,2]=4 935 B12R0.5 C/C=C/COCCCC/C=C\CC 891551ec9c1e168915415c3453a057ae [0,1,0,0,0,0|1,0,2]=4 936 B12R0.5 C/C=C/COCCCCCCCC fabd00cb24b85d43f9b6fb0984457835 [0,1,0,0,0,0|1,0,2]=4 937 B12R0.5 C/C=C\CCCNCCCCCC 391b38d4cb2b6d21b2e37560ccf0ee4a [0,1,0,0,0,0|1,0,2]=4 938 B12R0.5 C/C=C\CCCOCC/C=C/CC f21e9b5cca4c249eee520d63ce7984f7 [0,1,0,0,0,0|1,0,2]=4 939 B12R0.5 C/C=C\CCCOCC/C=C\CC 4edba88869144acf5b9faa6cdd35d1af [0,1,0,0,0,0|1,0,2]=4 940 B12R0.5 C/C=C\CCCOCCCCCC 87314a0ded391d86ad960e2059c69107 [0,1,0,0,0,0|1,0,2]=4 941 B12R0.5 C/C=C\CNCCCCCCCC 9ec2f81826659871948820ce3c5cf7c9 [0,1,0,0,0,0|1,0,2]=4 942 B12R0.5 C/C=C\COCCCC/C=C\CC 538e659d7a46f6d7a410cbb578ee0f6c [0,1,0,0,0,0|1,0,2]=4 943 B12R0.5 C/C=C\COCCCCCCCC 723a4d88de9bc676517865990fa5f3c8 [0,1,0,0,0,0|1,0,2]=4 944 B12R0.5 C=C/C=C/CCNCCCCCC 9075283cf01438c3d0e0e6404b6e8bf0 [0,1,0,0,0,0|1,0,1]=3 945 B12R0.5 C=C/C=C/CCNCCCCCF 2912a576ef990a98871c4a7c3a954aa9 [0,1,0,0,0,0|2,0,1]=4 946 B12R0.5 C=C/C=C/CCNCCCCCO 10c457bb188c47f16f367ccec2871d07 [0,1,0,0,0,0|2,0,1]=4 947 B12R0.5 C=C/C=C/CCNCCCCOC d14df47603e4b86f474079b3ad8012b5 [0,1,0,0,0,0|2,0,1]=4 948 B12R0.5 C=C/C=C/CCNCCCOCC f7e64097448a5f72c61c9ee99d21caa6 [0,1,0,0,0,0|2,0,1]=4 949 B12R0.5 C=C/C=C/CCNCCCSCC 24ec245a80fccaf60ade32982f9cdf2b [0,1,0,0,0,0|2,0,1]=4 950 B12R0.5 C=C/C=C/CCNCCOCCC 295becf18f8a2a38600d1aa56a62d122 [0,1,0,0,0,0|2,0,1]=4 951 B12R0.5 C=C/C=C/CCNCOCCCC 57a7c992bc7c53ce9c72dd279b181fef [0,1,0,0,0,0|2,0,1]=4 952 B12R0.5 C=C=CCCOCCCCCCC ab6b9138c624ddb23559c4c14d5f8fd9 [0,1,0,0,0,0|1,0,2]=4 953 B12R0.5 C=CCCCCCCCNCCO c13155a6dacba085105dc2fefc7a1a02 [0,1,0,0,0,0|1,0,2]=4 954 B12R0.5 C=CCCCCCNC/C=C/CC 5119b567ca74aad0c6a3be361304973e [0,1,0,0,0,0|1,0,2]=4 955 B12R0.5 C=CCCCCCOC/C=C/CC 36eb2d6486c4e53093e093248346f1f2 [0,1,0,0,0,0|1,0,2]=4 956 B12R0.5 C=CCCCCCOC/C=C\CC 2340ca7a6c1109567cc61419fd3ca641 [0,1,0,0,0,0|1,0,2]=4 957 B12R0.5 C=CCCCCNCC/C=C\CC 7d21201aa3b0ad096f34c257948dd7e3 [0,1,0,0,0,0|1,0,2]=4 958 B12R0.5 C=CCCCCOCC/C=C/CC 551d42c532d05f6fd57a1aba63d7d4a0 [0,1,0,0,0,0|1,0,2]=4 959 B12R0.5 C=CCCCCOCC/C=C\CC 654e1c6f4cc22e97f3f2131134874fc7 [0,1,0,0,0,0|1,0,2]=4 960 B12R0.5 C=CCCCOCCC/C=C\CC a446c31a10d0eb260a88e720de6d441d [0,1,0,0,0,0|1,0,2]=4 961 B12R0.5 C=CCCNCCCCCCCC 68b6a0b3d3053682d58a47cd116e2f94 [0,1,0,0,0,0|2,0,1]=4 962 B12R0.5 C=CCCOCCCC/C=C\CC d275720b4d3ec5acb1803aa1926116e0 [0,1,0,0,0,0|1,0,2]=4 963 B12R0.5 C=CCCOCCCCCCCC c5e8962e82b583fe28413e59e2a47dc8 [0,1,0,0,0,0|2,0,1]=4 964 B12R0.5 C=CCNCCCCCCCCC bd7bda25ff02d266cc6c0e96db5ddd6d [0,1,0,0,0,0|2,0,1]=4 965 B12R0.5 C=CCOCCCCC/C=C\CC 1f7d96ba422d6cd6d8576417febeb7ee [0,1,0,0,0,0|1,0,2]=4 966 B12R0.5 C=CCOCCCCCC=CCC 933f4e806b062863f8ebcc33248674ff [0,1,0,0,0,0|1,0,2]=4 967 B12R0.5 C=CCOCCCCCCCCC 9639a5917445d95bfd35c88d4e5b5bae [0,1,0,0,0,0|2,0,1]=4 968 B12R0.5 CC#CCCCOCC/C=C/CC 073331a9515ffb9e4296c0c7c1e6b7cd [0,1,0,0,0,0|1,0,2]=4 969 B12R0.5 CC#CCCCOCC/C=C\CC c79d7c7bb78776299b7a1e8e4c44a5d8 [0,1,0,0,0,0|1,0,2]=4 970 B12R0.5 CC#CCOCCCC/C=C\CC b968142e4d3afe55804b01a630511784 [0,1,0,0,0,0|1,0,2]=4 971 B12R0.5 CC/C=C/CC/C=C/COCCC 4a5d983a603d86734c380c9c200d4d19 [0,1,0,0,0,0|1,0,2]=4 972 B12R0.5 CC/C=C/CCOC/C=C/CCC d67c7f3b87407fd36e977a318d389688 [0,1,0,0,0,0|1,0,2]=4 973 B12R0.5 CC/C=C/CCOC/C=C\CCC a61c1e38d81896dacbcd317dba7630a9 [0,1,0,0,0,0|1,0,2]=4 974 B12R0.5 CC/C=C/CCOCCCCC#N 705eafe11f5645564edf1fe0642c3c30 [0,1,0,0,0,0|2,0,1]=4 975 B12R0.5 CC/C=C/CCOCCCCC=O 6d55b6e6a4837cfb96478f243218bd95 [0,1,0,0,0,0|2,0,1]=4 976 B12R0.5 CC/C=C/CCOCCCCCC 767871e5a0d73feb9eb5a7defcfb49c5 [0,1,0,0,0,0|1,0,0]=2 977 B12R0.5 CC/C=C/CCOCCCCCF 2b55f02c10e3ccdd6df31b1e0ba6a449 [0,1,0,0,0,0|2,0,0]=3 978 B12R0.5 CC/C=C/CCOCCCCOC e2b39f528317979cb9d1de9d5265ad73 [0,1,0,0,0,0|2,0,0]=3 979 B12R0.5 CC/C=C/CCOCCCOCC f88549108281ede7d294c020241ed805 [0,1,0,0,0,0|2,0,0]=3 980 B12R0.5 CC/C=C/CCOCCCSCC 9f663c630638119270f23bb956669f0a [0,1,0,0,0,0|2,0,0]=3 981 B12R0.5 CC/C=C/CCOCCOCCC a81f621c6a03f8cc18201edd475fc6b6 [0,1,0,0,0,0|2,0,0]=3 982 B12R0.5 CC/C=C/CCOCCOCOC 50110fbba6b3b1fd4ca474b0939bcbd6 [0,1,0,0,0,0|3,0,0]=4 983 B12R0.5 CC/C=C/CCOCOCCCC 6b5b004f900b0398d730b899d2d1e560 [0,1,0,0,0,0|2,0,0]=3 984 B12R0.5 CC/C=C/CCOCOCCOC f0129d7da362787e2bb4414a41d74f58 [0,1,0,0,0,0|3,0,0]=4 985 B12R0.5 CC/C=C/CNCCCCCC#N 5f91c1da1192a389b78de6d70a602fd2 [0,1,0,0,0,0|2,0,1]=4 986 B12R0.5 CC/C=C/CNCCCCCCC be4c202248a8fd68380accb39cdc09e3 [0,1,0,0,0,0|1,0,0]=2 987 B12R0.5 CC/C=C/CNCCCCCCCl b064ffe68c1c499da85124572bc11232 [0,1,0,0,0,0|2,0,0]=3 988 B12R0.5 CC/C=C/CNCCCCCCO 50b32522db2d487f8fe27e61753d0273 [0,1,0,0,0,0|2,0,0]=3 989 B12R0.5 CC/C=C/CNCCCCCOC 23d5616d0a8523cb76a453587283bd5c [0,1,0,0,0,0|2,0,0]=3 990 B12R0.5 CC/C=C/CNCCCCSCC 444ca7eddcf540db625a6f910ff34a14 [0,1,0,0,0,0|2,0,0]=3 991 B12R0.5 CC/C=C/CNCCCOCCC df0ead51a6ad3609c01a5fc038b94569 [0,1,0,0,0,0|2,0,0]=3 992 B12R0.5 CC/C=C/CNCCCOCCO 6047c4ac377b26e4d6b233675ab548ad [0,1,0,0,0,0|3,0,0]=4 993 B12R0.5 CC/C=C/CNCCOCCCC 459e30c647913e87db7342aa54566942 [0,1,0,0,0,0|2,0,0]=3 994 B12R0.5 CC/C=C/CNCCOCCCO 6cab7b08fa75d0deaad9dfc01fa6b605 [0,1,0,0,0,0|3,0,0]=4 995 B12R0.5 CC/C=C/CNCCOCCOC 3a09987fd803c6b6f6c7e1b1e2c04fca [0,1,0,0,0,0|3,0,0]=4 996 B12R0.5 CC/C=C/COC/C=C/CCCC a7acfb6006ebfc3023bfbb3c89eb8a68 [0,1,0,0,0,0|1,0,2]=4 997 B12R0.5 CC/C=C/COC/C=C\CCCC c13bca40ea80af75a486721eb6a6d465 [0,1,0,0,0,0|1,0,2]=4 998 B12R0.5 CC/C=C/COCC#CCCCC 5dc7e17f46758bb7ad22d2b6f92bd41d [0,1,0,0,0,0|1,0,2]=4 999 B12R0.5 CC/C=C/COCC/C=C\CCC 4961bb78ba2ec0f2dfca6156530a80a7 [0,1,0,0,0,0|1,0,2]=4 1000 B12R0.5 CC/C=C/COCCC#CCCC b12be223cc2e0b2816fa72bcbb989b46 [0,1,0,0,0,0|1,0,2]=4 1001 B12R0.5 CC/C=C/COCCCCCC#N 61224437e5e22dae9de28b53374499a3 [0,1,0,0,0,0|2,0,1]=4 1002 B12R0.5 CC/C=C/COCCCCCC=O 7fe073b8e803473df7ad7296b7dffdf5 [0,1,0,0,0,0|2,0,1]=4 1003 B12R0.5 CC/C=C/COCCCCCCC fac406ad60d77dca9871164b96925a1f [0,1,0,0,0,0|1,0,0]=2 1004 B12R0.5 CC/C=C/COCCCCCCF 7ce4ba674dec9c859e8223ebf414b908 [0,1,0,0,0,0|2,0,0]=3 1005 B12R0.5 CC/C=C/COCCCCCCS fed185229296b43027348f8379699cb5 [0,1,0,0,0,0|2,0,0]=3 1006 B12R0.5 CC/C=C/COCCCCCOC 9d8f0c980a1de9cdd8d3710b6ffd83c6 [0,1,0,0,0,0|2,0,0]=3 1007 B12R0.5 CC/C=C/COCCCOCCC 85da2ac6041f464410230236c9c59343 [0,1,0,0,0,0|2,0,0]=3 1008 B12R0.5 CC/C=C/COCCOCCCC a30c8683d731f6932c452cd44e389592 [0,1,0,0,0,0|2,0,0]=3 1009 B12R0.5 CC/C=C/COCCOCCOC 615a9a63f3c8af65c26bd0173689b520 [0,1,0,0,0,0|3,0,0]=4 1010 B12R0.5 CC/C=C/COCCSCCCC aec64f917c3429cbf1a193f1d5cc13aa [0,1,0,0,0,0|2,0,0]=3 1011 B12R0.5 CC/C=C\C/C=C\CCCOCC e180421407901b37c33dd41b99ed7129 [0,1,0,0,0,0|1,0,2]=4 1012 B12R0.5 CC/C=C\CC/C=C/COCCC a9c0fdb8965fb028f1b33f346fa6f630 [0,1,0,0,0,0|1,0,2]=4 1013 B12R0.5 CC/C=C\CCCCCNCC#N b06a5ee2b785d145a9a1c8b687148fb9 [0,1,0,0,0,0|2,0,1]=4 1014 B12R0.5 CC/C=C\CCCCCNCCBr 402617d91cd42e311558cfae0fa15a42 [0,1,0,0,0,0|2,0,0]=3 1015 B12R0.5 CC/C=C\CCCCCNCCC 69886208ccc481e644ef483e2c35e2e7 [0,1,0,0,0,0|1,0,0]=2 1016 B12R0.5 CC/C=C\CCCCCNCCF 49bbc114db8324da1f2cd8785fee6843 [0,1,0,0,0,0|2,0,0]=3 1017 B12R0.5 CC/C=C\CCCCCNCCI f4b28c3885807c14f1ac695196dd7e09 [0,1,0,0,0,0|2,0,0]=3 1018 B12R0.5 CC/C=C\CCCCCNCCO 4e3a3d1aed46810cbdfb0e736765655b [0,1,0,0,0,0|2,0,0]=3 1019 B12R0.5 CC/C=C\CCCCCNCCS 67bf5ddbb7002023c9a705d20845dbd3 [0,1,0,0,0,0|2,0,0]=3 1020 B12R0.5 CC/C=C\CCCCCOCC#N ae126fea6382c9aeeef766ef26427017 [0,1,0,0,0,0|2,0,1]=4 1021 B12R0.5 CC/C=C\CCCCCOCC=O f57dc4f05dd5cbc8077a8448efa3680d [0,1,0,0,0,0|2,0,1]=4 1022 B12R0.5 CC/C=C\CCCCCOCCC c88ae5976e237754dce5795d50b5c6fe [0,1,0,0,0,0|1,0,0]=2 1023 B12R0.5 CC/C=C\CCCCCOCCF 067f9c62df14def63232f7187ee5b0c6 [0,1,0,0,0,0|2,0,0]=3 1024 B12R0.5 CC/C=C\CCCCCOCCS 377469583db21bd4d3a3386fcae58d02 [0,1,0,0,0,0|2,0,0]=3 1025 B12R0.5 CC/C=C\CCCCCOCOC bff16d3142ae4a79dedeab3cc89e4313 [0,1,0,0,0,0|2,0,0]=3 1026 B12R0.5 CC/C=C\CCCCCOCSC ab40f0b80d750f4f0d4471f4cc0a86c1 [0,1,0,0,0,0|2,0,0]=3 1027 B12R0.5 CC/C=C\CCCCOCCC#N fa30d1052d47c5e5334d61401149adfc [0,1,0,0,0,0|2,0,1]=4 1028 B12R0.5 CC/C=C\CCCCOCCC=O 20a50154e295dea1cb35b59b3cf31e50 [0,1,0,0,0,0|2,0,1]=4 1029 B12R0.5 CC/C=C\CCCCOCCCC ae170e71a50bb653be2dba2606dad3f4 [0,1,0,0,0,0|1,0,0]=2 1030 B12R0.5 CC/C=C\CCCCOCCCF 4d330ab861b6af2483c52bf0bcaa5069 [0,1,0,0,0,0|2,0,0]=3 1031 B12R0.5 CC/C=C\CCCCOCCCS c2a1bcf54749b9359c31dd3cc6c81cb3 [0,1,0,0,0,0|2,0,0]=3 1032 B12R0.5 CC/C=C\CCCCOCCOC 176bab47df541131235f1983146c69c1 [0,1,0,0,0,0|2,0,0]=3 1033 B12R0.5 CC/C=C\CCCCOCCSC 3688e500590a0e5a2f793fd0964ddfc3 [0,1,0,0,0,0|2,0,0]=3 1034 B12R0.5 CC/C=C\CCCCOCOCC bf4cdef865c39018cbe95b62280b8462 [0,1,0,0,0,0|2,0,0]=3 1035 B12R0.5 CC/C=C\CCCOC/C=C/CC b529e2dd56f690f596478705615e3e4f [0,1,0,0,0,0|1,0,2]=4 1036 B12R0.5 CC/C=C\CCCOCCCC#N c4ac4d201af9a4ed29eb171445bc6fce [0,1,0,0,0,0|2,0,1]=4 1037 B12R0.5 CC/C=C\CCCOCCCC=O 84ea29ee5aec2d3656d76a89bcc66119 [0,1,0,0,0,0|2,0,1]=4 1038 B12R0.5 CC/C=C\CCCOCCCCC 01c9d8c10a56d308f7978a9ae4df2b5d [0,1,0,0,0,0|1,0,0]=2 1039 B12R0.5 CC/C=C\CCCOCCCCF 28106d9dd37e300748526607af9481f3 [0,1,0,0,0,0|2,0,0]=3 1040 B12R0.5 CC/C=C\CCCOCCCOC 3dfdd39afd911221cb1f661beb344af6 [0,1,0,0,0,0|2,0,0]=3 1041 B12R0.5 CC/C=C\CCCOCCCSC f3cbb40004a47fa1dba403280596ca24 [0,1,0,0,0,0|2,0,0]=3 1042 B12R0.5 CC/C=C\CCCOCCOCC 7e46d22f40d432ce293fce7dd3803f86 [0,1,0,0,0,0|2,0,0]=3 1043 B12R0.5 CC/C=C\CCCOCCSCC 1409eb88e96ebc6f36f4f586f2585649 [0,1,0,0,0,0|2,0,0]=3 1044 B12R0.5 CC/C=C\CCNCCCCC#N a80a3a351f21d865df3f49c5c07265e2 [0,1,0,0,0,0|2,0,1]=4 1045 B12R0.5 CC/C=C\CCNCCCCCC 49ae72512f311144c2d980bdb59c6aba [0,1,0,0,0,0|1,0,0]=2 1046 B12R0.5 CC/C=C\CCNCCCCCCl 10a0887d17f4423b14b1246554deb482 [0,1,0,0,0,0|2,0,0]=3 1047 B12R0.5 CC/C=C\CCNCCCCCO 5731462f1999a95940d06a77bb9768d7 [0,1,0,0,0,0|2,0,0]=3 1048 B12R0.5 CC/C=C\CCNCCCCOC 77e7588b297370fdf6763b0e1f0b0a94 [0,1,0,0,0,0|2,0,0]=3 1049 B12R0.5 CC/C=C\CCNCCCCSC 1471075d3dd66e6e7d887af54b06ecd5 [0,1,0,0,0,0|2,0,0]=3 1050 B12R0.5 CC/C=C\CCNCCCOCC d4b3fd087d0b1976d28b3ba47caf56aa [0,1,0,0,0,0|2,0,0]=3 1051 B12R0.5 CC/C=C\CCNCCOCCC 6a862fc6d3da86fb243f88c383698c3e [0,1,0,0,0,0|2,0,0]=3 1052 B12R0.5 CC/C=C\CCNCCOCCO a0742c5b035a58b28525e0977542ace7 [0,1,0,0,0,0|3,0,0]=4 1053 B12R0.5 CC/C=C\CCNCCOCCS 36433f11b7186e0a9cd0342717637278 [0,1,0,0,0,0|3,0,0]=4 1054 B12R0.5 CC/C=C\CCNCCSCCO ed9efb4ab8216e21f9a850b201d91e42 [0,1,0,0,0,0|3,0,0]=4 1055 B12R0.5 CC/C=C\CCOC/C=C/CCC f7a4639dad325c3eda76c3941e3ae7b8 [0,1,0,0,0,0|1,0,2]=4 1056 B12R0.5 CC/C=C\CCOC/C=C\CCC fa68dc1e81964ea2119607ae5e8fb79b [0,1,0,0,0,0|1,0,2]=4 1057 B12R0.5 CC/C=C\CCOCC#CCCC edd6ccba394c986cf815bb5b907b47b4 [0,1,0,0,0,0|1,0,2]=4 1058 B12R0.5 CC/C=C\CCOCC/C=C/CC 54389520b8c97ae61cc1fdffd37ad3ab [0,1,0,0,0,0|1,0,2]=4 1059 B12R0.5 CC/C=C\CCOCC/C=C\CC f39996f7261eda408b1814cb9b7c4754 [0,1,0,0,0,0|1,0,2]=4 1060 B12R0.5 CC/C=C\CCOCCCCC#N 3f837ec2be81ca026659778c5ae7f5f6 [0,1,0,0,0,0|2,0,1]=4 1061 B12R0.5 CC/C=C\CCOCCCCC=O 0f8dc160371f8f38e3ede5953a911f59 [0,1,0,0,0,0|2,0,1]=4 1062 B12R0.5 CC/C=C\CCOCCCCCC 117d4e26b4f19482ce885b8297aa45c2 [0,1,0,0,0,0|1,0,0]=2 1063 B12R0.5 CC/C=C\CCOCCCCCF 6fb45212300edcfa96669f4cc7373ec4 [0,1,0,0,0,0|2,0,0]=3 1064 B12R0.5 CC/C=C\CCOCCCCOC c0830f32361612f79a3ed408b3777eb6 [0,1,0,0,0,0|2,0,0]=3 1065 B12R0.5 CC/C=C\CCOCCCCSC a7f64699d7d5aa3195d03046c1e80d72 [0,1,0,0,0,0|2,0,0]=3 1066 B12R0.5 CC/C=C\CCOCCCOCC 4cb33ce7cc497b4d194188c410a4af4c [0,1,0,0,0,0|2,0,0]=3 1067 B12R0.5 CC/C=C\CCOCCCSCC d4fb26b0a1456cfe595b746c9209588c [0,1,0,0,0,0|2,0,0]=3 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77fa88fde0cce04fe5442e2aa45989e5 [0,1,0,0,0,0|1,0,0]=2 1080 B12R0.5 CC/C=C\COCCCCCCF 17b221ff13a4e30ab288c45536a65f71 [0,1,0,0,0,0|2,0,0]=3 1081 B12R0.5 CC/C=C\COCCCCCOC 38e9bf0627a08f1dd4c499539ac92400 [0,1,0,0,0,0|2,0,0]=3 1082 B12R0.5 CC/C=C\COCCCOCCC 0f910c358d5675725b3665254e730de1 [0,1,0,0,0,0|2,0,0]=3 1083 B12R0.5 CC/C=C\COCCOCCCC d9e6d565fa0e364a43a769ddb105b116 [0,1,0,0,0,0|2,0,0]=3 1084 B12R0.5 CC/C=C\COCCOCCOC 6547d8be39421a1d07210cda1b00709b [0,1,0,0,0,0|3,0,0]=4 1085 B12R0.5 CC=C=CCCOCCCCCC 71c7f17a03fe38986e22e4e69f9a3d53 [0,1,0,0,0,0|1,0,2]=4 1086 B12R0.5 CC=CC=CCOCCCCCC 461eef77b84d3c46ab283a399ed37042 [0,1,0,0,0,0|1,0,2]=4 1087 B12R0.5 CC=CCCCOCC/C=C\CC 8a9ded81b3b0bb8697c200a61a20c1f5 [0,1,0,0,0,0|1,0,2]=4 1088 B12R0.5 CC=CCCCOCCCCCC d68fb7387a0c3991f6a2343f2b5dbc29 [0,1,0,0,0,0|1,0,2]=4 1089 B12R0.5 CC=CCNCCCCCCCC 015266ac227befe5f058816616cf0809 [0,1,0,0,0,0|1,0,2]=4 1090 B12R0.5 CC=CCOCCCCCCCC 2aa23d7d5fc0a5236c3788ee62f0fa8b [0,1,0,0,0,0|1,0,2]=4 1091 B12R0.5 CCC#CCCOCC/C=C\CC a2ac2f513364197068cfd2df4b0060d4 [0,1,0,0,0,0|1,0,2]=4 1092 B12R0.5 CCC#CCCOCCCCCC fe7a01855cbf70fb1648ad6b083a772d [0,1,0,0,0,0|1,0,2]=4 1093 B12R0.5 CCC#CCNCCCCCCC 8bf4db45a882a23d873b0d95f08cf05c [0,1,0,0,0,0|1,0,2]=4 1094 B12R0.5 CCC#CCOCCC/C=C\CC 7873f14ddc5170d94f8cf0c3275e72fa [0,1,0,0,0,0|1,0,2]=4 1095 B12R0.5 CCC#CCOCCCCCCC 8837e9ebed62468194dad3de7efe8e23 [0,1,0,0,0,0|1,0,2]=4 1096 B12R0.5 CCC/C=C/CCCOCCCC d05acb292bb84d287eb30879ca488d91 [0,1,0,0,0,0|2,0,0]=3 1097 B12R0.5 CCC/C=C/CCCOCCCF 6cfa86613f792fa95348f6f19a55d5b9 [0,1,0,0,0,0|3,0,0]=4 1098 B12R0.5 CCC/C=C/CCCOCCCS 6541c897f2c6f261becc48ac2011a93c [0,1,0,0,0,0|3,0,0]=4 1099 B12R0.5 CCC/C=C/CCCOCCOC f37ab6750fac2aa735876472190ba3b6 [0,1,0,0,0,0|3,0,0]=4 1100 B12R0.5 CCC/C=C/CCCOCCSC 1d33e2a3ef4517df25ae83c63b0f0f96 [0,1,0,0,0,0|3,0,0]=4 1101 B12R0.5 CCC/C=C/CCCOCOCC c5dd559967e05f68f59ae2d9af95a8a7 [0,1,0,0,0,0|3,0,0]=4 1102 B12R0.5 CCC/C=C/CNCCCCCC b6c96c21ede246b1f0c45cf7cd26d0c9 [0,1,0,0,0,0|2,0,0]=3 1103 B12R0.5 CCC/C=C/CNCCCCCCl e3dab996f6c76334915a0a8964e9f1f8 [0,1,0,0,0,0|3,0,0]=4 1104 B12R0.5 CCC/C=C/CNCCCCCO 0511321e85213027ae506d7ee8b63c1f [0,1,0,0,0,0|3,0,0]=4 1105 B12R0.5 CCC/C=C/CNCCCCOC 36788a1d178049fe5aa3285b7a42b989 [0,1,0,0,0,0|3,0,0]=4 1106 B12R0.5 CCC/C=C/CNCCCCSC ef0026a71ecdb7a63893bf0b55affc38 [0,1,0,0,0,0|3,0,0]=4 1107 B12R0.5 CCC/C=C/CNCCCOCC 6704db5c459be2f76de7849a545d54d2 [0,1,0,0,0,0|3,0,0]=4 1108 B12R0.5 CCC/C=C/CNCCOCCC 7533d47e4ce5f5dd6d5e71078d06d99b [0,1,0,0,0,0|3,0,0]=4 1109 B12R0.5 CCC/C=C/COCCCCCC d65714be31a95b499f2e00ccb97fe4f0 [0,1,0,0,0,0|2,0,0]=3 1110 B12R0.5 CCC/C=C/COCCCCCF 304946bedf09648165b5a3747896f9d8 [0,1,0,0,0,0|3,0,0]=4 1111 B12R0.5 CCC/C=C/COCCCCOC c9dbc8a722daa18a2aea7bdd93a29767 [0,1,0,0,0,0|3,0,0]=4 1112 B12R0.5 CCC/C=C/COCCCCSC 1c940e7f777d6c4a7227f97bb212d09d [0,1,0,0,0,0|3,0,0]=4 1113 B12R0.5 CCC/C=C/COCCCOCC a4002d798c3e4022e5d5e96cf0cd2bc6 [0,1,0,0,0,0|3,0,0]=4 1114 B12R0.5 CCC/C=C/COCCCSCC 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B12R0.5 CCC/C=C\CCOCCCOC d1f8c6975b41bf781665a0bdd6c385bf [0,1,0,0,0,0|3,0,0]=4 1127 B12R0.5 CCC/C=C\CCOCCCSC 48ac0a216e14e604344a96a2a1e27945 [0,1,0,0,0,0|3,0,0]=4 1128 B12R0.5 CCC/C=C\CCOCCOCC 1ee6db777536b74abb1f01c1fbf79aab [0,1,0,0,0,0|3,0,0]=4 1129 B12R0.5 CCC/C=C\CCOCCSCC a0ace1aa7f1195a554d15f0cc252808f [0,1,0,0,0,0|3,0,0]=4 1130 B12R0.5 CCC/C=C\CNCCCCCC ec2f832d65696be1ea107f995d9aae42 [0,1,0,0,0,0|2,0,0]=3 1131 B12R0.5 CCC/C=C\CNCCCCCCl fbd9ec436b8089db7379b993d55aeca4 [0,1,0,0,0,0|3,0,0]=4 1132 B12R0.5 CCC/C=C\CNCCCCCO 9fffd53497e0ce255abd8262b49320e7 [0,1,0,0,0,0|3,0,0]=4 1133 B12R0.5 CCC/C=C\CNCCCCOC 648a4f266bc9c6d64dfac2d7185fd0a9 [0,1,0,0,0,0|3,0,0]=4 1134 B12R0.5 CCC/C=C\CNCCCCSC 0c462ac70b6d0bf5cdcca0a72a84f187 [0,1,0,0,0,0|3,0,0]=4 1135 B12R0.5 CCC/C=C\CNCCCOCC f9748369f1464fee12da46ba08033155 [0,1,0,0,0,0|3,0,0]=4 1136 B12R0.5 CCC/C=C\CNCCOCCC b9e080d51929dcbbecf6042ba176f12f [0,1,0,0,0,0|3,0,0]=4 1137 B12R0.5 CCC/C=C\COCCCCCC 1d5fd56b8c150c394afce0d32805d101 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2187d60311cc6aa2345a566a6ec9d1ad [0,1,0,0,0,0|0,0,2]=3 1186 B12R0.5 CCCCCCCCNCCCS 4cb2c5e7bf07e4f986bde323b7be68c9 [0,1,0,0,0,0|0,1,2]=4 1187 B12R0.5 CCCCCCCCNCCOC 8b44b16e8c9cf265ed7bf09fd8b20f6a [0,1,0,0,0,0|1,0,1]=3 1188 B12R0.5 CCCCCCCCNCCON ce842f428ebb7324eeaa4b7a7447f821 [0,1,0,0,0,0|1,0,1]=3 1189 B12R0.5 CCCCCCCCNCCSC ade65a1d31726c646b156dee3b97cabb [0,1,0,0,0,0|1,1,1]=4 1190 B12R0.5 CCCCCCCCNCOCC e408e59c5cb2d0cc1b0f539ab5ba5c56 [0,1,0,0,0,0|2,0,1]=4 1191 B12R0.5 CCCCCCCCOC/C=C/Cl abffaafd326c982c832888956fca00ea [0,1,0,0,0,0|1,0,2]=4 1192 B12R0.5 CCCCCCCCOC/C=C\Cl cdcf5d253fadb13770fe93a04a187e89 [0,1,0,0,0,0|1,0,2]=4 1193 B12R0.5 CCCCCCCCOCC=CCl f37f1317713cee86958cbbdff2c68da0 [0,1,0,0,0,0|1,0,2]=4 1194 B12R0.5 CCCCCCCCOCCC#N b9e917d20627945a703714d9a8cb5c2c [0,1,0,0,0,0|2,0,1]=4 1195 B12R0.5 CCCCCCCCOCCC=O d5590d4e338368a5ce166fd30f905848 [0,1,0,0,0,0|1,0,2]=4 1196 B12R0.5 CCCCCCCCOCCCC 24d8d63233de1427a8a72f2791a578b9 [0,1,0,0,0,0|1,0,2]=4 1197 B12R0.5 CCCCCCCCOCCCF bac6e71c7ea2b9d861664b36b891ce51 [0,1,0,0,0,0|1,0,2]=4 1198 B12R0.5 CCCCCCCCOCCCS fa1aa683e2e24f867054b057441b25d8 [0,1,0,0,0,0|0,1,2]=4 1199 B12R0.5 CCCCCCCCOCCOC ce4fb41f591ff420399ddd8966552574 [0,1,0,0,0,0|1,0,1]=3 1200 B12R0.5 CCCCCCCCOCCSC bfdb6ad08eae03e74439ad12516cd025 [0,1,0,0,0,0|1,1,1]=4 1201 B12R0.5 CCCCCCCCOCOCC 7c56cdbb637bc1b95dd21e9f11ba4ddb [0,1,0,0,0,0|2,0,1]=4 1202 B12R0.5 CCCCCCCNCC#CCO 047745a1170be8096f3837b8e4587d85 [0,1,0,0,0,0|0,0,2]=3 1203 B12R0.5 CCCCCCCNCC=CC#N 908c1d795f81225978afd764fee7caba [0,1,0,0,0,0|1,0,1]=3 1204 B12R0.5 CCCCCCCNCCCCC 72b549a405112f89aa8cd8b0dad16028 [0,1,0,0,0,0|1,0,2]=4 1205 B12R0.5 CCCCCCCNCCCCCl d7665c84dc7c2f5ec86f55710cc5f3f6 [0,1,0,0,0,0|1,0,2]=4 1206 B12R0.5 CCCCCCCNCCCCF 9ee5241d3b07835d098f7db4d7ceb58c [0,1,0,0,0,0|1,0,2]=4 1207 B12R0.5 CCCCCCCNCCCCO 4d5b80e4d0458a47b38eee6fb8b08426 [0,1,0,0,0,0|0,0,2]=3 1208 B12R0.5 CCCCCCCNCCCCS e840cc3a6165e6e3ed06d443607fabab [0,1,0,0,0,0|0,1,2]=4 1209 B12R0.5 CCCCCCCNCCCOC e050d7b41945291ef4b084d449efbe5f [0,1,0,0,0,0|1,0,2]=4 1210 B12R0.5 CCCCCCCNCCOCC 2440c4fde889d2b7d7d6369c99d44a5d [0,1,0,0,0,0|2,0,1]=4 1211 B12R0.5 CCCCCCCNCCSCC 7c0e2bffe25f1fa73a87ac541061a210 [0,1,0,0,0,0|2,0,1]=4 1212 B12R0.5 CCCCCCCOC/C=C/C=O fdead6d332c5646ef4839d54cba18113 [0,1,0,0,0,0|0,0,2]=3 1213 B12R0.5 CCCCCCCOCC=CC#N 18cae3ee49f9411bcf4f4c0a707199e7 [0,1,0,0,0,0|1,0,1]=3 1214 B12R0.5 CCCCCCCOCCCCC 285b946b6e6b7c9720427b30e2082938 [0,1,0,0,0,0|1,0,2]=4 1215 B12R0.5 CCCCCCCOCCCCF 28e64fb329754eafc0490dd418b652de [0,1,0,0,0,0|1,0,2]=4 1216 B12R0.5 CCCCCCCOCCCCS 5c8fcbadc0044730188b11ea22a8a2ac [0,1,0,0,0,0|0,1,2]=4 1217 B12R0.5 CCCCCCCOCCCOC b4260847eba89607b471de8d9566de12 [0,1,0,0,0,0|1,0,2]=4 1218 B12R0.5 CCCCCCCOCCOCC 4b6abbd4a8dd4b4a2b51ff934d81c59f [0,1,0,0,0,0|2,0,1]=4 1219 B12R0.5 CCCCCCCOCCSCC 9a1d5bc732877d57c3cea92c3d6e7a78 [0,1,0,0,0,0|2,0,1]=4 1220 B12R0.5 CCCCCCNCC#CCOC 0a33e1426d32a9f55fd25d37c79bafdf [0,1,0,0,0,0|1,0,2]=4 1221 B12R0.5 CCCCCCNCCCCCC d1aa2dfeb2d94f392124eb2f0bc63bb7 [0,1,0,0,0,0|1,0,2]=4 1222 B12R0.5 CCCCCCNCCCCCCl 19d2e9c28b57b3e54166d0e0083d11f0 [0,1,0,0,0,0|1,0,2]=4 1223 B12R0.5 CCCCCCNCCCCCF 18fef7ab5c58dd0ba5c9053b6435c0c5 [0,1,0,0,0,0|1,0,2]=4 1224 B12R0.5 CCCCCCNCCCCCO de314ce107d956be3c0ada014da53028 [0,1,0,0,0,0|0,0,2]=3 1225 B12R0.5 CCCCCCNCCCCOC d81185cf7e447ab8e33c1783732daa30 [0,1,0,0,0,0|1,0,2]=4 1226 B12R0.5 CCCCCCNCCCCON 5c0e13675d559874675c857a340b103f [0,1,0,0,0,0|1,0,2]=4 1227 B12R0.5 CCCCCCNCCCOCC f6549b444bf51547932ef78317b1cba1 [0,1,0,0,0,0|2,0,1]=4 1228 B12R0.5 CCCCCCNCCCSCC 30151552f625ea531d727aafbd1c6324 [0,1,0,0,0,0|2,0,1]=4 1229 B12R0.5 CCCCCCNCCOCCC e2a8a540ad96d6ceb8b51f4a797b7bf5 [0,1,0,0,0,0|2,0,1]=4 1230 B12R0.5 CCCCCCNCCOCCO 3325928e882f7f41246ad64376daacd0 [0,1,0,0,0,0|1,0,1]=3 1231 B12R0.5 CCCCCCNCCOCCS 95d2f1cd40cc70d493c9517202f53bf9 [0,1,0,0,0,0|1,1,1]=4 1232 B12R0.5 CCCCCCNCCOCOC 139200e9d0450a2988d3d9e0606506a2 [0,1,0,0,0,0|2,0,1]=4 1233 B12R0.5 CCCCCCNCCSCCO 29b4fc4fd30bdf24cdbbca4d9c797cc6 [0,1,0,0,0,0|1,0,1]=3 1234 B12R0.5 CCCCCCNCOCCOC ed2d153f89b34d5469ee722eb0727465 [0,1,0,0,0,0|2,0,1]=4 1235 B12R0.5 CCCCCCOCC#CCOC e3f23a6b8e04deb0aa142dfa87e96669 [0,1,0,0,0,0|1,0,2]=4 1236 B12R0.5 CCCCCCOCCCCCC cd1b7d8c0a048e5235c8a00a93f9576b [0,1,0,0,0,0|1,0,2]=4 1237 B12R0.5 CCCCCCOCCCCCF 9470617aa548969720c3eff0b47a2dc9 [0,1,0,0,0,0|1,0,2]=4 1238 B12R0.5 CCCCCCOCCCCOC 06811c8c89c5491d0c77f14e6e588208 [0,1,0,0,0,0|1,0,2]=4 1239 B12R0.5 CCCCCCOCCCOCC a3d8c9306f7dad21e20c6e661be67c7a [0,1,0,0,0,0|2,0,1]=4 1240 B12R0.5 CCCCCCOCCCSCC 128c98fa911d26c6b96d1acd87bdd715 [0,1,0,0,0,0|2,0,1]=4 1241 B12R0.5 CCCCCCOCCOCCC 0b776a6564a32a4d4baee1261a5f3b55 [0,1,0,0,0,0|2,0,1]=4 1242 B12R0.5 CCCCCCOCCOCCF bfc4dd6268d0604cec0bfd094f6efd3c [0,1,0,0,0,0|2,0,1]=4 1243 B12R0.5 CCCCCCOCCOCCS 201d823451c42ea41ad392f5b4eaaa4d [0,1,0,0,0,0|1,1,1]=4 1244 B12R0.5 CCCCCCOCCOCOC 85c693fee8d5b2467b545ac0c80d6b13 [0,1,0,0,0,0|2,0,1]=4 1245 B12R0.5 CCCCCCOCCSCCC 84fac9d41bb9fe99ededf5f486d0a604 [0,1,0,0,0,0|2,0,1]=4 1246 B12R0.5 CCCCCCOCOCCOC ec9eb27d751919b09cc32330d08d76d6 [0,1,0,0,0,0|2,0,1]=4 1247 B12R0.5 CCCCCNCCCCCCCl 2fae296f3057226de42abe245bbb99f1 [0,1,0,0,0,0|1,0,2]=4 1248 B12R0.5 CCCCCNCCCCCCF 49b73cb2cd1eb6868e0ea964ce13bb29 [0,1,0,0,0,0|1,0,2]=4 1249 B12R0.5 CCCCCNCCCCCCO 4ed31c1e38a3460e294f9174ed65608e [0,1,0,0,0,0|0,0,2]=3 1250 B12R0.5 CCCCCNCCCCCOC a3ce138cbd31c716d072a80b7b26533e [0,1,0,0,0,0|1,0,2]=4 1251 B12R0.5 CCCCCNCCCCSCC 3265f2c2c62d5f9c7954328456a04078 [0,1,0,0,0,0|2,0,1]=4 1252 B12R0.5 CCCCCNCCCOCCC 1cf415a99239b8493aea39dd9d978a5d [0,1,0,0,0,0|2,0,1]=4 1253 B12R0.5 CCCCCNCCCOCCO f13afb5315ecbc803833352e61414e6b [0,1,0,0,0,0|1,0,1]=3 1254 B12R0.5 CCCCCNCCOCCCO 5c6be3d520bec6c2dc5c279c671a5015 [0,1,0,0,0,0|1,0,2]=4 1255 B12R0.5 CCCCCNCCOCCOC c24298e41b3e8451d3f65b93991a41ce [0,1,0,0,0,0|2,0,1]=4 1256 B12R0.5 CCCCCNCCOCCON 68a3313124d18ed53f64eca25c19feec [0,1,0,0,0,0|2,0,1]=4 1257 B12R0.5 CCCCCNCCSSCCO b7a5d4d507bbfdf6544c7f2b66984c25 [0,1,0,0,0,0|2,0,1]=4 1258 B12R0.5 CCCCCOCCCCCCF 7734af3d3bf154628ebaef98ff156a39 [0,1,0,0,0,0|1,0,2]=4 1259 B12R0.5 CCCCCOCCCCCCS bb032fba919f7c550fb79b69925be26e [0,1,0,0,0,0|0,1,2]=4 1260 B12R0.5 CCCCCOCCCCCOC 0484cf637cc7af5c7ba315362b09ff93 [0,1,0,0,0,0|1,0,2]=4 1261 B12R0.5 CCCCCOCCCOCCC 53e637d746cc3048007b628e3f515b8a [0,1,0,0,0,0|2,0,1]=4 1262 B12R0.5 CCCCCOCCCOCCF b214e9dab34a87d987f3132188101b6f [0,1,0,0,0,0|2,0,1]=4 1263 B12R0.5 CCCCCOCCCOCCS 3dde90284256958f66b326cd165f54ef [0,1,0,0,0,0|1,1,1]=4 1264 B12R0.5 CCCCCOCCCOCOC 02ad96e08adcad9df53dc08a48c810de [0,1,0,0,0,0|2,0,1]=4 1265 B12R0.5 CCCCCOCCOCCOC 2c979ea1875b321d7ddd78aa1c18bf5b [0,1,0,0,0,0|2,0,1]=4 1266 B12R0.5 CCCCNCCCCCCCO db5d0f11e34f1825805dd03c1ce47fe9 [0,1,0,0,0,0|0,0,2]=3 1267 B12R0.5 CCCCNCCCCCCOC 866d0efd5924fadf5d370171c0cc287d [0,1,0,0,0,0|1,0,2]=4 1268 B12R0.5 CCCCNCCCCSCCC ba42d1840a02e8fa7cf3777473a761e9 [0,1,0,0,0,0|2,0,1]=4 1269 B12R0.5 CCCCNCCCCSCCO 4ca8287565f5fc3acf1c6925ad74e7d0 [0,1,0,0,0,0|1,0,1]=3 1270 B12R0.5 CCCCNCCCOCCCO 032087e15bee43c4412c17165a4a5298 [0,1,0,0,0,0|1,0,2]=4 1271 B12R0.5 CCCCNCCCOCCOC edd35be88e97e1156073d2c08bc3a415 [0,1,0,0,0,0|2,0,1]=4 1272 B12R0.5 CCCCOCCCCCCOC 3ee0c80b2c450c71976bb07bbc615e81 [0,1,0,0,0,0|1,0,2]=4 1273 B12R0.5 CCCCOCCCNC/C=C\O 8d834a4bb407bd00d18a72d197226712 [0,1,0,0,0,0|1,0,2]=4 1274 B12R0.5 CCCCOCCCNCCCO 580d7f2e945f2682f1df503cd27078f7 [0,1,0,0,0,0|1,0,2]=4 1275 B12R0.5 CCCCOCCCNCCOC f43285ce67bcdb27bb4ac1a04e46546c [0,1,0,0,0,0|2,0,1]=4 1276 B12R0.5 CCCCOCCCOCCOC da59877bd7a5f9bafd5a8746916e277a [0,1,0,0,0,0|2,0,1]=4 1277 B12R0.5 CCCCOCCNCC#CCO f242e021b9f64cfcaa9a932d8fc07243 [0,1,0,0,0,0|1,0,2]=4 1278 B12R0.5 CCCCOCCNCC=CC#N 1b3deff3346e9a193f24adc1968cac23 [0,1,0,0,0,0|2,0,1]=4 1279 B12R0.5 CCCCOCCNCCCCO 2f1e7a605d0c14e0096f169712beb026 [0,1,0,0,0,0|1,0,2]=4 1280 B12R0.5 CCCCOCCOC/C=C/C=O 06fd75efef919b153333263b70a20cb6 [0,1,0,0,0,0|1,0,2]=4 1281 B12R0.5 CCCCOCCOCC=CC#N 4340aa37ba456d17b32fb769e640e250 [0,1,0,0,0,0|2,0,1]=4 1282 B12R0.5 CCCCOCCOCCNCO 7a220e160ded79cf7a93b2f890b28b82 [0,1,0,0,0,0|2,0,1]=4 1283 B12R0.5 CCCCOCNCCCCCO defa7e9f951a149bd7d17957e120ee8a [0,1,0,0,0,0|1,0,2]=4 1284 B12R0.5 CCCCOCNCCOCCO e288266382f6b3d04656f8de42b6bc8b [0,1,0,0,0,0|2,0,1]=4 1285 B12R0.5 CCCCOCNCCSCCO 0148aafbf7486d99c0b228632ef0ad5f [0,1,0,0,0,0|2,0,1]=4 1286 B12R0.5 CCCCSCCOCC=CC#N 4196df7af7cb4b2554695ebea1f58c9c [0,1,0,0,0,0|2,0,1]=4 1287 B12R0.5 CCCNCCCCCCCCO 279ada66be00ef395989c37c06ec9911 [0,1,0,0,0,0|0,0,2]=3 1288 B12R0.5 CCCNCCCCOCCOC ade22b0c8eca50e4771799340f2c8615 [0,1,0,0,0,0|2,0,1]=4 1289 B12R0.5 CCCNCCOCCOCCO da6a3ef02a798c22146f776de2d3a4a6 [0,1,0,0,0,0|2,0,1]=4 1290 B12R0.5 CCCOCCCNCC#CCO fde29e408d7504bc4ce6abeeff974d71 [0,1,0,0,0,0|1,0,2]=4 1291 B12R0.5 CCCOCCCNCC=CC#N 115f936b37ab71000cf0cfc70b9cab69 [0,1,0,0,0,0|2,0,1]=4 1292 B12R0.5 CCCOCCCNCCCCO 4f33af16a5fe959f6bd1998e8c4b3596 [0,1,0,0,0,0|1,0,2]=4 1293 B12R0.5 CCCOCCCOC/C=C/C=O 35a0314602650cfb887663f2d7efc965 [0,1,0,0,0,0|1,0,2]=4 1294 B12R0.5 CCCOCCNCCCCCO c879bb31653c4e57bfa1fd2c13ebee62 [0,1,0,0,0,0|1,0,2]=4 1295 B12R0.5 CCCOCCNCCOCCO 5f0a7f256d1a3c35a74fde85f073af47 [0,1,0,0,0,0|2,0,1]=4 1296 B12R0.5 CCCOCCNCCSCCO 7339a9e84c0ae578649f736199b1d69c [0,1,0,0,0,0|2,0,1]=4 1297 B12R0.5 CCCSCCCCNC/C=C\O ef39416e286949815dfae958148d17c9 [0,1,0,0,0,0|1,0,2]=4 1298 B12R0.5 CCCSCCCCNCCCO 44cd542a6e9b5cdbb0ace543d6cc079b [0,1,0,0,0,0|1,0,2]=4 1299 B12R0.5 CCCSCCCCNCCOC 7f01e8608b5f9d92019ad655114cb397 [0,1,0,0,0,0|2,0,1]=4 1300 B12R0.5 CCNCCCCCCCCCO 17ffd1ad26e170da0244f3c11bf0a9ee [0,1,0,0,0,0|0,0,2]=3 1301 B12R0.5 CCNCCCOCCOCCO 7624d0344813c2913f06c6c5d0fd171f [0,1,0,0,0,0|2,0,1]=4 1302 B12R0.5 CCOCCCCCCCCCS 2d856351af3147dacb02f41de2264a48 [0,1,0,0,0,0|0,1,2]=4 1303 B12R0.5 CCOCCCNCCCCCO 8d9b1113daaf57436512415ae024f1d9 [0,1,0,0,0,0|1,0,2]=4 1304 B12R0.5 CCOCCCNCCOCCO 2b86c1d582286444e3ff5e5cf2e03c57 [0,1,0,0,0,0|2,0,1]=4 1305 B12R0.5 CCOCCCNCCSCCO ef5221fe057c7da283fc2af47cafe5b3 [0,1,0,0,0,0|2,0,1]=4 1306 B12R0.5 CCOCCNCCCCCCO 1468786e24e6d09236eb2eb908dd3400 [0,1,0,0,0,0|1,0,2]=4 1307 B12R0.5 CCOCCNCCCOCCO 2b510493b6d0d3f25043ae2ab19aa1d7 [0,1,0,0,0,0|2,0,1]=4 1308 B12R0.5 CCOCNCCCCCCCO b4176cb3e70ccf1c69b2f0a17d9018e3 [0,1,0,0,0,0|1,0,2]=4 1309 B12R0.5 CCOCNCCCCSCCO d60049722712dd1d95b336c7229435bc [0,1,0,0,0,0|2,0,1]=4 1310 B12R0.5 CCSCCCCNCC=CC#N b1403884b201e8ccd810c91d64b48367 [0,1,0,0,0,0|2,0,1]=4 1311 B12R0.5 CCSCCCCNCCCCO c362aea032ee11b431dc2d4620e2afbb [0,1,0,0,0,0|1,0,2]=4 1312 B12R0.5 CCSCCCNCCCCCO c35708cc058f44ed102ece55683e281e [0,1,0,0,0,0|1,0,2]=4 1313 B12R0.5 CCSCCCNCCOCCO b6439fa94ff84d31c48cbb98cfe5c2d8 [0,1,0,0,0,0|2,0,1]=4 1314 B12R0.5 CCSCCCNCCSCCO 404629a95cce5aa6d08a4d654724ed04 [0,1,0,0,0,0|2,0,1]=4 1315 B12R0.5 CCSCCNCCCCCCO 746ff69b534a21fc5bc2b7961a2f0dd5 [0,1,0,0,0,0|1,0,2]=4 1316 B12R0.5 CCSCCNCCCOCCO 40678fb32b45d563313e0a001f25cebd [0,1,0,0,0,0|2,0,1]=4 1317 B12R0.5 COCCCCCCNCCCO 3d91a7e85288f0f7ac147fa4e1d46f05 [0,1,0,0,0,0|1,0,2]=4 1318 B12R0.5 COCCCCCCNCCOC 49fb1c9e117459609f13d01be521beca [0,1,0,0,0,0|2,0,1]=4 1319 B12R0.5 COCCCCCCNCCON bdd508fe6cdd752cd419a2980c92676a [0,1,0,0,0,0|2,0,1]=4 1320 B12R0.5 COCCCCCCOCCOC 1fe492c258b33996c2579cca8e27acaa [0,1,0,0,0,0|2,0,1]=4 1321 B12R0.5 COCCCCCNCC#CCO f520095bf0d282bae6658c57d1437146 [0,1,0,0,0,0|1,0,2]=4 1322 B12R0.5 COCCCCCNCC=CC#N 91342e2cc01cab290aae9f5bec878010 [0,1,0,0,0,0|2,0,1]=4 1323 B12R0.5 COCCCCCNCCCCO 7f0ee4ff4b837f1a998843ba0f941235 [0,1,0,0,0,0|1,0,2]=4 1324 B12R0.5 COCCCCCOC/C=C/C=O d012aaf225e3b883d4cd8dbe2bd4676d [0,1,0,0,0,0|1,0,2]=4 1325 B12R0.5 COCCCCNCCCCCO ae303027e96ebe9aee99b480da36f27d [0,1,0,0,0,0|1,0,2]=4 1326 B12R0.5 COCCCCNCCOCCO a5121b69925aaa2cf42a75f8183ed87e [0,1,0,0,0,0|2,0,1]=4 1327 B12R0.5 COCCCCNCCSCCO e96ea41fdceb3eda17c3cd1baa9fa796 [0,1,0,0,0,0|2,0,1]=4 1328 B12R0.5 COCCCNCCCCCCO 9d2f4708b78ac09b08797eb1334bed5d [0,1,0,0,0,0|1,0,2]=4 1329 B12R0.5 COCCCNCCCOCCO d4a31c01debe114b3d9c0b34f4490e04 [0,1,0,0,0,0|2,0,1]=4 1330 B12R0.5 COCCNCCCCCCCO 165375447d09183dedbfa9cd5ce1810b [0,1,0,0,0,0|1,0,2]=4 1331 B12R0.5 COCCNCCCCSCCO 2a1197de8efaf4be51ed785531dfaa57 [0,1,0,0,0,0|2,0,1]=4 1332 B12R0.5 COCCOCCCCNCCO a4d5cc96e06658c4d61898fa134cdf9c [0,1,0,0,0,0|2,0,1]=4 1333 B12R0.5 COCNCCCCCCCCO 4291a0431b9fd57685a2cc961312d3f2 [0,1,0,0,0,0|1,0,2]=4 1334 B12R0.5 CSCCCCNCCCCCO 4e55ff6c0d739cbadc20aea230f92d51 [0,1,0,0,0,0|1,0,2]=4 1335 B12R0.5 CSCCCCNCCOCCO cbcf80238551c4902f3b5f65b7786ba4 [0,1,0,0,0,0|2,0,1]=4 1336 B12R0.5 CSCCCNCCCCCCO 1cd45f2058b09c1b1caa7a5bf7ff2dc5 [0,1,0,0,0,0|1,0,2]=4 1337 B12R0.5 CSCCCNCCCOCCO 79b1434075a8618912b4c25f3f6cd8c6 [0,1,0,0,0,0|2,0,1]=4 1338 B12R0.5 CSCCNCCCCCCCO 8765946b463d5d9aa62d523a23232dc8 [0,1,0,0,0,0|1,0,2]=4 1339 B12R0.5 CSCCNCCCCSCCO 1e9e25774479c50f3440efe21f53a343 [0,1,0,0,0,0|2,0,1]=4 1340 B12R0.5 CSCNCCCCCCCCO e8b7d3cd9dccba07c98219f4d8726a7f [0,1,0,0,0,0|1,0,2]=4 1341 B12R0.5 FCOCCCCCCCCCS affeeb83ac5483266cca6d736594be94 [0,1,0,0,0,0|2,0,1]=4 1342 B12R0.5 N#CC=CCNCCCCCCCl 4600ca5fa859e40aaea15bed634e90e0 [0,1,0,0,0,0|2,0,1]=4 1343 B12R0.5 N#CC=CCNCCCCCCO dcb5fa71181fdee6f21479e339e2db63 [0,1,0,0,0,0|2,0,1]=4 1344 B12R0.5 N#CC=CCOCCCCCCF 6aafcd28a24bdb46c826c658d69b67f0 [0,1,0,0,0,0|2,0,1]=4 1345 B12R0.5 N#CC=CCOCCCCCCS e752e997d37bba9f9c12dee12ae0afb7 [0,1,0,0,0,0|2,0,1]=4 1346 B12R0.5 NOCCNCCCCCCCO 17aac4125c4f22c9d96015cd2126325d [0,1,0,0,0,0|2,0,1]=4 1347 B12R0.5 O/C=C\CNCCCCCCCO c8cd669056fddb83dd21d470714ad3e5 [0,1,0,0,0,0|1,0,2]=4 1348 B12R0.5 O=C/C=C/COCCCCCCF dca2589c20ae6df83ad4387303991d66 [0,1,0,0,0,0|1,0,2]=4 1349 B12R0.5 OCC#CCNCCCCCCF c58d12825cb11a2946ff2103d0fedb00 [0,1,0,0,0,0|1,0,2]=4 1350 B12R0.5 OCC#CCNCCCCCCO 3474be36589d49a38e987967680a54ae [0,1,0,0,0,0|1,0,2]=4 1351 B12R0.5 OCCCCCCCCCNCF d242b5318b524d54127bd14f29eb91d7 [0,1,0,0,0,0|1,0,2]=4 1352 B12R0.5 OCCCCCCCCCNCO 0eb9b1537a58c42da46f3bcc3691c9a1 [0,1,0,0,0,0|1,0,1]=3 1353 B12R0.5 OCCCCCCCCNCCBr 35765e9a53ee6dc6418bc6bea5ee5ad6 [0,1,0,0,0,0|1,0,2]=4 1354 B12R0.5 OCCCCCCCCNCCF 6f66fb4c8aee923c23b3bd1d8053b193 [0,1,0,0,0,0|1,0,2]=4 1355 B12R0.5 OCCCCCCCCNCCI 6b6dbd57a56aaca0f50508646d145d97 [0,1,0,0,0,0|1,0,2]=4 1356 B12R0.5 OCCCCCCCCNCCO 3b82a17b2c136d6f5fde196424c62388 [0,1,0,0,0,0|1,0,1]=3 1357 B12R0.5 OCCCCCCCCNCCS ab11661479cc8257ca303f3e9ed5cff8 [0,1,0,0,0,0|1,0,2]=4 1358 B12R0.5 OCCCCCCCNCCCCl 299d5058535e3a4dc8b40b597e6a8d25 [0,1,0,0,0,0|1,0,2]=4 1359 B12R0.5 OCCCCCCCNCCCF a343be6f266cab3842136634deb768fa [0,1,0,0,0,0|1,0,2]=4 1360 B12R0.5 OCCCCCCCNCCCO 7bb45046461dd712ccd7bc8e6d936f04 [0,1,0,0,0,0|1,0,2]=4 1361 B12R0.5 OCCCCCCCNCCCS a1fd15f6d445aa05242b2fd055a20530 [0,1,0,0,0,0|1,0,2]=4 1362 B12R0.5 OCCCCCCNCCCCCl 929b0370a7584d99b8f750579ffb2a8e [0,1,0,0,0,0|1,0,2]=4 1363 B12R0.5 OCCCCCCNCCCCF db94a5ddf57d6bdfed58b3bf2ea1cab2 [0,1,0,0,0,0|1,0,2]=4 1364 B12R0.5 OCCCCCCNCCCCO 4ce72c9c6c20fd2ba5fa239446b5400f [0,1,0,0,0,0|1,0,2]=4 1365 B12R0.5 OCCCCCCNCCCCS 0b0bdab91836b031b6b48ecc9f01e2f0 [0,1,0,0,0,0|1,0,2]=4 1366 B12R0.5 OCCCCCNCCCCCCl 4adf9b3a8cd9cecfcd2186c383419b9d [0,1,0,0,0,0|1,0,2]=4 1367 B12R0.5 OCCCCCNCCCCCF e792c2bd5dc1a357f9773db4cd8afeb7 [0,1,0,0,0,0|1,0,2]=4 1368 B12R0.5 OCCCCCNCCCCCO 2453c6725160cc67093ca26f07956465 [0,1,0,0,0,0|1,0,2]=4 1369 B12R0.5 OCCCCCNCCOCCO e197e1f8dd8e8e4b011443a90577334f [0,1,0,0,0,0|2,0,1]=4 1370 B12R0.5 OCCCCCNCCSCCO af8237c12181602fe89ef12ef87ba4aa [0,1,0,0,0,0|2,0,1]=4 1371 B12R0.5 OCCCCNCCCCCCCl 6c4018201c3609488db97fc5adf514c4 [0,1,0,0,0,0|1,0,2]=4 1372 B12R0.5 OCCCCNCCCCCCF bab5f598b2f4423cf7c5a9a9709d2ebf [0,1,0,0,0,0|1,0,2]=4 1373 B12R0.5 OCCCCNCCCOCCO 8718002cfac2f45bbd51f9cced709a51 [0,1,0,0,0,0|2,0,1]=4 1374 B12R0.5 OCCCNCCCCSCCO f87e8f6bd317d9e5a9fa26f66c051018 [0,1,0,0,0,0|2,0,1]=4 1375 B12R0.5 OCCOCCCNCCCCF fbecdfd951cc669db0f1cfe2188ce139 [0,1,0,0,0,0|2,0,1]=4 1376 B12R0.5 OCCOCCNCCCCCCl e0ff5c7ce6a6440d28ad52b83ed9ece2 [0,1,0,0,0,0|2,0,1]=4 1377 B12R0.5 OCCOCCNCCCCCF 4f800ce1c34400d0bff43f3b2c45b295 [0,1,0,0,0,0|2,0,1]=4 1378 B12R0.5 OCCSCCCCNCCCF 1fb274f68f45102aca83b23f84d8005f [0,1,0,0,0,0|2,0,1]=4 1379 B12R0.5 OCCSCCCCNCCCS 8d65536efd4b521a0cd7f6d8599c1d28 [0,1,0,0,0,0|2,0,1]=4 1380 B12R0.5 OCCSCCNCCCCCF e1cfd3c4d97d5db87c62551c4dd82739 [0,1,0,0,0,0|2,0,1]=4 1381 B12R0.47 CC/C=C/CC(=O)NCCCCC 940f00cc07c5e329d645b46275494768 [0,1,0,0,0,0|2,0,1]=4 1382 B12R0.47 CC/C=C/CN(C)CCCCCC b12dbdd08039e145c197548ba5e3f69d [0,1,0,0,0,0|2,0,0]=3 1383 B12R0.47 CC/C=C/CN(C)CCCCCO 31829bf6dadfe236effbe99b578b8727 [0,1,0,0,0,0|3,0,0]=4 1384 B12R0.47 CC/C=C/CN(C)CCCCOC 0919520b474fd3811f3dd22a368fed1a [0,1,0,0,0,0|3,0,0]=4 1385 B12R0.47 CC/C=C/CNC(C)CCCCC 7263c1c7e3999c3c2febef1afaa391d0 [0,1,0,0,0,0|2,0,0]=3 1386 B12R0.47 CC/C=C/CN[C@@H](C)CCCCC 0b7d0875fe64524dd5ebb6af75e08ea2 [0,1,0,0,0,0|2,0,0]=3 1387 B12R0.47 CC/C=C/COC(C)CCCCC 041228763cf423e11b2ebf32a8e84ab3 [0,1,0,0,0,0|2,0,0]=3 1388 B12R0.47 CC/C=C/COC(C)COCCC f71ebf7a26c80115c85a5d0dcf2b245a [0,1,0,0,0,0|3,0,0]=4 1389 B12R0.47 CC/C=C/CO[C@@H](C)CCCCC 51933f92e2e9618d71909dfa5a5da7f9 [0,1,0,0,0,0|2,0,0]=3 1390 B12R0.47 CC/C=C/CO[C@H](C)CCCCC 436dc907b7ce36ca1769290471c4d99d [0,1,0,0,0,0|2,0,0]=3 1391 B12R0.47 CC/C=C\CC(=O)NCCCCC ffa7f4f086207d8f8ec7583d6ff6101f [0,1,0,0,0,0|2,0,1]=4 1392 B12R0.47 CC/C=C\CCN(C)CCCCC f31c906c96576da517f084ef21cd0ac3 [0,1,0,0,0,0|2,0,0]=3 1393 B12R0.47 CC/C=C\CCN(C)CCCCO 3b5d230809184553e15f73ae14660a4f [0,1,0,0,0,0|3,0,0]=4 1394 B12R0.47 CC/C=C\CCN(C)CCCOC 755a68c69ebe305769ba27e498061b86 [0,1,0,0,0,0|3,0,0]=4 1395 B12R0.47 CC/C=C\CCN(C)CCOCC 703d868a3c58a4ac2f4ea6182a179c15 [0,1,0,0,0,0|3,0,0]=4 1396 B12R0.47 CC/C=C\COC(C)CCCCC 822b935cb0d28486f03eec7b3bf71d47 [0,1,0,0,0,0|2,0,0]=3 1397 B12R0.47 CC/C=C\CO[C@@H](C)CCCCC 6912a19c5ed0820650103f3cc93f21a5 [0,1,0,0,0,0|2,0,0]=3 1398 B12R0.47 CCC=CCC(=O)NCCCCC 5e686aa7b1901d151515114dc104c375 [0,1,0,0,0,0|2,0,1]=4 1399 B12R0.47 CCCCCC(C)NCC#CCO 19c098ea8352ea7928a1d9a5e7df6027 [0,1,0,0,0,0|1,0,2]=4 1400 B12R0.47 CCCCCC(C)NCC=CC#N e4b06f642ba710c49340fd6fb680cdb9 [0,1,0,0,0,0|2,0,1]=4 1401 B12R0.47 CCCCCC(C)NCCCCO a934c5c7968ccd26e54af0242a66d012 [0,1,0,0,0,0|1,0,2]=4 1402 B12R0.47 CCCCCC(C)OC/C=C/C=O c709c54c57db8084fe00fb78b85afcd7 [0,1,0,0,0,0|1,0,2]=4 1403 B12R0.47 CCCCCC(C)OCC=CC#N bf7ac59a1c3c223dd5db13dc49f93814 [0,1,0,0,0,0|2,0,1]=4 1404 B12R0.47 CCCCCCC(C)CCOCC e2cc2dc480117f4910394fb51fcc11ea [0,1,0,0,0,0|2,0,1]=4 1405 B12R0.47 CCCCCCC(C)CCOCF cc2d13caf65682d1660246f6b0186336 [0,1,0,0,0,0|2,0,1]=4 1406 B12R0.47 CCCCCCC(C)COCCC 4f01491277f6f7ea73c9767ba8518a63 [0,1,0,0,0,0|2,0,1]=4 1407 B12R0.47 CCCCCCC(C)COCCF e4e1648716915753328b692fac962fc4 [0,1,0,0,0,0|2,0,1]=4 1408 B12R0.47 CCCCCCC(C)COCCS 7e907b4fc9bc76a9dd2c007518598190 [0,1,0,0,0,0|1,1,1]=4 1409 B12R0.47 CCCCCCC(C)NC/C=C\O ae13b3a96dc9b358a917b2857538dd33 [0,1,0,0,0,0|1,0,2]=4 1410 B12R0.47 CCCCCCC(C)NCCCO 915bb2b711a1bc1b36149e304557fbf7 [0,1,0,0,0,0|1,0,2]=4 1411 B12R0.47 CCCCCCN(C)CC#CCO 6e84575c3c31d249cf93d3f53d50d7a7 [0,1,0,0,0,0|1,0,2]=4 1412 B12R0.47 CCCCCCN(C)CC=CC#N c2a07b1776f62c3681e166f4352e9a90 [0,1,0,0,0,0|2,0,1]=4 1413 B12R0.47 CCCCCCN(C)CCCCO 19a9642de3a5470f77615907ffa925ac [0,1,0,0,0,0|1,0,2]=4 1414 B12R0.47 CCCCCC[C@@H](C)NC/C=C\O 51f4ec4bd66a02ce14a871bfd2aa2a90 [0,1,0,0,0,0|1,0,2]=4 1415 B12R0.47 CCCCCC[C@@H](C)NCCCO 61cf19d2c3f82e1e636c3bfb254ca967 [0,1,0,0,0,0|1,0,2]=4 1416 B12R0.47 CCCCCC[C@H](C)NC/C=C\O befaf91d42bc2785314548dd68c81d64 [0,1,0,0,0,0|1,0,2]=4 1417 B12R0.47 CCCCCC[C@H](C)NCCCO 70452ecdb132bbc6559ce1bfe685ce8f [0,1,0,0,0,0|1,0,2]=4 1418 B12R0.47 CCCCCN(C)CCCCCO 8da4ea1d8c0c6ea8ab7e6cd0ee4ba4b6 [0,1,0,0,0,0|1,0,2]=4 1419 B12R0.47 CCCCCN(C)CCOCCO fa8addea6438c44de116cd75e51d2713 [0,1,0,0,0,0|2,0,1]=4 1420 B12R0.47 CCCCCNC(C)CCCCO 4f268f8255644c2064fa16ace921940b [0,1,0,0,0,0|1,0,2]=4 1421 B12R0.47 CCCCC[C@@H](C)OCC=CC#N a80f89dfb1afeb7297660b0a0b10d7cf [0,1,0,0,0,0|2,0,1]=4 1422 B12R0.47 CCCCC[C@H](C)NCC#CCO 17be7cd5fde4a67bceb350346d6ced69 [0,1,0,0,0,0|1,0,2]=4 1423 B12R0.47 CCCCC[C@H](C)NCC=CC#N 2df2b4a20fa0a2b4ea5d89f2dffbb104 [0,1,0,0,0,0|2,0,1]=4 1424 B12R0.47 CCCCC[C@H](C)NCCCCO 1ccbbd229f64aa05ccd893dfbc011a98 [0,1,0,0,0,0|1,0,2]=4 1425 B12R0.47 CCCCC[C@H](C)OC/C=C/C=O 8d8d33082f65398e176dbcc04e4c561a [0,1,0,0,0,0|1,0,2]=4 1426 B12R0.47 CCCCC[C@H](C)OCC=CC#N 5e07509e907b5c8215cec53caf3db215 [0,1,0,0,0,0|2,0,1]=4 1427 B12R0.206 C=C/C=C/CCNC(C)CCCC 8bfe4b1d99db16407f8758b6330ad225 [0,1,0,0,0,0|2,0,1]=4 1428 B12R0.206 CC/C=C/C(=O)NCCCCCC 0ae15ea0c3e1227f52271a15cb9574cb [0,1,0,0,0,0|2,0,1]=4 1429 B12R0.206 CC/C=C/CCOC(C)CCCC e88db4de158c05cd7d055f606f6e9bde [0,1,0,0,0,0|2,0,0]=3 1430 B12R0.206 CC/C=C/CNCC(O)CCCC 0fcf3355814e4d3d189d7e03060e17c5 [0,1,0,0,0,0|2,0,0]=3 1431 B12R0.206 CC/C=C/CNCC(O)COCC 9e4008d5d7300b6399d474b936a731c2 [0,1,0,0,0,0|3,0,0]=4 1432 B12R0.206 CC/C=C/CNC[C@H](C)CCCO 13ce048667f95219e4b59815860b933f [0,1,0,0,0,0|3,0,0]=4 1433 B12R0.206 CC/C=C/COCC(C)CCCC 59414a99b19a27cbae1abcaa37ae78a4 [0,1,0,0,0,0|2,0,0]=3 1434 B12R0.206 CC/C=C/COCC(C)COCC a0881b05ee4e9e98f808d43d4c2f43ff [0,1,0,0,0,0|3,0,0]=4 1435 B12R0.206 CC/C=C\C(=O)NCCCCCC 8353d9dd77ca4f6ada77e5a2bc3fdb7a [0,1,0,0,0,0|2,0,1]=4 1436 B12R0.206 CC/C=C\CCNC(C)CCCC 8d869dea513cd452265416076e2c6df2 [0,1,0,0,0,0|2,0,0]=3 1437 B12R0.206 CC/C=C\CCNC(C)CCCO e4ff409019757f92291c448e548ccf53 [0,1,0,0,0,0|3,0,0]=4 1438 B12R0.206 CC/C=C\CCN[C@H](C)CCCC 5858a515333bbc0d0bfae419f5ff619b [0,1,0,0,0,0|2,0,0]=3 1439 B12R0.206 CC/C=C\CCN[C@H](C)CCCO 49e4aea08439727660c6f37216b89cd8 [0,1,0,0,0,0|3,0,0]=4 1440 B12R0.206 CC/C=C\CCOC(C)CCCC e75fb44695bcc9916114aa36898f33b4 [0,1,0,0,0,0|2,0,0]=3 1441 B12R0.206 CC/C=C\CCOC(C)CCOC 6f47cf8d324fef3e097fc1ff6bf26ff0 [0,1,0,0,0,0|3,0,0]=4 1442 B12R0.206 CC/C=C\CCOC(C)CCSC 0b1b5b7d508f01d4df3cd380efd042b8 [0,1,0,0,0,0|3,0,0]=4 1443 B12R0.206 CC/C=C\CCOC(C)COCC 2bd4dab7707dfe31e8b0eef8cf9cb040 [0,1,0,0,0,0|3,0,0]=4 1444 B12R0.206 CC/C=C\CCO[C@@H](C)CCCC 22e34ec79d10eb7a22946c6504044bcb [0,1,0,0,0,0|2,0,0]=3 1445 B12R0.206 CC/C=C\CCO[C@H](C)CCCC 2a7cdc60f19cc632aa22bc7ba8b7c600 [0,1,0,0,0,0|2,0,0]=3 1446 B12R0.206 CCC=CC(=O)NCCCCCC 13ff3a32fc5dcac22caca9b21b4d62d5 [0,1,0,0,0,0|2,0,1]=4 1447 B12R0.206 CCCCC(C)CCCCOCC 6c0ab479ca4e4d91d9675a6e499333e9 [0,1,0,0,0,0|2,0,1]=4 1448 B12R0.206 CCCCC(C)CCCCOCF 5b52eb00abd75ffd94011aa8e7372b0d [0,1,0,0,0,0|2,0,1]=4 1449 B12R0.206 CCCCC(C)COCC=CC#N bd8e089b4c2675356e6f48e7ebbf8659 [0,1,0,0,0,0|2,0,1]=4 1450 B12R0.206 CCCCC(C)NCCCCCO a2ba4bf7aa1461784556575fc817063a [0,1,0,0,0,0|1,0,2]=4 1451 B12R0.206 CCCCC(C)NCCOCCO e4ec20c44b531fc0b06315bdf33abe27 [0,1,0,0,0,0|2,0,1]=4 1452 B12R0.206 CCCCC(C)NCCSCCO 44ef2dc3c6a6a80b0a9fdc699bde095f [0,1,0,0,0,0|2,0,1]=4 1453 B12R0.206 CCCCC(O)CNCC=CC#N 52c6c693cd585456353c4cba6df5f413 [0,1,0,0,0,0|2,0,1]=4 1454 B12R0.206 CCCCC(O)CNCCCCO 20d72b6a001ed6d74e6b7f6baf40b3eb [0,1,0,0,0,0|1,0,2]=4 1455 B12R0.206 CCCCCCCC(=O)NCCO 59acf39a97659be39079e33de1548aab [0,1,0,0,0,0|1,0,2]=4 1456 B12R0.206 CCCCCCCC(C)COCC 1a3b833b2e2f5b7a93f9e25621f74f4b [0,1,0,0,0,0|2,0,1]=4 1457 B12R0.206 CCCCCCCC(C)COCF 7dcf55f14167fbebd750bf9b52b3439f [0,1,0,0,0,0|2,0,1]=4 1458 B12R0.206 CCCCCCCC(C)OCCC ff15cb47ec2eae70e616a2b282843d08 [0,1,0,0,0,0|2,0,1]=4 1459 B12R0.206 CCCCCCCC(C)OCCF 916fbca5b7c986f612e77a8b73c14885 [0,1,0,0,0,0|2,0,1]=4 1460 B12R0.206 CCCCCCCC(C)OCCS 28e0ad8aebadb16b5dc6cd32ffd3201f [0,1,0,0,0,0|1,1,1]=4 1461 B12R0.206 CCCCCCCN(C)C/C=C\O 8f4523fe5c845fd701dbbb0390d51e8b [0,1,0,0,0,0|1,0,2]=4 1462 B12R0.206 CCCCCCCN(C)CCCO d7ddd12e9bc0e2922d7d4b707ab593d4 [0,1,0,0,0,0|1,0,2]=4 1463 B12R0.206 CCCCCCC[C@H](C)NCCC 9e90aff5073fb1bac27e0ed9d66e782b [0,1,0,0,0,0|2,0,1]=4 1464 B12R0.206 CCCCCCC[C@H](C)NCCF 4087d274207839fcaa2b4bca0fd3cfd6 [0,1,0,0,0,0|2,0,1]=4 1465 B12R0.206 CCCCCCC[C@H](C)NCCO 46bf033bf9c627c262870b9157954af3 [0,1,0,0,0,0|1,0,1]=3 1466 B12R0.206 CCCCCCC[C@H](C)NCCS beba81e3a925d4a2875f7b8ffddcc739 [0,1,0,0,0,0|1,1,1]=4 1467 B12R0.206 CCCCCCNC(=O)/C=C/CF 5dc189665cbec589da8d3261ce5af8a9 [0,1,0,0,0,0|2,0,1]=4 1468 B12R0.206 CCCCCCNC(=O)/C=C/CO 1d7213f74573f0cb0656f7808bc0992f [0,1,0,0,0,0|1,0,1]=3 1469 B12R0.206 CCCCCCNC(=O)C=CCO 7007ec4db7b57d2382a77e91846b4afd [0,1,0,0,0,0|1,0,1]=3 1470 B12R0.206 CCCCCCNC(C)CCCO 094fe4e7c5e0bb99179dc661a5a91c5a [0,1,0,0,0,0|1,0,2]=4 1471 B12R0.206 CCCCCCN[C@H](C)CCCO 74976d6e8fcf610c5a26880618d2ce74 [0,1,0,0,0,0|1,0,2]=4 1472 B12R0.206 CCCCCNC[C@H](C)CCCO b59790b3c42b5b08abc08a0569d3fb52 [0,1,0,0,0,0|1,0,2]=4 1473 B12R0.206 CCCCN(C)CCCCCCO 792369f7a000f71581911f8121bad7cc [0,1,0,0,0,0|1,0,2]=4 1474 B12R0.206 CCCCN(C)CCCNCCO 5424a32478dcef064dfb07c28f2f0350 [0,1,0,0,0,0|2,0,1]=4 1475 B12R0.206 CCCC[C@@H](C)NCCCCCO 5306a68c64d64989f2825b0e025e9b3f [0,1,0,0,0,0|1,0,2]=4 1476 B12R0.206 CCCC[C@@H](C)NCCOCCO 0e1fac91645d32ba3f926da877e60912 [0,1,0,0,0,0|2,0,1]=4 1477 B12R0.206 CCCOCCNC(=O)/C=C/CO b4f62c6bc540905c1ca95c59bc302c51 [0,1,0,0,0,0|2,0,1]=4 1478 B12R0.206 CCCOCCNC(=O)C=CCO 4caa9486638df77d0acc7f91e128bb3b [0,1,0,0,0,0|2,0,1]=4 1479 B12R0.206 CCOCCCNC(=O)/C=C/CO 63ba217dc1db27c1df1ad48f791cfa68 [0,1,0,0,0,0|2,0,1]=4 1480 B12R0.206 CCOCCCNC(=O)C=CCO 1468ba43c9b84942da7df235528b86a2 [0,1,0,0,0,0|2,0,1]=4 1481 B12R0.206 COCCCCNC(=O)/C=C/CO 2df1edc1844b8cb8e496bf4af91d662e [0,1,0,0,0,0|2,0,1]=4 1482 B12R0.206 COCCCCNC(=O)C=CCO a9580d31de2d83e6310b84bdb8c10151 [0,1,0,0,0,0|2,0,1]=4 1483 B12R0.206 CSCCCCNC(=O)/C=C/CO 906f159184703c8e34c24f687f1a30e9 [0,1,0,0,0,0|2,0,1]=4 1484 B12R0.206 CSCCCCNC(=O)C=CCO 0927b9ee11c18882ea33f0ad96cf35a0 [0,1,0,0,0,0|2,0,1]=4 1485 B12R0.206 O=C(/C=C/CO)NCCCCCCl f946d85438dff8bbaf951d2998d08a9a [0,1,0,0,0,0|2,0,1]=4 1486 B12R0.206 O=C(/C=C/CO)NCCCCCO 55c4729dce9eea6d1a71a2f3b09a738c [0,1,0,0,0,0|2,0,1]=4 1487 B12R0.206 O=C(C=CCO)NCCCCCCl f0666f4b1663d94884b6d73cc54a6c4d [0,1,0,0,0,0|2,0,1]=4 1488 B12R0.206 O=C(C=CCO)NCCCCCO ad73bde11b5356bef09b0321aab150fa [0,1,0,0,0,0|2,0,1]=4 1489 B12R0.234 C=C(C)CCCOCC/C=C/CC adf71f1b8230b42ab1b442dbfbaab0c5 [0,1,0,0,0,0|2,0,1]=4 1490 B12R0.234 C=C(C)CCCOCC/C=C\CC bf76c732764b20800fbf7b753830ca20 [0,1,0,0,0,0|2,0,1]=4 1491 B12R0.234 C=C(C)CCOCCC/C=C\CC f06c421c6a5104b9b9c03957cbb53e22 [0,1,0,0,0,0|2,0,1]=4 1492 B12R0.234 C=C(C)COCCCC/C=C\CC 0ab9742f2a20781390dc9fdeb87f9772 [0,1,0,0,0,0|2,0,1]=4 1493 B12R0.234 C=C/C=C/CCNCCCC(C)C c189e4c111bd3a697cab260148d43aa2 [0,1,0,0,0,0|2,0,1]=4 1494 B12R0.234 C=C/C=C/CCNCCCC(C)O e87601048cea11fa04bef296d2e6c5c0 [0,1,0,0,0,0|2,0,1]=4 1495 B12R0.234 CC(C)/C=C/CNCCCCCCl 7b67e13ac5f02a25168fd74a6d5fac88 [0,1,0,0,0,0|3,0,0]=4 1496 B12R0.234 CC(C)/C=C/CNCCCCCO 73ddbde52ceaf98f7834e1c2ab52b647 [0,1,0,0,0,0|3,0,0]=4 1497 B12R0.234 CC(C)CCCCCCCOCF cbad12d80ee4f2f259e3bcfca768c101 [0,1,0,0,0,0|2,0,1]=4 1498 B12R0.234 CC(C)CCCCCCNCCF e6f0f244541d8dda2a2f69d8690746d7 [0,1,0,0,0,0|2,0,1]=4 1499 B12R0.234 CC(C)CCCCCCNCCO 6fbc7e604c6bf59412fda4edd7b0ae09 [0,1,0,0,0,0|1,0,1]=3 1500 B12R0.234 CC(C)CCCCCCNCCS 58d0dca3c4511fc37dd5c9c1f6e16f6d [0,1,0,0,0,0|1,1,1]=4 1501 B12R0.234 CC(C)CCCCCCOCCF ae10e074d7625928e56e3a76d12262ea [0,1,0,0,0,0|2,0,1]=4 1502 B12R0.234 CC(C)CCCCCCOCCS 0ca58f100cff7d8fb9a84ed53acaf3bb [0,1,0,0,0,0|1,1,1]=4 1503 B12R0.234 CC(C)CCCCCNC/C=C\O 9e625f0ae6e27dabedf1129a78e0d9cf [0,1,0,0,0,0|1,0,2]=4 1504 B12R0.234 CC(C)CCCCCNCCCO 794e9f38db7a13720e8e07c792297179 [0,1,0,0,0,0|1,0,2]=4 1505 B12R0.234 CC(C)CCCCNCC#CCO 6c53c142e2cb47b22fc48bd7d4c2e385 [0,1,0,0,0,0|1,0,2]=4 1506 B12R0.234 CC(C)CCCCNCCCCO 0dbe8b8548adb068264178bc3cb16e40 [0,1,0,0,0,0|1,0,2]=4 1507 B12R0.234 CC(C)CCCCOC/C=C/C=O a1b5ad9bf43c57ab29e8afcd9af98841 [0,1,0,0,0,0|1,0,2]=4 1508 B12R0.234 CC(C)CCCCOCC=CC#N 7587bf3ce4a110d5f32002b331579713 [0,1,0,0,0,0|2,0,1]=4 1509 B12R0.234 CC(C)CCCNCCCCCO 1200510d4fdb3666c92f4096f8e4c1e6 [0,1,0,0,0,0|1,0,2]=4 1510 B12R0.234 CC(C)CCCNCCOCCO d3055097e88cefb0ede066169b617aba [0,1,0,0,0,0|2,0,1]=4 1511 B12R0.234 CC(C)CCCNCCSCCO d9c05cb1ee8075ee139705636a2bd8ae [0,1,0,0,0,0|2,0,1]=4 1512 B12R0.234 CC(C)CCNCCCCCCO 3a0954e85cd5382a807128f8b5827436 [0,1,0,0,0,0|1,0,2]=4 1513 B12R0.234 CC(C)CCNCCCOCCO a01bec2173a2a6617c4eddfbd558faa1 [0,1,0,0,0,0|2,0,1]=4 1514 B12R0.234 CC(C)CNCCCCCCCO 17af4a06e19a9f19f4462b3a5a4692f8 [0,1,0,0,0,0|1,0,2]=4 1515 B12R0.234 CC(C)CNCCCCSCCO 6190a07e2bc49c4d51ab87b1a1b46267 [0,1,0,0,0,0|2,0,1]=4 1516 B12R0.234 CC(C)CSCCCCNCCO fd2461fe408a3554f742df165df988c6 [0,1,0,0,0,0|2,0,1]=4 1517 B12R0.234 CC(C)NCCCCCCCCO 77e83d169886f18dbdc8364c4f71ab3f [0,1,0,0,0,0|1,0,2]=4 1518 B12R0.234 CC(O)CCCCNCC#CCO cbf14fd39153759da302433ed62afe79 [0,1,0,0,0,0|1,0,2]=4 1519 B12R0.234 CC(O)CCCCNCCCCO 6f591ba8b394fe6a8130663abe33f70d [0,1,0,0,0,0|1,0,2]=4 1520 B12R0.234 CC(O)CCCNCCCCCO 89d286fb2c0daa27ff15e812eb4ced9f [0,1,0,0,0,0|1,0,2]=4 1521 B12R0.234 CC(O)CCCNCCOCCO 8587f910562ce98165fd27458bf4d47d [0,1,0,0,0,0|2,0,1]=4 1522 B12R0.234 CC(O)CCCNCCSCCO 70c853c48170f1e9c82e6b0ad6d21308 [0,1,0,0,0,0|2,0,1]=4 1523 B12R0.234 CC(O)CCNCCCCCCO cec5839655eba3390204b94252b0162a [0,1,0,0,0,0|1,0,2]=4 1524 B12R0.234 CC(O)CCNCCCOCCO ee8e5ee6a2d66b4acaf05317bb6547d4 [0,1,0,0,0,0|2,0,1]=4 1525 B12R0.234 CC(O)CNCCCCCCCO 5b58b6c518af704f6a565f93bf8d0622 [0,1,0,0,0,0|1,0,2]=4 1526 B12R0.234 CC(O)CNCCCCSCCO 601fafa1d019e9d67728a0a1f2089db3 [0,1,0,0,0,0|2,0,1]=4 1527 B12R0.234 CC/C=C/CCOCCCC(=O)C 5ff156b625ccad76578ef5eaf9b4618e [0,1,0,0,0,0|2,0,1]=4 1528 B12R0.234 CC/C=C/CCOCCCC(C)C 1eb99eb54c62da2dd92d4d02a30dd5d1 [0,1,0,0,0,0|2,0,0]=3 1529 B12R0.234 CC/C=C/CCOCCCN(C)C 72bc2463d78afbf908583c068ee16885 [0,1,0,0,0,0|3,0,0]=4 1530 B12R0.234 CC/C=C/CCOCCOC(C)C 219bd986ec826157109d5665af051d22 [0,1,0,0,0,0|3,0,0]=4 1531 B12R0.234 CC/C=C/CCOCCSC(C)C 6f2e7f664c3cb770ba0da7ff420c4480 [0,1,0,0,0,0|3,0,0]=4 1532 B12R0.234 CC/C=C/CNCCCCC(F)F 83998afbee7568f55fbbf7e70fc04285 [0,1,0,0,0,0|3,0,0]=4 1533 B12R0.234 CC/C=C/CNCCCCN(C)C d0ffba41b8bde08168deff3dc6814032 [0,1,0,0,0,0|3,0,0]=4 1534 B12R0.234 CC/C=C/CNCCCOC(C)C fb65a2954ba0b2316cb4a61a6ef89d5a [0,1,0,0,0,0|3,0,0]=4 1535 B12R0.234 CC/C=C/CNCCCSC(C)C f2b89c629903b43d90c57804cbc03ab2 [0,1,0,0,0,0|3,0,0]=4 1536 B12R0.234 CC/C=C/COCCCCC(=O)C 3ab3917684129170903183d5838c173f [0,1,0,0,0,0|2,0,1]=4 1537 B12R0.234 CC/C=C/COCCCCC(C)C 0dbebceb5bb3ceef69f17d38af4d39bb [0,1,0,0,0,0|2,0,0]=3 1538 B12R0.234 CC/C=C/COCCCCN(C)C 544bbd4ba96dd45bff0c98afe81cb921 [0,1,0,0,0,0|3,0,0]=4 1539 B12R0.234 CC/C=C/COCCCOC(C)C 915cf61c1ee4c0a298e7b22bd83a3507 [0,1,0,0,0,0|3,0,0]=4 1540 B12R0.234 CC/C=C/COCCCSC(C)C b2fbeac4deb6c807f0c4b2d71b7b3322 [0,1,0,0,0,0|3,0,0]=4 1541 B12R0.234 CC/C=C/COCCOCC(C)C 395a6a017cca2d806c6a3f901fb1bfff [0,1,0,0,0,0|3,0,0]=4 1542 B12R0.234 CC/C=C/COCCSCC(C)C 8c0abf6c377bb0c3b31a7d388568fe5a [0,1,0,0,0,0|3,0,0]=4 1543 B12R0.234 CC/C=C\CCCCCOC(C)C 30962e1403f8be2b24275814fee9785b [0,1,0,0,0,0|2,0,0]=3 1544 B12R0.234 CC/C=C\CCCCOCC(C)C a95610b4fb04d74a4638dc6c9520ae9f [0,1,0,0,0,0|2,0,0]=3 1545 B12R0.234 CC/C=C\CCCCOCC(F)F 97675250d12c243cee23d7266e5433f2 [0,1,0,0,0,0|3,0,0]=4 1546 B12R0.234 CC/C=C\CCCCOCN(C)C 14819cf54a912d23dce250f453dbbd56 [0,1,0,0,0,0|3,0,0]=4 1547 B12R0.234 CC/C=C\CCCOCCC(=O)C f5b56266d805e6125613210f70e7169f [0,1,0,0,0,0|2,0,1]=4 1548 B12R0.234 CC/C=C\CCCOCCC(C)C 373c5697820a50598e1e95195de64550 [0,1,0,0,0,0|2,0,0]=3 1549 B12R0.234 CC/C=C\CCCOCCN(C)C 456024936e2f3aee8ccd8f3798a97f47 [0,1,0,0,0,0|3,0,0]=4 1550 B12R0.234 CC/C=C\CCCOCCS(=O)C bbd4c7ce6d3a28f6799e2907a2f342af [0,1,0,0,0,0|3,0,0]=4 1551 B12R0.234 CC/C=C\CCCOCOC(C)C ed50843aa7282fbd3e96b243347bbc01 [0,1,0,0,0,0|3,0,0]=4 1552 B12R0.234 CC/C=C\CCNCCCC(C)C a2357bcd98e5361c725cecd10de4c1a7 [0,1,0,0,0,0|2,0,0]=3 1553 B12R0.234 CC/C=C\CCNCCCN(C)C b0010e011ddc103e8f219f0f24fed564 [0,1,0,0,0,0|3,0,0]=4 1554 B12R0.234 CC/C=C\CCNCCCS(=O)C 82de6d0b12fb3f7bff4dfbaabe7a26a5 [0,1,0,0,0,0|3,0,0]=4 1555 B12R0.234 CC/C=C\CCNCCOC(C)C aebac9983f795e70a801addb93bee437 [0,1,0,0,0,0|3,0,0]=4 1556 B12R0.234 CC/C=C\CCOCCCC(=O)C 9a0ab707ba3df73a5a9fc9ca0eaba9d3 [0,1,0,0,0,0|2,0,1]=4 1557 B12R0.234 CC/C=C\CCOCCCC(C)C de3528522f32f7a55475bcc84ceecc46 [0,1,0,0,0,0|2,0,0]=3 1558 B12R0.234 CC/C=C\CCOCCCN(C)C db78c969be61129225a3194ee8e677eb [0,1,0,0,0,0|3,0,0]=4 1559 B12R0.234 CC/C=C\CCOCCOC(C)C ca708b4b216f8a40b56da48e29da2741 [0,1,0,0,0,0|3,0,0]=4 1560 B12R0.234 CC/C=C\CCOCCSC(C)C 0850e07c834667a036c57ea894b80df7 [0,1,0,0,0,0|3,0,0]=4 1561 B12R0.234 CC/C=C\COCCCCC(=O)C 96b9eab5077cbc47ffc86e810df2931f [0,1,0,0,0,0|2,0,1]=4 1562 B12R0.234 CC/C=C\COCCCCC(C)C 9dd11cb2e23f7d976ca9e4aa43272479 [0,1,0,0,0,0|2,0,0]=3 1563 B12R0.234 CC/C=C\COCCCCN(C)C c66cbb5caa5067c1a73cccb6dd9afc12 [0,1,0,0,0,0|3,0,0]=4 1564 B12R0.234 CC/C=C\COCCOCC(C)C 535a010d10524388570696510cbe02d7 [0,1,0,0,0,0|3,0,0]=4 1565 B12R0.234 CCC=CCCCCCOC(C)C f39379d293e7db5f348bc7d59729ada8 [0,1,0,0,0,0|2,0,0]=3 1566 B12R0.234 CCCCCCCCCNC(C)C 633b87e87241210ce29b4c891b10d156 [0,1,0,0,0,0|2,0,1]=4 1567 B12R0.234 CCCCCCCCCOC(C)C 5bfa3d51b03e273aa1342ee47e729825 [0,1,0,0,0,0|2,0,1]=4 1568 B12R0.234 CCCCCCCCNCC(=O)O 83781ea853aa67014c4d40190a4bf6ba [0,1,0,0,0,0|1,0,2]=4 1569 B12R0.234 CCCCCCCCNCC(C)C edc2de24352412e89c0daea62e82a9f2 [0,1,0,0,0,0|2,0,1]=4 1570 B12R0.234 CCCCCCCCNCC(C)O 2ef8cc6de61c88a08a694653cec27f91 [0,1,0,0,0,0|1,0,1]=3 1571 B12R0.234 CCCCCCCCNCC(F)F 15e671588ddab528663a82538c54c026 [0,1,0,0,0,0|2,0,1]=4 1572 B12R0.234 CCCCCCCCNC[C@@H](C)O b95eeee27d9fa25791056fa2e6d0104a [0,1,0,0,0,0|1,0,1]=3 1573 B12R0.234 CCCCCCCCNC[C@H](C)O 259d26ce885c1415cf78f53d5926aa88 [0,1,0,0,0,0|1,0,1]=3 1574 B12R0.234 CCCCCCCCOCC(=O)O b83cc991500dd7f4cc1f14a947f049a9 [0,1,0,0,0,0|1,0,2]=4 1575 B12R0.234 CCCCCCCCOCC(C)C 86fa86f500776572e8f262245d9511e3 [0,1,0,0,0,0|2,0,1]=4 1576 B12R0.234 CCCCCCCCOCC(C)F ae1ca7e455dece962dc9262c593430ce [0,1,0,0,0,0|2,0,1]=4 1577 B12R0.234 CCCCCCCCOCC(C)S 2ade3d64af1a31c78f3b01dffc3145c2 [0,1,0,0,0,0|1,1,1]=4 1578 B12R0.234 CCCCCCCCOCC(F)F b17d4ef6b61ef484846f30a2979782b8 [0,1,0,0,0,0|2,0,1]=4 1579 B12R0.234 CCCCCCCCOCS(=O)O ddd48fec0524b009039de055a38d78b1 [0,1,0,0,0,0|2,0,1]=4 1580 B12R0.234 CCCCCCCCOC[C@@H](C)F 425190a999d384b9c5630093b2067c8a [0,1,0,0,0,0|2,0,1]=4 1581 B12R0.234 CCCCCCCCOC[C@H](C)F cc082e90c22cc1ff82b417a9c15691e0 [0,1,0,0,0,0|2,0,1]=4 1582 B12R0.234 CCCCCCCNCCC(C)O 46c6fa42f475c5b9fdf795a105468042 [0,1,0,0,0,0|1,0,2]=4 1583 B12R0.234 CCCCCCCNCC[C@@H](C)O d8b7b78276e6589d71be024e1f1f86de [0,1,0,0,0,0|1,0,2]=4 1584 B12R0.234 CCCCCCCNCC[C@H](C)O 71c1a0ee238684f7ba5730029f8afc27 [0,1,0,0,0,0|1,0,2]=4 1585 B12R0.234 CCCCCCNC/C=C/C(=O)O 7a59b770969d8fa4966078f52f1cfd59 [0,1,0,0,0,0|1,0,1]=3 1586 B12R0.234 CCCCCCNC/C=C/C(C)C ea6abad081ec7fc782291cd6ad21f7e7 [0,1,0,0,0,0|2,0,0]=3 1587 B12R0.234 CCCCCCNCC=CC(=O)O 034fd8f63c2a68994cdef6bdc5e8c763 [0,1,0,0,0,0|1,0,1]=3 1588 B12R0.234 CCCCCCNCCCC(C)O 64883e7be3613ca791393331610df0c6 [0,1,0,0,0,0|1,0,2]=4 1589 B12R0.234 CCCCCCOC/C=C/C(=O)O 128dea79449a57e6860601570247a082 [0,1,0,0,0,0|1,0,1]=3 1590 B12R0.234 CCCCCCOC/C=C/C(C)C 779e2bdcb188de6d6af2f476df7240be [0,1,0,0,0,0|2,0,0]=3 1591 B12R0.234 CCCCCCOCC=CC(=O)O 8819b9a5f31b28310280cbe2ba6bbd0a [0,1,0,0,0,0|1,0,1]=3 1592 B12R0.234 CCCCCNCCCCC(C)O 09f507821b174cb9dc8b0069b827deb5 [0,1,0,0,0,0|1,0,2]=4 1593 B12R0.234 CCCCCNCCCC[C@@H](C)O f281a32fc86dc68ed462aa4cc12815ea [0,1,0,0,0,0|1,0,2]=4 1594 B12R0.234 CCCCOCCCNCC(C)O 5363eef4d9045be13f2dd60529241278 [0,1,0,0,0,0|2,0,1]=4 1595 B12R0.234 CCCCOCCCNC[C@@H](C)O 3bf84874cdf64dde6d0b7e62d75a98e3 [0,1,0,0,0,0|2,0,1]=4 1596 B12R0.234 CCCCOCCCNC[C@H](C)O aa6c5e73b06117453354d01ebd28d012 [0,1,0,0,0,0|2,0,1]=4 1597 B12R0.234 CCCCOCNC/C=C/C(=O)O e77e8528df6646799820ed0f6bc4f6bd [0,1,0,0,0,0|2,0,1]=4 1598 B12R0.234 CCCCOCNCC=CC(=O)O c2eb3769e8ef17da34d136546d66fbed [0,1,0,0,0,0|2,0,1]=4 1599 B12R0.234 CCCCOCOC/C=C/C(=O)O 7c24b816a3d5c86ed5dc377984f03d09 [0,1,0,0,0,0|2,0,1]=4 1600 B12R0.234 CCCCOCOCC=CC(=O)O a37dfa9b440162fcd6108306ffca6d9e [0,1,0,0,0,0|2,0,1]=4 1601 B12R0.234 CCCNCCCCCCC(C)C d7915ed383ba5e074a9ffc806e43e909 [0,1,0,0,0,0|2,0,1]=4 1602 B12R0.234 CCCOCCCCCCC(C)C a6616e1411b449c54de8055468b842fa [0,1,0,0,0,0|2,0,1]=4 1603 B12R0.234 CCCOCCNC/C=C/C(=O)O 7fc15fcb49d7a035f8e3019d2384a8e7 [0,1,0,0,0,0|2,0,1]=4 1604 B12R0.234 CCCOCCNC/C=C/C(C)C 0ebf7e6fbff5ec103adaafe9932a72b2 [0,1,0,0,0,0|3,0,0]=4 1605 B12R0.234 CCCOCCNCC=CC(=O)O 39bab1c190e531865cfd2fe84aec7108 [0,1,0,0,0,0|2,0,1]=4 1606 B12R0.234 CCCOCCOC/C=C/C(=O)O b35908a59e106ff9eb36c932f19ca2ea [0,1,0,0,0,0|2,0,1]=4 1607 B12R0.234 CCCOCCOC/C=C/C(C)C 6b3dadb1242a7b779a1122c406af8878 [0,1,0,0,0,0|3,0,0]=4 1608 B12R0.234 CCCOCCOCC=CC(=O)O c2422e637fe160a3e4860c72dcd20b47 [0,1,0,0,0,0|2,0,1]=4 1609 B12R0.234 CCCSCCCCNCC(C)O bd13b69612da07515c70ea07cc9ed749 [0,1,0,0,0,0|2,0,1]=4 1610 B12R0.234 CCCSCCCCNC[C@@H](C)O b6b6583078503dbc17efe78aa1e922a2 [0,1,0,0,0,0|2,0,1]=4 1611 B12R0.234 CCCSCCCCNC[C@H](C)O 4eb9e2cf78056585403cf087edab879b [0,1,0,0,0,0|2,0,1]=4 1612 B12R0.234 CCCSCCOC/C=C/C(=O)O fdfccd5ee288afa8d2285003957a99e0 [0,1,0,0,0,0|2,0,1]=4 1613 B12R0.234 CCCSCCOC/C=C/C(C)C e9af8aa3cd4ae158cfea5e9cceacc587 [0,1,0,0,0,0|3,0,0]=4 1614 B12R0.234 CCCSCCOCC=CC(=O)O 8d43f4109343cb134db6f63730b59f83 [0,1,0,0,0,0|2,0,1]=4 1615 B12R0.234 CCOCCCCCCCC(C)C 626ed2c7256a41d21f10aff0ef8f5df5 [0,1,0,0,0,0|2,0,1]=4 1616 B12R0.234 CCOCCCNC/C=C/C(=O)O d70b37d583b2eaf35794031c3c171512 [0,1,0,0,0,0|2,0,1]=4 1617 B12R0.234 CCOCCCNC/C=C/C(C)C 12f3558944f8e78ca49ac6cd2dbdafe4 [0,1,0,0,0,0|3,0,0]=4 1618 B12R0.234 CCOCCCNCC=CC(=O)O 87f267b91233bbf05cb2847504e594a8 [0,1,0,0,0,0|2,0,1]=4 1619 B12R0.234 CCOCCCOC/C=C/C(=O)O 97b4a6884f8ea7128068d9e313974f93 [0,1,0,0,0,0|2,0,1]=4 1620 B12R0.234 CCOCCCOC/C=C/C(C)C 9aa5b836fd61fd428983e65117abfdd8 [0,1,0,0,0,0|3,0,0]=4 1621 B12R0.234 CCOCCCOCC=CC(=O)O 621c4f09976763105636fb26eefb13e2 [0,1,0,0,0,0|2,0,1]=4 1622 B12R0.234 CCSCCCNC/C=C/C(=O)O 9ca7b4a5dd7be221a3dbdc219f0d0e1f [0,1,0,0,0,0|2,0,1]=4 1623 B12R0.234 CCSCCCNCC=CC(=O)O 122a856489b19b411cc4a6f6efd0c990 [0,1,0,0,0,0|2,0,1]=4 1624 B12R0.234 CCSCCCOC/C=C/C(=O)O d219dedb866901e0e46fc8144a80426e [0,1,0,0,0,0|2,0,1]=4 1625 B12R0.234 CCSCCCOC/C=C/C(C)C 8f9a0a6d7c0b286b61466af9f9345661 [0,1,0,0,0,0|3,0,0]=4 1626 B12R0.234 CCSCCCOCC=CC(=O)O 8eadced9012f6df6f1ed8e6752d24b02 [0,1,0,0,0,0|2,0,1]=4 1627 B12R0.234 CN(C)CCCCCCCNCO d53b551138a18ded6e3e01d17aab1548 [0,1,0,0,0,0|2,0,1]=4 1628 B12R0.234 CN(C)CCCCCCNCCO a9e8ff1d0eaf73b1f0e2e98694ef23e1 [0,1,0,0,0,0|2,0,1]=4 1629 B12R0.234 COCCCCCCNCC(C)O 0c1a80b9848aa56fc3325b6661784652 [0,1,0,0,0,0|2,0,1]=4 1630 B12R0.234 COCCCCCCNC[C@@H](C)O 6ba8f4aab3a0a78787980b2ea9adf34e [0,1,0,0,0,0|2,0,1]=4 1631 B12R0.234 COCCCCCCNC[C@H](C)O b2a5bf398db2108a245b0be16a2afe1c [0,1,0,0,0,0|2,0,1]=4 1632 B12R0.234 COCCCCNC/C=C/C(=O)O 19d23fc16cf37e081fa7da8c57053a83 [0,1,0,0,0,0|2,0,1]=4 1633 B12R0.234 COCCCCNC/C=C/C(C)C 1c472686115cba230bd466613359394f [0,1,0,0,0,0|3,0,0]=4 1634 B12R0.234 COCCCCNCC=CC(=O)O 37f508d8da23813687ac6f41905e5192 [0,1,0,0,0,0|2,0,1]=4 1635 B12R0.234 COCCCCOC/C=C/C(=O)O 161e1b9eea9f96cd8fa16c3b8e90f8de [0,1,0,0,0,0|2,0,1]=4 1636 B12R0.234 COCCCCOC/C=C/C(C)C 9bff51eda06d73012abb7fb66df6a9df [0,1,0,0,0,0|3,0,0]=4 1637 B12R0.234 COCCCCOCC=CC(=O)O 75aae2cddb40d3b2bde8c2d13cb1c069 [0,1,0,0,0,0|2,0,1]=4 1638 B12R0.234 CSCCCCNC/C=C/C(=O)O a972113a6c2e687338caa89d516cdded [0,1,0,0,0,0|2,0,1]=4 1639 B12R0.234 CSCCCCNC/C=C/C(C)C 399dc5f3c84b925d1d5b21f93a47fca6 [0,1,0,0,0,0|3,0,0]=4 1640 B12R0.234 CSCCCCNCC=CC(=O)O 18340c8fb03fa0c80331d0c6fe101803 [0,1,0,0,0,0|2,0,1]=4 1641 B12R0.234 CSCCCCOC/C=C/C(=O)O 631e12b0f4fdd28971fe2d9491d51bca [0,1,0,0,0,0|2,0,1]=4 1642 B12R0.234 CSCCCCOC/C=C/C(C)C 7ae5547c4811d8430f4ed1bff82b007b [0,1,0,0,0,0|3,0,0]=4 1643 B12R0.234 CSCCCCOCC=CC(=O)O 7de488157ec869f65ca63cab15fb5880 [0,1,0,0,0,0|2,0,1]=4 1644 B12R0.234 C[C@@H](O)CCCCNCC#CCO 21ebb02066f3b49535ec26b1fd95ed3f [0,1,0,0,0,0|1,0,2]=4 1645 B12R0.234 C[C@@H](O)CCCCNCCCCO 0af8eeb1fd9cb4ed58954161a5cfcaab [0,1,0,0,0,0|1,0,2]=4 1646 B12R0.234 C[C@@H](O)CCNCCCCCCO d463f1e255d30a705e844db06f4ce8d6 [0,1,0,0,0,0|1,0,2]=4 1647 B12R0.234 C[C@@H](O)CNCCCCCCCO 173d9076ee1e4bceb0380557ae473def [0,1,0,0,0,0|1,0,2]=4 1648 B12R0.234 C[C@@H](O)CNCCCCSCCO 66325b38da731eca01893b178c98b382 [0,1,0,0,0,0|2,0,1]=4 1649 B12R0.234 C[C@H](O)CCNCCCCCCO 9c556961907f2cb1f07cc2a8f1996d47 [0,1,0,0,0,0|1,0,2]=4 1650 B12R0.234 C[C@H](O)CNCCCCCCCO 120cc2b1893fc31a2209a0ba4d17df3b [0,1,0,0,0,0|1,0,2]=4 1651 B12R0.234 C[C@H](O)CNCCCCSCCO 9dccf3211adf26a1c940e5fdace3c010 [0,1,0,0,0,0|2,0,1]=4 1652 B12R0.234 O=C(O)/C=C/CNCCCCCCl 037b6bb1659a2aeaec56fbe701bdc5bb [0,1,0,0,0,0|2,0,1]=4 1653 B12R0.234 O=C(O)/C=C/CNCCCCCF 6d331a0fef1a0418b3406ec963138003 [0,1,0,0,0,0|2,0,1]=4 1654 B12R0.234 O=C(O)/C=C/CNCCCCCO 7d145bae8c0bb046bd81ef7fee7cbe94 [0,1,0,0,0,0|2,0,1]=4 1655 B12R0.234 O=C(O)/C=C/COCCCCCF ba37850edaaa19116c17d176bfdfa9ee [0,1,0,0,0,0|2,0,1]=4 1656 B12R0.234 O=C(O)C=CCNCCCCCCl e71a93684e19cc248b4e355c7346dccc [0,1,0,0,0,0|2,0,1]=4 1657 B12R0.234 O=C(O)C=CCNCCCCCF dc886bff0cd68d063b2ffdc47e685fb9 [0,1,0,0,0,0|2,0,1]=4 1658 B12R0.234 O=C(O)C=CCNCCCCCO 7e662daa232921c6412e5a89223a3939 [0,1,0,0,0,0|2,0,1]=4 1659 B12R0.234 O=C(O)C=CCOCCCCCF f287c73263a6c6a7bbbe2a99f18d5cbe [0,1,0,0,0,0|2,0,1]=4 1660 B12R0.248 C#C/C(=C/COCCCCCC)/C 8fecc2600cdf1d1f27a1b3deebdc801d [0,1,0,0,0,0|2,0,1]=4 1661 B12R0.248 C#C/C(=C\COCCCCCC)/C 4d1a45a0d059eb973f6923144b9bac93 [0,1,0,0,0,0|2,0,1]=4 1662 B12R0.248 C#CC(=O)NCCCCCCCC 05da4a92117f41b786a238e8d1ad6fb2 [0,1,0,0,0,0|2,0,1]=4 1663 B12R0.248 C#CCCCCCCNC(=O)CO 6c968fe5f9e87c3aa78770adfc05d024 [0,1,0,0,0,0|1,0,2]=4 1664 B12R0.248 C=C(C=O)OCCCCCCCC 1c4af6dc31202c6998350da6878d3384 [0,1,0,0,0,0|1,0,2]=4 1665 B12R0.248 C=C(CC)CNCCCCCCC 83c846a2d548154ae3dfb9b64c559fb6 [0,1,0,0,0,0|2,0,1]=4 1666 B12R0.248 C=C(CC)COCCC/C=C\CC 7ed2ad6bad33fe6a9f1c8c97bea00e33 [0,1,0,0,0,0|2,0,1]=4 1667 B12R0.248 C=C(CC)COCCCCCCC 2a17750a84c0fac278516bd4ea134be7 [0,1,0,0,0,0|2,0,1]=4 1668 B12R0.248 C=C(CO)CNCCCCCCC 6f9d8fb6843df8e18f6327cbc4cf2df1 [0,1,0,0,0,0|1,0,1]=3 1669 B12R0.248 C=C(CO)CNCCCCCCCl a006692ce77473640c93a60ea3a7e0f1 [0,1,0,0,0,0|2,0,1]=4 1670 B12R0.248 C=C(CO)CNCCCCCCO 482ecbe11ebb09c22f805eaac2a3f3a5 [0,1,0,0,0,0|2,0,1]=4 1671 B12R0.248 C=C(CO)CNCCCCCOC e05e499772174218c43b387479e1eabd [0,1,0,0,0,0|2,0,1]=4 1672 B12R0.248 C=C(CO)CNCCCCSCC 9854f3991587f60ea2a53270f8798e1e [0,1,0,0,0,0|2,0,1]=4 1673 B12R0.248 C=C(CO)CNCCCOCCC eb404bbf29a9653fba449764548f6e96 [0,1,0,0,0,0|2,0,1]=4 1674 B12R0.248 C=C(CO)CNCCOCCCC c4f52981a56488fc6d7b113d66982df8 [0,1,0,0,0,0|2,0,1]=4 1675 B12R0.248 C=C/C=C/CCNCCC(C)CC 1cca2169b2aaef68ad1de1d35150c4c4 [0,1,0,0,0,0|2,0,1]=4 1676 B12R0.248 C=CC(=O)NCCCCCCCC e26adf79311ed4a39b1c817d53427836 [0,1,0,0,0,0|2,0,1]=4 1677 B12R0.248 CC(CO)NCCCCCCCO 836f150704ee93e4a17dcf3f7f67bd9e [0,1,0,0,0,0|2,0,1]=4 1678 B12R0.248 CC/C=C/CCOCCC(C)CC cd83d63bc2f7c80be1e05592fefaa7b8 [0,1,0,0,0,0|2,0,0]=3 1679 B12R0.248 CC/C=C/CCOCCS(=O)CC 7917f13f23802b015fb44e2641664f88 [0,1,0,0,0,0|3,0,0]=4 1680 B12R0.248 CC/C=C/CNCCCC(C)CO 8bd5b0bca262de12bb8a376d16e9a0a8 [0,1,0,0,0,0|3,0,0]=4 1681 B12R0.248 CC/C=C/CNCCCN(C)CC bea85c1a7059c56d113d836e02d363a3 [0,1,0,0,0,0|3,0,0]=4 1682 B12R0.248 CC/C=C/COCCCC(C)CC b23acf52d1a2f0a11a7881727afff2b4 [0,1,0,0,0,0|2,0,0]=3 1683 B12R0.248 CC/C=C/COCCCN(C)CC f385f4f76aaf94d70d88ef1adc3236f0 [0,1,0,0,0,0|3,0,0]=4 1684 B12R0.248 CC/C=C/COCCC[C@@H](C)CC ffc401cb55903f2f8871741472920273 [0,1,0,0,0,0|2,0,0]=3 1685 B12R0.248 CC/C=C\CCCCCN(C)CC 55d568a11d799f025266222138d68c12 [0,1,0,0,0,0|2,0,0]=3 1686 B12R0.248 CC/C=C\CCCCOC(C)CC b30d2174552e298fe950d5af8d3ac952 [0,1,0,0,0,0|2,0,0]=3 1687 B12R0.248 CC/C=C\CCCOCC(=O)CC 346361236ad50de4f745d323f2e7c175 [0,1,0,0,0,0|2,0,1]=4 1688 B12R0.248 CC/C=C\CCCOCC(C)CC 771407146c1c689dc45f268549ae39b5 [0,1,0,0,0,0|2,0,0]=3 1689 B12R0.248 CC/C=C\CCCOCC(C)OC 54817ad8548007e2b4fe069af440223d [0,1,0,0,0,0|3,0,0]=4 1690 B12R0.248 CC/C=C\CCCOCC(O)CO 6b76140a97f39f7e908aab6164350665 [0,1,0,0,0,0|3,0,0]=4 1691 B12R0.248 CC/C=C\CCCOC[C@@H](C)CC 48a06bb5b9df5533fce3f2b4bf3a7485 [0,1,0,0,0,0|2,0,0]=3 1692 B12R0.248 CC/C=C\CCCOC[C@@H](C)OC 8238e4621339caea60f1d68ed1cbae39 [0,1,0,0,0,0|3,0,0]=4 1693 B12R0.248 CC/C=C\CCCOC[C@@H](O)CO 7c0be6ba9916583c03b2ab6dba16cccd [0,1,0,0,0,0|3,0,0]=4 1694 B12R0.248 CC/C=C\CCCOC[C@H](C)CC 57314bf996e8c033e018c871727680be [0,1,0,0,0,0|2,0,0]=3 1695 B12R0.248 CC/C=C\CCCOC[C@H](C)OC 194c62395ba4300620fc201775f81129 [0,1,0,0,0,0|3,0,0]=4 1696 B12R0.248 CC/C=C\CCCOC[C@H](O)CO e2313dc018bbd6834452e658aee65cf9 [0,1,0,0,0,0|3,0,0]=4 1697 B12R0.248 CC/C=C\CCNCCC(C)CC f52f2f89a6091f2873fbbb3ab753bb87 [0,1,0,0,0,0|2,0,0]=3 1698 B12R0.248 CC/C=C\CCNCCC(C)CO fc526e9dcb09366eefa2f1467918ef34 [0,1,0,0,0,0|3,0,0]=4 1699 B12R0.248 CC/C=C\CCNCCC(O)CO 740d2009e92cca4f000987eda7ff6994 [0,1,0,0,0,0|3,0,0]=4 1700 B12R0.248 CC/C=C\CCNCC[C@@H](C)CO 71c275fa9a7606e966c1b5597532e648 [0,1,0,0,0,0|3,0,0]=4 1701 B12R0.248 CC/C=C\CCOCCC(C)CC 5288cf916f9763485bf9bda2a944de05 [0,1,0,0,0,0|2,0,0]=3 1702 B12R0.248 CC/C=C\CCOCCC(C)OC 4f749b8e15c6b5d70d6ff1efb6df29e7 [0,1,0,0,0,0|3,0,0]=4 1703 B12R0.248 CC/C=C\CCOCCC(S)CC 717cf4257880930a6049ce1bb3c69c2b [0,1,0,0,0,0|2,0,0]=3 1704 B12R0.248 CC/C=C\CCOCCS(=O)CC 9e5521826189214b92bb6d2f1975a686 [0,1,0,0,0,0|3,0,0]=4 1705 B12R0.248 CC/C=C\CCOCC[C@@H](C)CC ed2399f5a157c404c570ce12ccca3dd1 [0,1,0,0,0,0|2,0,0]=3 1706 B12R0.248 CCC(=O)NCCCCCCCO 6eed6530831d420f466164dc32f13bd7 [0,1,0,0,0,0|3,0,0]=4 1707 B12R0.248 CCC(C)CCCCCOCCF 3463d37c706e71003cd033e50db2374b [0,1,0,0,0,0|2,0,1]=4 1708 B12R0.248 CCC(C)CCCCCOCCS 2506809000fd18ca1161a38c0462152b [0,1,0,0,0,0|1,1,1]=4 1709 B12R0.248 CCC(C)CCCOCC=CC#N b49ee788e0699d60c8458b6bd0d6667c [0,1,0,0,0,0|2,0,1]=4 1710 B12R0.248 CCC(C)CCNCCCCCO 6081e1691cff6689294c09df0145c742 [0,1,0,0,0,0|1,0,2]=4 1711 B12R0.248 CCC(C)CCNCCOCCO 2277ae1884d29a99d43c59b4e1f777f9 [0,1,0,0,0,0|2,0,1]=4 1712 B12R0.248 CCC(C)CCNCCSCCO b897a9d59a2e52e1d70aeb3fd7bb6cb9 [0,1,0,0,0,0|2,0,1]=4 1713 B12R0.248 CCC(C)CNCCCCCCO be0cea1760f7cb2e8f6ccdb186ff563b [0,1,0,0,0,0|1,0,2]=4 1714 B12R0.248 CCC(C)CNCCCOCCO 0f79cc8e506311c8602a7fb0176277c1 [0,1,0,0,0,0|2,0,1]=4 1715 B12R0.248 CCC(C)NCCCCCCCO b1e64bc770d96cf8cd5d175fcbae0a1f [0,1,0,0,0,0|1,0,2]=4 1716 B12R0.248 CCC(C)NCCCCSCCO 45dfc33d1e2d83f425ff4b161cb3be6e [0,1,0,0,0,0|2,0,1]=4 1717 B12R0.248 CCC(O)CNCCCCCCO 6994982391dd2f1efac21f59bbd849bb [0,1,0,0,0,0|1,0,2]=4 1718 B12R0.248 CCC(O)CNCCCOCCO 30594ffa95d33c330cd7030b70373dda [0,1,0,0,0,0|2,0,1]=4 1719 B12R0.248 CCCCCCCCCN(C)CC a5d0856f18c569967bb7ff2510b586f9 [0,1,0,0,0,0|2,0,1]=4 1720 B12R0.248 CCCCCCCCCN(C)CF 915e80195ba3d30f9ab7e62941628a87 [0,1,0,0,0,0|2,0,1]=4 1721 B12R0.248 CCCCCCCCCN(C)CO f2b28438a5f9acff1bec3fbec3b1ae3a [0,1,0,0,0,0|1,0,1]=3 1722 B12R0.248 CCCCCCCCNC(=O)C=O 8a08c13bee9c51abb915d74ea4361bf9 [0,1,0,0,0,0|1,0,2]=4 1723 B12R0.248 CCCCCCCCNC(=O)CC 8d5ca65c7bc055f65ae9b9c0d4864e57 [0,1,0,0,0,0|2,0,0]=3 1724 B12R0.248 CCCCCCCCNC(=O)CF c4db3ee1a17357dbe65197ea56878593 [0,1,0,0,0,0|2,0,0]=3 1725 B12R0.248 CCCCCCCCNC(=O)CO 1b2314c0db76d0a277cf2f0f4d94503d [0,1,0,0,0,0|1,0,0]=2 1726 B12R0.248 CCCCCCCCNC(=O)CS c3e84d69a8fd363779f35405d911eb5a [0,1,0,0,0,0|1,1,0]=3 1727 B12R0.248 CCCCCCCCNC(C)CC 0d706d06af56069e47d71da4590659ec [0,1,0,0,0,0|2,0,1]=4 1728 B12R0.248 CCCCCCCCNC(C)CO 691930e7ee9f2252c33826e262a83a7b [0,1,0,0,0,0|1,0,1]=3 1729 B12R0.248 CCCCCCCCN[C@@H](C)CC 07f8472e1844311e4454a6d46efe94c0 [0,1,0,0,0,0|2,0,1]=4 1730 B12R0.248 CCCCCCCCN[C@@H](C)CO 07df57f5908b145777f7ba5962e16cae [0,1,0,0,0,0|1,0,1]=3 1731 B12R0.248 CCCCCCCCN[C@H](C)CC de5d6acf612c0009ee7dcd674b57b2c5 [0,1,0,0,0,0|2,0,1]=4 1732 B12R0.248 CCCCCCCCN[C@H](C)CO 367e68bc9cb86406686317ae8915801d [0,1,0,0,0,0|1,0,1]=3 1733 B12R0.248 CCCCCCCCOC(C)CC 47d72e45fc059a4b8f3035c8a9eef5c9 [0,1,0,0,0,0|2,0,1]=4 1734 B12R0.248 CCCCCCCCOC(C)CF fad66b895baa5853b1da99f3824e0977 [0,1,0,0,0,0|2,0,1]=4 1735 B12R0.248 CCCCCCCCOC(C)CS 3a5f57ec72fb2da9c1599e967afb9eff [0,1,0,0,0,0|1,1,1]=4 1736 B12R0.248 CCCCCCCCO[C@@H](C)CC e5751f18e914c751e22df72fbf0bee36 [0,1,0,0,0,0|2,0,1]=4 1737 B12R0.248 CCCCCCCCO[C@H](C)CC 5c6cafaf0679c51f7281abb351105278 [0,1,0,0,0,0|2,0,1]=4 1738 B12R0.248 CCCCCCCCO[C@H](C)CS 267d356702ec0c74da9c86d739d831f4 [0,1,0,0,0,0|1,1,1]=4 1739 B12R0.248 CCCCCCCNCC(=O)CC 89ed05db9bec07e2e6db05ecef7a0fca [0,1,0,0,0,0|2,0,1]=4 1740 B12R0.248 CCCCCCCNCC(=O)CO 78260d7bffbe5c9bc7eb28ddafc55fae [0,1,0,0,0,0|1,0,1]=3 1741 B12R0.248 CCCCCCCNCC(=O)NO 466eb679593197d7932fa512c2129bdc [0,1,0,0,0,0|2,0,1]=4 1742 B12R0.248 CCCCCCCNCC(C)CO c66e525eafcba3acd5a64eb7c7de82b2 [0,1,0,0,0,0|1,0,2]=4 1743 B12R0.248 CCCCCCCNCC(F)CO ca02ce3cdd2d4e4b7ea15fdf29b8f59f [0,1,0,0,0,0|1,0,2]=4 1744 B12R0.248 CCCCCCCNCC(O)CO 9afea52ca8722ada70c2f09e63e788cd [0,1,0,0,0,0|1,0,2]=4 1745 B12R0.248 CCCCCCCNC[C@@H](C)CO 6da6ce4cf2711418c5cb665f9953dc70 [0,1,0,0,0,0|1,0,2]=4 1746 B12R0.248 CCCCCCCNC[C@@H](F)CO 57393e78caa9829fe88f26e0b54941dd [0,1,0,0,0,0|1,0,2]=4 1747 B12R0.248 CCCCCCCNC[C@@H](O)CO 5f1ca85a80ea13607b6b264d64a6ba8f [0,1,0,0,0,0|1,0,2]=4 1748 B12R0.248 CCCCCCCNC[C@H](C)CO 512d941bf12e52d1f452076e2dd98123 [0,1,0,0,0,0|1,0,2]=4 1749 B12R0.248 CCCCCCCNC[C@H](F)CO eb7388c10575ec742adb18bf8921cc18 [0,1,0,0,0,0|1,0,2]=4 1750 B12R0.248 CCCCCCCNC[C@H](O)CO 858579fb9b2ee7593835f5359cac34e0 [0,1,0,0,0,0|1,0,2]=4 1751 B12R0.248 CCCCCCCOCC(=O)CC a8acc97960556a375783be8199237dca [0,1,0,0,0,0|2,0,1]=4 1752 B12R0.248 CCCCCCCOCC(O)CO b7968decdf391a6e1f275ba687c17c80 [0,1,0,0,0,0|1,0,2]=4 1753 B12R0.248 CCCCCCCOC[C@@H](O)CO 578ae06ebfc921f009c88093d935a3fa [0,1,0,0,0,0|1,0,2]=4 1754 B12R0.248 CCCCCCCOC[C@H](O)CO 4e16fd13f50d197d72e3c151b9b5054a [0,1,0,0,0,0|1,0,2]=4 1755 B12R0.248 CCCCCCNCCC(=O)NO a8c78afb268cd1328fe70b732051854a [0,1,0,0,0,0|2,0,1]=4 1756 B12R0.248 CCCCCCNCCC(C)CO 504977974d38fdea0e356fcbb30e426e [0,1,0,0,0,0|1,0,2]=4 1757 B12R0.248 CCCCCCNCCC(O)CO ce8edc3ac7dd8b7ceb3a76bc9758ba22 [0,1,0,0,0,0|1,0,2]=4 1758 B12R0.248 CCCCCCNCC[C@@H](C)CO 74511eb67258178be77544d52e2594e6 [0,1,0,0,0,0|1,0,2]=4 1759 B12R0.248 CCCCCCNCOC(=O)CC de7acfa60fcfbcd75fcb15b0338dbcdd [0,1,0,0,0,0|3,0,0]=4 1760 B12R0.248 CCCCCCOCOC(=O)CC 3b1eb2d7210e074df13a997019128ed2 [0,1,0,0,0,0|3,0,0]=4 1761 B12R0.248 CCCCCNCCCC(C)CO 75f4715a7fdd4014f169ec0d56ead1f2 [0,1,0,0,0,0|1,0,2]=4 1762 B12R0.248 CCCCCNCCNC(=O)CC cdceed1f0b72ea8f2dfb8d1c096a0193 [0,1,0,0,0,0|3,0,0]=4 1763 B12R0.248 CCCCCOCCNC(=O)CC dc63ddbc4f1369b6b1650cd52229a426 [0,1,0,0,0,0|3,0,0]=4 1764 B12R0.248 CCCCCOCCOC(=O)CC c5dcbbaf984711ca2355a0d7dcdc1660 [0,1,0,0,0,0|3,0,0]=4 1765 B12R0.248 CCCCNCCCCC(=O)CC 75ca588ca1aaa2c811fe1088d3346fe6 [0,1,0,0,0,0|2,0,1]=4 1766 B12R0.248 CCCCOCCCCC(=O)CC e302404d6275421b52ba8d82a0a0ca19 [0,1,0,0,0,0|2,0,1]=4 1767 B12R0.248 CCCCOCCCNC(=O)CC 8c32a8226d92a17d8be681c140dc721d [0,1,0,0,0,0|3,0,0]=4 1768 B12R0.248 CCCCOCCCNC(=O)CF 2906e3eadb5484d4907924886d82c387 [0,1,0,0,0,0|3,0,0]=4 1769 B12R0.248 CCCCOCCCNC(=O)CO 087682cecf6183cae64e9b91369034ed [0,1,0,0,0,0|2,0,0]=3 1770 B12R0.248 CCCCOCCCNC(=O)CS c59f0f40ea741739811fc4013c9f1030 [0,1,0,0,0,0|2,1,0]=4 1771 B12R0.248 CCCCOCCCNC(C)CO 248fe2ae548c5f280afabcbc876b3264 [0,1,0,0,0,0|2,0,1]=4 1772 B12R0.248 CCCCOCCCN[C@@H](C)CO 92d00ecc268b4fe78257e3de62352876 [0,1,0,0,0,0|2,0,1]=4 1773 B12R0.248 CCCCOCCCN[C@H](C)CO 0b202a885f208c21cc4b7a2e01cb8bce [0,1,0,0,0,0|2,0,1]=4 1774 B12R0.248 CCCCOCCNCC(=O)CO 0f6869b585c1cc45e54d6cf12ec4ef7c [0,1,0,0,0,0|2,0,1]=4 1775 B12R0.248 CCCOCCCCCC(C)CC 9f77c79cbbc99ad412360db274ad6c6a [0,1,0,0,0,0|2,0,1]=4 1776 B12R0.248 CCCOCCCCC[C@@H](C)CC aab92d9063ab272fd6336daab6308ca7 [0,1,0,0,0,0|2,0,1]=4 1777 B12R0.248 CCCOCCCNCC(=O)CO db8f51a8757a697da0933cf97ee3aefe [0,1,0,0,0,0|2,0,1]=4 1778 B12R0.248 CCCSCCCCNC(=O)CC 6ef64e56d6e70e23a877afb15366a972 [0,1,0,0,0,0|3,0,0]=4 1779 B12R0.248 CCCSCCCCNC(=O)CF 893a3cf948f463424ce2375006502259 [0,1,0,0,0,0|3,0,0]=4 1780 B12R0.248 CCCSCCCCNC(=O)CO 3540e96ec315a4b54c613ead14223674 [0,1,0,0,0,0|2,0,0]=3 1781 B12R0.248 CCCSCCCCNC(=O)CS 1aa5bc2e9dff082bebf06d754e7afcec [0,1,0,0,0,0|2,1,0]=4 1782 B12R0.248 CCCSCCCCNC(C)CO 6317146df2f20c2e26f54799d89814d7 [0,1,0,0,0,0|2,0,1]=4 1783 B12R0.248 CCCSCCCCN[C@@H](C)CO 720932c7d147a76024954a9fe6b5d029 [0,1,0,0,0,0|2,0,1]=4 1784 B12R0.248 CCCSCCCCN[C@H](C)CO 61188cea6c4c27d43130459a0705c9d1 [0,1,0,0,0,0|2,0,1]=4 1785 B12R0.248 CCN(C)CCCCCCCCO 247c7e02e3da17aa0d7359733b690928 [0,1,0,0,0,0|1,0,2]=4 1786 B12R0.248 CCOCCOCCNC(=O)CO 31d8ec841d88b62a77765112e00ad11c [0,1,0,0,0,0|3,0,0]=4 1787 B12R0.248 CCSCCCCNCC(=O)CO d8727184cedc77c89a3f31d46b051192 [0,1,0,0,0,0|2,0,1]=4 1788 B12R0.248 CC[C@@H](C)CNCCCCCCO 35a0b9210c12f687c8031112bea4842a [0,1,0,0,0,0|1,0,2]=4 1789 B12R0.248 CC[C@@H](C)CNCCCOCCO 235e7ac5e1181606bf28db178ed70ccc [0,1,0,0,0,0|2,0,1]=4 1790 B12R0.248 CC[C@@H](C)NCCCCCCCO 3070068b7cbaa931273c71e741a07715 [0,1,0,0,0,0|1,0,2]=4 1791 B12R0.248 CC[C@@H](O)CNCCCCCCO 2c7d46f7d769af87c612f1133919cd1b [0,1,0,0,0,0|1,0,2]=4 1792 B12R0.248 CC[C@H](C)CCCCCOCCF 9861d94717ee5a0c1fd0e8be350d2f3f [0,1,0,0,0,0|2,0,1]=4 1793 B12R0.248 CC[C@H](C)CCCCCOCCS 243793892c51337a2b88c1aebffd36d1 [0,1,0,0,0,0|1,1,1]=4 1794 B12R0.248 CC[C@H](C)CCCOCC=CC#N 98d3eba871a51ec73a0d51040852a73d [0,1,0,0,0,0|2,0,1]=4 1795 B12R0.248 CC[C@H](C)CNCCCCCCO 8228c83ddeab969996b8321b6e4059d6 [0,1,0,0,0,0|1,0,2]=4 1796 B12R0.248 CC[C@H](C)CNCCCOCCO 9e167fa4571ed19533c21dd05949e0a4 [0,1,0,0,0,0|2,0,1]=4 1797 B12R0.248 CC[C@H](C)NCCCCCCCO b3d4185050783c944d238126e2c7b238 [0,1,0,0,0,0|1,0,2]=4 1798 B12R0.248 COCCCCCCNC(C)CO c359e5d4b35810d8f94ff097c5dba394 [0,1,0,0,0,0|2,0,1]=4 1799 B12R0.248 COCCCCCCN[C@@H](C)CO 97d54bacb85f461973ceb7383f1e0ceb [0,1,0,0,0,0|2,0,1]=4 1800 B12R0.248 COCCCCCCN[C@H](C)CO 71f928a77adaea43e4b9fd9b70b0b806 [0,1,0,0,0,0|2,0,1]=4 1801 B12R0.248 COCCCCCNCC(=O)CO 3d62b0c8d589cd5fdcf1ed6791ef54a5 [0,1,0,0,0,0|2,0,1]=4 1802 B12R0.248 COCCOCCCNC(=O)CO b6722fd9cf098aebd31afc86ec0f5c23 [0,1,0,0,0,0|3,0,0]=4 1803 B12R0.248 CSCCOCCCNC(=O)CO f724e46bb8c8f00e40bd077b162cda6d [0,1,0,0,0,0|3,0,0]=4 1804 B12R0.248 C[C@@H](CO)NCCCCCCCO fb0e32d826a68555e54e7cfc1e6ffc30 [0,1,0,0,0,0|2,0,1]=4 1805 B12R0.248 C[C@H](CO)NCCCCCCCO 6c5b2b311ac6902bc2e8fa57fd5f82d5 [0,1,0,0,0,0|2,0,1]=4 1806 B12R0.248 O=C(CF)NCCCCCCCO 06005ded0b960d0e227ac8288c0d7875 [0,1,0,0,0,0|3,0,0]=4 1807 B12R0.248 O=C(CO)CNCCCCCCCl c986aa8335d6a99414b58b46306e1c2d [0,1,0,0,0,0|2,0,1]=4 1808 B12R0.248 O=C(CO)CNCCCCCCO 3963a25aaf3f74378966d98bae19b636 [0,1,0,0,0,0|2,0,1]=4 1809 B12R0.248 O=C(CO)NCCCCCCCO 1d801b6d0b98670986e94cc04bdd6634 [0,1,0,0,0,0|2,0,0]=3 1810 B12R0.248 O=C(CO)NCCCCSCCO e6fa3e75d4b36ada3fd886225c72a727 [0,1,0,0,0,0|3,0,0]=4 1811 B12R0.248 O=C(CO)NCCCOCCCO 8ad7b39654934d96015f193edf72fce8 [0,1,0,0,0,0|3,0,0]=4 1812 B12R0.248 O=C(CS)NCCCCCCCO 079aaa7f2419efb6ce76d08612a30585 [0,1,0,0,0,0|2,1,0]=4 1813 B12R1.8 BrCCNCCC1CCCCC1 efce1f28c4358e5350a94c67692d20b0 [0,0,0,1,0,0|2,0,1]=4 1814 B12R1.8 CC/C=C/CNC1CCCOC1 78b671fbca919b904f7996d9796811c7 [0,0,0,1,0,0|3,0,0]=4 1815 B12R1.8 CC/C=C/CNC1CCOCC1 98190a4f114ff7bf3a4fcacf87a47d07 [0,0,0,1,0,0|3,0,0]=4 1816 B12R1.8 CC/C=C/CNC1CCSCC1 a8c97c4dfc1860b05c7f27e0243b8f5c [0,0,0,1,0,0|3,0,0]=4 1817 B12R1.8 CC/C=C/CN[C@@H]1CCCOC1 f3c362a4a51bd4bf212240e69c17dc71 [0,0,0,1,0,0|3,0,0]=4 1818 B12R1.8 CC/C=C/CN[C@H]1CCCOC1 52cc9ca317a25b3c1af9be9529f5b05a [0,0,0,1,0,0|3,0,0]=4 1819 B12R1.8 CC/C=C/COC1CCCCC1 8e313273aad4eecdfbb37edf0be715a1 [0,0,0,1,0,0|2,0,0]=3 1820 B12R1.8 CC/C=C/COC1CCCCO1 b14500a0bef2f2c51043e871059d9d9d [0,0,0,1,0,0|3,0,0]=4 1821 B12R1.8 CC/C=C/COC1CCCOC1 18ffb61852ec59cb88c946806e7282bc [0,0,0,1,0,0|3,0,0]=4 1822 B12R1.8 CC/C=C/COC1CCCSC1 234a104674ba0386c311dcc337adc7e3 [0,0,0,1,0,0|3,0,0]=4 1823 B12R1.8 CC/C=C/COC1CCOCC1 3ead2278b3b6d44a3eabf78fbc9cd03a [0,0,0,1,0,0|3,0,0]=4 1824 B12R1.8 CC/C=C/COC1CCSCC1 655047c563393097324489d4ff1807ac [0,0,0,1,0,0|3,0,0]=4 1825 B12R1.8 CC/C=C/CO[C@@H]1CCCOC1 58da66ce50873fa6fe88cc96beae049a [0,0,0,1,0,0|3,0,0]=4 1826 B12R1.8 CC/C=C/CO[C@H]1CCCOC1 10f8124046242886715fa0c4a8a4dd55 [0,0,0,1,0,0|3,0,0]=4 1827 B12R1.8 CC/C=C\CCN1CCCOC1 bafe061c50abc282520cdbea3eec5c37 [0,0,0,1,0,0|3,0,0]=4 1828 B12R1.8 CC/C=C\CCN1CCCSC1 190ccc7bccb7ff948b95b2846eb51063 [0,0,0,1,0,0|3,0,0]=4 1829 B12R1.8 CC/C=C\CCN1CCOCC1 9f922ab81fa4d992456400b467c4fb68 [0,0,0,1,0,0|3,0,0]=4 1830 B12R1.8 CC/C=C\CCN1CCSCC1 b840b6218d81e8ef6888d0bd3f69d455 [0,0,0,1,0,0|3,0,0]=4 1831 B12R1.8 CC/C=C\COC1CCCCC1 4fafa70289569d9ad1e6ee26bc284516 [0,0,0,1,0,0|2,0,0]=3 1832 B12R1.8 CC/C=C\COC1CCCCO1 a0b0565b39d1b69f1806aa16fafde710 [0,0,0,1,0,0|3,0,0]=4 1833 B12R1.8 CC/C=C\COC1CCCOC1 99b87341d7e1f1e7949f3705f5a1e79b [0,0,0,1,0,0|3,0,0]=4 1834 B12R1.8 CC/C=C\COC1CCOCC1 b14e61eb25193dde6a1edf4a8fb2df75 [0,0,0,1,0,0|3,0,0]=4 1835 B12R1.8 CC/C=C\COC1CCSCC1 c5e97a7720b94014f4f73cec88897b5d [0,0,0,1,0,0|3,0,0]=4 1836 B12R1.8 CCCCCCN1CC=CCC1 67362ac0f458c62c0fdd87111e43e87d [0,0,0,1,0,0|2,0,0]=3 1837 B12R1.8 CCCCCNC1CCCCO1 a04a407ce82ef8b9e2f612b604deb88b [0,0,0,1,0,0|1,0,2]=4 1838 B12R1.8 CCCCCOC1CC=CCC1 98926859eebd82806784f0435b91a1e2 [0,0,0,1,0,0|2,0,0]=3 1839 B12R1.8 CCCCCOC1CCCCO1 18b43ff403d614c1654f078f891c172f [0,0,0,1,0,0|1,0,2]=4 1840 B12R1.8 CCCCNCC1CC=CCC1 1378cb96c226671017080cc72fbe3fe5 [0,0,0,1,0,0|2,0,0]=3 1841 B12R1.8 CCCCNCC1CCCCO1 7cbced637fe63dc7e5e80033b72c2362 [0,0,0,1,0,0|1,0,2]=4 1842 B12R1.8 CCCCNCC1COCCO1 f0af88977cba21756d54a15a18669289 [0,0,0,1,0,0|2,0,1]=4 1843 B12R1.8 CCCCNC[C@H]1COCCO1 71c2932ccbb87ecab1e21ba816904c5b [0,0,0,1,0,0|2,0,1]=4 1844 B12R1.8 CCCCOCC1CC=CCC1 8b42516e7a8d45b86de09b1ea298113b [0,0,0,1,0,0|2,0,0]=3 1845 B12R1.8 CCCCOCC1CCC=CO1 bda98194d2fe83e795c60dff33861c92 [0,0,0,1,0,0|1,0,2]=4 1846 B12R1.8 CCCCOCC1CCCCO1 72dbea7faa92e3748970c338c0dcc673 [0,0,0,1,0,0|1,0,2]=4 1847 B12R1.8 CCCCOCC1COCCO1 41082e772ed4b01c2f5ea2a9ab35b176 [0,0,0,1,0,0|2,0,1]=4 1848 B12R1.8 CCCCOCN1CC=CCC1 bb76fb6d22a9e0222f513863af74e470 [0,0,0,1,0,0|3,0,0]=4 1849 B12R1.8 CCCCOC[C@@H]1CC=CCC1 bd9bd0c77657d1c69dd6a8d247fa4f59 [0,0,0,1,0,0|2,0,0]=3 1850 B12R1.8 CCCCOC[C@@H]1CCCCO1 2c2dc3fd5a9ad35708b0d1b6f4ca8c98 [0,0,0,1,0,0|1,0,2]=4 1851 B12R1.8 CCCCOC[C@@H]1COCCO1 737b84316f197b56f6fd8e47dc8f8b31 [0,0,0,1,0,0|2,0,1]=4 1852 B12R1.8 CCCCOC[C@H]1CC=CCC1 902459b8d198eb52aa8be77fa2fd34d6 [0,0,0,1,0,0|2,0,0]=3 1853 B12R1.8 CCCCOC[C@H]1CCCCO1 b64af6b0b1b1d2a79193204a0cbd2ae0 [0,0,0,1,0,0|1,0,2]=4 1854 B12R1.8 CCCCOC[C@H]1COCCO1 bdd50a7f2d1d7438e2b30dabc9acb143 [0,0,0,1,0,0|2,0,1]=4 1855 B12R1.8 CCCNCCC1CCCCC1 d1d17e58e289b57ff871b741fe39870a [0,0,0,1,0,0|2,0,1]=4 1856 B12R1.8 CCCNCCC1CCCCO1 54f25f2836d544bd4202b59511fb5069 [0,0,0,1,0,0|1,0,2]=4 1857 B12R1.8 CCCNCCC1COCCO1 dd44fccf6072ffbfc0b303923683d6bf [0,0,0,1,0,0|2,0,1]=4 1858 B12R1.8 CCCOCCC1CCCCC1 6972365ee7d44893f33793fd36ecacb4 [0,0,0,1,0,0|2,0,1]=4 1859 B12R1.8 CCCOCCC1CCCCO1 8760945c045ffc1b2a4d32669c550bf0 [0,0,0,1,0,0|1,0,2]=4 1860 B12R1.8 CCCOCCC1COCCO1 78b7f1e8d79bac70152e995f0f5fa054 [0,0,0,1,0,0|2,0,1]=4 1861 B12R1.8 CCCOCCN1CC=CCC1 f6a588ecb9c5e792d79c080bab8f1194 [0,0,0,1,0,0|3,0,0]=4 1862 B12R1.8 CCCOCC[C@@H]1COCCO1 d9df17e7b63135674969432d7b663d18 [0,0,0,1,0,0|2,0,1]=4 1863 B12R1.8 CCCOCC[C@H]1COCCO1 13b2db8004fc4da805cb3baf6b3d616a [0,0,0,1,0,0|2,0,1]=4 1864 B12R1.8 CCNCCCC1CCCCC1 e676e5144e3fe772836e07585debd013 [0,0,0,1,0,0|2,0,1]=4 1865 B12R1.8 CCOCCCC1=CCC=CC1 c736e524db2f6bc6d387404d01ab523e [0,0,0,1,0,0|2,0,1]=4 1866 B12R1.8 CCOCCCC1CCCCC1 c17058507f85f0186044437f541ad4c5 [0,0,0,1,0,0|2,0,1]=4 1867 B12R1.8 CCOCCCN1CC=CCC1 b3a2cb2cf8138f0fdb975d3ad9f6538e [0,0,0,1,0,0|3,0,0]=4 1868 B12R1.8 CCOCCOC1CC=CCC1 68e6970175f1427517178e2928b4bb66 [0,0,0,1,0,0|3,0,0]=4 1869 B12R1.8 CCOCNCC1CC=CCC1 461e26bc71a4f32a433a8f6d13e897fd [0,0,0,1,0,0|3,0,0]=4 1870 B12R1.8 CCOCOCC1CC=CCC1 a770a430f8e348e549802f13a2cb6f09 [0,0,0,1,0,0|3,0,0]=4 1871 B12R1.8 CCOCOC[C@@H]1CC=CCC1 feef666a9c4daf1d308d886909536f2e [0,0,0,1,0,0|3,0,0]=4 1872 B12R1.8 CCOCOC[C@H]1CC=CCC1 73416892b549be7ce1992e3454d2ed46 [0,0,0,1,0,0|3,0,0]=4 1873 B12R1.8 CCSCCCN1CC=CCC1 7e0383d04c5de8b76548b9f9352ada60 [0,0,0,1,0,0|3,0,0]=4 1874 B12R1.8 CCSCCOC1CC=CCC1 7b023b783e94abda52b959e52acaa164 [0,0,0,1,0,0|3,0,0]=4 1875 B12R1.8 COCCCCN1CC=CCC1 df85e5f0c10851c948c46b4f08dfc30c [0,0,0,1,0,0|3,0,0]=4 1876 B12R1.8 COCCCOC1CC=CCC1 348a69afb0dc71606c21fd2f5bc01459 [0,0,0,1,0,0|3,0,0]=4 1877 B12R1.8 COCCNCC1CC=CCC1 4046affa58ac6e6c127c8f4d4f879cc9 [0,0,0,1,0,0|3,0,0]=4 1878 B12R1.8 COCCOCC1CC=CCC1 41cefd318c37bc987591e2d65a903b12 [0,0,0,1,0,0|3,0,0]=4 1879 B12R1.8 COCCOC[C@@H]1CC=CCC1 ef1dcc67a337b1253bb9bff1c768f933 [0,0,0,1,0,0|3,0,0]=4 1880 B12R1.8 COCCOC[C@H]1CC=CCC1 fc13455836b59f067f7db42c5c80bb34 [0,0,0,1,0,0|3,0,0]=4 1881 B12R1.8 CSCCCOC1CC=CCC1 735411b3c62c671e9e3f5f8621a284d0 [0,0,0,1,0,0|3,0,0]=4 1882 B12R1.8 CSCCNCC1CC=CCC1 768f0d414abcee7c94379fc6d3120d67 [0,0,0,1,0,0|3,0,0]=4 1883 B12R1.8 CSCCOCC1CC=CCC1 71097edcd68c904c44d28597536e50c2 [0,0,0,1,0,0|3,0,0]=4 1884 B12R1.8 CSCCOC[C@@H]1CC=CCC1 eab316269e2a0238eb4c33319d9e533b [0,0,0,1,0,0|3,0,0]=4 1885 B12R1.8 CSCCOC[C@H]1CC=CCC1 ddcafdff347a7c366c0d2b00f8a50b97 [0,0,0,1,0,0|3,0,0]=4 1886 B12R1.8 ClCCCNCC1CC=CCC1 ea562021a780b7f3f101b6640345c2c7 [0,0,0,1,0,0|3,0,0]=4 1887 B12R1.8 FCCCCCN1CC=CCC1 9c3792a2b8549c663540eb7ab424d0cf [0,0,0,1,0,0|3,0,0]=4 1888 B12R1.8 FCCCCOC1CC=CCC1 2b62fbcb75fb6b628f70edba98f81373 [0,0,0,1,0,0|3,0,0]=4 1889 B12R1.8 FCCCNCC1CC=CCC1 8bdd4aac09eb17cf4ce9c3d26210530f [0,0,0,1,0,0|3,0,0]=4 1890 B12R1.8 FCCCOCC1CC=CCC1 f5358856d1f15bb31320800f5e25b21a [0,0,0,1,0,0|3,0,0]=4 1891 B12R1.8 FCCCOC[C@@H]1CC=CCC1 358a31af3c55caa37def28f8f8c6ed8f [0,0,0,1,0,0|3,0,0]=4 1892 B12R1.8 FCCCOC[C@H]1CC=CCC1 e815ac36dfa734f4b345eddda395a2aa [0,0,0,1,0,0|3,0,0]=4 1893 B12R1.8 FCCNCCC1CCCCC1 5db03d051901eac1a2a78d15c89688c4 [0,0,0,1,0,0|2,0,1]=4 1894 B12R1.8 FCCOCCC1CCCCC1 c09384213110b05b7f274a40105e2fb7 [0,0,0,1,0,0|2,0,1]=4 1895 B12R1.8 FCNCCCC1CCCCC1 53fcf17cae753940898f55ad87c36893 [0,0,0,1,0,0|2,0,1]=4 1896 B12R1.8 FCOCCCC1CCCCC1 d0726fb42a01d855b966c2d241176627 [0,0,0,1,0,0|2,0,1]=4 1897 B12R1.8 ICCNCCC1CCCCC1 3989c38a49e3d040b84673ce34bbdc54 [0,0,0,1,0,0|2,0,1]=4 1898 B12R1.8 N#CC=CCOC1CCCCC1 a3dcb8d2cba5e7ff95cf74b4706550f3 [0,0,0,1,0,0|2,0,1]=4 1899 B12R1.8 O/C=C\CNCC1CCCCC1 a4cb7eee3a01c2bb1beacd7e510b5b76 [0,0,0,1,0,0|1,0,2]=4 1900 B12R1.8 O=C/C=C/COC1CCCCC1 27a88d1913d29f66be4c7436f6f95058 [0,0,0,1,0,0|1,0,2]=4 1901 B12R1.8 OCC#CCNC1CCCCC1 816f3ff3f11ff14e8b64762e9d43c13d [0,0,0,1,0,0|1,0,2]=4 1902 B12R1.8 OCCCCCN1CC=CCC1 c6f65802a1441fa6d8a433d2d7436568 [0,0,0,1,0,0|3,0,0]=4 1903 B12R1.8 OCCCCNC1CCCCC1 74eb085903e8c8017afdb60ddbe20518 [0,0,0,1,0,0|1,0,2]=4 1904 B12R1.8 OCCCNCC1CC=CCC1 d2caed70bdcb60b7c41d91750617d207 [0,0,0,1,0,0|3,0,0]=4 1905 B12R1.8 OCCCNCC1CCCCC1 fac072aa4ab9eb3451a69f9fc78c7f63 [0,0,0,1,0,0|1,0,2]=4 1906 B12R1.8 OCCNCCC1CCCCC1 b41ba2fcd1f826d0f683e2a8a7adb357 [0,0,0,1,0,0|1,0,1]=3 1907 B12R1.8 OCCNCCC1CCCCO1 672a9bd83a7e3dc0edce0628e0080e9a [0,0,0,1,0,0|2,0,1]=4 1908 B12R1.8 OCCNCCC1CCCOC1 8e13ba3ddaa77c24327201026fe5b204 [0,0,0,1,0,0|2,0,1]=4 1909 B12R1.8 OCCNCCC1CCOCC1 9d3d16d97b36523f9dcf5961e52d689f [0,0,0,1,0,0|2,0,1]=4 1910 B12R1.8 OCCNCCC1CCSCC1 e3970d4e11669e576bb78543bab4b7af [0,0,0,1,0,0|2,0,1]=4 1911 B12R1.8 OCCNCCN1CCCCC1 29a624ef0dfcb39249940ac8be5f48ae [0,0,0,1,0,0|2,0,1]=4 1912 B12R1.8 OCCNCOC1CCCCC1 c3dbbf8b99ab7f91e2b4579faafd7ac3 [0,0,0,1,0,0|2,0,1]=4 1913 B12R1.8 OCNCCCC1CCCCC1 6ecf9b1a3818e1bb2ecedadeae09f41d [0,0,0,1,0,0|1,0,1]=3 1914 B12R1.8 OCNCCCC1CCOCC1 175a0ad8af92b700de6e4345c1b38f36 [0,0,0,1,0,0|2,0,1]=4 1915 B12R1.8 OCNCCCN1CCCCC1 e54f4a33814d57a0687493e8cef25ee7 [0,0,0,1,0,0|2,0,1]=4 1916 B12R1.8 OCNCCSC1CCCCC1 580dc344303809b60c68009c3e8484d8 [0,0,0,1,0,0|2,0,1]=4 1917 B12R1.8 SCCCNCC1CC=CCC1 6e7eeae553d51fe41f3383e5933fc887 [0,0,0,1,0,0|3,0,0]=4 1918 B12R1.8 SCCCOCC1CC=CCC1 434478fe2fb25d7f6c4ad69cda7c0a91 [0,0,0,1,0,0|3,0,0]=4 1919 B12R1.8 SCCCOC[C@@H]1CC=CCC1 1d8e43966b668455e9c40505fa868e32 [0,0,0,1,0,0|3,0,0]=4 1920 B12R1.8 SCCCOC[C@H]1CC=CCC1 50cd48c92c5ca1d12b996da1988816aa [0,0,0,1,0,0|3,0,0]=4 1921 B12R1.8 SCCNCCC1CCCCC1 67e253173f3298ccd0a63e04ceb38f66 [0,0,0,1,0,0|1,1,1]=4 1922 B12R1.8 SCCOCCC1CCCCC1 a0935865ae6d775120ca9b050e96229f [0,0,0,1,0,0|1,1,1]=4 1923 B12R1.18 CC1CCCCCN1C/C=C\O 86020bc771efe3c26319fcddad3d1879 [0,0,0,1,0,0|1,0,2]=4 1924 B12R1.18 CC1CCCCCN1CCCO 41348fa4235b0eb9d5df2a4c0bbf2dc1 [0,0,0,1,0,0|1,0,2]=4 1925 B12R1.18 CCCN[C@@H]1CCCCC[C@@H]1O 84864d0bdbb682a0996966d7087dd0d8 [0,0,0,1,0,0|1,0,2]=4 1926 B12R1.18 CCCN[C@@H]1CCCCC[C@H]1O d11501c0e768b2e131548276feddf729 [0,0,0,1,0,0|1,0,2]=4 1927 B12R1.18 CCCN[C@H]1CCCCC[C@@H]1O c0252d14027ead24e692bc8a482c5d5c [0,0,0,1,0,0|1,0,2]=4 1928 B12R1.18 OCCN[C@@H]1CCCCC[C@@H]1O f410de31a01b6541dc2eaede3df01095 [0,0,0,1,0,0|2,0,1]=4 1929 B12R1.18 OCCN[C@@H]1CCCCC[C@H]1O a2bd91600098700f1ef2a034b6942bb3 [0,0,0,1,0,0|2,0,1]=4 1930 B12R1.18 OCCN[C@H]1CCCCC[C@@H]1O ddce79f24d7a0aa07427ed9dbadbc06a [0,0,0,1,0,0|2,0,1]=4 1931 B12R1.37 BrCCNCCCC1CCCC1 387e938adb2b22a38d1a97f0e2797a0e [0,0,0,1,0,0|2,0,1]=4 1932 B12R1.37 C=C/C=C/CCNC1CCCC1 261ca75a6d4827c270f9af460d7a3213 [0,0,0,1,0,0|2,0,1]=4 1933 B12R1.37 CC/C=C/CCOC1CCCC1 ddcd652bd1d83f24d68ba31d077aa1e0 [0,0,0,1,0,0|2,0,0]=3 1934 B12R1.37 CC/C=C/CCOC1CCOC1 e71a62ce6e40c42916357f3beb14d861 [0,0,0,1,0,0|3,0,0]=4 1935 B12R1.37 CC/C=C/CCO[C@@H]1CCOC1 572c6c7203a5e9d8df98fa156d85dcda [0,0,0,1,0,0|3,0,0]=4 1936 B12R1.37 CC/C=C/CCO[C@H]1CCOC1 294ff299dbdaaa385d929647c0b694f0 [0,0,0,1,0,0|3,0,0]=4 1937 B12R1.37 CC/C=C/CNCC1CCCC1 3bcd617011425c8ea3072bebd4df51b0 [0,0,0,1,0,0|2,0,0]=3 1938 B12R1.37 CC/C=C/CNCC1CCCO1 385ed3ee9793c7b3b7d86c754186ac46 [0,0,0,1,0,0|3,0,0]=4 1939 B12R1.37 CC/C=C/CNCC1CCOC1 6aff9bb7d86ffbd5c294b8238a538125 [0,0,0,1,0,0|3,0,0]=4 1940 B12R1.37 CC/C=C/CNC[C@@H]1CCCO1 952df779487d528a3ba8cb2f4f56a2be [0,0,0,1,0,0|3,0,0]=4 1941 B12R1.37 CC/C=C/CNC[C@@H]1CCOC1 e9b13843dbf14d07051208d7b9e5a2af [0,0,0,1,0,0|3,0,0]=4 1942 B12R1.37 CC/C=C/CNC[C@H]1CCCO1 4e71436cfa79fd923e1c21cab36a9284 [0,0,0,1,0,0|3,0,0]=4 1943 B12R1.37 CC/C=C/CNC[C@H]1CCOC1 2cfa695cbfe50fda79688559f1f3bcf1 [0,0,0,1,0,0|3,0,0]=4 1944 B12R1.37 CC/C=C/COCC1CCCC1 d12b0ac75363f47b5bbb385caa470a7b [0,0,0,1,0,0|2,0,0]=3 1945 B12R1.37 CC/C=C/COCC1CCCO1 d7d7367adf93910f5a906d129ee7d0bb [0,0,0,1,0,0|3,0,0]=4 1946 B12R1.37 CC/C=C/COCC1CCCS1 b3f7ac86b2d6353c5e83ae9db2be0b0e [0,0,0,1,0,0|3,0,0]=4 1947 B12R1.37 CC/C=C/COCC1CCOC1 235460201c1a70417300d4876ebadb19 [0,0,0,1,0,0|3,0,0]=4 1948 B12R1.37 CC/C=C/COCN1CCCC1 0af140a777a2cf491aa1034bd6621f39 [0,0,0,1,0,0|3,0,0]=4 1949 B12R1.37 CC/C=C/COC[C@@H]1CCCO1 309e4228ff61098cbb59dad693b6d850 [0,0,0,1,0,0|3,0,0]=4 1950 B12R1.37 CC/C=C/COC[C@@H]1CCOC1 009d40f1bfb7454f13c0eccff31f0bd1 [0,0,0,1,0,0|3,0,0]=4 1951 B12R1.37 CC/C=C/COC[C@H]1CCCO1 00ef88f1b0bcb7792509733af02d600e [0,0,0,1,0,0|3,0,0]=4 1952 B12R1.37 CC/C=C/COC[C@H]1CCOC1 e9136b57734ee721bc723879a7eae1a1 [0,0,0,1,0,0|3,0,0]=4 1953 B12R1.37 CC/C=C\CCNC1CCCC1 43ec2659d1850e69fc9e66343408bde1 [0,0,0,1,0,0|2,0,0]=3 1954 B12R1.37 CC/C=C\CCNC1CCOC1 d17c1a37c09efcd1369d0e8fb4652443 [0,0,0,1,0,0|3,0,0]=4 1955 B12R1.37 CC/C=C\CCNC1CCSC1 44cfe21f0a8129333793d111ceeeea82 [0,0,0,1,0,0|3,0,0]=4 1956 B12R1.37 CC/C=C\CCN[C@@H]1CCOC1 e3f16eb024d6f896bc3ee507c22a8735 [0,0,0,1,0,0|3,0,0]=4 1957 B12R1.37 CC/C=C\CCN[C@H]1CCOC1 38cdf071d259bac33ecfa424c487dbce [0,0,0,1,0,0|3,0,0]=4 1958 B12R1.37 CC/C=C\CCOC1CCCC1 6697c31ca6f1d37dedfede98e97cbc54 [0,0,0,1,0,0|2,0,0]=3 1959 B12R1.37 CC/C=C\CCOC1CCCO1 6e8584a96797af38114b7c67b2bf9a63 [0,0,0,1,0,0|3,0,0]=4 1960 B12R1.37 CC/C=C\CCOC1CCOC1 84a0e980d618b007b8ec839d82c5571e [0,0,0,1,0,0|3,0,0]=4 1961 B12R1.37 CC/C=C\CCOC1CCSC1 6941d240f20eae382b9fbfbde93c7bf1 [0,0,0,1,0,0|3,0,0]=4 1962 B12R1.37 CC/C=C\CCO[C@@H]1CCOC1 792eebefd512a71ef8cd02555a7fd0ee [0,0,0,1,0,0|3,0,0]=4 1963 B12R1.37 CC/C=C\CCO[C@@H]1CCSC1 230561fc84e8d6ea170786957ca4325b [0,0,0,1,0,0|3,0,0]=4 1964 B12R1.37 CC/C=C\CCO[C@H]1CCOC1 19c2e2a799fdc63b30cd31f35256abef [0,0,0,1,0,0|3,0,0]=4 1965 B12R1.37 CC/C=C\CCO[C@H]1CCSC1 f7d8fe5f50778d50d647ea5f48c7165c [0,0,0,1,0,0|3,0,0]=4 1966 B12R1.37 CC/C=C\COCC1CCCC1 b29f7a78a7e0b723f49700765c2cec03 [0,0,0,1,0,0|2,0,0]=3 1967 B12R1.37 CC/C=C\COCC1CCCO1 9989b156c7959f16480cee4c89e76e35 [0,0,0,1,0,0|3,0,0]=4 1968 B12R1.37 CC/C=C\COCC1CCOC1 6b60eac2527bcaf50300715bd10b4956 [0,0,0,1,0,0|3,0,0]=4 1969 B12R1.37 CCCCCCNc1ccco1 968a4d53efe53ed5a3a5c1a565e3ec23 [0,0,0,1,0,0|1,0,2]=4 1970 B12R1.37 CCCCCCNc1ccno1 3513a7e9da93e433db06c4f2c4f23f00 [0,0,0,1,0,0|2,0,1]=4 1971 B12R1.37 CCCCCCOC1C=CCC1 fb6fe820ee5aec5830927b27a5042c99 [0,0,0,1,0,0|2,0,0]=3 1972 B12R1.37 CCCCCCOC1CCCO1 a784d5baf1031429a7cb4335edc7e840 [0,0,0,1,0,0|1,0,2]=4 1973 B12R1.37 CCCCCCOc1ccco1 8cfc09f94ff03b23af7786a6374c9abc [0,0,0,1,0,0|1,0,2]=4 1974 B12R1.37 CCCCCNCC1CCCO1 58005a6250010bca29ca4950614fecfe [0,0,0,1,0,0|1,0,2]=4 1975 B12R1.37 CCCCCNC[C@@H]1CCCO1 885a217390b70505aae0de281c0c18f9 [0,0,0,1,0,0|1,0,2]=4 1976 B12R1.37 CCCCCNC[C@H]1CCCO1 d782c53b7135d3b8b5a497fbd37f2322 [0,0,0,1,0,0|1,0,2]=4 1977 B12R1.37 CCCCCNCc1ccco1 0d2a7e7994936d84447dd28ebeebbe81 [0,0,0,1,0,0|1,0,2]=4 1978 B12R1.37 CCCCCNCc1ccno1 8936603c4772481516f5f4e7b548e1ee [0,0,0,1,0,0|2,0,1]=4 1979 B12R1.37 CCCCCOCC1C=CCC1 c9dca47e92cd405ce08214550be345a6 [0,0,0,1,0,0|2,0,0]=3 1980 B12R1.37 CCCCCOCC1CCCO1 43d5eecb03049bb2b0418e1f8450fb4f [0,0,0,1,0,0|1,0,2]=4 1981 B12R1.37 CCCCCOC[C@@H]1CCCO1 167d70c4f06b79f05d0a5663da79cc95 [0,0,0,1,0,0|1,0,2]=4 1982 B12R1.37 CCCCCOC[C@H]1CCCO1 51a1bede5e76b985ae823936b91eb589 [0,0,0,1,0,0|1,0,2]=4 1983 B12R1.37 CCCCCOCc1ccco1 557c89e123001911e56b3421696ebf11 [0,0,0,1,0,0|1,0,2]=4 1984 B12R1.37 CCCCCOCc1ccno1 c4a8f9f3f62109a63497f8b181cfe734 [0,0,0,1,0,0|2,0,1]=4 1985 B12R1.37 CCCCNCCC1CCCO1 737e326ded73092df0d88261344e7481 [0,0,0,1,0,0|1,0,2]=4 1986 B12R1.37 CCCCNCCc1ccco1 f1a6e7bef760ebee5097e21f3ac2dc8c [0,0,0,1,0,0|1,0,2]=4 1987 B12R1.37 CCCCOCCC1CCCO1 0580c703421a0efd598daec454ae9f8a [0,0,0,1,0,0|1,0,2]=4 1988 B12R1.37 CCCCOCCc1ccco1 fbd46e274ee803351ace623e362366aa [0,0,0,1,0,0|1,0,2]=4 1989 B12R1.37 CCCCOCOC1C=CCC1 ded0e4f2f3966b25119016b64d82c963 [0,0,0,1,0,0|3,0,0]=4 1990 B12R1.37 CCCNCCCC1CCCC1 013f5e548721feb26186b97b111b664c [0,0,0,1,0,0|2,0,1]=4 1991 B12R1.37 CCCNCCCc1ccco1 e946fe96bad1891961df03e2504913dd [0,0,0,1,0,0|1,0,2]=4 1992 B12R1.37 CCCOCCCC1CCCC1 e2ec48fb1d1af1762ee16e22e32d7e1b [0,0,0,1,0,0|2,0,1]=4 1993 B12R1.37 CCCOCCCc1ccco1 9ac4b1617711b1fd2f4c01a3eb503ef4 [0,0,0,1,0,0|1,0,2]=4 1994 B12R1.37 CCCOCCOC1C=CCC1 e50210f4a59d44797369ce1e250ed013 [0,0,0,1,0,0|3,0,0]=4 1995 B12R1.37 CCNCCCCC1CCCC1 5ac1edb9dc7bc925fbc12311a13245e3 [0,0,0,1,0,0|2,0,1]=4 1996 B12R1.37 CCOCCCOC1C=CCC1 812b0966201ce0c26f683f1a84f6564c [0,0,0,1,0,0|3,0,0]=4 1997 B12R1.37 CCOCCOCC1C=CCC1 38b3e2148a18fe0a671fd14062662064 [0,0,0,1,0,0|3,0,0]=4 1998 B12R1.37 CCSCCCOC1C=CCC1 8ff926d8da6b688a5ef17c50bf3eeae2 [0,0,0,1,0,0|3,0,0]=4 1999 B12R1.37 CCSCCOCC1C=CCC1 7f7396339fccb0a475617f86cc572fb3 [0,0,0,1,0,0|3,0,0]=4 2000 B12R1.37 COCCCCOC1C=CCC1 65cffd9b0e21b63597b716327d444558 [0,0,0,1,0,0|3,0,0]=4 2001 B12R1.37 COCCCOCC1C=CCC1 fe286d7c09bf30a28fef900a90f18867 [0,0,0,1,0,0|3,0,0]=4 2002 B12R1.37 CSCCCOCC1C=CCC1 0c4c562dbc84e25ba063eba160e32e8b [0,0,0,1,0,0|3,0,0]=4 2003 B12R1.37 FCCCCCOC1C=CCC1 9e2039f134868bd5b27aefe08ce76806 [0,0,0,1,0,0|3,0,0]=4 2004 B12R1.37 FCCCCOCC1C=CCC1 61a2417e5ca3fc21dd6b2ed7e2aa7f7d [0,0,0,1,0,0|3,0,0]=4 2005 B12R1.37 FCCNCCCC1CCCC1 55e02c3f448391bfd93e241c7ce9c8e0 [0,0,0,1,0,0|2,0,1]=4 2006 B12R1.37 FCCOCCCC1CCCC1 2aa404e15b55266750d59fbd95b67f5a [0,0,0,1,0,0|2,0,1]=4 2007 B12R1.37 FCNCCCCC1CCCC1 0d1a9de52e035550083cd5075f0db219 [0,0,0,1,0,0|2,0,1]=4 2008 B12R1.37 ICCNCCCC1CCCC1 32fe34b3d83e62cf5b98867381cf1fed [0,0,0,1,0,0|2,0,1]=4 2009 B12R1.37 N#CC=CCNCC1CCCC1 16585eba3ed88e5b1349d448c223c5ff [0,0,0,1,0,0|2,0,1]=4 2010 B12R1.37 N#CC=CCOCC1CCCC1 0ef37e6ebbcf0094249e52f7b00ba639 [0,0,0,1,0,0|2,0,1]=4 2011 B12R1.37 O/C=C\CNCCC1CCCC1 f4beddd99fc54f473cbf09d2b0eb8f56 [0,0,0,1,0,0|1,0,2]=4 2012 B12R1.37 O=C/C=C/COCC1CCCC1 221248c642f6915a47d77459c15797da [0,0,0,1,0,0|1,0,2]=4 2013 B12R1.37 OCC#CCNCC1CCCC1 ef8cac318fe5a6cf27f9f00165d8cbdb [0,0,0,1,0,0|1,0,2]=4 2014 B12R1.37 OCCCCCNC1CCCC1 2e43a5f1f18c11463c0aa4456dfc923e [0,0,0,1,0,0|1,0,2]=4 2015 B12R1.37 OCCCCNCC1CCCC1 5b1214b277d131860cc3778a3691c055 [0,0,0,1,0,0|1,0,2]=4 2016 B12R1.37 OCCCNCCC1CCCC1 5f92420aaf03eaa4713a44e5a539d477 [0,0,0,1,0,0|1,0,2]=4 2017 B12R1.37 OCCNCCCC1CCCC1 177ba57c849211480c1491985a78d360 [0,0,0,1,0,0|1,0,1]=3 2018 B12R1.37 OCCNCCCC1CCOC1 f3efdd94d8db59e71e5df3f9fc915533 [0,0,0,1,0,0|2,0,1]=4 2019 B12R1.37 OCCNCCCN1CCCC1 40456a189ef49646ab2203718a324ff9 [0,0,0,1,0,0|2,0,1]=4 2020 B12R1.37 OCCNCCOC1CCCC1 b77fa35d12607226f62f49f4341ea77e [0,0,0,1,0,0|2,0,1]=4 2021 B12R1.37 OCCNCCSC1CCCC1 32545c78b11464d0907541d5d2ddd0cf [0,0,0,1,0,0|2,0,1]=4 2022 B12R1.37 OCCOCCNC1CCCC1 3e757ada8c7a1936f94c24c13376294b [0,0,0,1,0,0|2,0,1]=4 2023 B12R1.37 OCCSCCNC1CCCC1 4dda352fed3040262381daabb825146c [0,0,0,1,0,0|2,0,1]=4 2024 B12R1.37 OCNCCCCC1CCCC1 2caa6d41bbbb8593321305492597919f [0,0,0,1,0,0|1,0,1]=3 2025 B12R1.37 OCNCCCCN1CCCC1 7f0988ed5f65cafd737e4cdb7955df70 [0,0,0,1,0,0|2,0,1]=4 2026 B12R1.37 OCNCCCOC1CCCC1 107cac7c1385e5b6e7f3a8b599fd033b [0,0,0,1,0,0|2,0,1]=4 2027 B12R1.37 SCCNCCCC1CCCC1 e7b53544b87a1833d7acf104fb7b2aa0 [0,0,0,1,0,0|1,1,1]=4 2028 B12R1.37 SCCOCCCC1CCCC1 2ba396866977958b89b9d8bc3be1c7dd [0,0,0,1,0,0|1,1,1]=4 2029 B12R1.45 CC/C=C/CN1CCCC1CC 57dacdc0fffd40a60ec31ed0ff47607b [0,0,0,1,0,0|2,0,0]=3 2030 B12R1.45 CC/C=C/CN1CCCC1CO 565ad61cb32f6ab142555938bae54a2f [0,0,0,1,0,0|3,0,0]=4 2031 B12R1.45 CC/C=C/CN1CCCC1OC a4cfce7d1f2651f6ee52a0d372a9eb71 [0,0,0,1,0,0|3,0,0]=4 2032 B12R1.45 CC/C=C/CN1CCC[C@@H]1CF 264e8987fa5e1097e8e4bf70c715a5b2 [0,0,0,1,0,0|3,0,0]=4 2033 B12R1.45 CC/C=C/CN1CCC[C@@H]1CO 3fe33c879cb9384ad4ee8c5f721e1562 [0,0,0,1,0,0|3,0,0]=4 2034 B12R1.45 CC/C=C/CN1CCC[C@H]1CC 075a294c4d057ad3250298c6a3755912 [0,0,0,1,0,0|2,0,0]=3 2035 B12R1.45 CC/C=C/CN1CCC[C@H]1CF a830de6ce3bdbe04ef8c2dbfc7738fe1 [0,0,0,1,0,0|3,0,0]=4 2036 B12R1.45 CC/C=C/CN1CCC[C@H]1CO 9828a661bdc9b1f861cac1a10bd0c2c1 [0,0,0,1,0,0|3,0,0]=4 2037 B12R1.45 CCC1CCCN1CC=CC#N fe27fde33296469097497ddf5345c285 [0,0,0,1,0,0|2,0,1]=4 2038 B12R1.45 CCC1CCCN1CCCCO 70ffdf28f23049794fba93b3f5dd6a61 [0,0,0,1,0,0|1,0,2]=4 2039 B12R1.45 CCCCCN1CC=CC1CO 03401c20c810423096265cc6dbe8e832 [0,0,0,1,0,0|1,0,2]=4 2040 B12R1.45 CCCCCN1CCCC1CO f15fc04f127c8a53c228e2fe66e9655d [0,0,0,1,0,0|1,0,2]=4 2041 B12R1.45 CCCCCN1CCC[C@@H]1CO ca06160c64d0449532ebd6bdb83ff506 [0,0,0,1,0,0|1,0,2]=4 2042 B12R1.45 CCCCCN1CCC[C@H]1CO 9a322e09bf59b4c78cfbd03d9a99dec9 [0,0,0,1,0,0|1,0,2]=4 2043 B12R1.45 CCCCN[C@H]1CCC[C@H]1CO e647fc5c356082886e15ed6555250267 [0,0,0,1,0,0|1,0,2]=4 2044 B12R1.45 CCN1CCCC1CNCCO 4b9041c5172deb82f80bff45d53ec427 [0,0,0,1,0,0|2,0,1]=4 2045 B12R1.45 CCN1CCC[C@@H]1CNCCO 961df102cadb6746f3e7ed718317086e [0,0,0,1,0,0|2,0,1]=4 2046 B12R1.45 CCN1CCC[C@H]1CNCCO 1266ac0cfb055cf67774d060a4953a86 [0,0,0,1,0,0|2,0,1]=4 2047 B12R1.45 CC[C@@H]1CCCN1CC=CC#N 5fe1f26b53d4e58b21dc7730725261e7 [0,0,0,1,0,0|2,0,1]=4 2048 B12R1.45 CC[C@@H]1CCCN1CCCCO 20b9d7005a95573f5945925de58af1d6 [0,0,0,1,0,0|1,0,2]=4 2049 B12R1.45 CC[C@@H]1CCC[C@H]1NC/C=C\O a45f67b20af4b0e7793cf94400c0473a [0,0,0,1,0,0|1,0,2]=4 2050 B12R1.45 CC[C@@H]1CCC[C@H]1NCCCO 49564aea2c75ce1e7b517d54484b82da [0,0,0,1,0,0|1,0,2]=4 2051 B12R1.52 CCN[C@H]1CCCCCC[C@@H]1O c2a15b6f23f81f09f6169612a5318c2f [0,0,0,1,0,0|1,0,2]=4 2052 B12R1.52 OCN[C@H]1CCCCCC[C@@H]1O a9f253c167b94e1e343d6b8efb9615d2 [0,0,0,1,0,0|2,0,1]=4 2053 B12R1.121 CCC1CCCCC1OCCF 67f60fa8a8bed8e26b6d678b49b6e8c4 [0,0,0,1,0,0|2,0,1]=4 2054 B12R1.121 CCC1CCCCC1OCCS 44794fcfb0bdcca2cb4956d195ba2403 [0,0,0,1,0,0|1,1,1]=4 2055 B12R1.121 CCC1CCCCN1C/C=C\O 31c72ab5ca950260401e758a412c1cc5 [0,0,0,1,0,0|1,0,2]=4 2056 B12R1.121 CCC1CCCCN1CCCO 4fcc2994db70d092c5b3b0e0f9081de4 [0,0,0,1,0,0|1,0,2]=4 2057 B12R1.121 CCC1COCCC1NCCO 076a92976bb66a5a52df5b1967dd906d [0,0,0,1,0,0|2,0,1]=4 2058 B12R1.121 CCCCN1CCCCC1CO 9ce79bb596702edec2ce433d30665da5 [0,0,0,1,0,0|1,0,2]=4 2059 B12R1.121 CCCCN1CCCC[C@@H]1CO fb70076e47f33252bd67f80aa4d0af48 [0,0,0,1,0,0|1,0,2]=4 2060 B12R1.121 CCCCN1CCCC[C@H]1CO 1a1ddb6c5de5a2e32a42bdbc1d1e6411 [0,0,0,1,0,0|1,0,2]=4 2061 B12R1.121 CCCN[C@@H]1CCCC[C@@H]1CO 1dcb60b263f2c8a83026b48311476e15 [0,0,0,1,0,0|1,0,2]=4 2062 B12R1.121 CCCN[C@@H]1CCCC[C@H]1CO 991f62d788fa2fcea01bc0fd1805ba94 [0,0,0,1,0,0|1,0,2]=4 2063 B12R1.121 CCCN[C@H]1CCCC[C@H]1CO a81f5843daed1838e571dcf264b26fd6 [0,0,0,1,0,0|1,0,2]=4 2064 B12R1.121 CCCOC1CCCCC1CC 3e79f6dff69955cbdd8c592c27f3d258 [0,0,0,1,0,0|2,0,1]=4 2065 B12R1.121 CCN1CCCCC1CCCO df045224348ce7cdca8e36ca522614a8 [0,0,0,1,0,0|1,0,2]=4 2066 B12R1.121 CCN1CCCCC1CNCO 6edf6b9069db53e77ce8d3d5e80f69ff [0,0,0,1,0,0|2,0,1]=4 2067 B12R1.121 CC[C@@H]1CCCCN1C/C=C\O e9034a5e7a4fd90ee5680e3bb8681699 [0,0,0,1,0,0|1,0,2]=4 2068 B12R1.121 CC[C@@H]1CCCCN1CCCO 521011d77163028a5914e3e3e1a81639 [0,0,0,1,0,0|1,0,2]=4 2069 B12R1.121 CC[C@H]1CCCCN1C/C=C\O 42f507d5d639e0e91c35f6b9c2ae99b0 [0,0,0,1,0,0|1,0,2]=4 2070 B12R1.121 CC[C@H]1CCCCN1CCCO ee50f440d770fb57aba09eaea7748d5c [0,0,0,1,0,0|1,0,2]=4 2071 B12R1.121 COC1CCCCC1NCCO 73d7c2d8d45d8a911ea799087bcc12bd [0,0,0,1,0,0|2,0,1]=4 2072 B12R1.121 COCCC1CCCCN1CO 044beb96e38d06bead26558cc7ec340d [0,0,0,1,0,0|2,0,1]=4 2073 B12R1.121 CO[C@H]1CCCC[C@@H]1NCCO 8784ef6c0257ae8ed699f5573d59a7ff [0,0,0,1,0,0|2,0,1]=4 2074 B12R1.121 OCCCC1CCCCN1CO bbf4a05d680042f6bdeaa3803e664570 [0,0,0,1,0,0|2,0,1]=4 2075 B12R1.121 OCCN[C@@H]1CCCC[C@@H]1CO da5a3d040485223729bc968a9e2a8695 [0,0,0,1,0,0|2,0,1]=4 2076 B12R1.121 OCCN[C@@H]1CCCC[C@H]1CO 5003142808d5412d12651ad650662a4f [0,0,0,1,0,0|2,0,1]=4 2077 B12R1.121 OCCN[C@H]1CCCC[C@H]1CO 78cec753df44f7e609f67d985df5bf2c [0,0,0,1,0,0|2,0,1]=4 2078 B12R1.169 CCCC1CCCCC1OCC 3a019d1364554efae6c28ec1fd2953e3 [0,0,0,1,0,0|2,0,1]=4 2079 B12R1.169 CCCC1CCCCC1OCF e120d3cfc72e2375c18d9fc368c877b4 [0,0,0,1,0,0|2,0,1]=4 2080 B12R1.169 CCCC1COCCN1CCO 962c30ab7f63d7804d67d41a42bb54be [0,0,0,1,0,0|2,0,1]=4 2081 B12R1.169 CCCN1CCCCC1CCO faad90df3a7ab3022b1023e2efb123e0 [0,0,0,1,0,0|1,0,2]=4 2082 B12R1.169 CCCN1CCCC[C@@H]1CCO 8adedee799e06c940ab3576b7f012f5b [0,0,0,1,0,0|1,0,2]=4 2083 B12R1.169 CCCN1CCCC[C@H]1CCO d7f2363a4338c1e2102c82296f15aa6f [0,0,0,1,0,0|1,0,2]=4 2084 B12R1.169 COCC1CCCCN1CCO 6a30a6b0d10750ec0d07e632ad86cc18 [0,0,0,1,0,0|2,0,1]=4 2085 B12R1.169 OCCC1CCCCN1CCO f4930e27fb8d79c267430a48c7627fc9 [0,0,0,1,0,0|2,0,1]=4 2086 B12R1.169 OCCN1CCCCC1CCCl cf645940ba43e98075334715b4a8cc4c [0,0,0,1,0,0|2,0,1]=4 2087 B12R1.169 OCC[C@@H]1CCCCN1CCO 1445ec6f4c08c3e6b671508d11910ec8 [0,0,0,1,0,0|2,0,1]=4 2088 B12R1.169 OCC[C@H]1CCCCN1CCO 953d940f88c25fb07d269fff9bc4448f [0,0,0,1,0,0|2,0,1]=4 2089 B12R1.173 CCCN1CCCCCCCC1 123ca0e6590c73ac248efa4d87cbbd3f [0,0,0,1,0,0|2,0,1]=4 2090 B12R1.173 FCCN1CCCCCCCC1 45f19f59bf7ceb4059c89a58f5946ffa [0,0,0,1,0,0|2,0,1]=4 2091 B12R1.173 OCCN1CCCCCCCC1 68cdcc2cad8dad04040fec3894ca9693 [0,0,0,1,0,0|1,0,1]=3 2092 B12R1.173 SCCN1CCCCCCCC1 2c33e9fb98e9922c2df71982259b0d2b [0,0,0,1,0,0|1,1,1]=4 2093 B12R1.267 CC/C=C/CN1CCCCC1C 75864030b8085dfbce39add2976e9535 [0,0,0,1,0,0|2,0,0]=3 2094 B12R1.267 CC/C=C/CN1CCCC[C@@H]1C b34ab1022f8510e4dff331815e1c272e [0,0,0,1,0,0|2,0,0]=3 2095 B12R1.267 CC/C=C/CN1CCCC[C@H]1C 8810004199735de7c3ba949430ffcb04 [0,0,0,1,0,0|2,0,0]=3 2096 B12R1.267 CC/C=C/CN1CCOCC1C 4fabd59190aa1573beffe48a257d34e8 [0,0,0,1,0,0|3,0,0]=4 2097 B12R1.267 CC/C=C/CN1CCOC[C@@H]1C 342e5ce0ad9822698a9d7ebd8fe884f0 [0,0,0,1,0,0|3,0,0]=4 2098 B12R1.267 CC/C=C/CN1CCOC[C@H]1C b1be7fd1196328520e4e2d8ebf824e1c [0,0,0,1,0,0|3,0,0]=4 2099 B12R1.267 CC1CCCCC1CNCCF b839983148f5a8c132d811e60bbc3b8a [0,0,0,1,0,0|2,0,1]=4 2100 B12R1.267 CC1CCCCC1CNCCO cd6934d080269d9d84bea2c4f835ae58 [0,0,0,1,0,0|1,0,1]=3 2101 B12R1.267 CC1CCCCC1CNCCS 5779546cde12ea8af02d25ae05794c47 [0,0,0,1,0,0|1,1,1]=4 2102 B12R1.267 CC1CCCCC1NC/C=C\O 2eaa3cc5905b82dbae15bf343e40276e [0,0,0,1,0,0|1,0,2]=4 2103 B12R1.267 CC1CCCCC1NCCCO 8080d1696c25dbd39d13e81f494f7893 [0,0,0,1,0,0|1,0,2]=4 2104 B12R1.267 CC1CCCCN1CC=CC#N fe82921233c039258c54a274ed5e8dfc [0,0,0,1,0,0|2,0,1]=4 2105 B12R1.267 CC1CCCCN1CCCCO fda0a2e39c540a0fcafa720973424910 [0,0,0,1,0,0|1,0,2]=4 2106 B12R1.267 CC1CCCCN1CCNCO 3b05df3cbbfa34f054e51c94a987407c [0,0,0,1,0,0|2,0,1]=4 2107 B12R1.267 CCCCNC1CCCCC1O 07d3bfbd33594c1f67c71be3f5de8cb6 [0,0,0,1,0,0|1,0,2]=4 2108 B12R1.267 CCCCNC1CCOCC1O 4b0eb0eaed69dc5c963ae5484f443ad8 [0,0,0,1,0,0|2,0,1]=4 2109 B12R1.267 CCCCN[C@@H]1CCCC[C@H]1O f06ec26b0a0d5ddd148df6917f226f92 [0,0,0,1,0,0|1,0,2]=4 2110 B12R1.267 CCCCN[C@@H]1CCOC[C@@H]1O 509cb406790d15ac46e14dfc8c8efdbe [0,0,0,1,0,0|2,0,1]=4 2111 B12R1.267 CCCCN[C@@H]1CCOC[C@H]1O 0cb349ccb952c6f8f603d36acd1ef152 [0,0,0,1,0,0|2,0,1]=4 2112 B12R1.267 CCCCN[C@H]1CCCC[C@@H]1O a1d102a85e7609b1773aac16e0fc0699 [0,0,0,1,0,0|1,0,2]=4 2113 B12R1.267 CCCCN[C@H]1CCCC[C@H]1O db40fa0717ea50f143718821fb84b0e0 [0,0,0,1,0,0|1,0,2]=4 2114 B12R1.267 CCCCN[C@H]1CCOC[C@@H]1O 6d7e816b83427cba87d23fba5bad94ec [0,0,0,1,0,0|2,0,1]=4 2115 B12R1.267 CCCCN[C@H]1CCOC[C@H]1O cc827f6b374963551b1ac7969a27bf47 [0,0,0,1,0,0|2,0,1]=4 2116 B12R1.267 CCCNCC1CCCCC1C f47112bfffbea6d6130abee7aca6e9c5 [0,0,0,1,0,0|2,0,1]=4 2117 B12R1.267 CCCNCC1CCCCC1O 4c1e2bf92072f12ce5daa2c95eec0e23 [0,0,0,1,0,0|1,0,2]=4 2118 B12R1.267 CN1CCCCC1CCNCO 5f524690fb8717e1bb83df750c69f4dc [0,0,0,1,0,0|2,0,1]=4 2119 B12R1.267 CN1CCCCC1CNCCO 996623c4824038b6bbff75e644c9f1d8 [0,0,0,1,0,0|2,0,1]=4 2120 B12R1.267 C[C@@H]1CCCCN1CC=CC#N 24e89d856994c53245705ad9ac0de039 [0,0,0,1,0,0|2,0,1]=4 2121 B12R1.267 C[C@@H]1CCCCN1CCCCO ad5ed12fc2f30c9da18292609353c491 [0,0,0,1,0,0|1,0,2]=4 2122 B12R1.267 C[C@@H]1CCCC[C@@H]1NC/C=C\O 3c57b1134fcf69bb64cb99dc7932062e [0,0,0,1,0,0|1,0,2]=4 2123 B12R1.267 C[C@@H]1CCCC[C@@H]1NCCCO b99a7a990735ef53a3098996bcc77117 [0,0,0,1,0,0|1,0,2]=4 2124 B12R1.267 C[C@@H]1CCCC[C@H]1NC/C=C\O 2e810839b0a6e5007c029b310214d705 [0,0,0,1,0,0|1,0,2]=4 2125 B12R1.267 C[C@@H]1CCCC[C@H]1NCCCO 053eb3ae1b91a83d1fd1cc70f0c949a9 [0,0,0,1,0,0|1,0,2]=4 2126 B12R1.267 C[C@H]1CCCCN1CC=CC#N 5c1793f8d88bd9e8b22fa68be27bad00 [0,0,0,1,0,0|2,0,1]=4 2127 B12R1.267 C[C@H]1CCCCN1CCCCO df0e8c24add0fba09b06b565de72faae [0,0,0,1,0,0|1,0,2]=4 2128 B12R1.267 C[C@H]1CCCC[C@@H]1NC/C=C\O 440e871f382a938f14b07f813cb287a0 [0,0,0,1,0,0|1,0,2]=4 2129 B12R1.267 C[C@H]1CCCC[C@@H]1NCCCO 0be3d75894971ac80b104462997f7970 [0,0,0,1,0,0|1,0,2]=4 2130 B12R1.267 C[C@H]1CCCC[C@H]1NC/C=C\O 482d51cbe038b2408a70bf7886a2286b [0,0,0,1,0,0|1,0,2]=4 2131 B12R1.267 C[C@H]1CCCC[C@H]1NCCCO 4454c0ed397f96d3bd3ad0ede4bb6ef1 [0,0,0,1,0,0|1,0,2]=4 2132 B12R1.267 OCCNCC1CCCCC1O ef8e1fa922c85f82878399bb155a692b [0,0,0,1,0,0|2,0,1]=4 2133 B12R1.271 CC/C=C\CCOCC1CC1C e335a6508b1ad1959ae41e0d6b295cf8 [0,0,0,1,0,0|2,0,0]=3 2134 B12R1.271 CC/C=C\CCOC[C@@H]1C[C@@H]1C 6d4f9c0de2c74dba23e1533f9c62da65 [0,0,0,1,0,0|2,0,0]=3 2135 B12R1.271 CC/C=C\CCOC[C@@H]1C[C@@H]1F 7b7a5099298cec9878a911d8336335ba [0,0,0,1,0,0|3,0,0]=4 2136 B12R1.271 CC/C=C\CCOC[C@@H]1C[C@H]1C c7d9685b17f3ef06a5708bb0a56fe53c [0,0,0,1,0,0|2,0,0]=3 2137 B12R1.271 CC/C=C\CCOC[C@@H]1C[C@H]1F 8ccb808d8c3c70445f67f5d497eaffdc [0,0,0,1,0,0|3,0,0]=4 2138 B12R1.271 CC/C=C\CCOC[C@H]1C[C@@H]1C d7e359e0d32d40cdce54fb37dce53d07 [0,0,0,1,0,0|2,0,0]=3 2139 B12R1.271 CC/C=C\CCOC[C@H]1C[C@@H]1F 10c89492221bbf617d4dc5714d3d2f9c [0,0,0,1,0,0|3,0,0]=4 2140 B12R1.271 CC/C=C\CCOC[C@H]1C[C@H]1F 089b737c4a4a4e4872a2de3df282ce25 [0,0,0,1,0,0|3,0,0]=4 2141 B12R1.271 CC1CC1NCCCCCCO 9ca55ff423135930d30db5a4a59b327a [0,0,0,1,0,0|1,0,2]=4 2142 B12R1.272 C=C/C=C/CCNCC1CCC1 38343594c339cc940d3e6b5a16baaddf [0,0,0,1,0,0|2,0,1]=4 2143 B12R1.272 CC/C=C/CCOCC1CCC1 fdf8a4aa27d1e6c6521de234bbe3075f [0,0,0,1,0,0|2,0,0]=3 2144 B12R1.272 CC/C=C/CCOCC1CCO1 06f9c5c8f3b9b25de7cd8ecc6143241e [0,0,0,1,0,0|3,0,0]=4 2145 B12R1.272 CC/C=C/CCOCC1COC1 a920ae90e759ddb3cd53d45b21d27f97 [0,0,0,1,0,0|3,0,0]=4 2146 B12R1.272 CC/C=C/CCOC[C@@H]1CCO1 24f357144ee542e215f06be61418035e [0,0,0,1,0,0|3,0,0]=4 2147 B12R1.272 CC/C=C/CCOC[C@H]1CCO1 e82cf79bedcd052732107fc5dbd3e1ca [0,0,0,1,0,0|3,0,0]=4 2148 B12R1.272 CC/C=C/CNCCC1CCC1 cc1f523fb7b5d6a5673ffb3d9ccaa542 [0,0,0,1,0,0|2,0,0]=3 2149 B12R1.272 CC/C=C/CNCCC1CCO1 e93b296c5da495301f73a143b0a7570d [0,0,0,1,0,0|3,0,0]=4 2150 B12R1.272 CC/C=C/CNCCC1COC1 ff0faa907c1facc45d7cfaecf0012b42 [0,0,0,1,0,0|3,0,0]=4 2151 B12R1.272 CC/C=C/CNCCN1CCC1 3b6ea7271f8820eaa8673776cb476492 [0,0,0,1,0,0|3,0,0]=4 2152 B12R1.272 CC/C=C/CNCC[C@@H]1CCO1 2b6886b355a548526cf853eeb7136b4c [0,0,0,1,0,0|3,0,0]=4 2153 B12R1.272 CC/C=C/COCCC1CCC1 3eb8c1e8bc47d5e62edfed9d949e2170 [0,0,0,1,0,0|2,0,0]=3 2154 B12R1.272 CC/C=C/COCCC1CCO1 7d7afcfb3127c26277e4229499bd53a6 [0,0,0,1,0,0|3,0,0]=4 2155 B12R1.272 CC/C=C/COCCC1COC1 a1912c15463611744378115474ee741c [0,0,0,1,0,0|3,0,0]=4 2156 B12R1.272 CC/C=C/COCCN1CCC1 70f82ec8ef48d2601d176a36c909f14f [0,0,0,1,0,0|3,0,0]=4 2157 B12R1.272 CC/C=C/COCC[C@@H]1CCO1 aeb459010dda007ad1e107b808fdfa3d [0,0,0,1,0,0|3,0,0]=4 2158 B12R1.272 CC/C=C/COCC[C@H]1CCO1 30d9683dc52926497e96cdea14953d27 [0,0,0,1,0,0|3,0,0]=4 2159 B12R1.272 CC/C=C\CCCOC1CCC1 04818645248df48aea14de639580243d [0,0,0,1,0,0|2,0,0]=3 2160 B12R1.272 CC/C=C\CCCOC1COC1 b20a6d55f57e08bc8b61fcdb0498fcfc [0,0,0,1,0,0|3,0,0]=4 2161 B12R1.272 CC/C=C\CCNCC1CCC1 d1f3e6237d4a55221d06075a1449b5da [0,0,0,1,0,0|2,0,0]=3 2162 B12R1.272 CC/C=C\CCNCC1CCO1 bca04daf043ad0b7b409d001c896ac13 [0,0,0,1,0,0|3,0,0]=4 2163 B12R1.272 CC/C=C\CCNCC1COC1 2a954051a3aeb5089182127a18c24b9d [0,0,0,1,0,0|3,0,0]=4 2164 B12R1.272 CC/C=C\CCNC[C@@H]1CCO1 27c914ccd343cf2684606affbbf12f7b [0,0,0,1,0,0|3,0,0]=4 2165 B12R1.272 CC/C=C\CCNC[C@H]1CCO1 bd356bf85e2d29c59bc28246d2a73dfa [0,0,0,1,0,0|3,0,0]=4 2166 B12R1.272 CC/C=C\CCOCC1CCC1 a255c129dfe819aec185d6bf0dadf4b2 [0,0,0,1,0,0|2,0,0]=3 2167 B12R1.272 CC/C=C\CCOCC1CCO1 d72edb3c02467c01b6c84f08945bc4fe [0,0,0,1,0,0|3,0,0]=4 2168 B12R1.272 CC/C=C\CCOCC1COC1 035065423d1d45a345b2e46db79f38b2 [0,0,0,1,0,0|3,0,0]=4 2169 B12R1.272 CC/C=C\CCOCC1CSC1 c1696b424801c57f2ec611c8dbe0ed8d [0,0,0,1,0,0|3,0,0]=4 2170 B12R1.272 CC/C=C\CCOC[C@@H]1CCO1 816b0b353805cac2b24465f6d6c80ffa [0,0,0,1,0,0|3,0,0]=4 2171 B12R1.272 CC/C=C\CCOC[C@H]1CCO1 a74b1357ea077f9723931124392672fb [0,0,0,1,0,0|3,0,0]=4 2172 B12R1.272 CC/C=C\COCCC1CCC1 ad322434b98dec84bf4d30bb6c00ffd2 [0,0,0,1,0,0|2,0,0]=3 2173 B12R1.272 CC/C=C\COCCC1CCO1 1d546c9f713a88255145c39a64ef6c05 [0,0,0,1,0,0|3,0,0]=4 2174 B12R1.272 CC/C=C\COCCC1COC1 6dd00d6a4a2ed7b6b6db1c2a8ce60af5 [0,0,0,1,0,0|3,0,0]=4 2175 B12R1.272 CCCCCCCCN1CCC1 5a69648be43a851becafcd53a2d6e293 [0,0,0,1,0,0|2,0,1]=4 2176 B12R1.272 CCCCCCNCC1CCO1 8ccc148ab536509f3ed0c8ddaee59991 [0,0,0,1,0,0|1,0,2]=4 2177 B12R1.272 CCCCCCNC[C@@H]1CCO1 002823e4c213ac7269cde41099cd41a9 [0,0,0,1,0,0|1,0,2]=4 2178 B12R1.272 CCCCCCNC[C@H]1CCO1 090e5c98c44d92cbf44ce77e017be260 [0,0,0,1,0,0|1,0,2]=4 2179 B12R1.272 CCCCCCOCC1CCO1 9cd9a9ac418cee6f2c949b093ee548b9 [0,0,0,1,0,0|1,0,2]=4 2180 B12R1.272 CCCCCCOC[C@@H]1CCO1 718906fcb7c61b1957b26d53344d429b [0,0,0,1,0,0|1,0,2]=4 2181 B12R1.272 CCCCCCOC[C@H]1CCO1 a6ccd1ddca9aaeac6a0c61c57c396cc0 [0,0,0,1,0,0|1,0,2]=4 2182 B12R1.272 CCCCCNCCC1CCO1 fa21c818b5d697b9fe3328f5311e9098 [0,0,0,1,0,0|1,0,2]=4 2183 B12R1.272 CCCCCNCC[C@@H]1CCO1 9b801df27179d546a1d9e7db64c11f95 [0,0,0,1,0,0|1,0,2]=4 2184 B12R1.272 CCCCCOCCC1CCO1 3df76e1ba561e08d7ee22e315d82c69e [0,0,0,1,0,0|1,0,2]=4 2185 B12R1.272 CCCCCOCC[C@@H]1CCO1 5744ebad6ec95209f19fd294db187231 [0,0,0,1,0,0|1,0,2]=4 2186 B12R1.272 CCCCCOCC[C@H]1CCO1 1867b972c107ad80a81f3f7012dfaae1 [0,0,0,1,0,0|1,0,2]=4 2187 B12R1.272 N#CC=CCNCCC1CCC1 9c37eb5f77891576d0d2e05cfa3407d7 [0,0,0,1,0,0|2,0,1]=4 2188 B12R1.272 N#CC=CCOCCC1CCC1 73f23a15747732f35e026fe057db2c1f [0,0,0,1,0,0|2,0,1]=4 2189 B12R1.272 O=C/C=C/COCCC1CCC1 fac7cbbf74f80af00512787a00a30ddb [0,0,0,1,0,0|1,0,2]=4 2190 B12R1.272 OCC#CCNCCC1CCC1 e404ff09ed096d73a0c792a4dcb842f2 [0,0,0,1,0,0|1,0,2]=4 2191 B12R1.272 OCCCCCCCN1CCC1 2e3fc716c67292ae9fd48f0d579579c0 [0,0,0,1,0,0|1,0,2]=4 2192 B12R1.272 OCCCCCCNC1CCC1 c42dcab62c0d8b6411d41e66c0093eb6 [0,0,0,1,0,0|1,0,2]=4 2193 B12R1.272 OCCCCCNCC1CCC1 1c834986f209fab7d660994cc94667ab [0,0,0,1,0,0|1,0,2]=4 2194 B12R1.272 OCCCCNCCC1CCC1 011b2d604ca784c8d15705d1135df626 [0,0,0,1,0,0|1,0,2]=4 2195 B12R1.272 OCCOCCCNC1CCC1 2e832a88baedc188a4ebd5d2596af4c9 [0,0,0,1,0,0|2,0,1]=4 2196 B12R1.272 OCCOCCNCC1CCC1 d9d1b9a0d6ed8ea69bcf5f3c47c6433d [0,0,0,1,0,0|2,0,1]=4 2197 B12R1.272 OCCSCCNCC1CCC1 a4a7b7843838de5628ce27e494dd2e1c [0,0,0,1,0,0|2,0,1]=4 2198 B12R1.281 CCCN1CCCCCC1CO 79fc52d7728b3860f7fddfd4955fbd19 [0,0,0,1,0,0|1,0,2]=4 2199 B12R1.281 OCCN1CCCCCC1CO a36946bbe7bebfcb0012194e3fac26e2 [0,0,0,1,0,0|2,0,1]=4 2200 B12R1.282 CC/C=C/CN[C@H]1C[C@@H]1COC da2c23927bcb952c500364df0a083cf2 [0,0,0,1,0,0|3,0,0]=4 2201 B12R1.282 CC/C=C/CN[C@H]1C[C@H]1COC 08e38528f6b949f329e84e31be7e3d86 [0,0,0,1,0,0|3,0,0]=4 2202 B12R1.320 CCCCC1CCCC1NCC 0ce98edd89a206f3bb2a11291e2c2050 [0,0,0,1,0,0|2,0,1]=4 2203 B12R1.320 CCCCC1CCCC1NCF 9af963a176d5d0d69b7e0e47a41a1bbc [0,0,0,1,0,0|2,0,1]=4 2204 B12R1.320 CCCCC1CCCC1NCO 238a40d81b25f00ad98d7c6c18fea777 [0,0,0,1,0,0|1,0,1]=3 2205 B12R1.320 CCCCC1CCCN1CCC b5a2b6294e0043e42780d2363eb74ea3 [0,0,0,1,0,0|2,0,1]=4 2206 B12R1.320 CCCCC1CCCN1CCF 88baf184bb7765b23c1d4cf8f2e56a93 [0,0,0,1,0,0|2,0,1]=4 2207 B12R1.320 CCCCC1CCCN1CCO dfba3b86488c6d7c0d4e6bba54ce5122 [0,0,0,1,0,0|1,0,1]=3 2208 B12R1.320 CCCCC1CCCN1CCS f16f5742bd20fd5aa87cd98d7ad2fb08 [0,0,0,1,0,0|1,1,1]=4 2209 B12R1.320 CCCCN1CCCC1CCO d38c83ab506ad66b8d54e8685de9509d [0,0,0,1,0,0|1,0,2]=4 2210 B12R1.320 CCCCN1CCC[C@@H]1CCO bd78e713511e144336c30b555929ce05 [0,0,0,1,0,0|1,0,2]=4 2211 B12R1.320 CCOCC1CCCN1CCO 2fb2e2ecb48580d36998b0e08992e56d [0,0,0,1,0,0|2,0,1]=4 2212 B12R1.320 CCOC[C@@H]1CCCN1CCO 7a02b6a042cc60aa986caa3a0f2aef87 [0,0,0,1,0,0|2,0,1]=4 2213 B12R1.320 COCCC1CCCN1CCO 7719f5d40ab81929489c210ee32ed7d4 [0,0,0,1,0,0|2,0,1]=4 2214 B12R1.320 COC[C@@H]1CCC[C@@H]1NCCO edab116ab4f8b864d10e8bddb8246460 [0,0,0,1,0,0|2,0,1]=4 2215 B12R1.320 COC[C@H]1CCC[C@H]1NCCO b89d3c5d9e7a2fe4519a9edfe1bdd40c [0,0,0,1,0,0|2,0,1]=4 2216 B12R1.329 BrCCNC1CC/C=C\CCC1 ceaf356348591552fe3689fbede0a279 [0,0,0,1,0,0|3,0,0]=4 2217 B12R1.329 CCCNC1CC/C=C\CCC1 0e6be021ea2c89ee9665beddd96396aa [0,0,0,1,0,0|2,0,0]=3 2218 B12R1.329 CCCNC1CCCCCCC1 7f9125ee31f5a03093a77d52d7357740 [0,0,0,1,0,0|2,0,1]=4 2219 B12R1.329 CCCOC1CC/C=C/CCC1 1d601fcb16c90996b324da41e65a3154 [0,0,0,1,0,0|2,0,0]=3 2220 B12R1.329 CCCOC1CC/C=C\CCC1 9f36f1b74cd6f84a83553e780c1a956c [0,0,0,1,0,0|2,0,0]=3 2221 B12R1.329 CCCOC1CCC=CCCC1 8dfce14883f1db02334a1cc03bc6cf56 [0,0,0,1,0,0|2,0,0]=3 2222 B12R1.329 CCCOC1CCCCCCC1 4a765fc44e8d60716ce20532dd38b6d4 [0,0,0,1,0,0|2,0,1]=4 2223 B12R1.329 CCCO[C@@H]1CCC=CCCC1 b538539c3e14e626e486fabbb29333c8 [0,0,0,1,0,0|2,0,0]=3 2224 B12R1.329 CCOCC1CCCCCCC1 175d02310bf38ba881acd37e6e5716ed [0,0,0,1,0,0|2,0,1]=4 2225 B12R1.329 COCOC1CC/C=C/CCC1 7c664bc23270e91f0c3000478f36dbb6 [0,0,0,1,0,0|3,0,0]=4 2226 B12R1.329 COCOC1CC/C=C\CCC1 22b4cd4aa42e006dfec05b1a48c1c87f [0,0,0,1,0,0|3,0,0]=4 2227 B12R1.329 COCOC1CCC=CCCC1 e4eb245308aef2f42b46ab80bb83d47f [0,0,0,1,0,0|3,0,0]=4 2228 B12R1.329 COCO[C@@H]1CCC=CCCC1 1582dd250c6504ba2456314726365edb [0,0,0,1,0,0|3,0,0]=4 2229 B12R1.329 CSCOC1CC/C=C/CCC1 b1c8e72b2e229232c76d8b6a0761fb1d [0,0,0,1,0,0|3,0,0]=4 2230 B12R1.329 CSCOC1CC/C=C\CCC1 41b4fbf76fe4e72e5fdaa2c6a42ef2d7 [0,0,0,1,0,0|3,0,0]=4 2231 B12R1.329 CSCOC1CCC=CCCC1 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C/C=C/CCOCCSC 2d38818cd58c8496cbe29fdb8c8df6f6 [2,0,0,0,0,0|2,0,0]=4 2421 B9R0.45 C/C=C/CCOCOCC 70f3c48b000346091f71231d91c9996a [2,0,0,0,0,0|2,0,0]=4 2422 B9R0.45 C/C=C/CNCCCCC 173af57cfda70fbf416f0d5599bfa036 [2,0,0,0,0,0|1,0,0]=3 2423 B9R0.45 C/C=C/CNCCCCCl 403d470282ab81a987b4c495ce3e65b2 [2,0,0,0,0,0|2,0,0]=4 2424 B9R0.45 C/C=C/CNCCCCO ed0a9542760a19dc2971710326afc5ed [2,0,0,0,0,0|2,0,0]=4 2425 B9R0.45 C/C=C/CNCCCCS 42dce55feee6c9dd8609de6ac4aac20c [2,0,0,0,0,0|2,0,0]=4 2426 B9R0.45 C/C=C/CNCCCOC d2a8bcecabfc4119973e200bdda0f952 [2,0,0,0,0,0|2,0,0]=4 2427 B9R0.45 C/C=C/CNCCCSC a0c3ea3106200fc97b7a508253b676e7 [2,0,0,0,0,0|2,0,0]=4 2428 B9R0.45 C/C=C/CNCCOCC f6b74339a9458a435ce66f977b560c4d [2,0,0,0,0,0|2,0,0]=4 2429 B9R0.45 C/C=C/CNCCSCC 95eecb3a403e64e60768b69e1118582b [2,0,0,0,0,0|2,0,0]=4 2430 B9R0.45 C/C=C/COCCCCC 802c5cbc78037013e3e1230ad72e88ef [2,0,0,0,0,0|1,0,0]=3 2431 B9R0.45 C/C=C/COCCCCF b0a7ff31431d01dbfa0473bc3bacab4f [2,0,0,0,0,0|2,0,0]=4 2432 B9R0.45 C/C=C/COCCCCS ead8e557468ab6fca0834520c9a02bff [2,0,0,0,0,0|2,0,0]=4 2433 B9R0.45 C/C=C/COCCCOC 5f1bc5bcae94818ab169f2532d800a96 [2,0,0,0,0,0|2,0,0]=4 2434 B9R0.45 C/C=C/COCCCSC 3e859da376a456131ea6c3009e2e9528 [2,0,0,0,0,0|2,0,0]=4 2435 B9R0.45 C/C=C/COCCOCC 63fd2e31279ac1c3bb1fff8b57fcdcc1 [2,0,0,0,0,0|2,0,0]=4 2436 B9R0.45 C/C=C/COCCSCC dfcfe7131818abefbfad7e2a62a434a4 [2,0,0,0,0,0|2,0,0]=4 2437 B9R0.45 C/C=C\CCCNCCBr 3ec8a3cd206cf339f1ac099b5ff6cc70 [2,0,0,0,0,0|2,0,0]=4 2438 B9R0.45 C/C=C\CCCNCCC bd38004b14a3ffe818d001cefe29aee7 [2,0,0,0,0,0|1,0,0]=3 2439 B9R0.45 C/C=C\CCCNCCF 283361902fb3c78650af87b7c5748776 [2,0,0,0,0,0|2,0,0]=4 2440 B9R0.45 C/C=C\CCCNCCI f21b259cb36428756e868214168d88d1 [2,0,0,0,0,0|2,0,0]=4 2441 B9R0.45 C/C=C\CCCNCCO 901ecd7afc50202c54f6e79e74ff88fa [2,0,0,0,0,0|2,0,0]=4 2442 B9R0.45 C/C=C\CCCNCCS 576b49cef031c3fed7468a94c3f02c04 [2,0,0,0,0,0|2,0,0]=4 2443 B9R0.45 C/C=C\CCCOCCC 083c73f409535e210af3eb7849dd56ad [2,0,0,0,0,0|1,0,0]=3 2444 B9R0.45 C/C=C\CCCOCCF 27d69654f0c177d54bde61ba62492973 [2,0,0,0,0,0|2,0,0]=4 2445 B9R0.45 C/C=C\CCCOCCS 3b63f4b7228ccb7acd58077940f7635c [2,0,0,0,0,0|2,0,0]=4 2446 B9R0.45 C/C=C\CCCOCOC 468d16367ade1ec2e5c893afddf6b7c0 [2,0,0,0,0,0|2,0,0]=4 2447 B9R0.45 C/C=C\CCCOCSC 06123fa9e675d4006d38ffd2014f2008 [2,0,0,0,0,0|2,0,0]=4 2448 B9R0.45 C/C=C\CNCCCCC 2ee64f407eb13d42c64dbdca505fc819 [2,0,0,0,0,0|1,0,0]=3 2449 B9R0.45 C/C=C\CNCCCCCl d6e4fe895f7ef2b8fd417beea3d06ba1 [2,0,0,0,0,0|2,0,0]=4 2450 B9R0.45 C/C=C\CNCCCCO 1d08969d68ccbef78e75866e633febcf [2,0,0,0,0,0|2,0,0]=4 2451 B9R0.45 C/C=C\CNCCCCS ee4c8a80fc61b5dece65cfcc4ca86e95 [2,0,0,0,0,0|2,0,0]=4 2452 B9R0.45 C/C=C\CNCCCOC 9d59f702f547863e47dcef2fd64f1076 [2,0,0,0,0,0|2,0,0]=4 2453 B9R0.45 C/C=C\CNCCCSC cc9fe3e4ecf87d5e0af0a89dd0b9be85 [2,0,0,0,0,0|2,0,0]=4 2454 B9R0.45 C/C=C\CNCCOCC ba717dd4ff72ae30428deaceceb8e900 [2,0,0,0,0,0|2,0,0]=4 2455 B9R0.45 C/C=C\CNCCSCC 2344b094cedbab19eb8690e73e8bd09c [2,0,0,0,0,0|2,0,0]=4 2456 B9R0.45 C/C=C\COCCCCC 49d9ba2c76d4226b734a25af963b3a40 [2,0,0,0,0,0|1,0,0]=3 2457 B9R0.45 C/C=C\COCCCCF 4a23eeff00f906196af3c2b6cb55a437 [2,0,0,0,0,0|2,0,0]=4 2458 B9R0.45 C/C=C\COCCCCS 4dc475746e1fe6ee2835b6bd42d9f2cf [2,0,0,0,0,0|2,0,0]=4 2459 B9R0.45 C/C=C\COCCCOC 70d17fbec46f317997436441f1a708dd [2,0,0,0,0,0|2,0,0]=4 2460 B9R0.45 C/C=C\COCCCSC 0b7bc762f4b85e8dd03675e638fdc3a7 [2,0,0,0,0,0|2,0,0]=4 2461 B9R0.45 C/C=C\COCCOCC f9def2c1c1305f202dbf7f1c0e571fc4 [2,0,0,0,0,0|2,0,0]=4 2462 B9R0.45 C/C=C\COCCSCC 6029c7fe7770a1e49d0d0365a70777a3 [2,0,0,0,0,0|2,0,0]=4 2463 B9R0.45 C=CCCCCCNCC 890f1c6c1d85667d7cffa859ba2c1d3e [2,0,0,0,0,0|1,0,0]=3 2464 B9R0.45 C=CCCCCCNCF 5758c179fab104be34b09f047afc1fd5 [2,0,0,0,0,0|2,0,0]=4 2465 B9R0.45 C=CCCCCCNCO 4058549cb0627342cdb023e8e5d092ea [2,0,0,0,0,0|2,0,0]=4 2466 B9R0.45 C=CCCCCCOCC 23f590b48ebd5146440db0699ec4bb83 [2,0,0,0,0,0|1,0,0]=3 2467 B9R0.45 C=CCCCCCOCF b04f839cfe9fd44ba94f605d82c4d0ae [2,0,0,0,0,0|2,0,0]=4 2468 B9R0.45 C=CCCCCNCCBr 07640e6f216624020c084c51b2b6c0e3 [2,0,0,0,0,0|2,0,0]=4 2469 B9R0.45 C=CCCCCNCCC 1c3124d4bfead54322e8b6cd10acbe7e [2,0,0,0,0,0|1,0,0]=3 2470 B9R0.45 C=CCCCCNCCF bb135346f8d1f2fd9649100cc9cfdedb [2,0,0,0,0,0|2,0,0]=4 2471 B9R0.45 C=CCCCCNCCI 0a6513107528ba2abea852f44f3eb8ef [2,0,0,0,0,0|2,0,0]=4 2472 B9R0.45 C=CCCCCNCCO e90dd5dffbcd01a756bbd1f730cda699 [2,0,0,0,0,0|2,0,0]=4 2473 B9R0.45 C=CCCCCNCCS 981cc28718f0e82344c822015e52ce6e [2,0,0,0,0,0|2,0,0]=4 2474 B9R0.45 C=CCCCCNCOC 5b0c229bd641ac48d7ec078b3fc2ec2d [2,0,0,0,0,0|2,0,0]=4 2475 B9R0.45 C=CCCCCNCSC 12aaafcb136d8a0d0bd01b0db509102e [2,0,0,0,0,0|2,0,0]=4 2476 B9R0.45 C=CCCCCOCCC f624e5cfeefd7c8f70f95b431a05113e [2,0,0,0,0,0|1,0,0]=3 2477 B9R0.45 C=CCCCCOCCF e5688e416989ce0b8e2de252ce333c03 [2,0,0,0,0,0|2,0,0]=4 2478 B9R0.45 C=CCCCCOCCS 10dfd3c079a28d4d3066722414bfb2da [2,0,0,0,0,0|2,0,0]=4 2479 B9R0.45 C=CCCCCOCOC 374793be8a31c9ce728cb14abf402af4 [2,0,0,0,0,0|2,0,0]=4 2480 B9R0.45 C=CCCCCOCSC 195324d17fdf202ccef6359b6b5e3bb9 [2,0,0,0,0,0|2,0,0]=4 2481 B9R0.45 C=CCCCNCCCC fa1d0b4e193451fb553c9cd2afd75cca [2,0,0,0,0,0|1,0,0]=3 2482 B9R0.45 C=CCCCNCCCCl c0c501ba24935f3fdc55a6800c85d9f5 [2,0,0,0,0,0|2,0,0]=4 2483 B9R0.45 C=CCCCNCCCF 4fbf6888b4902e4977d561796e7f3c35 [2,0,0,0,0,0|2,0,0]=4 2484 B9R0.45 C=CCCCNCCCO 49ff67fd32a7e48d035cc39e8c6c93f5 [2,0,0,0,0,0|2,0,0]=4 2485 B9R0.45 C=CCCCNCCCS e91fc8975e9281b0c28f44d8e3139816 [2,0,0,0,0,0|2,0,0]=4 2486 B9R0.45 C=CCCCNCCOC 759115f4101e6143ad6ba137d2cb2134 [2,0,0,0,0,0|2,0,0]=4 2487 B9R0.45 C=CCCCNCCSC 835ee46189c1f88d4cdbdcc67650ffcb [2,0,0,0,0,0|2,0,0]=4 2488 B9R0.45 C=CCCCNCOCC f02bd04312dd897bff39b6bd9b93bc49 [2,0,0,0,0,0|2,0,0]=4 2489 B9R0.45 C=CCCCOCCCC e8806365586991cd800b2ef6da7fc881 [2,0,0,0,0,0|1,0,0]=3 2490 B9R0.45 C=CCCCOCCCF 2e6d7089b14dd641e54a76ae7dadaa14 [2,0,0,0,0,0|2,0,0]=4 2491 B9R0.45 C=CCCCOCCCS 00ab52b736b42ecb74aa8e1b43a7e9be [2,0,0,0,0,0|2,0,0]=4 2492 B9R0.45 C=CCCCOCCOC 3f3e29bd58ea27c0ff854dd25e431ca0 [2,0,0,0,0,0|2,0,0]=4 2493 B9R0.45 C=CCCCOCCSC 27b8b1769c1651eaa64484ccb85191f8 [2,0,0,0,0,0|2,0,0]=4 2494 B9R0.45 C=CCCCOCOCC 1cb3725d57ca40858b757ece9ea622f2 [2,0,0,0,0,0|2,0,0]=4 2495 B9R0.45 C=CCCNCCCCC a855019ae48c9b8cf6923444d001ccd3 [2,0,0,0,0,0|1,0,0]=3 2496 B9R0.45 C=CCCNCCCCCl a117ce913481632f0688d24994247e2a [2,0,0,0,0,0|2,0,0]=4 2497 B9R0.45 C=CCCNCCCCF efc5a9a56f0e77778e0d77be991290d0 [2,0,0,0,0,0|2,0,0]=4 2498 B9R0.45 C=CCCNCCCCO 483ccf905bb3e32f0679d7de05961fd6 [2,0,0,0,0,0|2,0,0]=4 2499 B9R0.45 C=CCCNCCCCS eb80eda9fad56453c79d6797c2b54750 [2,0,0,0,0,0|2,0,0]=4 2500 B9R0.45 C=CCCNCCCOC f114ed09e62c1c84dddd4497e61d0709 [2,0,0,0,0,0|2,0,0]=4 2501 B9R0.45 C=CCCNCCCSC 82fa4646237d709aa853365c812d6ebb [2,0,0,0,0,0|2,0,0]=4 2502 B9R0.45 C=CCCNCCOCC 3004d01d837d0f88a49d7ce90fd1bde4 [2,0,0,0,0,0|2,0,0]=4 2503 B9R0.45 C=CCCNCCSCC 407d8c67af07288795fc606cb0bad476 [2,0,0,0,0,0|2,0,0]=4 2504 B9R0.45 C=CCCOCCCCC 6e7cf8472e35f7c7bd7858bc8c7bfd04 [2,0,0,0,0,0|1,0,0]=3 2505 B9R0.45 C=CCCOCCCCF d4ec7484466a64c13890e327fd29e039 [2,0,0,0,0,0|2,0,0]=4 2506 B9R0.45 C=CCCOCCCCS 46572775d6dca25538d12c4917173d07 [2,0,0,0,0,0|2,0,0]=4 2507 B9R0.45 C=CCCOCCCOC 2c2711f1681894e043a28c331b1790e2 [2,0,0,0,0,0|2,0,0]=4 2508 B9R0.45 C=CCCOCCCSC a45023388d7b0125e3891a4f7bb25903 [2,0,0,0,0,0|2,0,0]=4 2509 B9R0.45 C=CCCOCCOCC d362d26f2d685dd3fa35bff0ccc84647 [2,0,0,0,0,0|2,0,0]=4 2510 B9R0.45 C=CCCOCCSCC fcb13c630a689c43c3fade0981e1cb62 [2,0,0,0,0,0|2,0,0]=4 2511 B9R0.45 C=CCNCCCCCC 6384eba9acd253c5ddf82f9491922adb [2,0,0,0,0,0|1,0,0]=3 2512 B9R0.45 C=CCNCCCCCCl 39b003764fbe36df5eaf2287055cfd68 [2,0,0,0,0,0|2,0,0]=4 2513 B9R0.45 C=CCNCCCCCO b81fe78c797f2a70aa21f5595d13d0f6 [2,0,0,0,0,0|2,0,0]=4 2514 B9R0.45 C=CCNCCCCOC 8d21e2ed462bb4954ce80ad5a5ca8a27 [2,0,0,0,0,0|2,0,0]=4 2515 B9R0.45 C=CCNCCCCSC cb376474ea5d0373c451927e013a14c9 [2,0,0,0,0,0|2,0,0]=4 2516 B9R0.45 C=CCNCCCOCC 2c5fb06034b78ea915033df9203a28d2 [2,0,0,0,0,0|2,0,0]=4 2517 B9R0.45 C=CCNCCOCCC 2f529c37c6157fe0a2cf6ac6ecb62671 [2,0,0,0,0,0|2,0,0]=4 2518 B9R0.45 C=CCOCCCCCC 87e2c78ad35addafbe1ba3af3a2416ee [2,0,0,0,0,0|1,0,0]=3 2519 B9R0.45 C=CCOCCCCOC 128cb8201d6a9addfa90ce2aa3d56855 [2,0,0,0,0,0|2,0,0]=4 2520 B9R0.45 C=CCOCCCCSC d6f879632d2f8647ad8df3191aa8d592 [2,0,0,0,0,0|2,0,0]=4 2521 B9R0.45 C=CCOCCCOCC 07f39b6bf8d420b1e0d79a059a1cabfd [2,0,0,0,0,0|2,0,0]=4 2522 B9R0.45 C=CCOCCCSCC 010127de1abeb4b03bb349c6ddd307c9 [2,0,0,0,0,0|2,0,0]=4 2523 B9R0.45 C=CCOCCNCCC 9694c4d9a9f18cb3ea4ec1572bfb4ddb [2,0,0,0,0,0|2,0,0]=4 2524 B9R0.45 C=CCOCCOCCC efb69812f28efe0f9f62374b7669e490 [2,0,0,0,0,0|2,0,0]=4 2525 B9R0.45 C=CCOCCSCCC 06be4be84f87fa36d14a267f98502073 [2,0,0,0,0,0|2,0,0]=4 2526 B9R0.45 C=COCCCCOCC af306989d4deb93a89f269ce19f884c9 [2,0,0,0,0,0|2,0,0]=4 2527 B9R0.45 C=COCCCNCCC 48f364dfd76ffa0b91930c0b5e61593d [2,0,0,0,0,0|2,0,0]=4 2528 B9R0.45 C=COCCNCCCC a4714520314ca7cd019c104ad0112ac9 [2,0,0,0,0,0|2,0,0]=4 2529 B9R0.45 C=COCCOCCCC c861b9e6afb5156062cdccf5beab2100 [2,0,0,0,0,0|2,0,0]=4 2530 B9R0.45 CC/C=C/CCOCCC 0a76c2aa4cb5309f57046e961567e1f0 [2,0,0,0,0,0|2,0,0]=4 2531 B9R0.45 CC/C=C/CNCCCC 205e3a3cf2dfbd78bc9d1c77318f250d [2,0,0,0,0,0|2,0,0]=4 2532 B9R0.45 CC/C=C/COCCCC 9dcd55c6f51e3b003595f546e655282b [2,0,0,0,0,0|2,0,0]=4 2533 B9R0.45 CC/C=C\CCCOCC f3a75a504e13faa2cf8e35adf4ed3e3b [2,0,0,0,0,0|2,0,0]=4 2534 B9R0.45 CC/C=C\CCNCCC 3bbbe00683e3d998587775bf41dd95d1 [2,0,0,0,0,0|2,0,0]=4 2535 B9R0.45 CC/C=C\CCOCCC 5fdb5a65a47740420a9d274005a3115f [2,0,0,0,0,0|2,0,0]=4 2536 B9R0.45 CC/C=C\COCCCC 02179af6b133216a2e2f2900dac6b807 [2,0,0,0,0,0|2,0,0]=4 2537 B9R0.45 CC=CCCCOCCC 544004ad9efa2af2fea80f1c7a474136 [2,0,0,0,0,0|1,0,0]=3 2538 B9R0.45 CC=CCCCOCCF dbd226b7210a3389dec602609fd6287c [2,0,0,0,0,0|2,0,0]=4 2539 B9R0.45 CC=CCCCOCCS 7bd8f4a474396aa849783a36358f8476 [2,0,0,0,0,0|2,0,0]=4 2540 B9R0.45 CC=CCCCOCOC 72b71ebeadbfae707e88713e17d937d7 [2,0,0,0,0,0|2,0,0]=4 2541 B9R0.45 CC=CCCCOCSC a1d08f1eea46f54aa4275162125103ce [2,0,0,0,0,0|2,0,0]=4 2542 B9R0.45 CC=CCNCCCCC 4ef4adafa1d8c573d6eb296bc442117e [2,0,0,0,0,0|1,0,0]=3 2543 B9R0.45 CC=CCNCCCCF 62744c6021832e453433ea5e1cec96b9 [2,0,0,0,0,0|2,0,0]=4 2544 B9R0.45 CC=CCNCCCCO b6b45149b09015d2bafd23ae2a68f9c1 [2,0,0,0,0,0|2,0,0]=4 2545 B9R0.45 CC=CCNCCCOC b51c625de33f835a1cb45133d506e071 [2,0,0,0,0,0|2,0,0]=4 2546 B9R0.45 CC=CCNCCCSC 1f53d026b2687eb5d595941ef6929c04 [2,0,0,0,0,0|2,0,0]=4 2547 B9R0.45 CC=CCNCCOCC 7f373513c7f9bc55d0ea8511b91de21d [2,0,0,0,0,0|2,0,0]=4 2548 B9R0.45 CC=CCNCCSCC 1a215b32363568fc2cf3fa953039a194 [2,0,0,0,0,0|2,0,0]=4 2549 B9R0.45 CC=CCOCCCCC 805449d8867d5a337059530a7812a078 [2,0,0,0,0,0|1,0,0]=3 2550 B9R0.45 CC=CCOCCCCF 6a8cb9313ca4b7bd38d5b438c4e9236e [2,0,0,0,0,0|2,0,0]=4 2551 B9R0.45 CC=CCOCCCOC 0948e1eb74f1a2c9a6b4cce71af0db97 [2,0,0,0,0,0|2,0,0]=4 2552 B9R0.45 CC=CCOCCCSC 931be6d2224eec3dcf1624c2b5a2a6e2 [2,0,0,0,0,0|2,0,0]=4 2553 B9R0.45 CC=CCOCCOCC 8aaf0b6d05c0e664561b324cae6670b9 [2,0,0,0,0,0|2,0,0]=4 2554 B9R0.45 CC=CCOCCSCC 1bfa6bc70dcde019a8187f955a73222b [2,0,0,0,0,0|2,0,0]=4 2555 B9R0.45 CCCCCCCNC=O 9b073fb330d599f3dde0b2db41b840f2 [2,0,0,0,0,0|1,0,1]=4 2556 B9R0.45 CCCCCCCNCC 31fa4e94f188453162c86e218e83a3fe [2,0,0,0,0,0|1,0,1]=4 2557 B9R0.45 CCCCCCCNCF 39b29e109b290c792595feab642af08e [2,0,0,0,0,0|2,0,0]=4 2558 B9R0.45 CCCCCCCNCO 7598d2cec5f82b679ede94b43530bd89 [2,0,0,0,0,0|1,0,0]=3 2559 B9R0.45 CCCCCCCOCC afc5a86de4d9d2aada96fa893fe06937 [2,0,0,0,0,0|1,0,1]=4 2560 B9R0.45 CCCCCCCOCF 34dddba0abdfe53e071e6123614e32ad [2,0,0,0,0,0|2,0,0]=4 2561 B9R0.45 CCCCCCNCC=O 7bf21a30ec03a5d95442fb7cb6f190b9 [2,0,0,0,0,0|1,0,1]=4 2562 B9R0.45 CCCCCCNCCBr 432851e349f9c8ac31da8524f48578e2 [2,0,0,0,0,0|2,0,0]=4 2563 B9R0.45 CCCCCCNCCC e9c4dc74296e69be276b9ef8aee733d2 [2,0,0,0,0,0|1,0,1]=4 2564 B9R0.45 CCCCCCNCCF 9254cc0c3491162ddb811a1ca350686d [2,0,0,0,0,0|2,0,0]=4 2565 B9R0.45 CCCCCCNCCI 211348b41f09447d155ab96e959b3555 [2,0,0,0,0,0|2,0,0]=4 2566 B9R0.45 CCCCCCNCCO 2c640e5cf0d398eb15c3da8e201ff9a9 [2,0,0,0,0,0|1,0,0]=3 2567 B9R0.45 CCCCCCNCCS 295b56fa02564919637f2af1760de842 [2,0,0,0,0,0|1,1,0]=4 2568 B9R0.45 CCCCCCNCOC aba2e41598bd49d27de9d216a6960960 [2,0,0,0,0,0|2,0,0]=4 2569 B9R0.45 CCCCCCNCSC 26b8d5c53ba2ffb7a0ad7aeefcef29cb [2,0,0,0,0,0|2,0,0]=4 2570 B9R0.45 CCCCCCOCC=O bd855bb441849ecb00a1d491cea228b2 [2,0,0,0,0,0|1,0,1]=4 2571 B9R0.45 CCCCCCOCCC e53b5b4f9e861a4f0969c775813c954e [2,0,0,0,0,0|1,0,1]=4 2572 B9R0.45 CCCCCCOCCF 5c07b9abefb4c7383b2510ed2f25aa7d [2,0,0,0,0,0|2,0,0]=4 2573 B9R0.45 CCCCCCOCCS dfca5cb8f17cf53fc21013be4aea075a [2,0,0,0,0,0|1,1,0]=4 2574 B9R0.45 CCCCCCOCOC 6663dbbf181def3e6cf6b976451eb0e9 [2,0,0,0,0,0|2,0,0]=4 2575 B9R0.45 CCCCCCOCSC ea8aeb7aec2e44107948b184f1a2484b [2,0,0,0,0,0|2,0,0]=4 2576 B9R0.45 CCCCCNC/C=C/Cl dd2b4d6593db8690c89984276577f51f [2,0,0,0,0,0|2,0,0]=4 2577 B9R0.45 CCCCCNC/C=C\Cl fb74b9636967ca4beacb07a8f7ddd469 [2,0,0,0,0,0|2,0,0]=4 2578 B9R0.45 CCCCCNC/C=C\O a03bd9f596fd925d470752532a1e67bf [2,0,0,0,0,0|1,0,0]=3 2579 B9R0.45 CCCCCNCCC=O eb975a62ee073d19d198cbf0dd0dbc33 [2,0,0,0,0,0|1,0,1]=4 2580 B9R0.45 CCCCCNCCCC 4b3b475ebd19f4e81120126dc44604b9 [2,0,0,0,0,0|1,0,1]=4 2581 B9R0.45 CCCCCNCCCCl 109aece1b500375b78357a337e9896e4 [2,0,0,0,0,0|2,0,0]=4 2582 B9R0.45 CCCCCNCCCF 5ad689e26c296fbe8637b1c72c8b1ac8 [2,0,0,0,0,0|2,0,0]=4 2583 B9R0.45 CCCCCNCCCO 3cb5b804fc7f29c415be4738c214f571 [2,0,0,0,0,0|1,0,0]=3 2584 B9R0.45 CCCCCNCCCS 7d387ec49be60b8d3336c43db9a47159 [2,0,0,0,0,0|1,1,0]=4 2585 B9R0.45 CCCCCNCCOC 0d0c9f836b1b0f565b919320cde5807e [2,0,0,0,0,0|2,0,0]=4 2586 B9R0.45 CCCCCNCCSC 738dc92cc1ee7c68b53e333bc3c1249e [2,0,0,0,0,0|2,0,0]=4 2587 B9R0.45 CCCCCOC/C=C/Cl 902b3675920ce425dd913260445c6a1b [2,0,0,0,0,0|2,0,0]=4 2588 B9R0.45 CCCCCOC/C=C\Cl 3081f394d252ec216de633eb3f90aefe [2,0,0,0,0,0|2,0,0]=4 2589 B9R0.45 CCCCCOCC=CCl 1caf48ce8f7b269d545bfce57c62ccdf [2,0,0,0,0,0|2,0,0]=4 2590 B9R0.45 CCCCCOCCC=O ed64f81c6eb909127bbb96fe2d29088b [2,0,0,0,0,0|1,0,1]=4 2591 B9R0.45 CCCCCOCCCC 452d4f5e08ae861a8237c2e4edaffcee [2,0,0,0,0,0|1,0,1]=4 2592 B9R0.45 CCCCCOCCCF fafa7792cbca75bb6104f416c496b552 [2,0,0,0,0,0|2,0,0]=4 2593 B9R0.45 CCCCCOCCCS d7a2eff0ce3ac908cbe201d57fc422a2 [2,0,0,0,0,0|1,1,0]=4 2594 B9R0.45 CCCCCOCCOC 64d0f3f4ad4f7f2b3f2cc5427c5eba08 [2,0,0,0,0,0|2,0,0]=4 2595 B9R0.45 CCCCCOCCSC 35787b22863a0bdd2a717cb23597facb [2,0,0,0,0,0|2,0,0]=4 2596 B9R0.45 CCCCNCCCC=O be1900420fface744e26218846840016 [2,0,0,0,0,0|1,0,1]=4 2597 B9R0.45 CCCCNCCCCCl 8e0e9ebf8dfb1495f624013ef828e19e [2,0,0,0,0,0|2,0,0]=4 2598 B9R0.45 CCCCNCCCCF 953d043841cd25eff2ef5c3d0831f1dd [2,0,0,0,0,0|2,0,0]=4 2599 B9R0.45 CCCCNCCCCO 74a60cb017e8f2dcfff3bd80cde22232 [2,0,0,0,0,0|1,0,0]=3 2600 B9R0.45 CCCCNCCCCS 293a84436b4673ea4650c3832cb6a843 [2,0,0,0,0,0|1,1,0]=4 2601 B9R0.45 CCCCNCCCOC 788f960a3da4a154a6d1eb4fd6357034 [2,0,0,0,0,0|2,0,0]=4 2602 B9R0.45 CCCCNCCCSC 1307aea73f697be7347c70961c337c72 [2,0,0,0,0,0|2,0,0]=4 2603 B9R0.45 CCCCOCCCC=O e3a2ccc9f19eff655a1e3387aa118b3a [2,0,0,0,0,0|1,0,1]=4 2604 B9R0.45 CCCCOCCCCF 42830ea441c5128d22602f571e3205b9 [2,0,0,0,0,0|2,0,0]=4 2605 B9R0.45 CCCCOCCCCS ec359e1317d20b353c1e6ee1fa4be1a0 [2,0,0,0,0,0|1,1,0]=4 2606 B9R0.45 CCCCOCCCOC 94ce11a6d684ef526eb2e193b6598c58 [2,0,0,0,0,0|2,0,0]=4 2607 B9R0.45 CCCCOCCCSC 62b74f8edfba0d3c5255c58121a65cb5 [2,0,0,0,0,0|2,0,0]=4 2608 B9R0.45 CCCCOCCNCO cd975e60385ed19fb54161372698cee4 [2,0,0,0,0,0|2,0,0]=4 2609 B9R0.45 CCCCOCNCCO 6bb9eca64afcebb6f28e84a821a2a862 [2,0,0,0,0,0|2,0,0]=4 2610 B9R0.45 CCCNCCCCC=O f2022f14c7209eed0862d6ecf6b84706 [2,0,0,0,0,0|1,0,1]=4 2611 B9R0.45 CCCNCCCCCCl 2d5ae8cd51b6a7e591941cb7b0622e55 [2,0,0,0,0,0|2,0,0]=4 2612 B9R0.45 CCCNCCCCCF 7ddf79ca6b37ad2b5e8ddc392231f404 [2,0,0,0,0,0|2,0,0]=4 2613 B9R0.45 CCCNCCCCCO f3d6f4913e5f254c1bf460b36dd70b4c [2,0,0,0,0,0|1,0,0]=3 2614 B9R0.45 CCCNCCCCOC 3a911d7832cca15ffba1db8d75c3525f [2,0,0,0,0,0|2,0,0]=4 2615 B9R0.45 CCCNCCCCSC 83af594d195aec376428f00fc6e6852d [2,0,0,0,0,0|2,0,0]=4 2616 B9R0.45 CCCNCCOCCO 26e2580fee42af23b6bec1a5344f6efe [2,0,0,0,0,0|2,0,0]=4 2617 B9R0.45 CCCNCCSCCO 1f86c5fc79a4d95fd86404e323963902 [2,0,0,0,0,0|2,0,0]=4 2618 B9R0.45 CCCOCCCCC=O 8b78d2c4a466c2768be601b9198fb016 [2,0,0,0,0,0|1,0,1]=4 2619 B9R0.45 CCCOCCCCCF b14e93115958730ea8214bff1c89eb77 [2,0,0,0,0,0|2,0,0]=4 2620 B9R0.45 CCCOCCCCOC 3aa974714759e935d3dbeb5a361d1541 [2,0,0,0,0,0|2,0,0]=4 2621 B9R0.45 CCCOCCCCSC 28df677e6e1829a07cbf3784e5a5b453 [2,0,0,0,0,0|2,0,0]=4 2622 B9R0.45 CCCOCCCNCO f453546a549baebba8d4dda9dd1f2b96 [2,0,0,0,0,0|2,0,0]=4 2623 B9R0.45 CCCOCCNCCO 2fe038760c01b7075e45b162c476ceb9 [2,0,0,0,0,0|2,0,0]=4 2624 B9R0.45 CCNCCCCCCCl 59b5285c49bc16b0b152df55e767300a [2,0,0,0,0,0|2,0,0]=4 2625 B9R0.45 CCNCCCCCCO 59b1923e7d0b8671db87a813cf6b4ab5 [2,0,0,0,0,0|1,0,0]=3 2626 B9R0.45 CCNCCCCCOC fc15d1f5a98279f7f6e7e0686f586bf9 [2,0,0,0,0,0|2,0,0]=4 2627 B9R0.45 CCNCCCOCCO 6c261c514fd28efb5350d358913fae05 [2,0,0,0,0,0|2,0,0]=4 2628 B9R0.45 CCNCCOCCCO 0587f8b538abe097ec5a15ca1741ae9c [2,0,0,0,0,0|2,0,0]=4 2629 B9R0.45 CCOCCCCCCF 1581be03b145221792da0e70f0dc7ced [2,0,0,0,0,0|2,0,0]=4 2630 B9R0.45 CCOCCCCCCS 890481a3122baa8d804b207afa67ebc3 [2,0,0,0,0,0|1,1,0]=4 2631 B9R0.45 CCOCCCNCCO 2b9ad8b94ae5a803722e62535f4291fd [2,0,0,0,0,0|2,0,0]=4 2632 B9R0.45 CCOCCNC/C=C\O 0aa78a5fbd95032696d68861b712e14e [2,0,0,0,0,0|2,0,0]=4 2633 B9R0.45 CCOCCNCCCO f920b2cdd5960150c1761b62d58446b4 [2,0,0,0,0,0|2,0,0]=4 2634 B9R0.45 CCOCNCCCCO 8a098d07046f425046fb40aa034ce721 [2,0,0,0,0,0|2,0,0]=4 2635 B9R0.45 CCSCCCCNCO b5317d3d243e051b414811fd9803b081 [2,0,0,0,0,0|2,0,0]=4 2636 B9R0.45 CCSCCCNCCO b73a81c9666f167eb7df0d9e4e845db9 [2,0,0,0,0,0|2,0,0]=4 2637 B9R0.45 CCSCCNC/C=C\O 25741737a09ab9cf25d1e1da49f5fc71 [2,0,0,0,0,0|2,0,0]=4 2638 B9R0.45 CCSCCNCCCO d094498045f2b61ea374614f3a36e63e [2,0,0,0,0,0|2,0,0]=4 2639 B9R0.45 COCCCCCNCO bcbefdff7df1910d96b91030fdd66d71 [2,0,0,0,0,0|2,0,0]=4 2640 B9R0.45 COCCCCNCCO c64f84dda1c7e1a3b83c8677baf02563 [2,0,0,0,0,0|2,0,0]=4 2641 B9R0.45 COCCCNC/C=C\O 7a8902930f1f9f59b8140ba9fba85efe [2,0,0,0,0,0|2,0,0]=4 2642 B9R0.45 COCCCNCCCO 80827af578dfd9221e88944d50b47203 [2,0,0,0,0,0|2,0,0]=4 2643 B9R0.45 COCCNCCCCO 98a0ba2b4e7cfdb77ca7eb5bd158bcce [2,0,0,0,0,0|2,0,0]=4 2644 B9R0.45 COCNCCCCCO 1110af8acba3f65702890e8caffb75f5 [2,0,0,0,0,0|2,0,0]=4 2645 B9R0.45 CSCCCCNCCO 71aec6063e81fccb3b9166d912cdd51e [2,0,0,0,0,0|2,0,0]=4 2646 B9R0.45 CSCCCNC/C=C\O e7fdc99181aca5fb372020cfd9c7eca5 [2,0,0,0,0,0|2,0,0]=4 2647 B9R0.45 CSCCCNCCCO 28a7baa82e21352faa8b2b7ae1ad9e7c [2,0,0,0,0,0|2,0,0]=4 2648 B9R0.45 CSCCNCCCCO 62e46910418c4ce52244f7fbd91c204a [2,0,0,0,0,0|2,0,0]=4 2649 B9R0.45 CSCNCCCCCO 5bb2e7db9b994ef76c056647cef0a208 [2,0,0,0,0,0|2,0,0]=4 2650 B9R0.45 O/C=C\CNCCCCCl 32d99f4bcc2d097dc5f961a7d77eb85e [2,0,0,0,0,0|2,0,0]=4 2651 B9R0.45 O/C=C\CNCCCCO 3aa0b00108be3944a3394c12f0569f56 [2,0,0,0,0,0|2,0,0]=4 2652 B9R0.45 O/C=C\CNCCCCS e7c825c7fbc5972a6c8f8ade5068f2d0 [2,0,0,0,0,0|2,0,0]=4 2653 B9R0.45 OCCCCCCNCF 9f8dd59df8b832f35306dcc311b8ba0b [2,0,0,0,0,0|2,0,0]=4 2654 B9R0.45 OCCCCCCNCO b03974d5eaea260ed44c4429a42a8efd [2,0,0,0,0,0|2,0,0]=4 2655 B9R0.45 OCCCCCNCCBr b6fe72a70aa9ee94c38953fc5fa03507 [2,0,0,0,0,0|2,0,0]=4 2656 B9R0.45 OCCCCCNCCF efe70d32a4c6133cd05e8c1bf8301a0a [2,0,0,0,0,0|2,0,0]=4 2657 B9R0.45 OCCCCCNCCI 4b343205ce8465baed90cb0f419c6c4d [2,0,0,0,0,0|2,0,0]=4 2658 B9R0.45 OCCCCCNCCO c6e0d5af126a56a449acd76dabb0d0a6 [2,0,0,0,0,0|2,0,0]=4 2659 B9R0.45 OCCCCCNCCS 81db03003d62237a4ac003bf8b7c1409 [2,0,0,0,0,0|2,0,0]=4 2660 B9R0.45 OCCCCNCCCCl 5d4dd36721e99428cdc35a6893c3e2fe [2,0,0,0,0,0|2,0,0]=4 2661 B9R0.45 OCCCCNCCCF 6f20b166a61175e5d8c115f1b02448f2 [2,0,0,0,0,0|2,0,0]=4 2662 B9R0.45 OCCCCNCCCO 5785bad1b39de5e973646d0653e00598 [2,0,0,0,0,0|2,0,0]=4 2663 B9R0.45 OCCCCNCCCS 15be786d5d00bee1f4424bf326f6da44 [2,0,0,0,0,0|2,0,0]=4 2664 B9R0.45 OCCCNCCCCCl 19919d9b789640b88d6d653b90e1be74 [2,0,0,0,0,0|2,0,0]=4 2665 B9R0.45 OCCCNCCCCF 1b694695d8d20de2554ac05a72c91dce [2,0,0,0,0,0|2,0,0]=4 2666 B9R0.45 OCCCNCCCCS 8e91b12d63d803cd106ce9f5169f8923 [2,0,0,0,0,0|2,0,0]=4 2667 B9R0.45 OCCNCCCCCCl e9f98005127c4b0d506088db3b60ee60 [2,0,0,0,0,0|2,0,0]=4 2668 B9R0.45 OCCNCCCCCF 758b4b8080a41888cab6ab1d11640066 [2,0,0,0,0,0|2,0,0]=4 2669 B9R0.45 OCNCCCCCCCl 6c66f104945205670f9512f61ea483f8 [2,0,0,0,0,0|2,0,0]=4 2670 B11R0.4 C/C=C/C(=O)NCCCCCC 377f28d02111af193298308d162007ca [1,1,0,0,0,0|1,0,1]=4 2671 B11R0.4 C/C=C/C(C)OCCCCCC ea28d412093358dd216c8723f1fca06a [1,1,0,0,0,0|1,0,0]=3 2672 B11R0.4 C/C=C/C(C)OCCCCCF b4df747ec6dcdf61bd6ad768f93ef73a [1,1,0,0,0,0|2,0,0]=4 2673 B11R0.4 C/C=C/C(C)OCCCCOC 3e370e9ef9aba47df0b234f0f3ab5e9a [1,1,0,0,0,0|2,0,0]=4 2674 B11R0.4 C/C=C/C(C)OCCCOCC ca2b2e3902d8fddb7d28929c824db816 [1,1,0,0,0,0|2,0,0]=4 2675 B11R0.4 C/C=C/C(C)OCCCSCC 5a84432abb16f3442cef80053c1a76f1 [1,1,0,0,0,0|2,0,0]=4 2676 B11R0.4 C/C=C/C(C)OCCOCCC f77e8c50792805b76af8cd8d91b3cded [1,1,0,0,0,0|2,0,0]=4 2677 B11R0.4 C/C=C/C(C)OCOCCCC afaf072cd7a7c476cc139bcb5750fe4b [1,1,0,0,0,0|2,0,0]=4 2678 B11R0.4 C/C=C/CCCOC(C)CCC 8358ebf24003def3f85c1da708a1a527 [1,1,0,0,0,0|1,0,0]=3 2679 B11R0.4 C/C=C/CCCOC(C)COC fe0ccb3723e03b4815f23a3bee5223b0 [1,1,0,0,0,0|2,0,0]=4 2680 B11R0.4 C/C=C/CCOCC(=O)CCC edf49135ac9aa378690e2be412736a8b [1,1,0,0,0,0|1,0,1]=4 2681 B11R0.4 C/C=C/CCOCC(C)CCC bcd0248fe7b5f7d499f8b7fc50e4eb25 [1,1,0,0,0,0|1,0,0]=3 2682 B11R0.4 C/C=C/CCOC[C@@H](O)CCO 7375ede615ffc47d44f6db2b96593ce1 [1,1,0,0,0,0|2,0,0]=4 2683 B11R0.4 C/C=C/COCCC(C)CCC 0c18bd6f6950974b063aca75205c03f6 [1,1,0,0,0,0|1,0,0]=3 2684 B11R0.4 C/C=C/COCCC(S)CCC 3f8e54ecb5e41543c6ef8b973075e42c [1,1,0,0,0,0|1,0,0]=3 2685 B11R0.4 C/C=C\CCCNC(C)CCC 5a19e31e349a19a1f9e3ef8761d91af9 [1,1,0,0,0,0|1,0,0]=3 2686 B11R0.4 C/C=C\CCCNC(C)CCO 3a971a136c46d3244ffd6348c67cf6a7 [1,1,0,0,0,0|2,0,0]=4 2687 B11R0.4 C/C=C\CCCNC(C)COC 09f5147a41a8896a33e83a103d74b8f9 [1,1,0,0,0,0|2,0,0]=4 2688 B11R0.4 C/C=C\CCCN[C@@H](C)CCC 14782cdc0999d0c6ab329b197fdc0810 [1,1,0,0,0,0|1,0,0]=3 2689 B11R0.4 C/C=C\CCCN[C@@H](C)CCO e35bc52a4e074c21ac4d5f2db069cefa [1,1,0,0,0,0|2,0,0]=4 2690 B11R0.4 C/C=C\CCCN[C@@H](C)COC 537e80ac049fc99685b65d5b61287f8f [1,1,0,0,0,0|2,0,0]=4 2691 B11R0.4 C/C=C\CCCN[C@H](C)CCO 12745d76fbf00a0cdd370adbdd7517aa [1,1,0,0,0,0|2,0,0]=4 2692 B11R0.4 C/C=C\CCCN[C@H](C)COC e4ca6ebc1369acd9ad3a3b4b0cdd2acb [1,1,0,0,0,0|2,0,0]=4 2693 B11R0.4 C/C=C\CCCOC(=S)CCC 2a40e8e0ad4571657160411f8ee6cf06 [1,1,0,0,0,0|1,0,1]=4 2694 B11R0.4 C/C=C\CCCOC(C)CCC c911121ef6b9362a32a9bcf7810ffc16 [1,1,0,0,0,0|1,0,0]=3 2695 B11R0.4 C/C=C\CCCOC(C)COC d18f8f32734b71ecf3a308d5844afe67 [1,1,0,0,0,0|2,0,0]=4 2696 B11R0.4 C/C=C\CCCOC(C)CSC 358945d4901d61745661bbbe566ec43e [1,1,0,0,0,0|2,0,0]=4 2697 B11R0.4 C/C=C\CCCO[C@@H](C)CCC e7f84084a0645c57b6bd2644cd3fc31a [1,1,0,0,0,0|1,0,0]=3 2698 B11R0.4 C/C=C\CCCO[C@@H](C)COC a2f348cad75aba9d6e79d9ed8b6362e8 [1,1,0,0,0,0|2,0,0]=4 2699 B11R0.4 C/C=C\CCCO[C@H](C)CCC fdf82199e9ceaf41cad8965c0456c9db [1,1,0,0,0,0|1,0,0]=3 2700 B11R0.4 C/C=C\CCCO[C@H](C)COC b6553d27b6a72e1579940d701de64ea1 [1,1,0,0,0,0|2,0,0]=4 2701 B11R0.4 C/C=C\COCCC(C)CCC 1ae84aa70d582864554825ccf5eb28f0 [1,1,0,0,0,0|1,0,0]=3 2702 B11R0.4 C/C=C\COCCC(S)CCC 6984a4fdca8f9d62dcf43ae1c29c6cc2 [1,1,0,0,0,0|1,0,0]=3 2703 B11R0.4 CC/C=C/CCOC(C)CCC 50c9714d31d7e32c45b3a073bcf57f7b [1,1,0,0,0,0|2,0,0]=4 2704 B11R0.4 CC/C=C/CNCC(O)CCC 53e6479e06b395e406fd3f685b562507 [1,1,0,0,0,0|2,0,0]=4 2705 B11R0.4 CC/C=C/COCC(C)CCC 77e69610c42c21f1391283c26c6a31fd [1,1,0,0,0,0|2,0,0]=4 2706 B11R0.4 CC/C=C\CCNC(C)CCC 438130b12849341c6b95563a8f1a2114 [1,1,0,0,0,0|2,0,0]=4 2707 B11R0.4 CC/C=C\CCN[C@@H](C)CCC 129a6ec43a834fc664f2aaa2b4073980 [1,1,0,0,0,0|2,0,0]=4 2708 B11R0.4 CC/C=C\CCOC(C)CCC 4d32216db9adefae9e2d273dc5ae1e26 [1,1,0,0,0,0|2,0,0]=4 2709 B11R0.4 CC/C=C\CCO[C@@H](C)CCC faacc9874935040b4b9721a8253fdf47 [1,1,0,0,0,0|2,0,0]=4 2710 B11R0.4 CC/C=C\CCO[C@H](C)CCC 3a30f30f122410c5b8ca02be0537e8d1 [1,1,0,0,0,0|2,0,0]=4 2711 B11R0.4 CC/C=C\COCC(C)CCC 4537f8018196cae9997e4f9e29f297a6 [1,1,0,0,0,0|2,0,0]=4 2712 B11R0.4 CC=CC(C)OCCCCCC ab2cb1ad90fed96f656c5c2e7f788d55 [1,1,0,0,0,0|1,0,0]=3 2713 B11R0.4 CC=CC(C)OCCCCCF 3d4386fbe9df591aae2428cd6c894d1b [1,1,0,0,0,0|2,0,0]=4 2714 B11R0.4 CC=CC(C)OCCCCOC 16fa3253e39a79db2e9030e09fc35cbf [1,1,0,0,0,0|2,0,0]=4 2715 B11R0.4 CC=CC(C)OCCCOCC a5c4805e282b044adb1dabc4ab6667e9 [1,1,0,0,0,0|2,0,0]=4 2716 B11R0.4 CC=CC(C)OCCCSCC a57cb7f9767671dabc9614efd6debdc3 [1,1,0,0,0,0|2,0,0]=4 2717 B11R0.4 CC=CC(C)OCCOCCC dcc2a9bf81d7ef0aedaabd1b942362c6 [1,1,0,0,0,0|2,0,0]=4 2718 B11R0.4 CC=CC(C)OCOCCCC 1bbb0dd16e759028030ee3895d638937 [1,1,0,0,0,0|2,0,0]=4 2719 B11R0.4 CC=CCCCOC(C)CCC e2559d18a78240142453497cf7bc4f92 [1,1,0,0,0,0|1,0,0]=3 2720 B11R0.4 CC=CCCCOC(C)COC 1f3975c23221c3dbe22138eb60f86bca [1,1,0,0,0,0|2,0,0]=4 2721 B11R0.4 CCCC(C)CCOC/C=C/Cl e062823761ab34da4ca2ad7c1bbd94d7 [1,1,0,0,0,0|2,0,0]=4 2722 B11R0.4 CCCC(C)CCOC/C=C\Cl 66659a948ea1c482413b36112d8b2212 [1,1,0,0,0,0|2,0,0]=4 2723 B11R0.4 CCCC(C)CNCCCCO 16ed810509952b5802a91fffe7eb7616 [1,1,0,0,0,0|1,0,1]=4 2724 B11R0.4 CCCC(C)NCCCCCO 42022f2d2382cced620bf4dacd7724d2 [1,1,0,0,0,0|1,0,1]=4 2725 B11R0.4 CCCC(O)CNCCCCO 40865fc06a718807fd947253975681ea [1,1,0,0,0,0|1,0,1]=4 2726 B11R0.4 CCCC(S)CCOC/C=C/Cl f7b383ccaee5fb8bc77a55190dc36dbe [1,1,0,0,0,0|2,0,0]=4 2727 B11R0.4 CCCC(S)CCOC/C=C\Cl 770d20d828c4de6a8495ea0b9d3fa058 [1,1,0,0,0,0|2,0,0]=4 2728 B11R0.4 CCCCCCCC(C)OCC 55dc2743b0b446cf9a6056de2b74c617 [1,1,0,0,0,0|1,0,1]=4 2729 B11R0.4 CCCCCCCC(C)OCF 3fba61538d49d98b37b9f07a88c7f983 [1,1,0,0,0,0|2,0,0]=4 2730 B11R0.4 CCCCCCCN(C)CCO 4b82b57c2e27ee478b4db099376fba2f [1,1,0,0,0,0|1,0,1]=4 2731 B11R0.4 CCCCCCC[C@H](C)NC=O c442fbbe6ed7aa25c681c876729d7560 [1,1,0,0,0,0|1,0,1]=4 2732 B11R0.4 CCCCCCC[C@H](C)NCC c7f8f4e0349dda9a4d6df587a3a48118 [1,1,0,0,0,0|1,0,1]=4 2733 B11R0.4 CCCCCCC[C@H](C)NCF 368f59e933291764ad1c7e2846e804c0 [1,1,0,0,0,0|2,0,0]=4 2734 B11R0.4 CCCCCCC[C@H](C)NCO b897aee6051defb04f5f6cf3c8a31ab5 [1,1,0,0,0,0|1,0,0]=3 2735 B11R0.4 CCCCCCNC(=O)CCO c087b3675c7cb5dcfde9fa6dcbdb3e38 [1,1,0,0,0,0|1,0,1]=4 2736 B11R0.4 CCCCCCNC(C)CCO 3c37ba78238e6b6e509c763f65a89e15 [1,1,0,0,0,0|1,0,1]=4 2737 B11R0.4 CCCCCCN[C@@H](C)CCO ef20604c1d13846f7a5ae7f726081f93 [1,1,0,0,0,0|1,0,1]=4 2738 B11R0.4 CCCCCCN[C@H](C)CCO d0862c4bfa9c321df31f29a6ac758d6b [1,1,0,0,0,0|1,0,1]=4 2739 B11R0.4 CCCCCNCC(=O)NCO aaf498b21bb4f2353489f1e4167ee52e [1,1,0,0,0,0|2,0,0]=4 2740 B11R0.4 CCCCCNCC(C)CCO e616c0d83429131bb679051a47b6be08 [1,1,0,0,0,0|1,0,1]=4 2741 B11R0.4 CCCCCNC[C@@H](O)CCO bdfd88a3d4ff55c01c5cfc1f5bba32b4 [1,1,0,0,0,0|1,0,1]=4 2742 B11R0.4 CCCCCOC[C@@H](O)CCO 3968df4237b71e64b4f9295c1d148fbc [1,1,0,0,0,0|1,0,1]=4 2743 B11R0.4 CCCN(C)CCCCCCO 7b2e6e9a2805e1f19dc02fa5859816c2 [1,1,0,0,0,0|1,0,1]=4 2744 B11R0.4 CCC[C@H](C)NCCCCCO 9145428cec86525735d1e0f47d1ced44 [1,1,0,0,0,0|1,0,1]=4 2745 B11R0.40 C/C=C/CCCOCC(=O)CC b8417a010e59d148e4d11d1ff225777e [1,1,0,0,0,0|1,0,1]=4 2746 B11R0.40 C/C=C/CCCOCC(C)CC 13182151a3faf3f557d3ca3ec8f4fb16 [1,1,0,0,0,0|1,0,0]=3 2747 B11R0.40 C/C=C/CCCOCC(C)OC dfc43728240abf4df5551c41158420f5 [1,1,0,0,0,0|2,0,0]=4 2748 B11R0.40 C/C=C/CCCOCC(O)CO 6ee21dcfad7501cf2b945fcd7f0de742 [1,1,0,0,0,0|2,0,0]=4 2749 B11R0.40 C/C=C/CCCOC[C@@H](C)CC 1b35af0ec8367c21a00139983725555b [1,1,0,0,0,0|1,0,0]=3 2750 B11R0.40 C/C=C/CCCOC[C@@H](C)OC 8801b9ae661e5882c4b5cd7c61c1a222 [1,1,0,0,0,0|2,0,0]=4 2751 B11R0.40 C/C=C/CCCOC[C@@H](O)CO 1f7e21dfa34e4e5e7d4d27eae239d972 [1,1,0,0,0,0|2,0,0]=4 2752 B11R0.40 C/C=C/CCCOC[C@H](C)CC ad2e68a8044d23c93f45c0c7e2762083 [1,1,0,0,0,0|1,0,0]=3 2753 B11R0.40 C/C=C/CCCOC[C@H](C)OC eb889a3530f52abda55c1129f7a63a04 [1,1,0,0,0,0|2,0,0]=4 2754 B11R0.40 C/C=C/CCCOC[C@H](O)CO 6a592b394a5a15b6ac5464874e412892 [1,1,0,0,0,0|2,0,0]=4 2755 B11R0.40 C/C=C/CCOCCC(C)CC a073088a9ebd9cdacbbd006671a4440d [1,1,0,0,0,0|1,0,0]=3 2756 B11R0.40 C/C=C/CCOCCS(=O)CC 2b1eeb00867e8806b0fb194a669e456e [1,1,0,0,0,0|2,0,0]=4 2757 B11R0.40 C/C=C/CNCCCC(C)CO 56084618fb012a42cade6638ed90c020 [1,1,0,0,0,0|2,0,0]=4 2758 B11R0.40 C/C=C/CNCCCN(C)CC 2ef7c5aa011216b0d9c215bf9e3a593a [1,1,0,0,0,0|2,0,0]=4 2759 B11R0.40 C/C=C/COCCCC(C)CC ee37d6ad913219bd92975b1a8166e799 [1,1,0,0,0,0|1,0,0]=3 2760 B11R0.40 C/C=C/COCCCN(C)CC f66c796c76d3fca337c9004ed20ec245 [1,1,0,0,0,0|2,0,0]=4 2761 B11R0.40 C/C=C/COCCC[C@@H](C)CC 250a29d25ee7c8ad5b83bb69f915b5d7 [1,1,0,0,0,0|1,0,0]=3 2762 B11R0.40 C/C=C\CCCNCC(Br)CBr a42da39043a89b07561a1a5420693272 [1,1,0,0,0,0|2,0,0]=4 2763 B11R0.40 C/C=C\CCCNCC(C)CC c989f8ea37ef153d646cc4cda6a3beed [1,1,0,0,0,0|1,0,0]=3 2764 B11R0.40 C/C=C\CCCNCC(C)CO cf780bc58d0e9dd35cdaa90f44765e20 [1,1,0,0,0,0|2,0,0]=4 2765 B11R0.40 C/C=C\CCCNCC(F)CO dfb0e3038c943c4a17c8987cbdcb6d2e [1,1,0,0,0,0|2,0,0]=4 2766 B11R0.40 C/C=C\CCCNCC(O)CC 558c4ee27c462d33544ee9900eb738ad [1,1,0,0,0,0|1,0,0]=3 2767 B11R0.40 C/C=C\CCCNCC(O)CO 6ff8e8d7e0b069d1a8a81867d21b5d71 [1,1,0,0,0,0|2,0,0]=4 2768 B11R0.40 C/C=C\CCCNC[C@@H](C)CC a4fb01628aaf72365530cbfe271e208c [1,1,0,0,0,0|1,0,0]=3 2769 B11R0.40 C/C=C\CCCNC[C@@H](C)OC 492ad349ae905ec0d3138605e73cf972 [1,1,0,0,0,0|2,0,0]=4 2770 B11R0.40 C/C=C\CCCNC[C@@H](F)CO 927f555b062972d6ff18f01836291e47 [1,1,0,0,0,0|2,0,0]=4 2771 B11R0.40 C/C=C\CCCNC[C@@H](O)CO bfb400f58ff7358cdcb31c4e42c89cf7 [1,1,0,0,0,0|2,0,0]=4 2772 B11R0.40 C/C=C\CCCNC[C@H](C)CO bf4ee0ed8c40c15c612f39fa01e2d588 [1,1,0,0,0,0|2,0,0]=4 2773 B11R0.40 C/C=C\CCCNC[C@H](C)OC ca305d580ae3601fd91d987349addd48 [1,1,0,0,0,0|2,0,0]=4 2774 B11R0.40 C/C=C\CCCNC[C@H](F)CO 2f1be38e06b0035b7086b1ae872e43d6 [1,1,0,0,0,0|2,0,0]=4 2775 B11R0.40 C/C=C\CCCNC[C@H](O)CC b31a37b88fd1c40af07b3ed52c24d855 [1,1,0,0,0,0|1,0,0]=3 2776 B11R0.40 C/C=C\CCCNC[C@H](O)CO 1d21cec18ba1e3b93a4aee990732bb6f [1,1,0,0,0,0|2,0,0]=4 2777 B11R0.40 C/C=C\CCCOCC(=O)CC 79b6e7959efb333df9c226e430731208 [1,1,0,0,0,0|1,0,1]=4 2778 B11R0.40 C/C=C\CCCOCC(Br)CBr 62e9886d308efa9ad272f5c2111f42be [1,1,0,0,0,0|2,0,0]=4 2779 B11R0.40 C/C=C\CCCOCC(C)CC 3e7be7defd56cbdd16e45144a074389c [1,1,0,0,0,0|1,0,0]=3 2780 B11R0.40 C/C=C\CCCOCC(C)OC 8b3d7a1179ee61c720c1271b29f98db8 [1,1,0,0,0,0|2,0,0]=4 2781 B11R0.40 C/C=C\CCCOCC(Cl)CCl 3d6ac030d0803c37edd96152d1ffb31c [1,1,0,0,0,0|2,0,0]=4 2782 B11R0.40 C/C=C\CCCOCC(O)CO b2b2b4dad75b74f6854c6390924e394f [1,1,0,0,0,0|2,0,0]=4 2783 B11R0.40 C/C=C\CCCOCC(S)CS 2ec6aed2e37d0df59361b5fbf1e6f393 [1,1,0,0,0,0|2,0,0]=4 2784 B11R0.40 C/C=C\CCCOC[C@@H](C)CC 6711cf084fc76c40894150aa57cb9802 [1,1,0,0,0,0|1,0,0]=3 2785 B11R0.40 C/C=C\CCCOC[C@@H](C)OC 1d1b8af537befaba891a660c278fe58e [1,1,0,0,0,0|2,0,0]=4 2786 B11R0.40 C/C=C\CCCOC[C@@H](O)CO 1337c493ba11dea3fa55cb3a61627d3e [1,1,0,0,0,0|2,0,0]=4 2787 B11R0.40 C/C=C\CCCOC[C@H](C)CC c73e9cb41ce216ddbe6ee8b93394e327 [1,1,0,0,0,0|1,0,0]=3 2788 B11R0.40 C/C=C\CCCOC[C@H](C)OC 16729bbe3f8b788831df2dad3088a4a0 [1,1,0,0,0,0|2,0,0]=4 2789 B11R0.40 C/C=C\CCCOC[C@H](O)CO 8fc08666ead010fe4588d32298e9dc25 [1,1,0,0,0,0|2,0,0]=4 2790 B11R0.40 C/C=C\CNCCCC(C)CO 04851e806541b70cc31535476f9905b8 [1,1,0,0,0,0|2,0,0]=4 2791 B11R0.40 C/C=C\CNCCCN(C)CC 865eb4d605f9f96a549a8ff329290cee [1,1,0,0,0,0|2,0,0]=4 2792 B11R0.40 C/C=C\COCCCC(C)CC eef689e089165c6415203ef9733ddbda [1,1,0,0,0,0|1,0,0]=3 2793 B11R0.40 C/C=C\COCCCN(C)CC 743899b62baf6450c9e46834ec54c0ab [1,1,0,0,0,0|2,0,0]=4 2794 B11R0.40 C/C=C\COCCC[C@@H](C)CC 367baf045deafbfbfa3782232eb94a06 [1,1,0,0,0,0|1,0,0]=3 2795 B11R0.40 C=C(C=O)OCCCCCCC 5222448d8e72f81bee19037f75e00b4c [1,1,0,0,0,0|1,0,1]=4 2796 B11R0.40 C=C(CC)CNCCCCCC 5673d4e4fc129c4bc12fcdeb75eab606 [1,1,0,0,0,0|1,0,1]=4 2797 B11R0.40 C=C(CC)COCCC/C=C/C 919263df40b7dbaed5d9432df431bf08 [1,1,0,0,0,0|1,0,1]=4 2798 B11R0.40 C=C(CC)COCCC/C=C\C bfdbde9e5b6d11831637fc0353bc2aaa [1,1,0,0,0,0|1,0,1]=4 2799 B11R0.40 C=C(CC)COCCCC=CC fc08ba7e8281500e864347638c37d9a4 [1,1,0,0,0,0|1,0,1]=4 2800 B11R0.40 C=C(CC)COCCCCCC 212d40314ce0351be00200277ccfea95 [1,1,0,0,0,0|1,0,1]=4 2801 B11R0.40 C=C(CNCCCCCC)OC b50f3fa0913553bb25a4d41e332bf3c9 [1,1,0,0,0,0|2,0,0]=4 2802 B11R0.40 C=C(CO)CNCCCCCC 55d23f35995915afb4b436463be1bd8f [1,1,0,0,0,0|1,0,0]=3 2803 B11R0.40 C=C(CO)CNCCCCCCl 788090b39e211166513572cce4bf895b [1,1,0,0,0,0|2,0,0]=4 2804 B11R0.40 C=C(CO)CNCCCCCO 7b9c2ad7d196ce3286fe71761213f401 [1,1,0,0,0,0|2,0,0]=4 2805 B11R0.40 C=C(CO)CNCCCCOC 63bf4df6caff86b45f176bd334044290 [1,1,0,0,0,0|2,0,0]=4 2806 B11R0.40 C=C(CO)CNCCCCSC 0178a0e11ba2022fd16744f6e32af9a7 [1,1,0,0,0,0|2,0,0]=4 2807 B11R0.40 C=C(CO)CNCCCOCC 4b6af077bdf2343c78e529a6822e84bf [1,1,0,0,0,0|2,0,0]=4 2808 B11R0.40 C=C(CO)CNCCOCCC 1cebd92afe98b32105045a5c18d5fa6d [1,1,0,0,0,0|2,0,0]=4 2809 B11R0.40 C=C(COCCCCCC)OC 0b95e642e1e4df81a1841fb1104211cb [1,1,0,0,0,0|2,0,0]=4 2810 B11R0.40 C=CC(=O)CCCNCCCC bbe6cc9efa2cfede0189e258e7938747 [1,1,0,0,0,0|1,0,1]=4 2811 B11R0.40 C=CC(=O)CCCOCCCC 47940038721735bb278c8d355b063009 [1,1,0,0,0,0|1,0,1]=4 2812 B11R0.40 C=CC(=O)NCCCCCCC f1adb5880043356bf107a0e1433c2cec [1,1,0,0,0,0|1,0,1]=4 2813 B11R0.40 CC(CO)CCCNC/C=C\O 623019d8a7b66a01a38f6f79519c7e69 [1,1,0,0,0,0|2,0,0]=4 2814 B11R0.40 CC/C=C/CCOCC(C)CC a18893e95294266df641a7f75df77371 [1,1,0,0,0,0|2,0,0]=4 2815 B11R0.40 CC/C=C/CCOC[C@@H](C)CC 6a7ff2db86ad7259184ffa9f1833190d [1,1,0,0,0,0|2,0,0]=4 2816 B11R0.40 CC/C=C/CCOC[C@H](C)CC 46f27b7828b11bb004eebf552002aba2 [1,1,0,0,0,0|2,0,0]=4 2817 B11R0.40 CC/C=C/CNCCC(C)CC e08bd51197f77277c9df96b6a9b47eb6 [1,1,0,0,0,0|2,0,0]=4 2818 B11R0.40 CC/C=C/COCCC(C)CC c8657a8dedc1141108538ffcbaf60b93 [1,1,0,0,0,0|2,0,0]=4 2819 B11R0.40 CC/C=C/COCCC(S)CC 2398d0f459936d50b24d4555d0f3701d [1,1,0,0,0,0|2,0,0]=4 2820 B11R0.40 CC/C=C/COCC[C@@H](C)CC 6c9480ce42c2a1a7d94d2e53430561f8 [1,1,0,0,0,0|2,0,0]=4 2821 B11R0.40 CC/C=C\CCCOC(C)CC d3d8b9519d2be88cee2ffda7eda847dd [1,1,0,0,0,0|2,0,0]=4 2822 B11R0.40 CC/C=C\CCNCC(C)CC f95284a6652f89b8ca36267b81279e41 [1,1,0,0,0,0|2,0,0]=4 2823 B11R0.40 CC/C=C\CCNCC(O)CC d3e06e192f877304707d30533ae19d86 [1,1,0,0,0,0|2,0,0]=4 2824 B11R0.40 CC/C=C\CCNC[C@@H](C)CC 37e68e9372b32a11010391a5104a30df [1,1,0,0,0,0|2,0,0]=4 2825 B11R0.40 CC/C=C\CCNC[C@H](O)CC 607e86fcce4ce79a2d479a974464af41 [1,1,0,0,0,0|2,0,0]=4 2826 B11R0.40 CC/C=C\CCOCC(C)CC 7be206bf36abd75136c6f76c2f007f15 [1,1,0,0,0,0|2,0,0]=4 2827 B11R0.40 CC/C=C\CCOC[C@@H](C)CC c3d86722637108e275c54b064d03985d [1,1,0,0,0,0|2,0,0]=4 2828 B11R0.40 CC/C=C\CCOC[C@H](C)CC 31b408c8a11bab3cf180e17165f8d169 [1,1,0,0,0,0|2,0,0]=4 2829 B11R0.40 CC/C=C\COCCC(C)CC 87a94e6c58dec9643bc2437a3affb74d [1,1,0,0,0,0|2,0,0]=4 2830 B11R0.40 CC=CCCCOCC(=O)CC 7b83ed5582f9954f8d323606ab334e05 [1,1,0,0,0,0|1,0,1]=4 2831 B11R0.40 CC=CCCCOCC(C)CC 12c577dd0f830a964e4705c1f2431e99 [1,1,0,0,0,0|1,0,0]=3 2832 B11R0.40 CC=CCCCOCC(C)OC 7b020ac4b74f089ff2eb9ed037ce2d75 [1,1,0,0,0,0|2,0,0]=4 2833 B11R0.40 CC=CCCCOCC(O)CO 556c9af9152eb5ce0893e855de507469 [1,1,0,0,0,0|2,0,0]=4 2834 B11R0.40 CC=CCCCOC[C@@H](C)CC e4ca4800db2261d9bfca276bb131b921 [1,1,0,0,0,0|1,0,0]=3 2835 B11R0.40 CC=CCCCOC[C@@H](C)OC ce52ea08994a5374fde81fa313b67959 [1,1,0,0,0,0|2,0,0]=4 2836 B11R0.40 CC=CCCCOC[C@@H](O)CO e081bcd7b39761caf259e42edf005a91 [1,1,0,0,0,0|2,0,0]=4 2837 B11R0.40 CC=CCCCOC[C@H](C)CC 07b1ae0804b259716b3d8ec7a8c35797 [1,1,0,0,0,0|1,0,0]=3 2838 B11R0.40 CC=CCCCOC[C@H](C)OC 79d0067ab30b4b5e13db7450e24c9a7f [1,1,0,0,0,0|2,0,0]=4 2839 B11R0.40 CC=CCCCOC[C@H](O)CO b8a764cb77889ededba0474dc44d9a0b [1,1,0,0,0,0|2,0,0]=4 2840 B11R0.40 CCC(C)CCCCCOCF b60526b77c9c5cfa3c2e4346213d2f40 [1,1,0,0,0,0|2,0,0]=4 2841 B11R0.40 CCC(C)CCCOC/C=C/Cl ed60000c4bb448b6731bb2d84460cf86 [1,1,0,0,0,0|2,0,0]=4 2842 B11R0.40 CCC(C)CCCOC/C=C\Cl ba33b4231a6c036beba6cbf834a2ec48 [1,1,0,0,0,0|2,0,0]=4 2843 B11R0.40 CCC(C)CCNCCCCO 3714c8a6512245ebd953ed4d38e866c5 [1,1,0,0,0,0|1,0,1]=4 2844 B11R0.40 CCC(C)CNCCCCCO 24d6bb34a9168935c8b4339b8217ec3b [1,1,0,0,0,0|1,0,1]=4 2845 B11R0.40 CCC(C)NCCCCCCO c56340f60c3db96b7780b39d8e32cf3e [1,1,0,0,0,0|1,0,1]=4 2846 B11R0.40 CCC(O)CNCCCCCO 5f93feec4e745184fa4236389c6b9cb3 [1,1,0,0,0,0|1,0,1]=4 2847 B11R0.40 CCCCCCCCN(C)C=O 60df17e7bff532b45ddfc3473c76a602 [1,1,0,0,0,0|1,0,1]=4 2848 B11R0.40 CCCCCCCCN(C)CC 70508c4ce057b69cc70f21f7c84ad582 [1,1,0,0,0,0|1,0,1]=4 2849 B11R0.40 CCCCCCCCN(C)CF db3adf26f95450df7a62d7f7ad5e9bf6 [1,1,0,0,0,0|2,0,0]=4 2850 B11R0.40 CCCCCCCCN(C)CO fae3de65e7b8918f8c44c346d84947bf [1,1,0,0,0,0|1,0,0]=3 2851 B11R0.40 CCCCCCCNC(=O)C=O abee9ded1e7a7a6b29f3f186b2d24366 [1,1,0,0,0,0|1,0,1]=4 2852 B11R0.40 CCCCCCCNC(=O)CC 686f1ce47fd62528159d592ae6144fd0 [1,1,0,0,0,0|1,0,1]=4 2853 B11R0.40 CCCCCCCNC(=O)CF 406840209e6eaaa926c9723f43f43bb3 [1,1,0,0,0,0|2,0,0]=4 2854 B11R0.40 CCCCCCCNC(=O)CO 649c57dfd5f4fa0f4565341b8aa151e7 [1,1,0,0,0,0|1,0,0]=3 2855 B11R0.40 CCCCCCCNC(=O)CS 53771c9c8b167b3f7995337d22f4a6f9 [1,1,0,0,0,0|1,1,0]=4 2856 B11R0.40 CCCCCCCNC(C)CO 11186d32dbdc7c7240a14960e89c6d68 [1,1,0,0,0,0|1,0,1]=4 2857 B11R0.40 CCCCCCCN[C@@H](C)CO 2e828866cd2ec0f76bc74f9725d50eb5 [1,1,0,0,0,0|1,0,1]=4 2858 B11R0.40 CCCCCCCN[C@H](C)CO 2ed6ae1c070d9c3e4b9dc61528b39162 [1,1,0,0,0,0|1,0,1]=4 2859 B11R0.40 CCCCCCNC/C(=C/Cl)/Cl d724e536ccc81f71307319d5e647b3f5 [1,1,0,0,0,0|2,0,0]=4 2860 B11R0.40 CCCCCCNCC(=O)CC c8e5732d0f65da9c5c5b2a092b9f01ac [1,1,0,0,0,0|1,0,1]=4 2861 B11R0.40 CCCCCCNCC(=O)CO 22481f5647b4924598aea5bd39f61ac5 [1,1,0,0,0,0|1,0,0]=3 2862 B11R0.40 CCCCCCNCC(=O)NC 40b08a506355532a04de3945e21a62e5 [1,1,0,0,0,0|2,0,0]=4 2863 B11R0.40 CCCCCCNCC(=O)NO 70ed1d49a75a058f80d6cb8d6355c00e [1,1,0,0,0,0|2,0,0]=4 2864 B11R0.40 CCCCCCNCC(=O)OC b4b64d05ad9791105a1ead038a87d73e [1,1,0,0,0,0|2,0,0]=4 2865 B11R0.40 CCCCCCNCC(C)CO cf0dea6bd5913beddb6515e445f99f79 [1,1,0,0,0,0|1,0,1]=4 2866 B11R0.40 CCCCCCNCC(F)CO d6a8e8760a6d8b374a472cfd73c264c4 [1,1,0,0,0,0|1,0,1]=4 2867 B11R0.40 CCCCCCNCC(O)CO db7d7ddc5e0415102c6ef78dcb41df40 [1,1,0,0,0,0|1,0,1]=4 2868 B11R0.40 CCCCCCNC[C@@H](C)CO fc1cd6b385021207c9f5ddc2eb42a052 [1,1,0,0,0,0|1,0,1]=4 2869 B11R0.40 CCCCCCNC[C@@H](F)CO 81010159413625c27f9dcae6cec8511d [1,1,0,0,0,0|1,0,1]=4 2870 B11R0.40 CCCCCCNC[C@@H](O)CO 4631a41a8e7b23c621f4060433d7943c [1,1,0,0,0,0|1,0,1]=4 2871 B11R0.40 CCCCCCNC[C@H](C)CO 6305c36cb8a89ed146b5b0f448427b56 [1,1,0,0,0,0|1,0,1]=4 2872 B11R0.40 CCCCCCNC[C@H](F)CO 1d1b1beea0723c5dcc24dd722009e7bb [1,1,0,0,0,0|1,0,1]=4 2873 B11R0.40 CCCCCCNC[C@H](O)CO 9bffc38446f234d6651d93db9c62cc8a [1,1,0,0,0,0|1,0,1]=4 2874 B11R0.40 CCCCCCOC/C(=C/Cl)/Cl 86f761b34c6cef5aa9a647b39798a90a [1,1,0,0,0,0|2,0,0]=4 2875 B11R0.40 CCCCCCOC/C(=C/I)/C 118407e3a9f9868e9525728ce4adeb55 [1,1,0,0,0,0|2,0,0]=4 2876 B11R0.40 CCCCCCOCC(=CI)C 30a7afefc4e5fafeab8c2950ea14ac5f [1,1,0,0,0,0|2,0,0]=4 2877 B11R0.40 CCCCCCOCC(=O)CC adcf10a6b79c1dbe703e4ef32ea4d479 [1,1,0,0,0,0|1,0,1]=4 2878 B11R0.40 CCCCCCOCC(=O)NC 36fff55613dedf0508c95b9965e07157 [1,1,0,0,0,0|2,0,0]=4 2879 B11R0.40 CCCCCCOCC(=O)OC 09bff5c54ea2c2317e4ffa1248f416e4 [1,1,0,0,0,0|2,0,0]=4 2880 B11R0.40 CCCCCCOCC(O)CO ddf18778675217e7bedbbd4889e96847 [1,1,0,0,0,0|1,0,1]=4 2881 B11R0.40 CCCCCCOC[C@@H](O)CO 4d2a9898ffd605a1a0642c3fd8b092c2 [1,1,0,0,0,0|1,0,1]=4 2882 B11R0.40 CCCCCCOC[C@H](O)CO a86fe3adbba81d9c2d7853bccbcc0904 [1,1,0,0,0,0|1,0,1]=4 2883 B11R0.40 CCCCCNCCC(=O)NC bf2880d61bf311927f37d9459b95311c [1,1,0,0,0,0|2,0,0]=4 2884 B11R0.40 CCCCCNCCC(=O)NO 0e3cd417c385fa2267d618895d9f197e [1,1,0,0,0,0|2,0,0]=4 2885 B11R0.40 CCCCCNCCC(=O)OC 528d03f621767c5da7a29df90a9b38b7 [1,1,0,0,0,0|2,0,0]=4 2886 B11R0.40 CCCCCNCCC(C)CO 733814c2dbc4e40dc11ccb8ff86576c0 [1,1,0,0,0,0|1,0,1]=4 2887 B11R0.40 CCCCCNCCC(O)CO bb0917424ca5e15763a892df5cc68355 [1,1,0,0,0,0|1,0,1]=4 2888 B11R0.40 CCCCCNCC[C@@H](C)CO 14e8630a92053f727b05e3015c67297a [1,1,0,0,0,0|1,0,1]=4 2889 B11R0.40 CCCCCOCCC(=O)NC d53a8d398531b211866f279fd03bc27d [1,1,0,0,0,0|2,0,0]=4 2890 B11R0.40 CCCCCOCCC(=O)OC ccac832df9f8c79f4c2f2e191d935c4d [1,1,0,0,0,0|2,0,0]=4 2891 B11R0.40 CCCCNCCCC(=O)NC 5ab58c06c9aebec88dfab837bc396f59 [1,1,0,0,0,0|2,0,0]=4 2892 B11R0.40 CCCCNCCCC(=O)OC af4a3bbabc42a3dd3e1785630a7ed514 [1,1,0,0,0,0|2,0,0]=4 2893 B11R0.40 CCCCNCCCC(C)CO cd70668888afa3bd15a67434b1530b13 [1,1,0,0,0,0|1,0,1]=4 2894 B11R0.40 CCCCOCCCC(=O)NC c2d274710c85b38a446478cdb547f403 [1,1,0,0,0,0|2,0,0]=4 2895 B11R0.40 CCCCOCCCC(=O)OC 2c00c25d55f4aed289459825ca6caf67 [1,1,0,0,0,0|2,0,0]=4 2896 B11R0.40 CCCCOCCNC(=O)CO 46d63bbe6e95cb3021fbf39dbedf64e4 [1,1,0,0,0,0|2,0,0]=4 2897 B11R0.40 CCCNCCCCC(=O)CC a0ca041e30af7810958502bfc4beeb26 [1,1,0,0,0,0|1,0,1]=4 2898 B11R0.40 CCCNCCCCC(=O)OC 060557c49fc8b2682bce09dcecd26897 [1,1,0,0,0,0|2,0,0]=4 2899 B11R0.40 CCCOCCCCC(=O)CC 177be31e74ea458cdea2086674fce0ec [1,1,0,0,0,0|1,0,1]=4 2900 B11R0.40 CCCOCCCCC(=O)OC c38c96dc4e6815105987ed08074c5cd5 [1,1,0,0,0,0|2,0,0]=4 2901 B11R0.40 CCCOCCCNC(=O)CO a47934e78a1d20ef948dc30f597ef7f9 [1,1,0,0,0,0|2,0,0]=4 2902 B11R0.40 CCCOCCNCC(=O)CO 47b079dfc4b06824587236598da16550 [1,1,0,0,0,0|2,0,0]=4 2903 B11R0.40 CCN(C)CCCCCCCO c2bb6585c3974fdcef6e90549ca1477c [1,1,0,0,0,0|1,0,1]=4 2904 B11R0.40 CCN(C)CCCNC/C=C\O 1d137a6b0b79a1864c84364336e7ebd9 [1,1,0,0,0,0|2,0,0]=4 2905 B11R0.40 CCNCCCCCC(=O)OC 78bd529289af6b285c7f270dc69f9cc3 [1,1,0,0,0,0|2,0,0]=4 2906 B11R0.40 CCOCCCCCC(=O)OC 9b80041f3611c56f4bedd2a18eade3b1 [1,1,0,0,0,0|2,0,0]=4 2907 B11R0.40 CCOCCCCCC(C)CC 16c8baaa4ed54d8202ffa3a03e7be5ba [1,1,0,0,0,0|1,0,1]=4 2908 B11R0.40 CCOCCCCC[C@@H](C)CC 2926b2af0298b0f410e612451c0a6338 [1,1,0,0,0,0|1,0,1]=4 2909 B11R0.40 CCOCCCNCC(=O)CO 38c5656cb2b027b7ffdf35a630aad082 [1,1,0,0,0,0|2,0,0]=4 2910 B11R0.40 CCSCCCCNC(=O)CO 3d767f9c997321d233814d207e1ee524 [1,1,0,0,0,0|2,0,0]=4 2911 B11R0.40 CC[C@@H](C)CNCCCCCO 388b000fc7537ea460a9a8342d2af388 [1,1,0,0,0,0|1,0,1]=4 2912 B11R0.40 CC[C@@H](C)NCCCCCCO 013006ebb5f903a647eebc1801822353 [1,1,0,0,0,0|1,0,1]=4 2913 B11R0.40 CC[C@@H](O)CNCCCCCO 3e64048a96cd997f5cd275931a6016da [1,1,0,0,0,0|1,0,1]=4 2914 B11R0.40 CC[C@H](C)CCCCCOCF d022b1edab298bb224862a9fa9a8a0b6 [1,1,0,0,0,0|2,0,0]=4 2915 B11R0.40 CC[C@H](C)CCCOC/C=C/Cl aa5c3931e32e376ac53ad881bfda586e [1,1,0,0,0,0|2,0,0]=4 2916 B11R0.40 CC[C@H](C)CCCOC/C=C\Cl 2bdb6266d06d63083c9348fe5fc1e294 [1,1,0,0,0,0|2,0,0]=4 2917 B11R0.40 CC[C@H](C)CNCCCCCO 5ebbd425576faab6f7009f3d799e8c7a [1,1,0,0,0,0|1,0,1]=4 2918 B11R0.40 CC[C@H](C)NCCCCCCO e0347a0a81438b54706d2f62a25c3de3 [1,1,0,0,0,0|1,0,1]=4 2919 B11R0.40 COCCCCCNC(=O)CO 60d8072e5d6484d79910c980a11ba8d6 [1,1,0,0,0,0|2,0,0]=4 2920 B11R0.40 COCCCCNCC(=O)CO 31d44522c7c4c00441905fa4da232bdc [1,1,0,0,0,0|2,0,0]=4 2921 B11R0.40 CSCCCCNCC(=O)CO f2fd79f1ccfc8ac07d50685faaa51616 [1,1,0,0,0,0|2,0,0]=4 2922 B11R0.40 O=C(CO)CNCCCCCCl 606a142a4758e981892716dfd004ff3b [1,1,0,0,0,0|2,0,0]=4 2923 B11R0.40 O=C(CO)CNCCCCCO dd2db0edcecc3767d3c9d40443d3d1ae [1,1,0,0,0,0|2,0,0]=4 2924 B11R0.40 O=C(CO)NCCCCCCCl dbfc21936551b9a9fe635f023097f8d4 [1,1,0,0,0,0|2,0,0]=4 2925 B11R0.40 O=C(CO)NCCCCCCO 7bfceec3914389840f05d685c72f8368 [1,1,0,0,0,0|2,0,0]=4 2926 B11R0.81 C/C=C/CC(=O)NCCCCC 774328c90bf0e133b0d7bc3d5e34ebd5 [1,1,0,0,0,0|1,0,1]=4 2927 B11R0.81 C/C=C/CCCC(=O)NCCC 320cd7ca372be81d7dd0b97c4069ce50 [1,1,0,0,0,0|1,0,1]=4 2928 B11R0.81 C/C=C/CCOC(C)CCCC fc755d5939ac545b621671d079cee386 [1,1,0,0,0,0|1,0,0]=3 2929 B11R0.81 C/C=C/CN(C)CCCCCC 54726a9dcc8a633aa5b2da8b044f6f74 [1,1,0,0,0,0|1,0,0]=3 2930 B11R0.81 C/C=C/CN(C)CCCCCO 22716ce341ff07be0c6bf3626522afed [1,1,0,0,0,0|2,0,0]=4 2931 B11R0.81 C/C=C/CN(C)CCCCOC a8332fd0cd4e5cd18dc617b24adb97f1 [1,1,0,0,0,0|2,0,0]=4 2932 B11R0.81 C/C=C/CNCC(O)CCCC 87fd6db9490d6c1da66aa8f76fe0b86e [1,1,0,0,0,0|1,0,0]=3 2933 B11R0.81 C/C=C/CNCC(O)COCC ae7c6e386e0dd7576d145ff2783dfae4 [1,1,0,0,0,0|2,0,0]=4 2934 B11R0.81 C/C=C/CNC[C@H](C)CCCO 68f5b34f0ea253b39f421accc4637d7a [1,1,0,0,0,0|2,0,0]=4 2935 B11R0.81 C/C=C/COCC(C)CCCC 5bcd98637b964293a8851a87741e496d [1,1,0,0,0,0|1,0,0]=3 2936 B11R0.81 C/C=C/COCC(C)COCC 85856fb2768991549edf3d5c91cd43d9 [1,1,0,0,0,0|2,0,0]=4 2937 B11R0.81 C/C=C\CCCN(C)CCCC dab94aa0fa141d79a59319ed5832c43b [1,1,0,0,0,0|1,0,0]=3 2938 B11R0.81 C/C=C\CCCN(C)CCCO 48cb3f8812952a46dce701293cfdcc89 [1,1,0,0,0,0|2,0,0]=4 2939 B11R0.81 C/C=C\CCCN(C)CCOC 33254b16fa3e209d89011746088ecd04 [1,1,0,0,0,0|2,0,0]=4 2940 B11R0.81 C/C=C\CCCN(C)CCSC 30381923232ef1f0088e498d9e52c75c [1,1,0,0,0,0|2,0,0]=4 2941 B11R0.81 C/C=C\CN(C)CCCCCC 5f6fcecec0730ae58d56118db1602692 [1,1,0,0,0,0|1,0,0]=3 2942 B11R0.81 C/C=C\CN(C)CCCCCO 8a130ec195791358ef38fcef8565dd16 [1,1,0,0,0,0|2,0,0]=4 2943 B11R0.81 C/C=C\CN(C)CCCCOC c7511b04a4723def7559cd82184f3e7d [1,1,0,0,0,0|2,0,0]=4 2944 B11R0.81 C/C=C\CNCC(O)CCCC 7d29d3689b8572d3e06f3d053a6e36ed [1,1,0,0,0,0|1,0,0]=3 2945 B11R0.81 C/C=C\CNCC(O)COCC 50b12ac2a9352bf3a4d8cb4c94029341 [1,1,0,0,0,0|2,0,0]=4 2946 B11R0.81 C/C=C\CNC[C@H](C)CCCO 4d796079e40d3403eb845b9db0f167cc [1,1,0,0,0,0|2,0,0]=4 2947 B11R0.81 C/C=C\COCC(C)CCCC 7f52ba5b633c5e5a5d38a4648e70434c [1,1,0,0,0,0|1,0,0]=3 2948 B11R0.81 C/C=C\COCC(C)COCC 3115fd5a9a6a042fdcedc0952bb07054 [1,1,0,0,0,0|2,0,0]=4 2949 B11R0.81 CC/C=C/CNC(C)CCCC 81e86a8b9f48b2cc1219d4de5d459744 [1,1,0,0,0,0|2,0,0]=4 2950 B11R0.81 CC/C=C/CN[C@H](C)CCCC f79cdffbb693f716fcf5d93b69b0310b [1,1,0,0,0,0|2,0,0]=4 2951 B11R0.81 CC/C=C/COC(C)CCCC 42b37d9860f90ae1395ebb1fa01f0a58 [1,1,0,0,0,0|2,0,0]=4 2952 B11R0.81 CC/C=C/CO[C@@H](C)CCCC e4d373f852c3e3656bf4fcd1d8dc87f5 [1,1,0,0,0,0|2,0,0]=4 2953 B11R0.81 CC/C=C/CO[C@H](C)CCCC a61448b5c4d7007538aaf40b63254bb0 [1,1,0,0,0,0|2,0,0]=4 2954 B11R0.81 CC/C=C\CCN(C)CCCC ec9dc44d647d04a82557832f950258f9 [1,1,0,0,0,0|2,0,0]=4 2955 B11R0.81 CC/C=C\COC(C)CCCC 2c34bb4d4c5cae98da461010746a1e1c [1,1,0,0,0,0|2,0,0]=4 2956 B11R0.81 CCCCC(C)COC/C=C/Cl b66911ba7c9be266a251487520527bb9 [1,1,0,0,0,0|2,0,0]=4 2957 B11R0.81 CCCCC(C)COC/C=C\Cl 193d55c4fc8c047e22b924c4e5d5db6a [1,1,0,0,0,0|2,0,0]=4 2958 B11R0.81 CCCCC(C)NCCCCO 9f29a105dee7b4bf1e952c699c8fa561 [1,1,0,0,0,0|1,0,1]=4 2959 B11R0.81 CCCCC(O)CNC/C=C/Cl 7cb6cfbf89d892631366bb25a9a88d2b [1,1,0,0,0,0|2,0,0]=4 2960 B11R0.81 CCCCC(O)CNC/C=C\Cl 4bbc91245648faf12aea3a1280145a92 [1,1,0,0,0,0|2,0,0]=4 2961 B11R0.81 CCCCC(O)CNC/C=C\O f4694b2f29922bbd646016f506b06446 [1,1,0,0,0,0|1,0,0]=3 2962 B11R0.81 CCCCC(O)CNCCCO 83fd5fe175405563fa5052ff53e1ba21 [1,1,0,0,0,0|1,0,1]=4 2963 B11R0.81 CCCCCCC(C)COCC 77f334f632b571e05de48ea67149c2d4 [1,1,0,0,0,0|1,0,1]=4 2964 B11R0.81 CCCCCCC(C)COCF 9e97cf89ae569a7fdc534cbfe6861c48 [1,1,0,0,0,0|2,0,0]=4 2965 B11R0.81 CCCCCCC(C)NCCO f38668e54c52cfb1a95ef21269912c88 [1,1,0,0,0,0|1,0,1]=4 2966 B11R0.81 CCCCCCN(C)C/C=C/Cl 86168a410916e9cbeb8a895550acc585 [1,1,0,0,0,0|2,0,0]=4 2967 B11R0.81 CCCCCCN(C)C/C=C\Cl 7b77cf612815e0120926c19ceef5d7d3 [1,1,0,0,0,0|2,0,0]=4 2968 B11R0.81 CCCCCCN(C)C/C=C\O 26fd2197a40f946258538fc03ea543c2 [1,1,0,0,0,0|1,0,0]=3 2969 B11R0.81 CCCCCCN(C)CCCO 2aef5358383be552dd30ac8ca9e5f873 [1,1,0,0,0,0|1,0,1]=4 2970 B11R0.81 CCCCCC[C@@H](C)NCCO 58aca5a2be6637938056556584adf0c5 [1,1,0,0,0,0|1,0,1]=4 2971 B11R0.81 CCCCCC[C@H](C)NCCO 8fbbf3b644301d85f6bafefddb099f7d [1,1,0,0,0,0|1,0,1]=4 2972 B11R0.81 CCCCCNC(=O)/C=C/CO a41f5197cf0d690cfca6c7f3174709bc [1,1,0,0,0,0|1,0,1]=4 2973 B11R0.81 CCCCCNC(=O)C=CCO 2e84c976f12d11f7b50b54648b6d2afa [1,1,0,0,0,0|1,0,1]=4 2974 B11R0.81 CCCCCNC(C)CCCO 406073321f0839fe6087b998442feca1 [1,1,0,0,0,0|1,0,1]=4 2975 B11R0.81 CCCCCN[C@H](C)CCCO 7315223bb4b33e83083e6a29b9477bde [1,1,0,0,0,0|1,0,1]=4 2976 B11R0.81 CCCCN(C)CCCCCO c5675d46ea3544a800eca8dfc876b4c2 [1,1,0,0,0,0|1,0,1]=4 2977 B11R0.81 CCCCN(C)CCCNCO a152fbf2b8d31143a4ace281743fb47f [1,1,0,0,0,0|2,0,0]=4 2978 B11R0.81 CCCCNC[C@H](C)CCCO 0fc13b38840d250bb93148c460e32459 [1,1,0,0,0,0|1,0,1]=4 2979 B11R0.81 CCCC[C@@H](C)NCCCCO 09767edc918506fb3bfb78bd2e9f817b [1,1,0,0,0,0|1,0,1]=4 2980 B11R0.81 CCOCC(O)CNC/C=C\O 74c415a69acb580a3975475cd445aa32 [1,1,0,0,0,0|2,0,0]=4 2981 B11R0.81 CN(C/C=C\O)CCCCCO bb68016de67a77d44e9e118a3b81811b [1,1,0,0,0,0|2,0,0]=4 2982 B11R0.81 COCCCCN(C)C/C=C\O f9568129d30abf87b27d4e963f9b63f3 [1,1,0,0,0,0|2,0,0]=4 2983 B11R0.81 C[C@H](CCCO)CNC/C=C\O 0cdca628e2cc00db2744f521f1ff37b7 [1,1,0,0,0,0|2,0,0]=4 2984 B11R0.140 C/C=C/CNC(C)CCCCC 5bd3e9f92ac4251d1326d23c73a7309d [1,1,0,0,0,0|1,0,0]=3 2985 B11R0.140 C/C=C/CN[C@@H](C)CCCCC 0ce4ca0b16d77a4256353d334386eb9f [1,1,0,0,0,0|1,0,0]=3 2986 B11R0.140 C/C=C/COC(C)CCCCC 77edce5e1f30cd6a3da66dfc67688109 [1,1,0,0,0,0|1,0,0]=3 2987 B11R0.140 C/C=C/COC(C)COCCC 73ca9741337f36518d7630713ea4fe59 [1,1,0,0,0,0|2,0,0]=4 2988 B11R0.140 C/C=C/CO[C@@H](C)CCCCC 597df5ea4894014a88d84ac3692dc051 [1,1,0,0,0,0|1,0,0]=3 2989 B11R0.140 C/C=C/CO[C@H](C)CCCCC 65192d271f93182bbe16e8ef03423efa [1,1,0,0,0,0|1,0,0]=3 2990 B11R0.140 C/C=C\CNC(C)CCCCC 3e4a4674d96a30f6f2b5bc16028d9a79 [1,1,0,0,0,0|1,0,0]=3 2991 B11R0.140 C/C=C\CN[C@@H](C)CCCCC 5e8d5ca0812cc3357fc4653035ce91d5 [1,1,0,0,0,0|1,0,0]=3 2992 B11R0.140 C/C=C\COC(C)CCCCC 61108ccd8912e90374f2c527331982bf [1,1,0,0,0,0|1,0,0]=3 2993 B11R0.140 C/C=C\COC(C)COCCC 9a7b8575de30f90647ea785d739a83e4 [1,1,0,0,0,0|2,0,0]=4 2994 B11R0.140 C/C=C\CO[C@@H](C)CCCCC f324ed47ae8365f25bba4580d4c66f10 [1,1,0,0,0,0|1,0,0]=3 2995 B11R0.140 C/C=C\CO[C@H](C)CCCCC b35955222a9d1240cc101bd57a321e15 [1,1,0,0,0,0|1,0,0]=3 2996 B11R0.140 CC/C=C/CN(C)CCCCC daae4a22f1436367e66179146cdfdd89 [1,1,0,0,0,0|2,0,0]=4 2997 B11R0.140 CC=CCCC(=O)NCCCC cb7b4f363ee80a4e8c2f125d20ba6811 [1,1,0,0,0,0|1,0,1]=4 2998 B11R0.140 CC=CCNC(=O)CCCCC 26655ea04bc309f17742144a729b0fd4 [1,1,0,0,0,0|1,0,1]=4 2999 B11R0.140 CC=CCNC(C)CCCCC cd36fd8da762010e39551d843679d87a [1,1,0,0,0,0|1,0,0]=3 3000 B11R0.140 CC=CCNC(C)CCCCO ff22bdb1687d362578870e3168529f0f [1,1,0,0,0,0|2,0,0]=4 3001 B11R0.140 CC=CCN[C@@H](C)CCCCC c70d7623129a75aadbd4b4bf0776878c [1,1,0,0,0,0|1,0,0]=3 3002 B11R0.140 CC=CCOC(C)CCCCC 4b171f95f050f4e502840e022150e218 [1,1,0,0,0,0|1,0,0]=3 3003 B11R0.140 CC=CCO[C@@H](C)CCCCC db6495fe183ce091d7516f693f8a9ca5 [1,1,0,0,0,0|1,0,0]=3 3004 B11R0.140 CCCCCC(C)NC/C=C/Cl 159c262224b66fe9b777a767115e331e [1,1,0,0,0,0|2,0,0]=4 3005 B11R0.140 CCCCCC(C)NC/C=C\Cl 8d081a8079d49420173db853b423a297 [1,1,0,0,0,0|2,0,0]=4 3006 B11R0.140 CCCCCC(C)NC/C=C\O 76bd26a58a9917c7294aa15c046ee28e [1,1,0,0,0,0|1,0,0]=3 3007 B11R0.140 CCCCCC(C)NCCCO 6ce8b1ff6fc28b8f96fcabf18f1f4835 [1,1,0,0,0,0|1,0,1]=4 3008 B11R0.140 CCCCCC(C)OC/C=C/Cl 7cccfc9193123ac1cf4ef26f50e75af6 [1,1,0,0,0,0|2,0,0]=4 3009 B11R0.140 CCCCCC(C)OC/C=C\Cl 551aad2202bc3a3cbfcd2e403addebc2 [1,1,0,0,0,0|2,0,0]=4 3010 B11R0.140 CCCCCC(C)OCC=CCl f5ffe0e5513453ba1966abdf3bc87c4a [1,1,0,0,0,0|2,0,0]=4 3011 B11R0.140 CCCCCN(C)CCCCO c1bda2d7c23ebff2ff15e9d21aa7f778 [1,1,0,0,0,0|1,0,1]=4 3012 B11R0.140 CCCCC[C@@H](C)OC/C=C/Cl 4cdf4a4771a2886da848014d1c99a68f [1,1,0,0,0,0|2,0,0]=4 3013 B11R0.140 CCCCC[C@@H](C)OC/C=C\Cl 5bea5493c608d0bf63c1642a7ed34750 [1,1,0,0,0,0|2,0,0]=4 3014 B11R0.140 CCCCC[C@H](C)NC/C=C/Cl ea10ed131b2064e0c84b3920f037ce1c [1,1,0,0,0,0|2,0,0]=4 3015 B11R0.140 CCCCC[C@H](C)NC/C=C\Cl f590a813f0a968dee1ba553ada30603f [1,1,0,0,0,0|2,0,0]=4 3016 B11R0.140 CCCCC[C@H](C)NC/C=C\O 50d9be5e59d484b83e738a5dd5f06b17 [1,1,0,0,0,0|1,0,0]=3 3017 B11R0.140 CCCCC[C@H](C)NCCCO f42f4f5af4e85d656812f8de0a549128 [1,1,0,0,0,0|1,0,1]=4 3018 B11R0.140 CCCCC[C@H](C)OC/C=C/Cl f0505822a142555eef46d4c9189f847f [1,1,0,0,0,0|2,0,0]=4 3019 B11R0.140 CCCCC[C@H](C)OC/C=C\Cl d339aaff8bd5e855085eacf95f3dfc20 [1,1,0,0,0,0|2,0,0]=4 3020 B11R0.140 CCCCC[C@H](C)OCC=CCl d00c379ee0a7ac7c297f3f6c446a8b42 [1,1,0,0,0,0|2,0,0]=4 3021 B11R0.140 CCCCNC(C)CCCCO 53bd565484070c606e01dec30c2a1081 [1,1,0,0,0,0|1,0,1]=4 3022 B11R0.148 C/C(=C/CNCCCCCCl)/I b02a62098834b35aa498cbae62117f38 [1,1,0,0,0,0|2,0,0]=4 3023 B11R0.148 C/C(=C/CNCCCCCO)/I 456f1b3af9fc2daffe5f7d8b47d3251f [1,1,0,0,0,0|2,0,0]=4 3024 B11R0.148 C/C(=C/COCCCCCF)/Cl 59580186f25a5c58099d1296ffffa184 [1,1,0,0,0,0|2,0,0]=4 3025 B11R0.148 C/C(=C/COCCCCCF)/I 213bf2b903f0ded44ab4e57b4cda8bfa [1,1,0,0,0,0|2,0,0]=4 3026 B11R0.148 C/C(=C\CNCCCCCCl)/Cl 70c65c4bc836db2ace497d2716784d03 [1,1,0,0,0,0|2,0,0]=4 3027 B11R0.148 C/C(=C\CNCCCCCO)/Cl 98f399823bbee161adc9bec523a81a4c [1,1,0,0,0,0|2,0,0]=4 3028 B11R0.148 C/C=C/CCCOCCC(=O)C 6af31ccb6c5cfbdc31a7ba1d70c26273 [1,1,0,0,0,0|1,0,1]=4 3029 B11R0.148 C/C=C/CCCOCCC(C)C 962d87afe070bc9ccb52c528c2e16511 [1,1,0,0,0,0|1,0,0]=3 3030 B11R0.148 C/C=C/CCCOCCN(C)C fe67cf5df7b5302dbd82520ad9f2b4f5 [1,1,0,0,0,0|2,0,0]=4 3031 B11R0.148 C/C=C/CCCOCCS(=O)C 8df00ed6fb9e38f0fe1e28d506b99fe6 [1,1,0,0,0,0|2,0,0]=4 3032 B11R0.148 C/C=C/CCCOCOC(C)C 30e22d01657bbfc84a3c6e858910e985 [1,1,0,0,0,0|2,0,0]=4 3033 B11R0.148 C/C=C/CCOCCCC(=O)C 0bfc1e16cd242a6ffba7baaeed75a478 [1,1,0,0,0,0|1,0,1]=4 3034 B11R0.148 C/C=C/CCOCCCC(C)C dd51f39174850bb5ffe76b27ab9463be [1,1,0,0,0,0|1,0,0]=3 3035 B11R0.148 C/C=C/CCOCCCN(C)C cee9958b92e62b633244b0e294e3542a [1,1,0,0,0,0|2,0,0]=4 3036 B11R0.148 C/C=C/CCOCCOC(C)C 70504aed0f732ac425ae79483e2d93b1 [1,1,0,0,0,0|2,0,0]=4 3037 B11R0.148 C/C=C/CCOCCSC(C)C e18f933a02fe0dabc926d19f57c85a16 [1,1,0,0,0,0|2,0,0]=4 3038 B11R0.148 C/C=C/CNCCCCC(F)F 5080e732b7ae9618e2cfe166ec5135c4 [1,1,0,0,0,0|2,0,0]=4 3039 B11R0.148 C/C=C/CNCCCCN(C)C bd051c96a9b4e8cfe9b35990c936e2f4 [1,1,0,0,0,0|2,0,0]=4 3040 B11R0.148 C/C=C/CNCCCOC(C)C 50e6a06253f406bcbde9ccd6160d8f51 [1,1,0,0,0,0|2,0,0]=4 3041 B11R0.148 C/C=C/CNCCCSC(C)C 4c188a3f892b476f0f0a5823896c8867 [1,1,0,0,0,0|2,0,0]=4 3042 B11R0.148 C/C=C/COCCCCC(=O)C bc4770b7051a58da4eb45c98e2b78f18 [1,1,0,0,0,0|1,0,1]=4 3043 B11R0.148 C/C=C/COCCCCC(C)C 7585b8ea5dc13e8dab24c7fb7780bb3c [1,1,0,0,0,0|1,0,0]=3 3044 B11R0.148 C/C=C/COCCCCN(C)C 877ed2b8db3719aeb67c3654ca78765b [1,1,0,0,0,0|2,0,0]=4 3045 B11R0.148 C/C=C/COCCCOC(C)C 8cfeaeec5d15b1db26630da1489522c6 [1,1,0,0,0,0|2,0,0]=4 3046 B11R0.148 C/C=C/COCCCSC(C)C f19a0157cec4329a3534ea59495197f5 [1,1,0,0,0,0|2,0,0]=4 3047 B11R0.148 C/C=C/COCCOCC(C)C 32a69f20ad52a150d3345ab9108b39f8 [1,1,0,0,0,0|2,0,0]=4 3048 B11R0.148 C/C=C/COCCSCC(C)C 2a63986627ae6de89f65af2e24251cd1 [1,1,0,0,0,0|2,0,0]=4 3049 B11R0.148 C/C=C\CCCNCCC(C)C 5f9cbf731c3eafa8c17ee0eb7370ecba [1,1,0,0,0,0|1,0,0]=3 3050 B11R0.148 C/C=C\CCCNCCC(C)O ba7125d3efd9f755d874b46216146458 [1,1,0,0,0,0|1,0,0]=3 3051 B11R0.148 C/C=C\CCCNCCC(F)F 3588e6c302865f53d38cff90ba6a6e3d [1,1,0,0,0,0|2,0,0]=4 3052 B11R0.148 C/C=C\CCCNCCN(C)C c7eb75eb6431eeada25179774717832a [1,1,0,0,0,0|2,0,0]=4 3053 B11R0.148 C/C=C\CCCNCCS(=O)C cf267bfc6fdacc9db9c77b05db684d80 [1,1,0,0,0,0|2,0,0]=4 3054 B11R0.148 C/C=C\CCCNCC[C@@H](C)O 76c2c5107916fc9f56c907b1b653f4be [1,1,0,0,0,0|1,0,0]=3 3055 B11R0.148 C/C=C\CCCNCC[C@H](C)O 33c35d3155604a4673c86124d4778f69 [1,1,0,0,0,0|1,0,0]=3 3056 B11R0.148 C/C=C\CCCOCCC(=O)C b4e669a2e0688ef6b804e802906b565b [1,1,0,0,0,0|1,0,1]=4 3057 B11R0.148 C/C=C\CCCOCCC(C)C b0e96552cf338a5eb0c0a9728f57fd06 [1,1,0,0,0,0|1,0,0]=3 3058 B11R0.148 C/C=C\CCCOCCC(F)F b6fed29f6f7bb023b7e6d7041b04419b [1,1,0,0,0,0|2,0,0]=4 3059 B11R0.148 C/C=C\CCCOCCN(C)C 54d9815d4b1c79041d5ab89b36e708b5 [1,1,0,0,0,0|2,0,0]=4 3060 B11R0.148 C/C=C\CCCOCCS(=O)C cbdf7045e8112ac602394eea1583d5b0 [1,1,0,0,0,0|2,0,0]=4 3061 B11R0.148 C/C=C\CCCOCOC(C)C 71908314b9e72e376ff8ec13cf3845ff [1,1,0,0,0,0|2,0,0]=4 3062 B11R0.148 C/C=C\CNCCCCC(F)F 6884e7367a0ddf00671b17e9bbf25001 [1,1,0,0,0,0|2,0,0]=4 3063 B11R0.148 C/C=C\CNCCCCN(C)C 64c8d3018d305031a2a2e9adaab55f10 [1,1,0,0,0,0|2,0,0]=4 3064 B11R0.148 C/C=C\CNCCCOC(C)C 0b8e9f4f5a547acec95654c92ed43080 [1,1,0,0,0,0|2,0,0]=4 3065 B11R0.148 C/C=C\CNCCCSC(C)C b82fc2eb0770fa0baa72f922acc70fad [1,1,0,0,0,0|2,0,0]=4 3066 B11R0.148 C/C=C\COCCCCC(=O)C a0730490237f018f540fe7a7151b7b1f [1,1,0,0,0,0|1,0,1]=4 3067 B11R0.148 C/C=C\COCCCCC(C)C c784be99fedb586f5e5c6ed928be4ee5 [1,1,0,0,0,0|1,0,0]=3 3068 B11R0.148 C/C=C\COCCCCN(C)C ec95a87d8d439e5fed85480885e8b737 [1,1,0,0,0,0|2,0,0]=4 3069 B11R0.148 C/C=C\COCCCOC(C)C 76800936448d84a124c28df08c4a6a72 [1,1,0,0,0,0|2,0,0]=4 3070 B11R0.148 C/C=C\COCCCSC(C)C 3ae58ea1afe8987edaa2387b71b307db [1,1,0,0,0,0|2,0,0]=4 3071 B11R0.148 C/C=C\COCCOCC(C)C b24b96cbd8f56ce6c910da07f00bb0d9 [1,1,0,0,0,0|2,0,0]=4 3072 B11R0.148 C/C=C\COCCSCC(C)C 3650a1897a1ec934e889e001e3e919dc [1,1,0,0,0,0|2,0,0]=4 3073 B11R0.148 C=C(C)CCCNCCCCC 2a61d6a86b53b2d6ed8ca64bfa3ebb10 [1,1,0,0,0,0|1,0,1]=4 3074 B11R0.148 C=C(C)CCCOCC/C=C/C d0cc7488e4c5230e2347b72e9bf6f22a [1,1,0,0,0,0|1,0,1]=4 3075 B11R0.148 C=C(C)CCCOCCCCC 7ddee3a31fabfc9464b6764c3b9e7cff [1,1,0,0,0,0|1,0,1]=4 3076 B11R0.148 C=C(C)CCNCCC/C=C\C 368375f15a2a50261a3190fe8e64abe2 [1,1,0,0,0,0|1,0,1]=4 3077 B11R0.148 C=C(C)CCNCCCCCC 7e6410037cc055178b065ec8aa195598 [1,1,0,0,0,0|1,0,1]=4 3078 B11R0.148 C=C(C)CCOCCC/C=C/C 2c4b3e75ec91de15b0caaa21ce8b2698 [1,1,0,0,0,0|1,0,1]=4 3079 B11R0.148 C=C(C)CCOCCC/C=C\C 392ec1d8bd40679a1f2af3aee455b871 [1,1,0,0,0,0|1,0,1]=4 3080 B11R0.148 C=C(C)CCOCCCC=CC c8631a93ce0f5856706afb15397552a3 [1,1,0,0,0,0|1,0,1]=4 3081 B11R0.148 C=C(C)CCOCCCCCC f3b42b02f97b5ae546a5d0ce100d5f9b [1,1,0,0,0,0|1,0,1]=4 3082 B11R0.148 C=C(C)CNCCCCCCC b09be588b32545d66c354051c751378d [1,1,0,0,0,0|1,0,1]=4 3083 B11R0.148 C=C(C)COCCCCCCC 6e86eb79eebc0414260368e904a927e1 [1,1,0,0,0,0|1,0,1]=4 3084 B11R0.148 CC(=CCCNCCCCCl)C 028d88a3ea098acc17902f8b4544d6ff [1,1,0,0,0,0|2,0,0]=4 3085 B11R0.148 CC(=CCCNCCCCO)C a4ac3a3cd86fc92ef9561c7bd3c54444 [1,1,0,0,0,0|2,0,0]=4 3086 B11R0.148 CC(=CCCNCCCCS)C b1b94378988ecd053acb59d911b78259 [1,1,0,0,0,0|2,0,0]=4 3087 B11R0.148 CC(=CCCOCCCCF)C 292387e211d49f28f184f99e419c9e34 [1,1,0,0,0,0|2,0,0]=4 3088 B11R0.148 CC(=CCCOCCCCS)C 9cad5f40b6fbe8f4376ffbe3fe1ab774 [1,1,0,0,0,0|2,0,0]=4 3089 B11R0.148 CC(=CCNCCCCCCl)C 8d468bc276a00c6c896ac4e6b7ceabdf [1,1,0,0,0,0|2,0,0]=4 3090 B11R0.148 CC(=CCNCCCCCCl)Cl 05a6882df6d8fc318c0118243ec35032 [1,1,0,0,0,0|2,0,0]=4 3091 B11R0.148 CC(=CCNCCCCCCl)I c1270b1f5dd83bd163784f1ebf822ebc [1,1,0,0,0,0|2,0,0]=4 3092 B11R0.148 CC(=CCNCCCCCF)C dd971862d23fc81213d00d02dc078303 [1,1,0,0,0,0|2,0,0]=4 3093 B11R0.148 CC(=CCNCCCCCO)C cda7a914750cfae21f914bf147017fc4 [1,1,0,0,0,0|2,0,0]=4 3094 B11R0.148 CC(=CCNCCCCCO)Cl 2575c85981eb58dacfcfa55a51f1af7c [1,1,0,0,0,0|2,0,0]=4 3095 B11R0.148 CC(=CCNCCCCCO)I ed9a2431bdae1cd6194b6310429f1452 [1,1,0,0,0,0|2,0,0]=4 3096 B11R0.148 CC(=CCOCCCCCF)C aba4bbde39eccdc8866c38d8982a7b0c [1,1,0,0,0,0|2,0,0]=4 3097 B11R0.148 CC(=CCOCCCCCF)I 394f5054ce522a0f36c73c83b90fd3c5 [1,1,0,0,0,0|2,0,0]=4 3098 B11R0.148 CC(=O)NCCCCCCCO 375247c5b76fff4f96757dfebee6b6e0 [1,1,0,0,0,0|2,0,0]=4 3099 B11R0.148 CC(C)CCCCCCNC=O 3f1822f5ff2ee7d8a1105bf77a829c4f [1,1,0,0,0,0|1,0,1]=4 3100 B11R0.148 CC(C)CCCCCCNCF 07e7547058968009f62cd6ff16da8999 [1,1,0,0,0,0|2,0,0]=4 3101 B11R0.148 CC(C)CCCCCCNCO c67da97a578ef941f715194c999211cb [1,1,0,0,0,0|1,0,0]=3 3102 B11R0.148 CC(C)CCCCCCOCF 36d479357b5e82829446ef28eb8b1a82 [1,1,0,0,0,0|2,0,0]=4 3103 B11R0.148 CC(C)CCCCCNCCO 32c9507b6eccf4ed605d3d1f4db0ad0a [1,1,0,0,0,0|1,0,1]=4 3104 B11R0.148 CC(C)CCCCNCCCO 66fccb49cc596f23a13457d139f2281e [1,1,0,0,0,0|1,0,1]=4 3105 B11R0.148 CC(C)CCCCOC/C=C/Cl 2278220307929bc9cf5c2102740f5e74 [1,1,0,0,0,0|2,0,0]=4 3106 B11R0.148 CC(C)CCCCOC/C=C\Cl e0a4238fce9e668a179c5a8de1c8c9a0 [1,1,0,0,0,0|2,0,0]=4 3107 B11R0.148 CC(C)CCCCOCC=CCl c3f442dbf6506d3a82b2f4e83ce9f1ae [1,1,0,0,0,0|2,0,0]=4 3108 B11R0.148 CC(C)CCCNCCCCO f480653b3df19ce94d31cd5ad807be07 [1,1,0,0,0,0|1,0,1]=4 3109 B11R0.148 CC(C)CCNCCCCCO fc49ec5c15f39f3a7337721d9235656e [1,1,0,0,0,0|1,0,1]=4 3110 B11R0.148 CC(C)CNCCCCCCO ff6d9ee46e52197dee5255a09adb5386 [1,1,0,0,0,0|1,0,1]=4 3111 B11R0.148 CC(C)CSCCCCNCO f96d487a45f8aa32ca5de6fb1389ccdc [1,1,0,0,0,0|2,0,0]=4 3112 B11R0.148 CC(C)NCCCCCCCO c837ff2d926a42272236a6f998018725 [1,1,0,0,0,0|1,0,1]=4 3113 B11R0.148 CC(C)OCCCNC/C=C\O 21165700f5b12fa7ddf2e1adfdd6b80a [1,1,0,0,0,0|2,0,0]=4 3114 B11R0.148 CC(C)SCCCNC/C=C\O 2570b5b180ae933a224f4538a80cd805 [1,1,0,0,0,0|2,0,0]=4 3115 B11R0.148 CC(O)CCCCNCCCO c21e68376b74a4270591e394eb58b490 [1,1,0,0,0,0|1,0,1]=4 3116 B11R0.148 CC(O)CCCNCCCCO 3793e3cf16ce7d82568c302cad84803a [1,1,0,0,0,0|1,0,1]=4 3117 B11R0.148 CC(O)CCNCCCCCO b1137dcf863a1f0f413c1d6c91a9e0b1 [1,1,0,0,0,0|1,0,1]=4 3118 B11R0.148 CC(O)CNCCCCCCO 36eca31e338ce79c2fd6b65828843992 [1,1,0,0,0,0|1,0,1]=4 3119 B11R0.148 CC/C=C/CCOCCC(C)C 0c409bbce4f0953e5714918144060bc0 [1,1,0,0,0,0|2,0,0]=4 3120 B11R0.148 CC/C=C/CNCCCC(C)C dd92a520afe2c7227f226d879c8c4223 [1,1,0,0,0,0|2,0,0]=4 3121 B11R0.148 CC/C=C/COCCCC(C)C 8d5313ce42fe76520ae4b4f08c512cca [1,1,0,0,0,0|2,0,0]=4 3122 B11R0.148 CC/C=C\CCCCOC(C)C e04104864f3cbf170a036c5860e894ad [1,1,0,0,0,0|2,0,0]=4 3123 B11R0.148 CC/C=C\CCCOCC(C)C f8bf2f68b16ad84043bbf53ff7974f2b [1,1,0,0,0,0|2,0,0]=4 3124 B11R0.148 CC/C=C\CCNCCC(C)C 6a3cabd009c8f25df7594bac6c761814 [1,1,0,0,0,0|2,0,0]=4 3125 B11R0.148 CC/C=C\CCNCCC(C)O c665383f5fbf967ba7cfc2537fb515ab [1,1,0,0,0,0|2,0,0]=4 3126 B11R0.148 CC/C=C\CCNCC[C@@H](C)O 7c9b7f670eefb8999e7ad7fc265a06c6 [1,1,0,0,0,0|2,0,0]=4 3127 B11R0.148 CC/C=C\CCNCC[C@H](C)O 55c96021768f05b6ad6bfef79bc6610d [1,1,0,0,0,0|2,0,0]=4 3128 B11R0.148 CC/C=C\CCOCCC(C)C 5dbcceee9676e5d2ec6618069adfb935 [1,1,0,0,0,0|2,0,0]=4 3129 B11R0.148 CC/C=C\COCCCC(C)C c74ef8b6d3de5c4612de62973b0cf9b3 [1,1,0,0,0,0|2,0,0]=4 3130 B11R0.148 CC=CCCCOCCC(=O)C 50bcf156e2369b18b56816d1805153d2 [1,1,0,0,0,0|1,0,1]=4 3131 B11R0.148 CC=CCCCOCCC(C)C 42aa7259db997d65a8a2bd4af62b98ef [1,1,0,0,0,0|1,0,0]=3 3132 B11R0.148 CC=CCCCOCCN(C)C 1cd3ffaa631e0557c1a75141ccc4dec0 [1,1,0,0,0,0|2,0,0]=4 3133 B11R0.148 CC=CCCCOCCS(=O)C 37d312764365693913a4c44101ed8a0e [1,1,0,0,0,0|2,0,0]=4 3134 B11R0.148 CC=CCCCOCOC(C)C ac0943bfe29e53880c4bb6a102c23527 [1,1,0,0,0,0|2,0,0]=4 3135 B11R0.148 CC=CCNCCCCC(=O)C 296a94e0be62cf093cb8964898119659 [1,1,0,0,0,0|1,0,1]=4 3136 B11R0.148 CC=CCNCCCCC(C)C 53c6e636215e2fed4b5fd31485ee6d7d [1,1,0,0,0,0|1,0,0]=3 3137 B11R0.148 CC=CCNCCCCC(C)O 816c12272573a005bebb88d47fb3b653 [1,1,0,0,0,0|1,0,0]=3 3138 B11R0.148 CC=CCNCCCCN(C)C aad262d69cac6e7f91325780f2d2f272 [1,1,0,0,0,0|2,0,0]=4 3139 B11R0.148 CC=CCNCCCC[C@@H](C)O 4d0e10532762972cacd71480313b8261 [1,1,0,0,0,0|1,0,0]=3 3140 B11R0.148 CC=CCNCCOCC(C)C c17a9f474a5f1426d6520f0be94b8e04 [1,1,0,0,0,0|2,0,0]=4 3141 B11R0.148 CC=CCOCCCCC(=O)C 5c6450f66cf65929f42847c908ea9f53 [1,1,0,0,0,0|1,0,1]=4 3142 B11R0.148 CC=CCOCCCCC(C)C 53aee0d6adcb73e5269f489f2284278e [1,1,0,0,0,0|1,0,0]=3 3143 B11R0.148 CC=CCOCCCCN(C)C e7b0eb5da5f1b3430a41c6238a96fc78 [1,1,0,0,0,0|2,0,0]=4 3144 B11R0.148 CC=CCOCCOCC(C)C 5ea5c3043ea89098ad75fcdcc2bac682 [1,1,0,0,0,0|2,0,0]=4 3145 B11R0.148 CCCCCCCCNC(=O)C 9209ef01a8d3ac54b45708fef3a289cf [1,1,0,0,0,0|1,0,0]=3 3146 B11R0.148 CCCCCCCCNC(C)C f8be70ea57d82353a700029658149a3c [1,1,0,0,0,0|1,0,1]=4 3147 B11R0.148 CCCCCCCCOC(C)C 9ea4ce62ae8de285c4f7fbe1b0cab410 [1,1,0,0,0,0|1,0,1]=4 3148 B11R0.148 CCCCCCCNCC(=O)C ac5ad78030b2337dde4637cf4e637be8 [1,1,0,0,0,0|1,0,1]=4 3149 B11R0.148 CCCCCCCNCC(=O)O 604ac707776db9c80f9dbe81aba07aab [1,1,0,0,0,0|1,0,1]=4 3150 B11R0.148 CCCCCCCNCC(C)O 4ec41632ad94b262d50d201b12eea63c [1,1,0,0,0,0|1,0,1]=4 3151 B11R0.148 CCCCCCCNC[C@@H](C)O 2f370e1df4cf53b1cc448becf8319123 [1,1,0,0,0,0|1,0,1]=4 3152 B11R0.148 CCCCCCCNC[C@H](C)O ffa725a82af0b73a341a438150dba913 [1,1,0,0,0,0|1,0,1]=4 3153 B11R0.148 CCCCCCCOCC(=O)C dc592c317774d5dcca7353cd0379c413 [1,1,0,0,0,0|1,0,1]=4 3154 B11R0.148 CCCCCCCOCC(=O)O 2e9c1bc97c278d8f4eec0fc057b4f886 [1,1,0,0,0,0|1,0,1]=4 3155 B11R0.148 CCCCCCNC/C=C(/C)\I de46a617e926fa7265c7ea6a0d6454b4 [1,1,0,0,0,0|1,0,0]=3 3156 B11R0.148 CCCCCCNC/C=C(\C)/Cl 5e1e5f5c0eae22e6ce2fa87264437d45 [1,1,0,0,0,0|1,0,0]=3 3157 B11R0.148 CCCCCCNCC=C(C)C 268cde1eac403971a29775244b20f6fb [1,1,0,0,0,0|1,0,0]=3 3158 B11R0.148 CCCCCCNCC=C(C)Cl 9b26f9313727dabf75856a169d7d9509 [1,1,0,0,0,0|1,0,0]=3 3159 B11R0.148 CCCCCCNCC=C(C)I 4649296a1e9af8c45e014cea46a02b0d [1,1,0,0,0,0|1,0,0]=3 3160 B11R0.148 CCCCCCNCC=C(Cl)Cl d5e07fcc4c50d4d3f1ace6ae7b997120 [1,1,0,0,0,0|2,0,0]=4 3161 B11R0.148 CCCCCCNCCC(=O)C dae7d5a91b1ed61fc00f967bfae50950 [1,1,0,0,0,0|1,0,1]=4 3162 B11R0.148 CCCCCCNCCC(=O)O 8d33e817dab78094c47164cc7392c6c0 [1,1,0,0,0,0|1,0,1]=4 3163 B11R0.148 CCCCCCNCCC(C)O b61f5b6cff5c878fd1c98373352f3fc1 [1,1,0,0,0,0|1,0,1]=4 3164 B11R0.148 CCCCCCNCC[C@@H](C)O 5073f91f32a9c4b3d6ac7aff2d46c023 [1,1,0,0,0,0|1,0,1]=4 3165 B11R0.148 CCCCCCNCC[C@H](C)O 87478981820d3d93e2f171457dfcd978 [1,1,0,0,0,0|1,0,1]=4 3166 B11R0.148 CCCCCCNCOC(=O)C 1c1a5627acb6c3fcacc91b183f2cb953 [1,1,0,0,0,0|2,0,0]=4 3167 B11R0.148 CCCCCCOC/C=C(/C)\Cl 3217da00020186109ac684268f3a4229 [1,1,0,0,0,0|1,0,0]=3 3168 B11R0.148 CCCCCCOC/C=C(/C)\I 42d6eaabbd9ccb5371b986581e746e3c [1,1,0,0,0,0|1,0,0]=3 3169 B11R0.148 CCCCCCOC/C=C(\C)/Cl fe5511dbc0d53edaf2e45e378bf83eb9 [1,1,0,0,0,0|1,0,0]=3 3170 B11R0.148 CCCCCCOCC=C(C)C 01521535f7ea090dd629b3eba93168e9 [1,1,0,0,0,0|1,0,0]=3 3171 B11R0.148 CCCCCCOCC=C(C)Cl 449202f9925926f3cc218782fb7d580a [1,1,0,0,0,0|1,0,0]=3 3172 B11R0.148 CCCCCCOCC=C(C)I 8716b7b87fe38c49ecc86d416f4d13fd [1,1,0,0,0,0|1,0,0]=3 3173 B11R0.148 CCCCCCOCC=C(Cl)Cl 284b7ffbb5033acc6fdf1f25a24db64c [1,1,0,0,0,0|2,0,0]=4 3174 B11R0.148 CCCCCCOCCC(=O)C ba6ca6ffd5fb9c6cc4e8d129cf77ebb5 [1,1,0,0,0,0|1,0,1]=4 3175 B11R0.148 CCCCCCOCCC(=O)O 4717319825633e38fbcaeec5411785fc [1,1,0,0,0,0|1,0,1]=4 3176 B11R0.148 CCCCCCOCNC(=O)C 821b7a0837138668b121aff777d67519 [1,1,0,0,0,0|2,0,0]=4 3177 B11R0.148 CCCCCCOCOC(=O)C 7357a2b41ac7b5a18efb5ca4e2678b36 [1,1,0,0,0,0|2,0,0]=4 3178 B11R0.148 CCCCCNC/C=C/C(=O)O b8046f0d80c9ff3885cdfa6c42d71162 [1,1,0,0,0,0|1,0,1]=4 3179 B11R0.148 CCCCCNC/C=C/C(C)C d7d2cc7b858d16bae64842f05b6b9796 [1,1,0,0,0,0|2,0,0]=4 3180 B11R0.148 CCCCCNCC=CC(=O)O 58813a84cba492cefaaec0f7c2af3ed6 [1,1,0,0,0,0|1,0,1]=4 3181 B11R0.148 CCCCCNCCC=C(C)C d6637617b4955445c507124ad86b540e [1,1,0,0,0,0|1,0,0]=3 3182 B11R0.148 CCCCCNCCC=C(F)F 12a9b0ffdb638c3ef2d1bbe0b6915112 [1,1,0,0,0,0|2,0,0]=4 3183 B11R0.148 CCCCCNCCCC(=O)C ae79e8ea156a5e770911e0ef57b141fd [1,1,0,0,0,0|1,0,1]=4 3184 B11R0.148 CCCCCNCCCC(=O)O ce92314d02facc18c8164866ccc58acb [1,1,0,0,0,0|1,0,1]=4 3185 B11R0.148 CCCCCNCCCC(C)O 6e88f019848ff48aa5580012b93e4ead [1,1,0,0,0,0|1,0,1]=4 3186 B11R0.148 CCCCCNCCNC(=O)C 7ff8c0f5354f73956142fbe6902b9879 [1,1,0,0,0,0|2,0,0]=4 3187 B11R0.148 CCCCCNCCOC(=O)C 729f700d5178f65d822ba15d79799d97 [1,1,0,0,0,0|2,0,0]=4 3188 B11R0.148 CCCCCNCCSC(=O)C d915aac4f03ed25f4f02a1b6cd47cc5d [1,1,0,0,0,0|2,0,0]=4 3189 B11R0.148 CCCCCOC/C=C/C(=O)O 3d3460a3a6eee12116378f2de4d92d1f [1,1,0,0,0,0|1,0,1]=4 3190 B11R0.148 CCCCCOC/C=C/C(C)C afb911daeb4fd0404f914e7e073954e3 [1,1,0,0,0,0|2,0,0]=4 3191 B11R0.148 CCCCCOCC=CC(=O)O ac6921bf081433b1f8d6059fbeb527c4 [1,1,0,0,0,0|1,0,1]=4 3192 B11R0.148 CCCCCOCCC=C(C)C 474567c7ad39799d75b5ca9d8bdddc96 [1,1,0,0,0,0|1,0,0]=3 3193 B11R0.148 CCCCCOCCC=C(F)F 4bc2bc592390ae6e531d4933262b3ac3 [1,1,0,0,0,0|2,0,0]=4 3194 B11R0.148 CCCCCOCCCC(=O)C 2d5fb2796be532f83de2b588a833a781 [1,1,0,0,0,0|1,0,1]=4 3195 B11R0.148 CCCCCOCCNC(=O)C 89e6bc94e5e2df2872af87ea20002aa7 [1,1,0,0,0,0|2,0,0]=4 3196 B11R0.148 CCCCCOCCOC(=O)C ce892e28021cd219f16b0c1b93f354de [1,1,0,0,0,0|2,0,0]=4 3197 B11R0.148 CCCCCOCCSC(=O)C 381130fac5641be83bacac00ee2d726c [1,1,0,0,0,0|2,0,0]=4 3198 B11R0.148 CCCCNCCCCC(=O)C 544c9e2e2e33eb4d7d7343bae90cd58e [1,1,0,0,0,0|1,0,1]=4 3199 B11R0.148 CCCCNCCCCC(=O)O db2891a1a49d26c3dd9a356095c13ecb [1,1,0,0,0,0|1,0,1]=4 3200 B11R0.148 CCCCNCCCCC(C)O d25cea83b94c590c11c2a73b0c167344 [1,1,0,0,0,0|1,0,1]=4 3201 B11R0.148 CCCCNCCCC[C@@H](C)O 8b68c1025addda349947f3fed9cd8b0f [1,1,0,0,0,0|1,0,1]=4 3202 B11R0.148 CCCCNCCCNC(=O)C 6d0de7a58670364332bd2c26e8ee7cdd [1,1,0,0,0,0|2,0,0]=4 3203 B11R0.148 CCCCNCCCOC(=O)C 7853525c1345bc50778fe7631411e66c [1,1,0,0,0,0|2,0,0]=4 3204 B11R0.148 CCCCNCCCOC(=S)C 73028220c83de81b0b3e572a11606df7 [1,1,0,0,0,0|2,0,0]=4 3205 B11R0.148 CCCCNCCCSC(=O)C db939ed2d8d03cfa10c8f82ccb5505ff [1,1,0,0,0,0|2,0,0]=4 3206 B11R0.148 CCCCOCCCCC(=O)C a62f0819767c2537c037059a9981780c [1,1,0,0,0,0|1,0,1]=4 3207 B11R0.148 CCCCOCCCCC(=O)O 00e520501e14c3e825ffc7300146a3fe [1,1,0,0,0,0|1,0,1]=4 3208 B11R0.148 CCCCOCCCNC(=O)C 14281244af5a76ea832226605fbb85e4 [1,1,0,0,0,0|2,0,0]=4 3209 B11R0.148 CCCCOCCCOC(=O)C 477c462ef377d29beb78f95f82bb25eb [1,1,0,0,0,0|2,0,0]=4 3210 B11R0.148 CCCCOCCCOC(=S)C d7aa2aa09240a85edad907d4be4b954e [1,1,0,0,0,0|2,0,0]=4 3211 B11R0.148 CCCCOCCCSC(=O)C 614b19a166ecdbfad1b2d0cb89ad3484 [1,1,0,0,0,0|2,0,0]=4 3212 B11R0.148 CCCCOCNCC=C(C)C 137018fdbdd6c94164e6db344ad65e4c [1,1,0,0,0,0|2,0,0]=4 3213 B11R0.148 CCCCOCOC/C=C(/C)\Cl 2a3baa1ec32779e4c7e7e01620c0dd7e [1,1,0,0,0,0|2,0,0]=4 3214 B11R0.148 CCCCOCOC/C=C(/C)\I f4adb03271d90dd1b554166b8687db9b [1,1,0,0,0,0|2,0,0]=4 3215 B11R0.148 CCCCOCOCC=C(C)C a1ea0aea9548ae8905b0ce287bae6814 [1,1,0,0,0,0|2,0,0]=4 3216 B11R0.148 CCCCOCOCC=C(C)I edc781567ecab4347a7deeddff5f0e09 [1,1,0,0,0,0|2,0,0]=4 3217 B11R0.148 CCCNCCCCCC(=O)C 354cff2ef02214f278274b1186349715 [1,1,0,0,0,0|1,0,1]=4 3218 B11R0.148 CCCNCCCCCC(=O)O 040617eb9e641e6c46ed6e1b925655c5 [1,1,0,0,0,0|1,0,1]=4 3219 B11R0.148 CCCNCCCCNC(=O)C afc7cb87fbf2cd12eb8fe76075788aed [1,1,0,0,0,0|2,0,0]=4 3220 B11R0.148 CCCNCCCCOC(=O)C 5de6dd97eb13f02e3674c0a89f759217 [1,1,0,0,0,0|2,0,0]=4 3221 B11R0.148 CCCNCCCCSC(=O)C e67c14e897e8fe6720f2feb7de9105a1 [1,1,0,0,0,0|2,0,0]=4 3222 B11R0.148 CCCOCCCCCC(=O)C a9dd639cc488907d7b3255974d45f633 [1,1,0,0,0,0|1,0,1]=4 3223 B11R0.148 CCCOCCCCCC(=O)O fa333152e0beffd56620c1d14609917b [1,1,0,0,0,0|1,0,1]=4 3224 B11R0.148 CCCOCCCCOC(=O)C 76d456e7ca4c7cd8d390c54bbbefcd78 [1,1,0,0,0,0|2,0,0]=4 3225 B11R0.148 CCCOCCCCSC(=O)C 369c27db8c9be1ed6dd5c9b10da52191 [1,1,0,0,0,0|2,0,0]=4 3226 B11R0.148 CCCOCCNC/C=C(/C)\I 68cf4bdb6e8ae8682706ad70683d22ad [1,1,0,0,0,0|2,0,0]=4 3227 B11R0.148 CCCOCCNC/C=C(\C)/Cl 3030ef0ce2fc4d98d2d059bf37f91933 [1,1,0,0,0,0|2,0,0]=4 3228 B11R0.148 CCCOCCNCC=C(C)C 1a87ea8fd08585a3c676641e0383f716 [1,1,0,0,0,0|2,0,0]=4 3229 B11R0.148 CCCOCCNCC=C(C)Cl 7c509debbf7ee093489e5a3e0986ceac [1,1,0,0,0,0|2,0,0]=4 3230 B11R0.148 CCCOCCNCC=C(C)I 1f1689b99991c4c07bd0f765f24ec871 [1,1,0,0,0,0|2,0,0]=4 3231 B11R0.148 CCCOCCOC/C=C(/C)\Cl 2faf7f12327a37677c545c7a5c0c5121 [1,1,0,0,0,0|2,0,0]=4 3232 B11R0.148 CCCOCCOC/C=C(/C)\I 3e9b4cefbf63da996deaac84d68dbf26 [1,1,0,0,0,0|2,0,0]=4 3233 B11R0.148 CCCOCCOC/C=C(\C)/Cl 77939258c7e4c3aeb8c1851c85c99de2 [1,1,0,0,0,0|2,0,0]=4 3234 B11R0.148 CCCOCCOCC=C(C)C 661d8c7dbd7d8db11854ebf8fadf6d7d [1,1,0,0,0,0|2,0,0]=4 3235 B11R0.148 CCCOCCOCC=C(C)Cl 837462c953139b8804829ea4c2449f6d [1,1,0,0,0,0|2,0,0]=4 3236 B11R0.148 CCCOCCOCC=C(C)I 7e8e467f97d0882adb3677f384ebc2bd [1,1,0,0,0,0|2,0,0]=4 3237 B11R0.148 CCCSCCCCNC(=O)C b995a956a32500c52f19eeccf108b053 [1,1,0,0,0,0|2,0,0]=4 3238 B11R0.148 CCCSCCOC/C=C(/C)\I a7327be0a8a0cb177ae4ad0f883388f6 [1,1,0,0,0,0|2,0,0]=4 3239 B11R0.148 CCCSCCOC/C=C(\C)/Cl 18dfb85a182cc431a9bf3514748ac220 [1,1,0,0,0,0|2,0,0]=4 3240 B11R0.148 CCCSCCOCC=C(C)C 0b6e5bef7638258ab81ab2d2a8362431 [1,1,0,0,0,0|2,0,0]=4 3241 B11R0.148 CCCSCCOCC=C(C)Cl ae29f7b662608a1bf10be77eac3855fe [1,1,0,0,0,0|2,0,0]=4 3242 B11R0.148 CCCSCCOCC=C(C)I 9b6ea824077b8ee500e3df756ee5a170 [1,1,0,0,0,0|2,0,0]=4 3243 B11R0.148 CCNCCCCCCC(=O)O e9a5c8afc11b12a621b1b3a6781fbc3e [1,1,0,0,0,0|1,0,1]=4 3244 B11R0.148 CCNCCCCCCC(C)C 5ed601e8bc317c5240d8cdd8cca0d3a5 [1,1,0,0,0,0|1,0,1]=4 3245 B11R0.148 CCNCCCCCNC(=O)C 73d4870ba672365fcc36e846ca9b99bb [1,1,0,0,0,0|2,0,0]=4 3246 B11R0.148 CCOCCCCCCC(=O)O c60be55443aee57331a1445b50b93edc [1,1,0,0,0,0|1,0,1]=4 3247 B11R0.148 CCOCCCCCCC(C)C 86a3297b0d267c43a1da48814b1341a5 [1,1,0,0,0,0|1,0,1]=4 3248 B11R0.148 CCOCCCNC/C=C(/C)\I 37f672fbda1a631e6c59861598a0f6c4 [1,1,0,0,0,0|2,0,0]=4 3249 B11R0.148 CCOCCCNC/C=C(\C)/Cl 9ad76f9b4fd394a585a4ca6a77d48f79 [1,1,0,0,0,0|2,0,0]=4 3250 B11R0.148 CCOCCCNCC=C(C)C e6bba91381230df427106c011fa95e5e [1,1,0,0,0,0|2,0,0]=4 3251 B11R0.148 CCOCCCNCC=C(C)Cl cec09850b2d4b7a8e3e4bfb3e7ac39c9 [1,1,0,0,0,0|2,0,0]=4 3252 B11R0.148 CCOCCCNCC=C(C)I 7651f6932d707df3afc2f12a9c61b271 [1,1,0,0,0,0|2,0,0]=4 3253 B11R0.148 CCOCCCOC/C=C(/C)\Cl 81d3ad8d3e2a31adf0946820a58c1cf4 [1,1,0,0,0,0|2,0,0]=4 3254 B11R0.148 CCOCCCOC/C=C(/C)\I e9b06a0f2fa936722bf996e07cbe6b90 [1,1,0,0,0,0|2,0,0]=4 3255 B11R0.148 CCOCCCOC/C=C(\C)/Cl f7cf0bd7034c439d7ee3b9ce8914ac54 [1,1,0,0,0,0|2,0,0]=4 3256 B11R0.148 CCOCCCOCC=C(C)C 660eba6b62010b2ea0a99535ad7c530d [1,1,0,0,0,0|2,0,0]=4 3257 B11R0.148 CCOCCCOCC=C(C)Cl 80d8e1d0d3373d02322e15ff552bf84a [1,1,0,0,0,0|2,0,0]=4 3258 B11R0.148 CCOCCCOCC=C(C)I 1c6b745c80b298cdde259bbe7cf66e05 [1,1,0,0,0,0|2,0,0]=4 3259 B11R0.148 CCOCCNCCC=C(C)C c3b6eae7c1dc64fcf9d461179ae7c6a2 [1,1,0,0,0,0|2,0,0]=4 3260 B11R0.148 CCOCCOCCC=C(C)C 73540d3b0eb112e058bab7cad361aeb3 [1,1,0,0,0,0|2,0,0]=4 3261 B11R0.148 CCSCCCNCC=C(C)C cf6285b05677142268a4fcea7f9b77d4 [1,1,0,0,0,0|2,0,0]=4 3262 B11R0.148 CCSCCCOC/C=C(/C)\Cl e8a4ae7056b49a81fc81044de5f9a2af [1,1,0,0,0,0|2,0,0]=4 3263 B11R0.148 CCSCCCOC/C=C(/C)\I eb84154c3c55995ae1b695918f83a9cf [1,1,0,0,0,0|2,0,0]=4 3264 B11R0.148 CCSCCCOC/C=C(\C)/Cl 279a178876cd1865e352b3c33e7e77e4 [1,1,0,0,0,0|2,0,0]=4 3265 B11R0.148 CCSCCCOCC=C(C)C b4b2d1a8215e5566be179ce58992e445 [1,1,0,0,0,0|2,0,0]=4 3266 B11R0.148 CCSCCCOCC=C(C)Cl 107b551b8415fa257d8790c8595f676e [1,1,0,0,0,0|2,0,0]=4 3267 B11R0.148 CCSCCCOCC=C(C)I 503be92c5811cc814418d17eeec7cc7d [1,1,0,0,0,0|2,0,0]=4 3268 B11R0.148 CCSCCNCCC=C(C)C 3576ff5fb450bcf3a0e4cb5ee276707a [1,1,0,0,0,0|2,0,0]=4 3269 B11R0.148 CCSCCOCCC=C(C)C fecf1e1c56922df0c0afd3ebd8d9d000 [1,1,0,0,0,0|2,0,0]=4 3270 B11R0.148 CN(C)CCCCCCNCO 63dbfc8b0f6e635d981f15a9b987ff33 [1,1,0,0,0,0|2,0,0]=4 3271 B11R0.148 CN(C)CCCCNC/C=C\O 2b663e42c4bc000ee648661327fae786 [1,1,0,0,0,0|2,0,0]=4 3272 B11R0.148 COCCCCNC/C=C(/C)\I c2899ce0637e065868e340434171dea3 [1,1,0,0,0,0|2,0,0]=4 3273 B11R0.148 COCCCCNC/C=C(\C)/Cl bbe09d32bf9dbaa3478f0f6e56688407 [1,1,0,0,0,0|2,0,0]=4 3274 B11R0.148 COCCCCNCC=C(C)C 589fede8067f8e694993738f0fc0c160 [1,1,0,0,0,0|2,0,0]=4 3275 B11R0.148 COCCCCNCC=C(C)Cl 5aff98f37a885f6038439bc974c69930 [1,1,0,0,0,0|2,0,0]=4 3276 B11R0.148 COCCCCNCC=C(C)I 81db8e1bbb057174ac20f448a2e2c820 [1,1,0,0,0,0|2,0,0]=4 3277 B11R0.148 COCCCCOC/C=C(/C)\Cl 15370ee841feb8b0fa28ceb76df999f2 [1,1,0,0,0,0|2,0,0]=4 3278 B11R0.148 COCCCCOC/C=C(/C)\I 327518876bb5b3e30bef44689aa3f7b1 [1,1,0,0,0,0|2,0,0]=4 3279 B11R0.148 COCCCCOC/C=C(\C)/Cl 18ce242655456ee0b76c2fd84ef54cd6 [1,1,0,0,0,0|2,0,0]=4 3280 B11R0.148 COCCCCOCC=C(C)C 7b848bb3e4bc970a14885aa0b66c6bb6 [1,1,0,0,0,0|2,0,0]=4 3281 B11R0.148 COCCCCOCC=C(C)Cl cf9a5113a7439ab76e5a882136eb5be8 [1,1,0,0,0,0|2,0,0]=4 3282 B11R0.148 COCCCCOCC=C(C)I e5b0a5a54a3c897ab3cc5d7c22368b57 [1,1,0,0,0,0|2,0,0]=4 3283 B11R0.148 COCCCNCCC=C(C)C c2b848823fd696dc53a41d1adb0d230b [1,1,0,0,0,0|2,0,0]=4 3284 B11R0.148 COCCCOCCC=C(C)C 75cd562fb03012a6cb3d006175df16de [1,1,0,0,0,0|2,0,0]=4 3285 B11R0.148 CSCCCCNC/C=C(/C)\I 68b310572feb0843e69cdf12e71dbda2 [1,1,0,0,0,0|2,0,0]=4 3286 B11R0.148 CSCCCCNC/C=C(\C)/Cl e24272fa15965c2cc386eeadacc39dbe [1,1,0,0,0,0|2,0,0]=4 3287 B11R0.148 CSCCCCNCC=C(C)C f4b13ec784ee8e358a1083f024658c84 [1,1,0,0,0,0|2,0,0]=4 3288 B11R0.148 CSCCCCNCC=C(C)Cl f26526f75e4c54c702b26b10c63df2dc [1,1,0,0,0,0|2,0,0]=4 3289 B11R0.148 CSCCCCNCC=C(C)I 7cb991c3c8d703977499f4d93caa7d90 [1,1,0,0,0,0|2,0,0]=4 3290 B11R0.148 CSCCCCOC/C=C(/C)\I 43f90f430ad023ebc4d2522b810f8cb6 [1,1,0,0,0,0|2,0,0]=4 3291 B11R0.148 CSCCCCOC/C=C(\C)/Cl 950f742c3f74519483af83b3257ef6fa [1,1,0,0,0,0|2,0,0]=4 3292 B11R0.148 CSCCCCOCC=C(C)C ec8d3ca6ab12051808a95bf3ba249248 [1,1,0,0,0,0|2,0,0]=4 3293 B11R0.148 CSCCCCOCC=C(C)Cl a3f69586ea04ae13c41d5408a80ea7fc [1,1,0,0,0,0|2,0,0]=4 3294 B11R0.148 CSCCCCOCC=C(C)I 3893d94467df96305183e705d21faefc [1,1,0,0,0,0|2,0,0]=4 3295 B11R0.148 CSCCCNCCC=C(C)C 3a2df481dea03d6c9e0476eccd127a90 [1,1,0,0,0,0|2,0,0]=4 3296 B11R0.148 CSCCCOCCC=C(C)C e4d7277707f88d7112892ed8194ef7f2 [1,1,0,0,0,0|2,0,0]=4 3297 B11R0.148 C[C@@H](O)CCCCNCCCO 783f0910fd9a7305a3b3999e4f1a242f [1,1,0,0,0,0|1,0,1]=4 3298 B11R0.148 C[C@@H](O)CCNCCCCCO b13471bd516df4bd2bedb25c936c8159 [1,1,0,0,0,0|1,0,1]=4 3299 B11R0.148 C[C@@H](O)CNCCCCCCO 2408f53f8ed8549405bf9c3a948ce3d5 [1,1,0,0,0,0|1,0,1]=4 3300 B11R0.148 C[C@H](O)CCNCCCCCO 42357ac6f4fcddf5586a4fd9971d1d01 [1,1,0,0,0,0|1,0,1]=4 3301 B11R0.148 C[C@H](O)CNCCCCCCO 643e793020ae7e33277250873fb00f80 [1,1,0,0,0,0|1,0,1]=4 3302 B11R0.148 O/C=C\CNCCCCC(F)F b02de2493b9aa9a9c85a271cd32665c7 [1,1,0,0,0,0|2,0,0]=4 3303 B13R0.2 C#CCC(=O)NCCCCCCCC e26c2c2635eea3a182605ecc56fe5247 [0,2,0,0,0,0|2,0,0]=4 3304 B13R0.2 C/C=C/C(=O)NCCCCCCCC 3dd15d0b590db7ea3e102a6d446391ec [0,2,0,0,0,0|1,0,1]=4 3305 B13R0.2 C=CCC(=O)NCCCCCCCC 102aed6f3e91e8f126480cf9dd3c0b08 [0,2,0,0,0,0|2,0,0]=4 3306 B13R0.2 CC/C=C/COCCCC(C)CCC e2989655183c2d006582274aaf1ee224 [0,2,0,0,0,0|1,0,0]=3 3307 B13R0.2 CC/C=C\CCCCCN(C)CCC 0d4a4422b009f79283fae9be7253e33f [0,2,0,0,0,0|1,0,0]=3 3308 B13R0.2 CC/C=C\CCCCCN(C)CCF 0147233818d760d7fe8d1bfc5a899020 [0,2,0,0,0,0|2,0,0]=4 3309 B13R0.2 CC/C=C\CCCCCN(C)CCO f62e36f9f74f362cb54a9f51fce51178 [0,2,0,0,0,0|2,0,0]=4 3310 B13R0.2 CC/C=C\CCCCOC(C)CCC 9a3eabf432cd66a990c032597d794c0b [0,2,0,0,0,0|1,0,0]=3 3311 B13R0.2 CC/C=C\CCCCOC(C)COC a8e6759a6be777ca7eec48595ab4fae7 [0,2,0,0,0,0|2,0,0]=4 3312 B13R0.2 CC/C=C\CCCOCC(=O)CCC 6fc13199b88b3c83ba1b381596df88ae [0,2,0,0,0,0|1,0,1]=4 3313 B13R0.2 CC/C=C\CCCOCC(C)CCC df6e9e9d8ff435ce9cf7c898249ef8e8 [0,2,0,0,0,0|1,0,0]=3 3314 B13R0.2 CC/C=C\CCCOC[C@@H](O)CCO dc28082d2e0db09745f6228449279b57 [0,2,0,0,0,0|2,0,0]=4 3315 B13R0.2 CC/C=C\CCOCCC(C)CCC 3c48f8076248e48da4306ae486a93048 [0,2,0,0,0,0|1,0,0]=3 3316 B13R0.2 CC/C=C\CCOCCC(S)CCC d9b258410fd2b3bcad30ae7c82347d8c [0,2,0,0,0,0|1,0,0]=3 3317 B13R0.2 CCC/C=C/CCCOC(C)CCC af4e2450da93d50e6e942a6076c24c49 [0,2,0,0,0,0|2,0,0]=4 3318 B13R0.2 CCC/C=C/COCCC(C)CCC a413b0663f60cea66bc62e2773729ae8 [0,2,0,0,0,0|2,0,0]=4 3319 B13R0.2 CCC/C=C/COCCC(S)CCC 4fe0817be7704da2dd1e7f7579d3f53b [0,2,0,0,0,0|2,0,0]=4 3320 B13R0.2 CCC/C=C\CCCOC(C)CCC 8c5316c3591bad83776e9cd11223c393 [0,2,0,0,0,0|2,0,0]=4 3321 B13R0.2 CCC/C=C\CCOCC(C)CCC ec5a46100697183a3729698b53619375 [0,2,0,0,0,0|2,0,0]=4 3322 B13R0.2 CCC/C=C\COCCC(C)CCC 26129bc22db4404091fb4de9f624314c [0,2,0,0,0,0|2,0,0]=4 3323 B13R0.2 CCC/C=C\COCCC(S)CCC 0ce66c8c4793c3d9013f57230b3aa9c5 [0,2,0,0,0,0|2,0,0]=4 3324 B13R0.2 CCCC(C)CCCOCC=CC#N 12d8a5fb1ffc5253cbdd3f38e4e4be36 [0,2,0,0,0,0|1,0,1]=4 3325 B13R0.2 CCCC(C)CNCCCCCCO 2631b2ce48edab7f1300c7af1c8f7d29 [0,2,0,0,0,0|0,0,2]=4 3326 B13R0.2 CCCC(C)CNCCCOCCO b1f5216b427b391580385c22cc659f6a [0,2,0,0,0,0|1,0,1]=4 3327 B13R0.2 CCCC(C)NCCCCCCCO 4d633289ae9794e9db749fea67ea87e1 [0,2,0,0,0,0|0,0,2]=4 3328 B13R0.2 CCCC(C)NCCCCSCCO 023a55bb104dadd6b62904f7e84ba5c1 [0,2,0,0,0,0|1,0,1]=4 3329 B13R0.2 CCCC(O)CNCCCCCCO c246910355e8b4e43db290520e7ac449 [0,2,0,0,0,0|0,0,2]=4 3330 B13R0.2 CCCCCCCCCN(C)CCO e86a6ec2d45cc3087c2f98ff67146fe4 [0,2,0,0,0,0|0,0,2]=4 3331 B13R0.2 CCCCCCCCCN(C)COC 109463908101ed291492e18ca8421e24 [0,2,0,0,0,0|1,0,1]=4 3332 B13R0.2 CCCCCCCCNC(=O)/C=C/Br a3c589eafbf6fb29175163174ac0dc5c [0,2,0,0,0,0|1,0,1]=4 3333 B13R0.2 CCCCCCCCNC(=O)/C=C/Cl 719b28eefd01a2cd3e0fa0c02e0b9fd2 [0,2,0,0,0,0|1,0,1]=4 3334 B13R0.2 CCCCCCCCNC(=O)/C=C/I 8bfc065b7a760d102e13bde4f9736eff [0,2,0,0,0,0|1,0,1]=4 3335 B13R0.2 CCCCCCCCNC(=O)/C=C\Br 21309ea81b5f44a8e2141cd4ad099358 [0,2,0,0,0,0|1,0,1]=4 3336 B13R0.2 CCCCCCCCNC(=O)/C=C\Cl 30883b264c0734ae5bd1de1280a0d9db [0,2,0,0,0,0|1,0,1]=4 3337 B13R0.2 CCCCCCCCNC(=O)/C=C\I d22667d3c63f5d44054f677649b7ec2f [0,2,0,0,0,0|1,0,1]=4 3338 B13R0.2 CCCCCCCCNC(=O)C=CBr 843558a3a8466dd08eef7f937db2e12d [0,2,0,0,0,0|1,0,1]=4 3339 B13R0.2 CCCCCCCCNC(=O)C=CI 2e017ea87837b29289ed14a1fc502a9c [0,2,0,0,0,0|1,0,1]=4 3340 B13R0.2 CCCCCCCCNC(=O)CC#N 35ba1715e4622d40e401d6bceccb4497 [0,2,0,0,0,0|2,0,0]=4 3341 B13R0.2 CCCCCCCCNC(=O)CC=O 504a27d86363d5855713a2863576b560 [0,2,0,0,0,0|1,0,1]=4 3342 B13R0.2 CCCCCCCCNC(=O)CCC fd52ed268219c9eaea5cd0bca1a7b45c [0,2,0,0,0,0|1,0,1]=4 3343 B13R0.2 CCCCCCCCNC(=O)CCF 6d629f7ee7e2b72201f8fad37bd41aa1 [0,2,0,0,0,0|1,0,1]=4 3344 B13R0.2 CCCCCCCCNC(=O)CCO 7fe058f70c6f82e7e9341a5e811579fc [0,2,0,0,0,0|0,0,1]=3 3345 B13R0.2 CCCCCCCCNC(=O)CCS 770be40da0b567b4b557389280374fe8 [0,2,0,0,0,0|0,1,1]=4 3346 B13R0.2 CCCCCCCCNC(=O)COC 47f1d49276911c281e4e5d8541e891e0 [0,2,0,0,0,0|1,0,0]=3 3347 B13R0.2 CCCCCCCCNC(=O)CON 32b3d3016e866a217a7c784de0417fc1 [0,2,0,0,0,0|1,0,0]=3 3348 B13R0.2 CCCCCCCCNC(=O)CSC c8478f9ddd59a60ba0eb77e2fde87af1 [0,2,0,0,0,0|1,1,0]=4 3349 B13R0.2 CCCCCCCCNC(C)CCO a0ab0f0005439106082a8a3ac73ff74f [0,2,0,0,0,0|0,0,2]=4 3350 B13R0.2 CCCCCCCCNC(C)COC 2c830abebd4f40d5656285750345a342 [0,2,0,0,0,0|1,0,1]=4 3351 B13R0.2 CCCCCCCCN[C@@H](C)CCO e7d24df107dfedac4094efcd2970dc1a [0,2,0,0,0,0|0,0,2]=4 3352 B13R0.2 CCCCCCCCN[C@@H](C)COC aad4872dc72ced7f23e49e1e3e2eed53 [0,2,0,0,0,0|1,0,1]=4 3353 B13R0.2 CCCCCCCCN[C@H](C)CCO 11d8f10109220d8e5d4b44f26e76758b [0,2,0,0,0,0|0,0,2]=4 3354 B13R0.2 CCCCCCCCN[C@H](C)COC 98172b27a867b8537dc469d4a3d22a7b [0,2,0,0,0,0|1,0,1]=4 3355 B13R0.2 CCCCCCCCOC(=S)CCC 43aa6c109e3c7caa3a73c7a895a94d67 [0,2,0,0,0,0|1,0,1]=4 3356 B13R0.2 CCCCCCCCOC(C)COC 810123b756b50ec0092cce9a7d6d9c31 [0,2,0,0,0,0|1,0,1]=4 3357 B13R0.2 CCCCCCCCO[C@@H](C)COC 766c6c59414a859c6d46be238978348c [0,2,0,0,0,0|1,0,1]=4 3358 B13R0.2 CCCCCCCCO[C@H](C)COC 9c65ade9075cea060f3bc65f98b52534 [0,2,0,0,0,0|1,0,1]=4 3359 B13R0.2 CCCCCCCNCC(=O)CCC 4eaa96e38cafce43b712582bc5131cdd [0,2,0,0,0,0|1,0,1]=4 3360 B13R0.2 CCCCCCCNCC(=O)COC 00a49161b46d585bb8c6643b00c1eee6 [0,2,0,0,0,0|1,0,1]=4 3361 B13R0.2 CCCCCCCNCC(=O)NCC 927bd34618f78b5d148fd000def32111 [0,2,0,0,0,0|2,0,0]=4 3362 B13R0.2 CCCCCCCNCC(=O)NCO 6f1d7119df21f754ee7dfc5a62eb1105 [0,2,0,0,0,0|1,0,0]=3 3363 B13R0.2 CCCCCCCNCC(=O)OCC abd85a7e37601b1753a0da1ffad8260f [0,2,0,0,0,0|2,0,0]=4 3364 B13R0.2 CCCCCCCNCC(C)CCO 77ab520e6728338f97c217388605d237 [0,2,0,0,0,0|0,0,2]=4 3365 B13R0.2 CCCCCCCNC[C@@H](O)CCO 87e0fd350dadfecd26e39a6d5e18a760 [0,2,0,0,0,0|0,0,2]=4 3366 B13R0.2 CCCCCCCOCC(=O)CCC e7a4ea2034eba7858b1da433f42e5b37 [0,2,0,0,0,0|1,0,1]=4 3367 B13R0.2 CCCCCCCOCC(=O)COC 3ec9fc8695c5218e1de632417c2b4180 [0,2,0,0,0,0|1,0,1]=4 3368 B13R0.2 CCCCCCCOCC(=O)NCC ca5053b06d2062fa5e184426c216fc0e [0,2,0,0,0,0|2,0,0]=4 3369 B13R0.2 CCCCCCCOCC(=O)OCC 4a05e6b375ec7268012afe5b15ef0517 [0,2,0,0,0,0|2,0,0]=4 3370 B13R0.2 CCCCCCCOC[C@@H](O)CCO 0726915f64936645b98900d3b484a985 [0,2,0,0,0,0|0,0,2]=4 3371 B13R0.2 CCCCCCNCCC(=O)NCC 47ad628fd5a43b3b16a35d82def183ec [0,2,0,0,0,0|2,0,0]=4 3372 B13R0.2 CCCCCCNCCC(=O)OCC aff4c424081f16a0015b47b5c232fbec [0,2,0,0,0,0|2,0,0]=4 3373 B13R0.2 CCCCCCNCCN(C)CCO 7e50554f1a1c9465081d8b7e1012df2b [0,2,0,0,0,0|1,0,1]=4 3374 B13R0.2 CCCCCCOCCC(=O)NCC 2432b3fb2bfaa47ab50e1fa11b0a3781 [0,2,0,0,0,0|2,0,0]=4 3375 B13R0.2 CCCCCCOCCC(=O)OCC e54f3ab4d73e5d613afa1b2c27111033 [0,2,0,0,0,0|2,0,0]=4 3376 B13R0.2 CCCCCNCCCC(=O)OCC 0df93ab1587649687a4df691133aff68 [0,2,0,0,0,0|2,0,0]=4 3377 B13R0.2 CCCCCNCCCN(C)CCO dad9ff585479176fcad98bd9d7c7015d [0,2,0,0,0,0|1,0,1]=4 3378 B13R0.2 CCCCCOCCCC(=O)OCC 35ede942d9fb4c8f0cd553d34e8d4c7e [0,2,0,0,0,0|2,0,0]=4 3379 B13R0.2 CCCCNCCCCC(=O)OCC ddf10fa62cd2dab558dd66df1e4ec875 [0,2,0,0,0,0|2,0,0]=4 3380 B13R0.2 CCCCNCCCCS(=O)CCO 2ec0364285aa91e40f5030d9571a992d [0,2,0,0,0,0|1,0,1]=4 3381 B13R0.2 CCCCOCCCCC(=O)OCC 2e19a20ec679fd1dc5239d756f3abbd1 [0,2,0,0,0,0|2,0,0]=4 3382 B13R0.2 CCCCOCCCNC(=O)CCO 510f01d26553fe0c21a83dd971cb72d5 [0,2,0,0,0,0|1,0,1]=4 3383 B13R0.2 CCCCOCCCNC(=O)COC 693e843cc58dd5fdcb04a0ef3c350060 [0,2,0,0,0,0|2,0,0]=4 3384 B13R0.2 CCCCOCCCNC(=O)CON 2b93cbfd5e34473b5808c38a8d1954f0 [0,2,0,0,0,0|2,0,0]=4 3385 B13R0.2 CCCCOCCNCC(=O)NCO f137c127a7b3f8441b92a2fb06ab80cc [0,2,0,0,0,0|2,0,0]=4 3386 B13R0.2 CCCN(C)CCCCCCCCO 5fd7e55c3cba618a0fb5fae88ca50b08 [0,2,0,0,0,0|0,0,2]=4 3387 B13R0.2 CCCNCCCCCC(=O)OCC 2155c8508ea1d0a2cfa86b886eb73ca1 [0,2,0,0,0,0|2,0,0]=4 3388 B13R0.2 CCCOCCCCCC(=O)OCC 5ba0b8140b4acc736192f8bf133c0100 [0,2,0,0,0,0|2,0,0]=4 3389 B13R0.2 CCCOCCCNCC(=O)NCO 21cc14baa5d6b9e839344106ebe1e89d [0,2,0,0,0,0|2,0,0]=4 3390 B13R0.2 CCCSCCCCNC(=O)CCO 8bf683e6d44902a3709a1d6e891eeaa0 [0,2,0,0,0,0|1,0,1]=4 3391 B13R0.2 CCCSCCCCNC(=O)COC 7d7f1ef87f018886e82bd2448bc48244 [0,2,0,0,0,0|2,0,0]=4 3392 B13R0.2 CCCSCCCCNC(=O)CON 1fd641626858ad30178729b1b5aefa6e [0,2,0,0,0,0|2,0,0]=4 3393 B13R0.2 CCC[C@H](C)NCCCCCCCO 015185b980fc04e0b0d92c5586b7ab93 [0,2,0,0,0,0|0,0,2]=4 3394 B13R0.2 CCOCCCCCCC(=O)OCC 369101502abbabdd99c66bce4dd9ee99 [0,2,0,0,0,0|2,0,0]=4 3395 B13R0.2 CCSCCCCNCC(=O)NCO f9a0254439ea0c7e66f93c2d6d7416ba [0,2,0,0,0,0|2,0,0]=4 3396 B13R0.2 CN(CCO)CCCCCCCCO e77b45bed7e9f030f8eddd521b95c715 [0,2,0,0,0,0|1,0,1]=4 3397 B13R0.2 COCC(=O)NCCCCCCCO 1ea0500e0cbf2d54c18b4d34e33227a5 [0,2,0,0,0,0|2,0,0]=4 3398 B13R0.2 COCCCCCNCC(=O)NCO 9ffe183eefa75031285d0d57c5ffa45f [0,2,0,0,0,0|2,0,0]=4 3399 B13R0.2 NOCC(=O)NCCCCCCCO 16abe26afde3520697583bac4f2e5a53 [0,2,0,0,0,0|2,0,0]=4 3400 B13R0.2 O=C(CCO)NCCCCCCCO 5e13475730ccd5c3cfa6504ea455bcf3 [0,2,0,0,0,0|1,0,1]=4 3401 B13R0.2 O=C(CNCCCCCCCl)NCO 767953557fb7b3fcfcc0110034e4d8e1 [0,2,0,0,0,0|2,0,0]=4 3402 B13R0.2 O=C(CNCCCCCCO)NCO 6ce7ca084bce4c3a07abeab78b1fbaf9 [0,2,0,0,0,0|2,0,0]=4 3403 B13R0.66 C#CCNC(=O)CCCCCCCC 4509dc17fbf4f36b2432ff995463130b [0,2,0,0,0,0|2,0,0]=4 3404 B13R0.66 C=C(CNCCCCCC)OCOC 147eaef7f47ab04981349f2a0e13e055 [0,2,0,0,0,0|2,0,0]=4 3405 B13R0.66 C=C(COCCCCCC)OCOC a5fd2f3f46fbcb6098c9aa13ee59f04f [0,2,0,0,0,0|2,0,0]=4 3406 B13R0.66 CC/C=C/C(=O)NCCCCCCC 05ac8071f68c6a0cc57072f1bb63bcc0 [0,2,0,0,0,0|1,0,1]=4 3407 B13R0.66 CC/C=C/CNCCN(C)CCCC ab1cae6f3e79a9992a4d19676b70d613 [0,2,0,0,0,0|2,0,0]=4 3408 B13R0.66 CC/C=C/COCCC(C)CCCC 5b6d30193a22ab061f137879a2e0f85d [0,2,0,0,0,0|1,0,0]=3 3409 B13R0.66 CC/C=C\C(=O)NCCCCCCC b34f35a3c040fd08ba4c0e96a953ec9f [0,2,0,0,0,0|1,0,1]=4 3410 B13R0.66 CC/C=C\CCCOC(C)CCCC a97bcd30d1eca581b92e6d4b04a91116 [0,2,0,0,0,0|1,0,0]=3 3411 B13R0.66 CC/C=C\CCNCC(O)CCCC d2ae8980f912deb1a180dc29e7790be6 [0,2,0,0,0,0|1,0,0]=3 3412 B13R0.66 CC/C=C\CCNCC(O)COCC 7c65e8b56a3f8bec66bdace1e5b76036 [0,2,0,0,0,0|2,0,0]=4 3413 B13R0.66 CC/C=C\CCNC[C@H](C)CCCO a3a74ded99fa0ac6c8eca74d8afc0d6f [0,2,0,0,0,0|2,0,0]=4 3414 B13R0.66 CC/C=C\CCOCC(C)CCCC 3d9df6a9cddf5c103b5420d99fe9bf25 [0,2,0,0,0,0|1,0,0]=3 3415 B13R0.66 CC/C=C\CCOCC(C)COCC 674cf8b24d659baf08d6537292fd5077 [0,2,0,0,0,0|2,0,0]=4 3416 B13R0.66 CCC/C=C/CNCC(O)CCCC 5b3ee55b115fc904a7ff3463f9d93a84 [0,2,0,0,0,0|2,0,0]=4 3417 B13R0.66 CCC/C=C/COCC(C)CCCC 1cdc81f60e003cd1234fea42f0570a60 [0,2,0,0,0,0|2,0,0]=4 3418 B13R0.66 CCC/C=C\CCOC(C)CCCC 407540d9c88fe1df3a3a0156e60142ac [0,2,0,0,0,0|2,0,0]=4 3419 B13R0.66 CCC/C=C\CNCC(O)CCCC 500a6cc4d96bb37b252be7ff67211944 [0,2,0,0,0,0|2,0,0]=4 3420 B13R0.66 CCC/C=C\COCC(C)CCCC 2fc8659c0052ed27969929f012c4669d [0,2,0,0,0,0|2,0,0]=4 3421 B13R0.66 CCC=CC(=O)NCCCCCCC 7f0ead522e53e8fc666b1a981aa65cd9 [0,2,0,0,0,0|1,0,1]=4 3422 B13R0.66 CCCCC(C)CCCCOCOC 8b96601dc6f44a2b00e4c833373cb115 [0,2,0,0,0,0|1,0,1]=4 3423 B13R0.66 CCCCC(C)CCOCC=CC#N 07e13b8e76c25e8fe5630e3281cec7dc [0,2,0,0,0,0|1,0,1]=4 3424 B13R0.66 CCCCC(C)NCCCCCCO 92e7c855fa379c977f2b83c420ee1c91 [0,2,0,0,0,0|0,0,2]=4 3425 B13R0.66 CCCCC(C)NCCCOCCO ca53e48ff4eefb208dc12c7e711dd437 [0,2,0,0,0,0|1,0,1]=4 3426 B13R0.66 CCCCC(O)CNCCCCCO ca51a6ec397f0a89221d65bb69d4ee8d [0,2,0,0,0,0|0,0,2]=4 3427 B13R0.66 CCCCC(O)CNCCOCCO aa07ad9cec145110bf2baf474b2a7562 [0,2,0,0,0,0|1,0,1]=4 3428 B13R0.66 CCCCCCCCC(=O)NCC#N 80a74150b037e74bbfe18594a4ccb74c [0,2,0,0,0,0|2,0,0]=4 3429 B13R0.66 CCCCCCCCC(=O)NCCBr 6b9608e992e8628473e5a8368c9011b9 [0,2,0,0,0,0|1,0,1]=4 3430 B13R0.66 CCCCCCCCC(=O)NCCC 39adb8d7e06aff2d67a89c1e94e08cd7 [0,2,0,0,0,0|1,0,1]=4 3431 B13R0.66 CCCCCCCCC(=O)NCCF c85f44f9836706d925460485749b548c [0,2,0,0,0,0|1,0,1]=4 3432 B13R0.66 CCCCCCCCC(=O)NCCI 845f0a16ed8009800d3f6051be9e6bee [0,2,0,0,0,0|1,0,1]=4 3433 B13R0.66 CCCCCCCCC(=O)NCCO e68ec99bd1b154476e5512267ddb63e0 [0,2,0,0,0,0|0,0,1]=3 3434 B13R0.66 CCCCCCCCC(=O)NCCS 0e1b253813698b211e5de3c78da025ce [0,2,0,0,0,0|0,1,1]=4 3435 B13R0.66 CCCCCCCCC(C)NCCO a54d0fac5b62ec49199df6d0ca04ca54 [0,2,0,0,0,0|0,0,2]=4 3436 B13R0.66 CCCCCCCCC(C)NCOC 8fe213e0dbf16263d17e56898227a601 [0,2,0,0,0,0|1,0,1]=4 3437 B13R0.66 CCCCCCCCC(C)OCOC eb414ba18b8a3a83130e8c6775e28bb2 [0,2,0,0,0,0|1,0,1]=4 3438 B13R0.66 CCCCCCCCN(C)C/C=C\O 99360d6f0998a4be6ec1cda7f06eac44 [0,2,0,0,0,0|0,0,2]=4 3439 B13R0.66 CCCCCCCCN(C)CCCO a9e8a8ae5f4654cac0f686fb7f912fbd [0,2,0,0,0,0|0,0,2]=4 3440 B13R0.66 CCCCCCCCN(C)CCOC 21eebe86a02ff26a0097f1b504b17625 [0,2,0,0,0,0|1,0,1]=4 3441 B13R0.66 CCCCCCCCN(C)CCON 99b276c05a95363c0befb53afbc0cfee [0,2,0,0,0,0|1,0,1]=4 3442 B13R0.66 CCCCCCCC[C@@H](C)OCOC 6591bcddddf1cc8d80751e13d9c361b4 [0,2,0,0,0,0|1,0,1]=4 3443 B13R0.66 CCCCCCCNC(=O)/C=C/CF 0da2b2904803c9b141cbb3ad2dd0c669 [0,2,0,0,0,0|1,0,1]=4 3444 B13R0.66 CCCCCCCNC(=O)/C=C/CO fefab12a198c46ed6e7262e11d8970ee [0,2,0,0,0,0|0,0,1]=3 3445 B13R0.66 CCCCCCCNC(=O)/C=C/OC 11e6d03a89907a332d7520d8da9dc736 [0,2,0,0,0,0|1,0,1]=4 3446 B13R0.66 CCCCCCCNC(=O)C#CCO 0f38154a287a0cee76ca037289f6e4f7 [0,2,0,0,0,0|1,0,1]=4 3447 B13R0.66 CCCCCCCNC(=O)C=CCO 59015b9662fcbff7d7e751c24727b502 [0,2,0,0,0,0|0,0,1]=3 3448 B13R0.66 CCCCCCCNC(=O)C=COC 523e207fd2f81f4583c346d17c0bedd8 [0,2,0,0,0,0|1,0,1]=4 3449 B13R0.66 CCCCCCCNC(=O)CCOC c76f5c2a576579292be0310300d981af [0,2,0,0,0,0|1,0,1]=4 3450 B13R0.66 CCCCCCCNC(=O)NCCO ffdfb96c6074f6be9453eabc417ac247 [0,2,0,0,0,0|1,0,1]=4 3451 B13R0.66 CCCCCCCNC(=S)NCCO a7c94562e2299b87bef4d618a0fe68f2 [0,2,0,0,0,0|1,0,1]=4 3452 B13R0.66 CCCCCCCNC(C)CCCO 4f49810173ebc06709c7b7063fbed69e [0,2,0,0,0,0|0,0,2]=4 3453 B13R0.66 CCCCCCCN[C@H](C)CCCO e15ee4a9e67a0471ec05d5a6848108d7 [0,2,0,0,0,0|0,0,2]=4 3454 B13R0.66 CCCCCCNCC(=O)NCCO 2cf8a044d51690422185c7b624e790d1 [0,2,0,0,0,0|1,0,1]=4 3455 B13R0.66 CCCCCCNC[C@H](C)CCCO 7d94537290f62ebd0f454b5b1a5fbb6b [0,2,0,0,0,0|0,0,2]=4 3456 B13R0.66 CCCCN(C)CCCCCCCO 6f2c388edf59af6534e92e094f43f64f [0,2,0,0,0,0|0,0,2]=4 3457 B13R0.66 CCCCOCCNC(=O)/C=C/CO f087787e22ccdfe6e26119c5b4dfe1ca [0,2,0,0,0,0|1,0,1]=4 3458 B13R0.66 CCCCOCCNC(=O)C=CCO 246fbe097641a2fbd350aef63a85d819 [0,2,0,0,0,0|1,0,1]=4 3459 B13R0.66 CCCC[C@@H](C)NCCCCCCO e79c8dedbe42778d717c28279a319020 [0,2,0,0,0,0|0,0,2]=4 3460 B13R0.66 CCCOCCCNC(=O)/C=C/CO b73de10c4b1c56541bfcf464652eaf3a [0,2,0,0,0,0|1,0,1]=4 3461 B13R0.66 CCCOCCCNC(=O)C=CCO 2dc23343212f475cf0a6e405bef3d6bf [0,2,0,0,0,0|1,0,1]=4 3462 B13R0.66 CCSCCCCNC(=O)/C=C/CO 738ae4f7aaf6783848ee2f5153d9ff94 [0,2,0,0,0,0|1,0,1]=4 3463 B13R0.66 CCSCCCCNC(=O)C=CCO 42537a20705b9e92938ecab26202bc7f [0,2,0,0,0,0|1,0,1]=4 3464 B13R0.66 COCCCCCNC(=O)/C=C/CO 138065de1b096e87005f10bf7f66119c [0,2,0,0,0,0|1,0,1]=4 3465 B13R0.66 COCCCCCNC(=O)C=CCO 6398e0b5ab5f3901b2ffe6179fe6f364 [0,2,0,0,0,0|1,0,1]=4 3466 B13R0.66 CSCCCCCCC(=O)NCCO ce3f311950dd9f32f357337c76b74af0 [0,2,0,0,0,0|1,0,1]=4 3467 B13R0.66 O=C(/C=C/CO)NCCCCCCCl 870845e507849c3d9340b27c3a5df71c [0,2,0,0,0,0|1,0,1]=4 3468 B13R0.66 O=C(/C=C/CO)NCCCCCCO 8d0cc446ef16c63a081263e71335752e [0,2,0,0,0,0|1,0,1]=4 3469 B13R0.66 O=C(C=CCO)NCCCCCCCl 29e736d153e0f573c3d44a034f807229 [0,2,0,0,0,0|1,0,1]=4 3470 B13R0.66 O=C(C=CCO)NCCCCCCO 44a706035ab1dc7fa3e883b5e26af64c [0,2,0,0,0,0|1,0,1]=4 3471 B13R0.66 O=C(CCCCCCCF)NCCO 0296695e444f2974fc7f82cc22887620 [0,2,0,0,0,0|1,0,1]=4 3472 B13R0.66 O=C(CCCCCCCO)NCCO 8fc044ae3fc6cb2a25c4f9201407d52c [0,2,0,0,0,0|1,0,1]=4 3473 B13R0.66 O=C(CCCCCCCS)NCCO 5061c94b5952e11cd5aa08eb06a652f1 [0,2,0,0,0,0|1,0,1]=4 3474 B13R0.88 CC(C)CCCCCNC(=O)CCO dd6ac559543bdd59defdbe9e8253428f [0,2,0,0,0,0|1,0,1]=4 3475 B13R0.88 CCCC(C)CCOC/C=C/C(=O)O cacac63bc9a8326f5529ff990f350332 [0,2,0,0,0,0|1,0,1]=4 3476 B13R0.88 CCCC(C)CCOC/C=C/C(C)C 64476d9ed8f3046850535fac5225b442 [0,2,0,0,0,0|2,0,0]=4 3477 B13R0.88 CCCC(C)CCOCC=CC(=O)O 5d426278b2eba6d021cea8be3ed56eea [0,2,0,0,0,0|1,0,1]=4 3478 B13R0.88 CCCC(S)CCOC/C=C/C(=O)O 622c9c4586a047231a9d911d90977cc7 [0,2,0,0,0,0|1,0,1]=4 3479 B13R0.88 CCCC(S)CCOC/C=C/C(C)C 763078db71d166716f218033151d853a [0,2,0,0,0,0|2,0,0]=4 3480 B13R0.88 CCCC(S)CCOCC=CC(=O)O 91839dd7983f4f6fdf0d209b706d4ac7 [0,2,0,0,0,0|1,0,1]=4 3481 B13R0.175 CCCCC(O)CNCC(=O)NCO 7331d1f533218e79a28d9fb2ec63a87c [0,2,0,0,0,0|2,0,0]=4 3482 B13R0.193 CCCCCC(C)NCC(=O)NCO 9cdb4ce69ce9a91880cf2915b8710eb7 [0,2,0,0,0,0|2,0,0]=4 3483 B13R0.193 CCCCC[C@H](C)NCC(=O)NCO 59f1d2f9e59025fccff85599996b392a [0,2,0,0,0,0|2,0,0]=4 3484 B13R0.275 CCCCCCCN(C)C(=O)CCO a696d719ff95c16ff8f0d4fc1d53f556 [0,2,0,0,0,0|1,0,1]=4 3485 B13R0.282 CC/C=C/COCCC(CCC)SC 6643beec1e70b8b76684f42305472e86 [0,2,0,0,0,0|2,0,0]=4 3486 B13R0.282 CC/C=C\CCCOC(CC)CCC ca0bc9ae84d6c1ec252002da990f3b7e [0,2,0,0,0,0|2,0,0]=4 3487 B13R0.282 CC/C=C\CCOCC(CC)CCC afd3b1baebddc8a094b6721aec1c83a2 [0,2,0,0,0,0|2,0,0]=4 3488 B13R0.282 CCCCCCCCN(CC)CCO 787085502e4702d39ce8d0f9135bceac [0,2,0,0,0,0|1,0,1]=4 3489 B13R0.282 CCCCCCCCN(CO)CCO 8f78a81b8cfff15891940d2c48ad1f32 [0,2,0,0,0,0|1,0,1]=4 3490 B13R0.330 CC/C=C/COC(C)CC(C)CCC e64698c8374d2f29792e966e8bbdf6a5 [0,2,0,0,0,0|2,0,0]=4 3491 B13R0.330 CCCCCCC(C)NC(=O)CCO b1a6a6a6209e62fb860449064f940e9b [0,2,0,0,0,0|1,0,1]=4 3492 B13R0.330 CCCCCCN(C)CC(=O)NCO 9b341294ee856d8caaa52327068277a5 [0,2,0,0,0,0|2,0,0]=4 3493 B13R0.330 CCCCCC[C@@H](C)NC(=O)CCO a31c17eaad3adf38481ac860d1e6ce1f [0,2,0,0,0,0|1,0,1]=4 3494 B13R0.330 CCCCCC[C@H](C)NC(=O)CCO 28b4828ff32fec1d994284d9f6945cf0 [0,2,0,0,0,0|1,0,1]=4 3495 B13R0.335 CC/C=C/COCCC(C)CC(C)C 372e95f682a40724ca9fbeb0ec495bc9 [0,2,0,0,0,0|2,0,0]=4 3496 B13R0.335 CC/C=C\CCCOC(C)CC(C)C 8d697fce027a1aeb8f28ffc0ea9ca6e1 [0,2,0,0,0,0|2,0,0]=4 3497 B13R0.335 CC/C=C\CCNCC(O)CC(C)C 36fda7307bb61e95b154dc47964b2859 [0,2,0,0,0,0|2,0,0]=4 3498 B13R0.335 CC/C=C\CCOCC(C)CC(C)C 5f412df298a74f8ac80d4d9f0be90bf4 [0,2,0,0,0,0|2,0,0]=4 3499 B13R0.335 CCCCCCCCN(C)CC(C)O 3e35fd517ad6104457c4e25e9653e832 [0,2,0,0,0,0|1,0,1]=4 3500 B13R0.335 CCCCCCCCN(C)C[C@@H](C)O 639b97e107ff18408fdb3f91493ff448 [0,2,0,0,0,0|1,0,1]=4 3501 B13R0.335 CCCCCCCCN(C)C[C@H](C)O 99c061e2cde8b53292b2fdca51eb4bc0 [0,2,0,0,0,0|1,0,1]=4 3502 B13R0.335 CCCCCCCNC(=O)CC(C)O 8e9e2cb02e99869e2acf4d3b9d7445f7 [0,2,0,0,0,0|1,0,1]=4 3503 B13R0.335 CCCCCCCNC(=O)C[C@@H](C)O 47466de886acdfd84f8894d18b9038fb [0,2,0,0,0,0|1,0,1]=4 3504 B13R0.335 CCCCCCCNC(=O)C[C@H](C)O 76d3ed10a3459596bd6af11187a622b6 [0,2,0,0,0,0|1,0,1]=4 3505 B13R0.340 C=C(CC)C(=O)NCCCCCCC eec600fb89f255b80b40ecdd2016b304 [0,2,0,0,0,0|2,0,0]=4 3506 B13R0.340 C=C(CO)C(=O)NCCCCCCC 330e26e4064c6430f6441e6b2ecf0812 [0,2,0,0,0,0|1,0,0]=3 3507 B13R0.340 C=C(CO)C(=O)NCCCCCCCl eb02e22a4c6d51c43d993e6898b211a6 [0,2,0,0,0,0|2,0,0]=4 3508 B13R0.340 C=C(CO)C(=O)NCCCCCCO 8ef0d0bbbfdc0623157799b1ecab6fc4 [0,2,0,0,0,0|2,0,0]=4 3509 B13R0.340 C=C(CO)C(=O)NCCCCCOC facbabd233977768ff6bade555095f7d [0,2,0,0,0,0|2,0,0]=4 3510 B13R0.340 C=C(CO)C(=O)NCCCCSCC cc2212dc38a12a040352de9053260223 [0,2,0,0,0,0|2,0,0]=4 3511 B13R0.340 C=C(CO)C(=O)NCCCOCCC 51c79a790abde8dd9ca97139ebfa51bd [0,2,0,0,0,0|2,0,0]=4 3512 B13R0.340 C=C(CO)C(=O)NCCOCCCC abad09703e6397fe79b5cf0fd3426163 [0,2,0,0,0,0|2,0,0]=4 3513 B13R0.340 CC/C=C\CCOCC(C)C(S)CC 1e384f378b9bd65432d914f272738c69 [0,2,0,0,0,0|2,0,0]=4 3514 B13R0.340 CCCCCCCCC(=O)N(C)CC 90632a98e13d6686ede05eb4932ffccf [0,2,0,0,0,0|2,0,0]=4 3515 B13R0.340 CCCCCCCCN(C)C(=O)CC e4ced5942755a753cb4a3207f709db06 [0,2,0,0,0,0|2,0,0]=4 3516 B13R0.340 CCCCCCCCN(C)C(=O)CF 6f4541e04e9ec5161ff091e77b9c24cf [0,2,0,0,0,0|2,0,0]=4 3517 B13R0.340 CCCCCCCCN(C)C(=O)CO 21ad55bc472c9011ced854965f7b98b7 [0,2,0,0,0,0|1,0,0]=3 3518 B13R0.340 CCCCCCCCN(C)C(=O)CS 79110fae4bb4eefe427e60ad3326b094 [0,2,0,0,0,0|1,1,0]=4 3519 B13R0.340 CCCCCCCCN(C)C(C)CO 46efac2c86b525f6b318f60991333648 [0,2,0,0,0,0|1,0,1]=4 3520 B13R0.340 CCCCCCCCN(C)[C@@H](C)CO 7c7f61be0f2b0f8e714daf520119113a [0,2,0,0,0,0|1,0,1]=4 3521 B13R0.340 CCCCCCCCN(C)[C@H](C)CO 17363275bcbd404f16e37a85a9d1b758 [0,2,0,0,0,0|1,0,1]=4 3522 B13R0.340 CCCCCCCNC(=O)C(=O)CC 0e10c74afedeede919a60931ad69d212 [0,2,0,0,0,0|2,0,0]=4 3523 B13R0.340 CCCCCCCNC(=O)C(=O)CS eef8a9c7aea44c632975ca36de0c9c00 [0,2,0,0,0,0|1,1,0]=4 3524 B13R0.340 CCCCCCCNC(=O)C(O)CO badad6e1b6f4f4416592bf2ec77e0b94 [0,2,0,0,0,0|1,0,1]=4 3525 B13R0.340 CCCCCCCNC(=O)[C@@H](O)CO 19a701c92fe05ed67fd2b6b87c995fb0 [0,2,0,0,0,0|1,0,1]=4 3526 B13R0.1338 CC/C=C/COCCC(C)(S)CCC ae86d2d717702ef01289c9b9ea3954fa [0,2,0,0,0,0|2,0,0]=4 3527 B13R0.1338 CC/C=C\CCNCC(C)(O)CCC 29cb82fea9310e8a2b7a376f4ba1c845 [0,2,0,0,0,0|2,0,0]=4 3528 B13R0.54 C=C(C)CCCOCCC/C=C\CC 0635b110dcd38205c5a2f7f2f2be2f1a [0,2,0,0,0,0|1,0,1]=4 3529 B13R0.54 C=C(C)CCOCCCC/C=C\CC f8504211e85d3ec59995ad25f11462ca [0,2,0,0,0,0|1,0,1]=4 3530 B13R0.54 C=C(C)CNCCCCC/C=C\CC 630334d501a65a393473f0354270d5d3 [0,2,0,0,0,0|1,0,1]=4 3531 B13R0.54 C=C(C)COCCCCC/C=C\CC ee2d895bff04d62fc57627028bee74d6 [0,2,0,0,0,0|1,0,1]=4 3532 B13R0.54 C=C(C)COCCCCCC=CCC 87c559b2204941251201c7a12da50e64 [0,2,0,0,0,0|1,0,1]=4 3533 B13R0.54 C=C/C=C/CCNCCCCC(C)C a969159fcedb7dd91e7642768ab31c98 [0,2,0,0,0,0|1,0,1]=4 3534 B13R0.54 C=C/C=C/CCNCCCCC(C)O 355ab7daaa1859bd70964ddcd6346653 [0,2,0,0,0,0|1,0,1]=4 3535 B13R0.54 C=C/C=C/CCNCCCC[C@@H](C)O 00082a7d3607fa52a39e889cccc78b74 [0,2,0,0,0,0|1,0,1]=4 3536 B13R0.54 CC(C)/C=C/CNCCCCCCCl c4b318ca9bdf98d57ce804c2b632b5d4 [0,2,0,0,0,0|2,0,0]=4 3537 B13R0.54 CC(C)/C=C/CNCCCCCCO 7c75ab59202a0f7b9f14bc7cfcade351 [0,2,0,0,0,0|2,0,0]=4 3538 B13R0.54 CC(C)/C=C/COCCCCCCF 28423bd9ade07d45926ca24e1a080736 [0,2,0,0,0,0|2,0,0]=4 3539 B13R0.54 CC(C)/C=C/COCCCCCCS 6581facf97b97c2d1b2018d36308fd96 [0,2,0,0,0,0|2,0,0]=4 3540 B13R0.54 CC(C)CCCCCCNC/C=C\O 4f20370618aa3dccf22fa35cc52a0166 [0,2,0,0,0,0|0,0,2]=4 3541 B13R0.54 CC(C)CCCCCCNCCCO 99c176cc5491ebaccbf7992692e050b1 [0,2,0,0,0,0|0,0,2]=4 3542 B13R0.54 CC(C)CCCCCNCC#CCO 34f1959ad9948a5fafb9905a19f1297d [0,2,0,0,0,0|0,0,2]=4 3543 B13R0.54 CC(C)CCCCCNCC=CC#N d515accc89a9a8d46c15452c912ef8ce [0,2,0,0,0,0|1,0,1]=4 3544 B13R0.54 CC(C)CCCCCNCCCCO 4bd8ef98fdbdfd6fa37afc36fba610f0 [0,2,0,0,0,0|0,0,2]=4 3545 B13R0.54 CC(C)CCCCCOC/C=C/C=O 0b9328c1ea045186acc3d40fb80f6186 [0,2,0,0,0,0|0,0,2]=4 3546 B13R0.54 CC(C)CCCCCOCC=CC#N 89c987e15dfa21da3486a4d93be457b5 [0,2,0,0,0,0|1,0,1]=4 3547 B13R0.54 CC(C)CCCCNCCCCCO 73af73f9bc13952c57c637deb0a8d0c3 [0,2,0,0,0,0|0,0,2]=4 3548 B13R0.54 CC(C)CCCCNCCOCCO 03d901567f87fe7c857d03bc15393093 [0,2,0,0,0,0|1,0,1]=4 3549 B13R0.54 CC(C)CCCCNCCSCCO 36711fcd250bf459230a8dcdb81ae24d [0,2,0,0,0,0|1,0,1]=4 3550 B13R0.54 CC(C)CCCNCCCCCCO 4e14420580017297bc93687fbd7af6e9 [0,2,0,0,0,0|0,0,2]=4 3551 B13R0.54 CC(C)CCCNCCCOCCO 0e4fe2853fa578d4fabf4286c99925ac [0,2,0,0,0,0|1,0,1]=4 3552 B13R0.54 CC(C)CCNCCCCCCCO f6d7519376c5fc7e4d0b195c5671f153 [0,2,0,0,0,0|0,0,2]=4 3553 B13R0.54 CC(C)CCNCCCCSCCO b57e35b7c1bb9e6686784c4c9cb91a27 [0,2,0,0,0,0|1,0,1]=4 3554 B13R0.54 CC(C)CNCCCCCCCCO 2e352329733121f8d294d6ac349aec53 [0,2,0,0,0,0|0,0,2]=4 3555 B13R0.54 CC(C)NCCCCCCCCCO 61d98e7f0371d76ca8ebcbdc038c0acf [0,2,0,0,0,0|0,0,2]=4 3556 B13R0.54 CC(O)CCCCNCCCCCO 39200f08686ba1ef8e10b59aebc1b1dd [0,2,0,0,0,0|0,0,2]=4 3557 B13R0.54 CC(O)CCCCNCCOCCO 30951cad63fb35ba44181bafdcba093f [0,2,0,0,0,0|1,0,1]=4 3558 B13R0.54 CC(O)CCCCNCCSCCO 010465e4c4e4fb1d8d600d9638e731cb [0,2,0,0,0,0|1,0,1]=4 3559 B13R0.54 CC(O)CCCNCCCCCCO 568479c9cdcba2e0acb6b04d6c673e04 [0,2,0,0,0,0|0,0,2]=4 3560 B13R0.54 CC(O)CCCNCCCOCCO 545a59c0bbee0b2d33fd6cdbafa2a977 [0,2,0,0,0,0|1,0,1]=4 3561 B13R0.54 CC(O)CCNCCCCCCCO a2691130f855cc5dd9a372930929b190 [0,2,0,0,0,0|0,0,2]=4 3562 B13R0.54 CC(O)CCNCCCCSCCO 6d79dae0b24e3e895c4bbf0e0631638c [0,2,0,0,0,0|1,0,1]=4 3563 B13R0.54 CC(O)CNCCCCCCCCO 0a3ac505f7047cf615bf8bd2dbdfb323 [0,2,0,0,0,0|0,0,2]=4 3564 B13R0.54 CC/C=C/CCOCCCCC(=O)C 958818d1624543f92a9a4221774b6fdd [0,2,0,0,0,0|1,0,1]=4 3565 B13R0.54 CC/C=C/CCOCCCCC(C)C eaad8fb30b8eaeac433ea084935c8ed4 [0,2,0,0,0,0|1,0,0]=3 3566 B13R0.54 CC/C=C/CCOCCCCN(C)C 333471e5d26da57e5dd2dc3374ba1fd3 [0,2,0,0,0,0|2,0,0]=4 3567 B13R0.54 CC/C=C/CCOCCOCC(C)C 407d2db2bb04f174e680a98baf5e8783 [0,2,0,0,0,0|2,0,0]=4 3568 B13R0.54 CC/C=C/CNCCCCCC(C)C 7b578e5396133b8e0612b79f2116856c [0,2,0,0,0,0|1,0,0]=3 3569 B13R0.54 CC/C=C/CNCCCCCN(C)C 19a2aeee2d858c5425ec10cb65ea3315 [0,2,0,0,0,0|2,0,0]=4 3570 B13R0.54 CC/C=C/CNCCCOCC(C)C 77e28f4383b646a1e78a2b326c0e96b8 [0,2,0,0,0,0|2,0,0]=4 3571 B13R0.54 CC/C=C/COCCCCCC(=O)C 5b4983684b974105549b0b8639b53c62 [0,2,0,0,0,0|1,0,1]=4 3572 B13R0.54 CC/C=C/COCCCCCC(C)C 59d7b547d6081d817d7cef7c7fbe8127 [0,2,0,0,0,0|1,0,0]=3 3573 B13R0.54 CC/C=C/COCCCCCC(F)F 2baca522047accb43063d6212469eb19 [0,2,0,0,0,0|2,0,0]=4 3574 B13R0.54 CC/C=C/COCCCCCN(C)C d645faf1899b9d55016ebfbac56be586 [0,2,0,0,0,0|2,0,0]=4 3575 B13R0.54 CC/C=C/COCCCOCC(C)C 1a93f8bfd6aacfdfc187f7c46aea967c [0,2,0,0,0,0|2,0,0]=4 3576 B13R0.54 CC/C=C/COCCCSCC(C)C 912bf213d8971caa7cc11de2b060aa6d [0,2,0,0,0,0|2,0,0]=4 3577 B13R0.54 CC/C=C\CCCCCNCC(=O)C 63f528784a07915d74ba37e16599f30e [0,2,0,0,0,0|1,0,1]=4 3578 B13R0.54 CC/C=C\CCCCCNCC(C)C 875eb69cc7cf4414be397b4b8197371b [0,2,0,0,0,0|1,0,0]=3 3579 B13R0.54 CC/C=C\CCCCCNCC(C)O e070643ad4802705dfd3e46a971cea38 [0,2,0,0,0,0|1,0,0]=3 3580 B13R0.54 CC/C=C\CCCCCNCC(F)F 824b23514cb80d894d54c9dbb6d68ed4 [0,2,0,0,0,0|2,0,0]=4 3581 B13R0.54 CC/C=C\CCCCCNC[C@@H](C)O 25386eedd61a080054d0b9362cde40d4 [0,2,0,0,0,0|1,0,0]=3 3582 B13R0.54 CC/C=C\CCCCCNC[C@H](C)O 2df9e928d75d680d4bd8688de0e09c94 [0,2,0,0,0,0|1,0,0]=3 3583 B13R0.54 CC/C=C\CCCCCOCC(=O)C 44397a14773825992019615b71bfcff8 [0,2,0,0,0,0|1,0,1]=4 3584 B13R0.54 CC/C=C\CCCCCOCC(C)C 3fd5a08637b03a604127ad9948dc8719 [0,2,0,0,0,0|1,0,0]=3 3585 B13R0.54 CC/C=C\CCCCCOCC(C)F 00f1695df5096c448e59aa81d4490aa6 [0,2,0,0,0,0|1,0,0]=3 3586 B13R0.54 CC/C=C\CCCCCOCC(C)S f537e612bfe9851e81780b74cef2ef1f [0,2,0,0,0,0|1,0,0]=3 3587 B13R0.54 CC/C=C\CCCCCOCC(F)F 16c0dcbdffe0d6a7168266db7b70824c [0,2,0,0,0,0|2,0,0]=4 3588 B13R0.54 CC/C=C\CCCCCOCN(C)C 51d104ce8cb587cb221d5eb26cbf5d8e [0,2,0,0,0,0|2,0,0]=4 3589 B13R0.54 CC/C=C\CCCCCOC[C@@H](C)F 9c015c772736732d94c24e72d0c8aad2 [0,2,0,0,0,0|1,0,0]=3 3590 B13R0.54 CC/C=C\CCCCCOC[C@H](C)F 4217eeaa3e5a2dc393ebe169e9424b7a [0,2,0,0,0,0|1,0,0]=3 3591 B13R0.54 CC/C=C\CCCCOCCC(=O)C 915360da4ba396b7931619752998c7ef [0,2,0,0,0,0|1,0,1]=4 3592 B13R0.54 CC/C=C\CCCCOCCC(C)C de0ee71e0d0d8f0f3d84b7d7e714f05f [0,2,0,0,0,0|1,0,0]=3 3593 B13R0.54 CC/C=C\CCCCOCCN(C)C bb6dcd792c1a86911fa14cfce74b6eef [0,2,0,0,0,0|2,0,0]=4 3594 B13R0.54 CC/C=C\CCCCOCCS(=O)C 3592dbf334cb21dfbb517eeb7c62ba7f [0,2,0,0,0,0|2,0,0]=4 3595 B13R0.54 CC/C=C\CCCCOCOC(C)C e4d06b46d570c30f229e62c1bbeb6d00 [0,2,0,0,0,0|2,0,0]=4 3596 B13R0.54 CC/C=C\CCCOCCCC(=O)C 5fced1c9760dcc272ccd33d603cbe2f3 [0,2,0,0,0,0|1,0,1]=4 3597 B13R0.54 CC/C=C\CCCOCCCC(C)C 8b7f13287624394c42ce4c488e02a53c [0,2,0,0,0,0|1,0,0]=3 3598 B13R0.54 CC/C=C\CCCOCCCN(C)C d67a822c9b005de6d21bb8c2ced1541f [0,2,0,0,0,0|2,0,0]=4 3599 B13R0.54 CC/C=C\CCCOCCOC(C)C 4028ee033b9f59b6abdcaa948889eb4d [0,2,0,0,0,0|2,0,0]=4 3600 B13R0.54 CC/C=C\CCCOCCSC(C)C 8b1883ca73eb5ee8f29362a41b63244a [0,2,0,0,0,0|2,0,0]=4 3601 B13R0.54 CC/C=C\CCNCCCCC(F)F 1a99099659cf660305f07d91228b3f5c [0,2,0,0,0,0|2,0,0]=4 3602 B13R0.54 CC/C=C\CCNCCCCN(C)C 237dc946b2c54031dc364395da3cb4c2 [0,2,0,0,0,0|2,0,0]=4 3603 B13R0.54 CC/C=C\CCNCCCOC(C)C 707aa9a3658508f76a246ddd0e8c647f [0,2,0,0,0,0|2,0,0]=4 3604 B13R0.54 CC/C=C\CCNCCCSC(C)C 76c2c03c721b10e2b116e2a3520f763b [0,2,0,0,0,0|2,0,0]=4 3605 B13R0.54 CC/C=C\CCOCCCCC(=O)C c95bc83526e4ab454b898f3654e61c32 [0,2,0,0,0,0|1,0,1]=4 3606 B13R0.54 CC/C=C\CCOCCCCC(C)C b7d837037c86592d43b663bb48cf7119 [0,2,0,0,0,0|1,0,0]=3 3607 B13R0.54 CC/C=C\CCOCCCCN(C)C ead4e10860fcdef46c7c50af262026d4 [0,2,0,0,0,0|2,0,0]=4 3608 B13R0.54 CC/C=C\CCOCCCOC(C)C ffaa6dbe7fddb19323a33c8a8f48abcc [0,2,0,0,0,0|2,0,0]=4 3609 B13R0.54 CC/C=C\CCOCCCSC(C)C 37f0617e0183e2f91c65df9ada928a2a [0,2,0,0,0,0|2,0,0]=4 3610 B13R0.54 CC/C=C\CCOCCOCC(C)C 0c6ebd07c86d0c7d3a1c37ca71df2a86 [0,2,0,0,0,0|2,0,0]=4 3611 B13R0.54 CC/C=C\CCOCCSCC(C)C 13073a4bdbe0b165f9cd0473573ee660 [0,2,0,0,0,0|2,0,0]=4 3612 B13R0.54 CC/C=C\COCCCCCC(=O)C 1991df2c034028ffacbf9a2f2d71ef45 [0,2,0,0,0,0|1,0,1]=4 3613 B13R0.54 CC/C=C\COCCCCCC(C)C 02e5676b28d175a1b4f6efdafe6451a5 [0,2,0,0,0,0|1,0,0]=3 3614 B13R0.54 CC/C=C\COCCCCCC(F)F 395b8284fab17aae48b2d2c5be55a3c4 [0,2,0,0,0,0|2,0,0]=4 3615 B13R0.54 CCC/C=C/CCCOCCC(C)C 0f935fea5dcc3b5136ddaec0275474fc [0,2,0,0,0,0|2,0,0]=4 3616 B13R0.54 CCC/C=C/COCCCCC(C)C b93c281510d04cc1a4748b9f6d1eddcb [0,2,0,0,0,0|2,0,0]=4 3617 B13R0.54 CCC/C=C\CCCOCCC(C)C b0f8887d0dfdc9dc54f717fe84df63bb [0,2,0,0,0,0|2,0,0]=4 3618 B13R0.54 CCC/C=C\CCOCCCC(C)C f7bce26ec5d7b7a97e891e64c748a913 [0,2,0,0,0,0|2,0,0]=4 3619 B13R0.54 CCC/C=C\COCCCCC(C)C 6f44145cae91c7c3afba38b376229466 [0,2,0,0,0,0|2,0,0]=4 3620 B13R0.54 CCC=CCCCCCOCC(C)C 701896463ba6269b45d0adde0cf28bdf [0,2,0,0,0,0|1,0,0]=3 3621 B13R0.54 CCC=CCCCCCOCC(F)F 30f21cb381543730542cbe66577ca3a6 [0,2,0,0,0,0|2,0,0]=4 3622 B13R0.54 CCC=CCCCCCOCN(C)C 4a727a18a98c262f58e9542674114be5 [0,2,0,0,0,0|2,0,0]=4 3623 B13R0.54 CCCCCCCCCNCC(=O)O 7fe37e42f1bd61b43c93a56a2716301b [0,2,0,0,0,0|1,0,1]=4 3624 B13R0.54 CCCCCCCCCNCC(C)O c5a0775d7b7b66281f42f9ba56f5415b [0,2,0,0,0,0|0,0,2]=4 3625 B13R0.54 CCCCCCCCCNC[C@@H](C)O 6ec7abd6d608d81636bbba805d13c84c [0,2,0,0,0,0|0,0,2]=4 3626 B13R0.54 CCCCCCCCCNC[C@H](C)O 63bfa8073f054426a4043bd7fc680aae [0,2,0,0,0,0|0,0,2]=4 3627 B13R0.54 CCCCCCCCCOCC(=O)O b5ad244415d15ef7380ec5f81e97882f [0,2,0,0,0,0|1,0,1]=4 3628 B13R0.54 CCCCCCCCCOCS(=O)O 8b5c6e8cea51f4475fcbbf1631dfc443 [0,2,0,0,0,0|1,0,1]=4 3629 B13R0.54 CCCCCCCCNCCC(=O)O f70b1cba9d4621f79ec6f5b876443aca [0,2,0,0,0,0|1,0,1]=4 3630 B13R0.54 CCCCCCCCNCCC(C)O 944a3cb796afd02a2e5aee68c0a8a5ef [0,2,0,0,0,0|0,0,2]=4 3631 B13R0.54 CCCCCCCCNCCS(=O)O 51fbfb4066ecfea1ac3ed400a30a2380 [0,2,0,0,0,0|1,0,1]=4 3632 B13R0.54 CCCCCCCCNCC[C@@H](C)O 8ff14f92e600951e00fd7af7b9816057 [0,2,0,0,0,0|0,0,2]=4 3633 B13R0.54 CCCCCCCCNCC[C@H](C)O 97963810abe967d373c657742e7cb74c [0,2,0,0,0,0|0,0,2]=4 3634 B13R0.54 CCCCCCCCOCCC(=O)O 4eb12bac98ba83059c97d141773c2d2d [0,2,0,0,0,0|1,0,1]=4 3635 B13R0.54 CCCCCCCNC/C=C/C(=O)O 29509cdb7b3fc998e458f82b95659b1a [0,2,0,0,0,0|0,0,1]=3 3636 B13R0.54 CCCCCCCNC/C=C/C(C)C ba66bfc5d0f301a8e02cd008ddde3cfc [0,2,0,0,0,0|1,0,0]=3 3637 B13R0.54 CCCCCCCNCC=CC(=O)O 126a853a91bee149c65b545de2cfba1d [0,2,0,0,0,0|0,0,1]=3 3638 B13R0.54 CCCCCCCNCCCC(C)O 2afc79ee2d11e08362bec750f0e2a38d [0,2,0,0,0,0|0,0,2]=4 3639 B13R0.54 CCCCCCCOC/C=C/C(=O)O 7e59a4246093eb5291d19990e7730f52 [0,2,0,0,0,0|0,0,1]=3 3640 B13R0.54 CCCCCCCOC/C=C/C(C)C 4daf47460d7e79d0577d2d961bc0ec1b [0,2,0,0,0,0|1,0,0]=3 3641 B13R0.54 CCCCCCCOCC=CC(=O)O 956ce20d3bcd87d892383257e880bf5c [0,2,0,0,0,0|0,0,1]=3 3642 B13R0.54 CCCCCCNCCCCC(C)O 01f89e27e7f3d6b6bbea487768007fdd [0,2,0,0,0,0|0,0,2]=4 3643 B13R0.54 CCCCCCNCCCC[C@@H](C)O 8a79a56ce35293400e8fac0cbf96dab8 [0,2,0,0,0,0|0,0,2]=4 3644 B13R0.54 CCCCOCCNC/C=C/C(=O)O 25dca06ac521dbe4bd2cc3937d8aacb5 [0,2,0,0,0,0|1,0,1]=4 3645 B13R0.54 CCCCOCCNC/C=C/C(C)C 1e9cb10f54ac16e8aa93f46de1561086 [0,2,0,0,0,0|2,0,0]=4 3646 B13R0.54 CCCCOCCNCC=CC(=O)O 3fe10dbbd6b95e092aa1aea261892271 [0,2,0,0,0,0|1,0,1]=4 3647 B13R0.54 CCCCOCCOC/C=C/C(=O)O b5304d820ec33ef37b1d8a855611ce01 [0,2,0,0,0,0|1,0,1]=4 3648 B13R0.54 CCCCOCCOC/C=C/C(C)C 0b27aadf12dab90c1ccf29e86e0e0a02 [0,2,0,0,0,0|2,0,0]=4 3649 B13R0.54 CCCCOCCOCC=CC(=O)O f65bda90bb53751b1d6018b74bb4e757 [0,2,0,0,0,0|1,0,1]=4 3650 B13R0.54 CCCCSCCOC/C=C/C(=O)O 169a026a97866e044930d7b05d223d9d [0,2,0,0,0,0|1,0,1]=4 3651 B13R0.54 CCCCSCCOC/C=C/C(C)C 4f09d6ea6745b70e99d5c53e21e34b33 [0,2,0,0,0,0|2,0,0]=4 3652 B13R0.54 CCCCSCCOCC=CC(=O)O 0db4ea024f9b62f7da7b8eabe1965e79 [0,2,0,0,0,0|1,0,1]=4 3653 B13R0.54 CCCOCCCNC/C=C/C(=O)O a6796c9d13705a8c49ca5e52aa2051d1 [0,2,0,0,0,0|1,0,1]=4 3654 B13R0.54 CCCOCCCNC/C=C/C(C)C 05fbb0c3b396ff84eb8a5767a8d35da9 [0,2,0,0,0,0|2,0,0]=4 3655 B13R0.54 CCCOCCCNCC=CC(=O)O 14ad29441c0365d1c0822892bd13bd54 [0,2,0,0,0,0|1,0,1]=4 3656 B13R0.54 CCCOCCCOC/C=C/C(=O)O 0c7c986a268ce86cf378a04da2727dd0 [0,2,0,0,0,0|1,0,1]=4 3657 B13R0.54 CCCOCCCOCC=CC(=O)O 419ab74ecba1afa27d3eaf359fa157f3 [0,2,0,0,0,0|1,0,1]=4 3658 B13R0.54 CCSCCCCNC/C=C/C(=O)O e2d45ab89840d734d90dfd757bd91d6c [0,2,0,0,0,0|1,0,1]=4 3659 B13R0.54 CCSCCCCNC/C=C/C(C)C 6a23bac68b7fed1f8ba691545d60d6b7 [0,2,0,0,0,0|2,0,0]=4 3660 B13R0.54 CCSCCCCNCC=CC(=O)O fd002b0ee3094205e7651ae55b3ab89f [0,2,0,0,0,0|1,0,1]=4 3661 B13R0.54 CN(C)CCCCCCCNCCO 661d7290191d3323c9a49313af512b1a [0,2,0,0,0,0|1,0,1]=4 3662 B13R0.54 COCCCCCNC/C=C/C(=O)O 133c5d2ef0523e48ab89677694dde022 [0,2,0,0,0,0|1,0,1]=4 3663 B13R0.54 COCCCCCNC/C=C/C(C)C 78fe6c674817edeb2fe57d24c8b8f3c9 [0,2,0,0,0,0|2,0,0]=4 3664 B13R0.54 COCCCCCNCC=CC(=O)O cc06fdeda93bd42ba0524faad4c32c58 [0,2,0,0,0,0|1,0,1]=4 3665 B13R0.54 COCCCCCOC/C=C/C(=O)O d2e046b46ffe91302e1018539a582848 [0,2,0,0,0,0|1,0,1]=4 3666 B13R0.54 COCCCCCOCC=CC(=O)O 0b77671813ef8ea55adc2f2072d8c7e3 [0,2,0,0,0,0|1,0,1]=4 3667 B13R0.54 COCCNCCCCCCC(C)C 408a330d43b0869afdc3d43543d83b1f [0,2,0,0,0,0|1,0,1]=4 3668 B13R0.54 COCCOCCCCCCC(C)C a2e62af0ac92fe1bdba6d4dec580e7fa [0,2,0,0,0,0|1,0,1]=4 3669 B13R0.54 COCOCCCCCCCC(C)C ece8f46a37653fb21d4ec66eded53828 [0,2,0,0,0,0|1,0,1]=4 3670 B13R0.54 C[C@@H](O)CCCCNCCCCCO 78359f98c8e84e6b4594f8343960cbc3 [0,2,0,0,0,0|0,0,2]=4 3671 B13R0.54 C[C@@H](O)CCCCNCCOCCO f6e4abba52d08acdaef1373545a699df [0,2,0,0,0,0|1,0,1]=4 3672 B13R0.54 C[C@@H](O)CCCCNCCSCCO f8f58836840d8a42e1f6da9540c95f21 [0,2,0,0,0,0|1,0,1]=4 3673 B13R0.54 C[C@@H](O)CCNCCCCCCCO 76cb257b7e1d57f2e40da6e2ebfacaf5 [0,2,0,0,0,0|0,0,2]=4 3674 B13R0.54 C[C@@H](O)CNCCCCCCCCO b1e84124ce8a9971a8164c8203afcdc8 [0,2,0,0,0,0|0,0,2]=4 3675 B13R0.54 C[C@H](O)CCNCCCCCCCO 959cbd1407285841b88137340237a884 [0,2,0,0,0,0|0,0,2]=4 3676 B13R0.54 C[C@H](O)CNCCCCCCCCO 6fa72f99082fd8835d49c90b7acbc59e [0,2,0,0,0,0|0,0,2]=4 3677 B13R0.54 O=C(O)/C=C/CNCCCCCCCl 25f5c69966991824f5ee9650e89d0e70 [0,2,0,0,0,0|1,0,1]=4 3678 B13R0.54 O=C(O)/C=C/CNCCCCCCF 7a3a658ff2c0fbef2fe6d97768cef04c [0,2,0,0,0,0|1,0,1]=4 3679 B13R0.54 O=C(O)/C=C/CNCCCCCCO 71e009ad724b604c86480ef770b27df8 [0,2,0,0,0,0|1,0,1]=4 3680 B13R0.54 O=C(O)/C=C/COCCCCCCF af1db5c8d41fd711e9bb2c64efbf6cae [0,2,0,0,0,0|1,0,1]=4 3681 B13R0.54 O=C(O)/C=C/COCCCCCCS b065c419220e3bfc2fec47769a44cba0 [0,2,0,0,0,0|1,0,1]=4 3682 B13R0.54 O=C(O)C=CCNCCCCCCCl 3dac4fdf256c3ce4fb0bda4414832fff [0,2,0,0,0,0|1,0,1]=4 3683 B13R0.54 O=C(O)C=CCNCCCCCCF f4e8c9dd29f2013e387780cd939302f3 [0,2,0,0,0,0|1,0,1]=4 3684 B13R0.54 O=C(O)C=CCNCCCCCCO 0c5d07f3a82d7a60d6d690515adcb525 [0,2,0,0,0,0|1,0,1]=4 3685 B13R0.54 O=C(O)C=CCOCCCCCCF 218877355faa0225de9441c4a9a9c711 [0,2,0,0,0,0|1,0,1]=4 3686 B13R0.54 O=C(O)C=CCOCCCCCCS d3d19f977b2fac6810b1ef3f2caa9c8b [0,2,0,0,0,0|1,0,1]=4 3687 B13R0.147 C#C/C(=C/COCCCCCCC)/C 8cab120350644e07ecc56befd3d7522e [0,2,0,0,0,0|1,0,1]=4 3688 B13R0.147 C#C/C(=C\COCCCCCCC)/C 9110daf31b2e4e086a5117b79d5b06a8 [0,2,0,0,0,0|1,0,1]=4 3689 B13R0.147 C#CC(C)NCCCCC/C=C\CC 3623f7807e8e901a3513263716dfff38 [0,2,0,0,0,0|2,0,0]=4 3690 B13R0.147 C#CC(C)OCCCCC/C=C\CC 778a2798033905e9d3893dae9013f11a [0,2,0,0,0,0|2,0,0]=4 3691 B13R0.147 C#CC(C)OCCCCCC=CCC 1acafc2c10828479e8a1d77b5d20b6c5 [0,2,0,0,0,0|2,0,0]=4 3692 B13R0.147 C#C[C@@H](C)NCCCCC/C=C\CC ca6faf5a337c2333abb489ff6b5c5ba0 [0,2,0,0,0,0|2,0,0]=4 3693 B13R0.147 C#C[C@@H](C)OCCCCC/C=C\CC 48f0938c7ee8e0be6018d5d1f71bb9dc [0,2,0,0,0,0|2,0,0]=4 3694 B13R0.147 C#C[C@H](C)NCCCCC/C=C\CC 166727d69c1b6785fdba2668a92318a8 [0,2,0,0,0,0|2,0,0]=4 3695 B13R0.147 C#C[C@H](C)OCCCCC/C=C\CC ad733a9ac9a96eb11755c94f6ec99a87 [0,2,0,0,0,0|2,0,0]=4 3696 B13R0.147 C=C(CC)CNCCCCCCCC 93961cf34fa0de3d4db720e799423f33 [0,2,0,0,0,0|1,0,1]=4 3697 B13R0.147 C=C(CC)COCCCC/C=C\CC 6f0843ac3914ea3e6e23f44ca7776162 [0,2,0,0,0,0|1,0,1]=4 3698 B13R0.147 C=C(CC)COCCCCCCCC 48ab808801c64e2af84ddf379a472aa3 [0,2,0,0,0,0|1,0,1]=4 3699 B13R0.147 C=C(CO)CNCCCCCCCC 3f774da4c78ea1084a02bdd4474e944f [0,2,0,0,0,0|0,0,1]=3 3700 B13R0.147 C=C(CO)CNCCCCCCCO 92a666f829953fd93a71153bc560325d [0,2,0,0,0,0|1,0,1]=4 3701 B13R0.147 C=C(CO)CNCCCCSCCC 971ac9171e244b0adbd53da0cbabaa61 [0,2,0,0,0,0|1,0,1]=4 3702 B13R0.147 C=C(CO)CNCCCOCCCC b751e19ee3f24d1c29b8ffd0421669ae [0,2,0,0,0,0|1,0,1]=4 3703 B13R0.147 C=CC(C)NCCCCC/C=C\CC ad73fba710078895e98c27984e676f57 [0,2,0,0,0,0|2,0,0]=4 3704 B13R0.147 C=CC(C)OCCCCC/C=C\CC 1992832e3c6f07463369ea492a9529b4 [0,2,0,0,0,0|2,0,0]=4 3705 B13R0.147 C=CC(C)OCCCCCC=CCC 04baded6b39a7287668e6eb48143079e [0,2,0,0,0,0|2,0,0]=4 3706 B13R0.147 C=CC(O)CNCCCCCCCC b949d2977ffe9a4d1d4f87d98feefa71 [0,2,0,0,0,0|1,0,1]=4 3707 B13R0.147 C=C[C@H](C)OCCCCC/C=C\CC 6a5a5e8c1d708c46b83e65304ef14f10 [0,2,0,0,0,0|2,0,0]=4 3708 B13R0.147 CC(CO)NCCCCCCCCO b1dc3b83f55b51fee9aa0c5c6ce2daaa [0,2,0,0,0,0|1,0,1]=4 3709 B13R0.147 CC/C=C/COCCCCC(=O)CC f9c0191f6c7e278f8fbb4f5b84ce26ac [0,2,0,0,0,0|1,0,1]=4 3710 B13R0.147 CC/C=C/COCCCCC(C)CC 3a064f9a5e98e7a134e070b518fb645f [0,2,0,0,0,0|1,0,0]=3 3711 B13R0.147 CC/C=C/COCCCC[C@@H](C)CC 1fcdb82a73d01c408946e1c8bf220b14 [0,2,0,0,0,0|1,0,0]=3 3712 B13R0.147 CC/C=C\CCCCCNC(C)C#N fcbfa3b70a6de9b36bac9fb5d2e55cbe [0,2,0,0,0,0|2,0,0]=4 3713 B13R0.147 CC/C=C\CCCCCNC(C)CC 85704e566ccdebdbce301190f979a41d [0,2,0,0,0,0|1,0,0]=3 3714 B13R0.147 CC/C=C\CCCCCNC(C)CO 41772e7ed8cf54fc95bb6e2b748c006b [0,2,0,0,0,0|2,0,0]=4 3715 B13R0.147 CC/C=C\CCCCCN[C@@H](C)CC 41ed278af7e18907dac8dc2b4ce6e9fa [0,2,0,0,0,0|1,0,0]=3 3716 B13R0.147 CC/C=C\CCCCCN[C@@H](C)CO bad10969e1f11c1b7da99cfd8acd63f2 [0,2,0,0,0,0|2,0,0]=4 3717 B13R0.147 CC/C=C\CCCCCN[C@H](C)CC dd89490778761f0b3f1b4e1d4e0d7eea [0,2,0,0,0,0|1,0,0]=3 3718 B13R0.147 CC/C=C\CCCCCN[C@H](C)CO 12410fd8d7a471e633b57e86b653ca26 [0,2,0,0,0,0|2,0,0]=4 3719 B13R0.147 CC/C=C\CCCCCOC(C)C#N 83637d15552a039ff10e3393762fbe65 [0,2,0,0,0,0|2,0,0]=4 3720 B13R0.147 CC/C=C\CCCCCOC(C)C=O a23c96e0f648042e8b3f9d9661b3c5fd [0,2,0,0,0,0|2,0,0]=4 3721 B13R0.147 CC/C=C\CCCCCOC(C)CC c231bfc3cf41dc281ff013931eb0b3d2 [0,2,0,0,0,0|1,0,0]=3 3722 B13R0.147 CC/C=C\CCCCCOC(C)CF 8b2f481e7cd2537900661115513e9824 [0,2,0,0,0,0|2,0,0]=4 3723 B13R0.147 CC/C=C\CCCCCOC(C)CS bd3d2e272b7a3b369ca2efc9b0840605 [0,2,0,0,0,0|2,0,0]=4 3724 B13R0.147 CC/C=C\CCCCCO[C@@H](C)CC 69b34b7ef985f186871cee09103d4427 [0,2,0,0,0,0|1,0,0]=3 3725 B13R0.147 CC/C=C\CCCCCO[C@H](C)C=O ace120689b6781d569fdace952c4ace0 [0,2,0,0,0,0|2,0,0]=4 3726 B13R0.147 CC/C=C\CCCCCO[C@H](C)CC ebf34f8d7a5c3f0a428273be965eeeda [0,2,0,0,0,0|1,0,0]=3 3727 B13R0.147 CC/C=C\CCCCCO[C@H](C)CS 2be7f21b298ab718c49bd872a253779c [0,2,0,0,0,0|2,0,0]=4 3728 B13R0.147 CC/C=C\CCCCOCC(=O)CC 24f553a8681df8c9110b0b989f6f51d8 [0,2,0,0,0,0|1,0,1]=4 3729 B13R0.147 CC/C=C\CCCCOCC(C)C#N 7069114c2c0f16d4f2be3d6c044cd398 [0,2,0,0,0,0|2,0,0]=4 3730 B13R0.147 CC/C=C\CCCCOCC(C)CC e3e622884db43c812efee533042b1b7f [0,2,0,0,0,0|1,0,0]=3 3731 B13R0.147 CC/C=C\CCCCOCC(C)OC 85185e121bfb8bac5014e8da5082e7a7 [0,2,0,0,0,0|2,0,0]=4 3732 B13R0.147 CC/C=C\CCCCOCC(O)CO b469c16503ceeadc3baac9ebb04ed56d [0,2,0,0,0,0|2,0,0]=4 3733 B13R0.147 CC/C=C\CCCCOC[C@@H](C)CC 7df6ef7b2acf06388e99649dfc0858a4 [0,2,0,0,0,0|1,0,0]=3 3734 B13R0.147 CC/C=C\CCCCOC[C@@H](C)OC 42ee5badca29a4e776dd70bb2032c6a7 [0,2,0,0,0,0|2,0,0]=4 3735 B13R0.147 CC/C=C\CCCCOC[C@@H](O)CO ed365e5a95f699cc17b43a24c9964ddd [0,2,0,0,0,0|2,0,0]=4 3736 B13R0.147 CC/C=C\CCCCOC[C@H](C)CC 1440cbd3182eb0d6e37f9119f5929628 [0,2,0,0,0,0|1,0,0]=3 3737 B13R0.147 CC/C=C\CCCCOC[C@H](C)OC 05fd50fde2ffa2765205157a9f8253c8 [0,2,0,0,0,0|2,0,0]=4 3738 B13R0.147 CC/C=C\CCCCOC[C@H](O)CO a137e17c3c2ef3375bc6f20e3d2fa7c9 [0,2,0,0,0,0|2,0,0]=4 3739 B13R0.147 CC/C=C\CCCOCCC(C)CC 29fcc8fb36d33921d163aa3b2175c75c [0,2,0,0,0,0|1,0,0]=3 3740 B13R0.147 CC/C=C\CCCOCCS(=O)CC 8f5cd43e938b5fbf2f65cbb0308fbc16 [0,2,0,0,0,0|2,0,0]=4 3741 B13R0.147 CC/C=C\CCNCCCC(C)CO 76510fc56db68bb7b34e416d9fa5245f [0,2,0,0,0,0|2,0,0]=4 3742 B13R0.147 CC/C=C\CCNCCCN(C)CC b6e6d6dfe2ccc4a7aaa6d8cb7e39e6f2 [0,2,0,0,0,0|2,0,0]=4 3743 B13R0.147 CC/C=C\CCOCCCC(C)CC 348fc1145e1e7c85a4c337fd710d6350 [0,2,0,0,0,0|1,0,0]=3 3744 B13R0.147 CC/C=C\CCOCCCN(C)CC 008844ab77b180f666dd73f2a7d1471f [0,2,0,0,0,0|2,0,0]=4 3745 B13R0.147 CC/C=C\CCOCCC[C@@H](C)CC 253f2690d1807826dd543e94a4d0d24d [0,2,0,0,0,0|1,0,0]=3 3746 B13R0.147 CC/C=C\COCCCCC(=O)CC 588565d1d1b3d8a8574781d16dd71f3e [0,2,0,0,0,0|1,0,1]=4 3747 B13R0.147 CCC(=O)NCCCCCCCCO 1cb8c1f718a6886d98e99cd661e4760c [0,2,0,0,0,0|2,0,0]=4 3748 B13R0.147 CCC(C)CCCCCOCCOC 73566d9ebdbbce07faa2e5d1bc13fe94 [0,2,0,0,0,0|1,0,1]=4 3749 B13R0.147 CCC(C)CCCCOCC=CC#N 048b16e235e8db9b1380ccf9c1e1f442 [0,2,0,0,0,0|1,0,1]=4 3750 B13R0.147 CCC(C)CCNCCCCCCO cd85dd851c30b05b4f755f0fdbc11d3e [0,2,0,0,0,0|0,0,2]=4 3751 B13R0.147 CCC(C)CCNCCCOCCO 4ce22b2b8e5aa316d88336b6f81b9895 [0,2,0,0,0,0|1,0,1]=4 3752 B13R0.147 CCC(C)CNCCCCCCCO edb301d8834bc7bf4661ac5852090c03 [0,2,0,0,0,0|0,0,2]=4 3753 B13R0.147 CCC(C)CNCCCCSCCO 16b03f78d3e46d043a16f6b7dabc6991 [0,2,0,0,0,0|1,0,1]=4 3754 B13R0.147 CCC(C)NCCCCCCCCO 7210376f05f64b70a783c5b0aecb0af1 [0,2,0,0,0,0|0,0,2]=4 3755 B13R0.147 CCC(O)CNCCCCCCCO 939e987bda9e036188a62b99f80abd18 [0,2,0,0,0,0|0,0,2]=4 3756 B13R0.147 CCC(O)CNCCCCSCCO c4a0c0eee4ca6a5b983e639cf69621e4 [0,2,0,0,0,0|1,0,1]=4 3757 B13R0.147 CCC/C=C/CCCOCC(C)CC 0a305ec79c78199f245315bd24820100 [0,2,0,0,0,0|2,0,0]=4 3758 B13R0.147 CCC/C=C/CCCOC[C@@H](C)CC 32641bc7fc97c96dc4b3ec161eee29f8 [0,2,0,0,0,0|2,0,0]=4 3759 B13R0.147 CCC/C=C/CCCOC[C@H](C)CC 052d6425cec5b42c34900242c9745d8f [0,2,0,0,0,0|2,0,0]=4 3760 B13R0.147 CCC/C=C/COCCCC(C)CC 0080769dcd8f75c0cf88260e43497e37 [0,2,0,0,0,0|2,0,0]=4 3761 B13R0.147 CCC/C=C/COCCC[C@@H](C)CC 4625e4e73b5d06ee04e2f502b2194045 [0,2,0,0,0,0|2,0,0]=4 3762 B13R0.147 CCC/C=C\CCCOCC(C)CC 94a583b0e89d46f377f86fbd56c06c67 [0,2,0,0,0,0|2,0,0]=4 3763 B13R0.147 CCC/C=C\CCCOC[C@@H](C)CC 100156e20b8f0e6c2d13bacbb3aff7b6 [0,2,0,0,0,0|2,0,0]=4 3764 B13R0.147 CCC/C=C\CCCOC[C@H](C)CC aa8d213299f2a60960530c15c274a372 [0,2,0,0,0,0|2,0,0]=4 3765 B13R0.147 CCC/C=C\CCOCCC(C)CC 6e952ef35969a12da691b7257f3add93 [0,2,0,0,0,0|2,0,0]=4 3766 B13R0.147 CCC/C=C\COCCCC(C)CC bf3f807f2b4979a114cd97e98a42614b [0,2,0,0,0,0|2,0,0]=4 3767 B13R0.147 CCC/C=C\COCCC[C@@H](C)CC 239d30d05a299d0daabab72b2918f347 [0,2,0,0,0,0|2,0,0]=4 3768 B13R0.147 CCC=CCCCCCOC(C)C#N dcd1fdca547a71b87f3491b0bd534114 [0,2,0,0,0,0|2,0,0]=4 3769 B13R0.147 CCC=CCCCCCOC(C)C=O d312099bc60d8c98f9d86a2338bce255 [0,2,0,0,0,0|2,0,0]=4 3770 B13R0.147 CCC=CCCCCCOC(C)CC 47b456e10517fd81024c85d59953af9c [0,2,0,0,0,0|1,0,0]=3 3771 B13R0.147 CCC=CCCCCCO[C@H](C)C=O 3c3e042eaf44d458babc6216439e9ee5 [0,2,0,0,0,0|2,0,0]=4 3772 B13R0.147 CCCCCCCCCCN(C)CO 348e9b3cba5235ffbf669bbfe6bc6e4d [0,2,0,0,0,0|0,0,2]=4 3773 B13R0.147 CCCCCCCCCNC(=O)CC 22ef5d3798469cc75ce8300df7dac3ff [0,2,0,0,0,0|1,0,1]=4 3774 B13R0.147 CCCCCCCCCNC(=O)CF 55b238b89cbabebda54ac6f90a2f593f [0,2,0,0,0,0|1,0,1]=4 3775 B13R0.147 CCCCCCCCCNC(=O)CO 92c25d5e3b910d35b28c819015c37d24 [0,2,0,0,0,0|0,0,1]=3 3776 B13R0.147 CCCCCCCCCNC(=O)CS eb36a40d539976cbe2168f2f74abeadf [0,2,0,0,0,0|0,1,1]=4 3777 B13R0.147 CCCCCCCCCNC(C)CO e615512f763ca358e8ca8dbc5a1e4819 [0,2,0,0,0,0|0,0,2]=4 3778 B13R0.147 CCCCCCCCCN[C@@H](C)CO 04d33e16dfc697b387400370e5753bd4 [0,2,0,0,0,0|0,0,2]=4 3779 B13R0.147 CCCCCCCCCN[C@H](C)CO e0542c8aa4e021605f5df5d77cbe7605 [0,2,0,0,0,0|0,0,2]=4 3780 B13R0.147 CCCCCCCCNCC(=O)CC baf0ee8c7f5c169c254b280e2cc7130e [0,2,0,0,0,0|1,0,1]=4 3781 B13R0.147 CCCCCCCCNCC(=O)CO f586ce7a669e24502f466e4e7886aee3 [0,2,0,0,0,0|0,0,1]=3 3782 B13R0.147 CCCCCCCCNCC(=O)NO ff56059b567ccba4cc7bbd233161257b [0,2,0,0,0,0|1,0,1]=4 3783 B13R0.147 CCCCCCCCNCC(C)CO 9aefe401d73daff7eb00de7477219dd8 [0,2,0,0,0,0|0,0,2]=4 3784 B13R0.147 CCCCCCCCNCC(C)OC 83013ee6c033a4a80cde4f3145dd7c0d [0,2,0,0,0,0|1,0,1]=4 3785 B13R0.147 CCCCCCCCNCC(F)CO 98129e1a220b7a6ab3c3bbd52bf01fd1 [0,2,0,0,0,0|0,0,2]=4 3786 B13R0.147 CCCCCCCCNCC(O)CC 2ab834300d0a7e181771499d51a89b57 [0,2,0,0,0,0|1,0,1]=4 3787 B13R0.147 CCCCCCCCNCC(O)CF 5005f9fd70cfe3c4e15e043b3468a581 [0,2,0,0,0,0|1,0,1]=4 3788 B13R0.147 CCCCCCCCNCC(O)CO 374b79ceabc57d3b98e6d4d0375a6698 [0,2,0,0,0,0|0,0,2]=4 3789 B13R0.147 CCCCCCCCNC[C@@H](C)CO 95cf363db8406396abd18326da7b745f [0,2,0,0,0,0|0,0,2]=4 3790 B13R0.147 CCCCCCCCNC[C@@H](C)OC be6a2a5119af4bcf38750e6264d16035 [0,2,0,0,0,0|1,0,1]=4 3791 B13R0.147 CCCCCCCCNC[C@@H](F)CO 4a2f58eb388e6836f0e5e4c638f657e2 [0,2,0,0,0,0|0,0,2]=4 3792 B13R0.147 CCCCCCCCNC[C@@H](O)CO 7a82ffae7f4b34231269482a75272373 [0,2,0,0,0,0|0,0,2]=4 3793 B13R0.147 CCCCCCCCNC[C@H](C)CO 607e12a1ef01df2d5207c8bfde50bf30 [0,2,0,0,0,0|0,0,2]=4 3794 B13R0.147 CCCCCCCCNC[C@H](C)OC 9960446797c2948b089200a9cd030b79 [0,2,0,0,0,0|1,0,1]=4 3795 B13R0.147 CCCCCCCCNC[C@H](F)CO 829bae360fd8b3e7f52474c1bddc9bbb [0,2,0,0,0,0|0,0,2]=4 3796 B13R0.147 CCCCCCCCNC[C@H](O)CC bea6baae13f6e8e4bea251bed0a0b265 [0,2,0,0,0,0|1,0,1]=4 3797 B13R0.147 CCCCCCCCNC[C@H](O)CO c0a89ce2312cb7d2e7e4a842dc6e9a16 [0,2,0,0,0,0|0,0,2]=4 3798 B13R0.147 CCCCCCCCOCC(=O)CC 482deb618797c21132365b461ba03a20 [0,2,0,0,0,0|1,0,1]=4 3799 B13R0.147 CCCCCCCCOCC(C)OC 0f4430a853cce88308ded10fb34f6ad3 [0,2,0,0,0,0|1,0,1]=4 3800 B13R0.147 CCCCCCCCOCC(O)CO 46c2fe0520c1ac395ddb4f27a61434bd [0,2,0,0,0,0|0,0,2]=4 3801 B13R0.147 CCCCCCCCOC[C@@H](C)OC eab161fcecd28215ce94221644b5bbe9 [0,2,0,0,0,0|1,0,1]=4 3802 B13R0.147 CCCCCCCCOC[C@@H](O)CO 8ce262f4ace5403e5f1c0107af2da196 [0,2,0,0,0,0|0,0,2]=4 3803 B13R0.147 CCCCCCCCOC[C@H](C)OC 11e40b8703a43576778cef76e5b3e27a [0,2,0,0,0,0|1,0,1]=4 3804 B13R0.147 CCCCCCCCOC[C@H](O)CO 9885e0ea6a07cf7b143de90bc057568c [0,2,0,0,0,0|0,0,2]=4 3805 B13R0.147 CCCCCCCNCCC(=O)NO 89bbc52765a09d657df6ea07b1da7893 [0,2,0,0,0,0|1,0,1]=4 3806 B13R0.147 CCCCCCCNCCC(C)CO 155dc892d0fbfeab6f5495b22611b7fe [0,2,0,0,0,0|0,0,2]=4 3807 B13R0.147 CCCCCCCNCCC(O)CO 8bd422c93cc865ccc2883ac76ae9bdff [0,2,0,0,0,0|0,0,2]=4 3808 B13R0.147 CCCCCCCNCC[C@@H](C)CO 909bd8564c4053a1fc420ece4e2b1cc2 [0,2,0,0,0,0|0,0,2]=4 3809 B13R0.147 CCCCCCCNCOC(=O)CC 2cb81149e57374acdfb7d7bd5f55aaeb [0,2,0,0,0,0|2,0,0]=4 3810 B13R0.147 CCCCCCCOCOC(=O)CC c8547b52873f7d093d0bec4b70d2a332 [0,2,0,0,0,0|2,0,0]=4 3811 B13R0.147 CCCCCCNC/C=C/C(=O)OC da65ca5fca4de657aadbe3d855541080 [0,2,0,0,0,0|1,0,1]=4 3812 B13R0.147 CCCCCCNC/C=C\C(=O)OC 417afe7fbdae5499ca563b2962e78af7 [0,2,0,0,0,0|1,0,1]=4 3813 B13R0.147 CCCCCCNCC=CC(=O)OC 86a086a24c5c088422f5a0ecb3e0f6c7 [0,2,0,0,0,0|1,0,1]=4 3814 B13R0.147 CCCCCCNCCCC(C)CO ca09d6941bc8146f331e0ee1e6dbfe90 [0,2,0,0,0,0|0,0,2]=4 3815 B13R0.147 CCCCCCNCCNC(=O)CC 7e7ec5e84a1e9d2cecb62e4130590a87 [0,2,0,0,0,0|2,0,0]=4 3816 B13R0.147 CCCCCCOC/C=C/C(=O)OC 0b65a61de6b5df8ca86801402fff08df [0,2,0,0,0,0|1,0,1]=4 3817 B13R0.147 CCCCCCOC/C=C\C(=O)OC ff086bc80eb704cc5bf67d9b169606cc [0,2,0,0,0,0|1,0,1]=4 3818 B13R0.147 CCCCCCOCC=CC(=O)OC 187d143181422d47aa30aa1184b9a897 [0,2,0,0,0,0|1,0,1]=4 3819 B13R0.147 CCCCCCOCCNC(=O)CC 595e68d4e9766e183ec3d895416fa07c [0,2,0,0,0,0|2,0,0]=4 3820 B13R0.147 CCCCCCOCCOC(=O)CC 5de9c7b3d11dfb8a4419ad50a0d9e03b [0,2,0,0,0,0|2,0,0]=4 3821 B13R0.147 CCCCCNCCCCC(=O)CC 90b728a095ade7586124fa525c7f53e7 [0,2,0,0,0,0|1,0,1]=4 3822 B13R0.147 CCCCCOCCCCC(=O)CC e2ac128e37c582a4e7d20ec42c0aa585 [0,2,0,0,0,0|1,0,1]=4 3823 B13R0.147 CCCCOCCCNCC(=O)CO 1e21ddb9c829695724cd581dd89c345e [0,2,0,0,0,0|1,0,1]=4 3824 B13R0.147 CCCSCCCCNCC(=O)CO ddc7348621c24d3d1bc3a61711b30c98 [0,2,0,0,0,0|1,0,1]=4 3825 B13R0.147 CCN(C)CCCCCCCCCO 48b8e5143c0fc38af1200deabf80bafe [0,2,0,0,0,0|0,0,2]=4 3826 B13R0.147 CCN(C)CCCCCCOCCO ce63ea9c0c920dc606b9193a9663dc95 [0,2,0,0,0,0|1,0,1]=4 3827 B13R0.147 CC[C@@H](C)CNCCCCCCCO 012eb931a20c9cde53b84d2814d2e9f8 [0,2,0,0,0,0|0,0,2]=4 3828 B13R0.147 CC[C@@H](C)CNCCCCSCCO 7f41a8b580c1536bc103030a178c5a83 [0,2,0,0,0,0|1,0,1]=4 3829 B13R0.147 CC[C@@H](C)NCCCCCCCCO f570992c7c51705708994b1f6fb0a9a9 [0,2,0,0,0,0|0,0,2]=4 3830 B13R0.147 CC[C@@H](O)CNCCCCCCCO 5ccaaad05be53ab9cfd6786c2d776362 [0,2,0,0,0,0|0,0,2]=4 3831 B13R0.147 CC[C@H](C)CCCCCOCCOC fe6530747c658d326abe1ac79a2d8a8d [0,2,0,0,0,0|1,0,1]=4 3832 B13R0.147 CC[C@H](C)CCCCOCC=CC#N 8dc034fd42d64094980894610b4f1635 [0,2,0,0,0,0|1,0,1]=4 3833 B13R0.147 CC[C@H](C)CNCCCCCCCO d82ded72d15d78202d6749c0dc9af2c3 [0,2,0,0,0,0|0,0,2]=4 3834 B13R0.147 CC[C@H](C)CNCCCCSCCO 3077f164bef9ddeea6cee4da67eefefa [0,2,0,0,0,0|1,0,1]=4 3835 B13R0.147 CC[C@H](C)NCCCCCCCCO f68ada16bce7a2a5201dc16afffeeb4a [0,2,0,0,0,0|0,0,2]=4 3836 B13R0.147 CN(CO)CCCCCCCCCO e654e9c8b4cd72db421361722b191099 [0,2,0,0,0,0|1,0,1]=4 3837 B13R0.147 COCCOCCCCNC(=O)CO 4c882f77fe1c7844e9b7493dbe1fc0cd [0,2,0,0,0,0|2,0,0]=4 3838 B13R0.147 C[C@@H](CO)NCCCCCCCCO d931ddbbf40c4b659a02eacc88583fba [0,2,0,0,0,0|1,0,1]=4 3839 B13R0.147 C[C@H](CO)NCCCCCCCCO 8233dd150becb03da1cccde641401c4c [0,2,0,0,0,0|1,0,1]=4 3840 B13R0.147 O=C(CF)NCCCCCCCCO 55badb61250936cb9a1887689ea46a95 [0,2,0,0,0,0|2,0,0]=4 3841 B13R0.147 O=C(CO)CNCCCCCCCO b350551a35f2aa2bf9c23fd666ba0360 [0,2,0,0,0,0|1,0,1]=4 3842 B13R0.147 O=C(CO)NCCCCCCCCO 2d309250f02fc65fc3c53cab9f0e56d5 [0,2,0,0,0,0|1,0,0]=3 3843 B13R0.147 O=C(CS)NCCCCCCCCO af9b8466241b802ff1549510bf474073 [0,2,0,0,0,0|1,1,0]=4 3844 B13R0.165 CC/C=C/CNC(C)CCCCCC 15d42754f7c02fa032d8b43c86d64692 [0,2,0,0,0,0|1,0,0]=3 3845 B13R0.165 CC/C=C/CN[C@@H](C)CCCCCC 2f5e90ce9be30b379fc5bf37aa19a6bf [0,2,0,0,0,0|1,0,0]=3 3846 B13R0.165 CC/C=C/CN[C@H](C)CCCCCC f4266325ef033d4ee6cde2c0a712194e [0,2,0,0,0,0|1,0,0]=3 3847 B13R0.165 CC/C=C/COC(C)CCCCCC 6bddbf1cf63d8b20b5b6591ccfe8a49f [0,2,0,0,0,0|1,0,0]=3 3848 B13R0.165 CC/C=C/COC(C)COCCCC 2b8407b280a347708b4c60a286053e45 [0,2,0,0,0,0|2,0,0]=4 3849 B13R0.165 CC/C=C/CO[C@@H](C)CCCCCC 72ecb70408bb91e6badb10a5c84de719 [0,2,0,0,0,0|1,0,0]=3 3850 B13R0.165 CC/C=C/CO[C@H](C)CCCCCC 67bb5f824e6a5e09c924464beada90a6 [0,2,0,0,0,0|1,0,0]=3 3851 B13R0.165 CC/C=C\CCN(C)CCCCCC 9bf5649c892ce843d31a5b36f4e6c496 [0,2,0,0,0,0|1,0,0]=3 3852 B13R0.165 CC/C=C\CCN(C)CCCCCO e4f79ec94d9d412b2b7cc7399556673d [0,2,0,0,0,0|2,0,0]=4 3853 B13R0.165 CC/C=C\CCN(C)CCCCOC 9764e9174aa0c136a7cf755ee7cb2d54 [0,2,0,0,0,0|2,0,0]=4 3854 B13R0.165 CC/C=C\COC(C)CCCCCC a8a0308c0777559066097c3b958aaf92 [0,2,0,0,0,0|1,0,0]=3 3855 B13R0.165 CCC/C=C/CN(C)CCCCCC 899da87da3f163196d37774be7c5e1e4 [0,2,0,0,0,0|2,0,0]=4 3856 B13R0.165 CCC/C=C\CN(C)CCCCCC 98884606c3dfb21f40f2fcc29e527dcb [0,2,0,0,0,0|2,0,0]=4 3857 B13R0.165 CCCCCCC(C)CCOCOC 9e4ab9f446eb91efd65f012b7a1e022e [0,2,0,0,0,0|1,0,1]=4 3858 B13R0.165 CCCCCCC(C)COCCOC 27099d4b2d95566109e7b0ab1a3bf996 [0,2,0,0,0,0|1,0,1]=4 3859 B13R0.165 CCCCCCC(C)NCC#CCO c73eb319a969978ca9e6c8dcf14c6a03 [0,2,0,0,0,0|0,0,2]=4 3860 B13R0.165 CCCCCCC(C)NCC=CC#N 9472411d3dc3011174c03df1cab2602c [0,2,0,0,0,0|1,0,1]=4 3861 B13R0.165 CCCCCCC(C)NCCCCO 2f316b24fe696a78e20d4361f330317f [0,2,0,0,0,0|0,0,2]=4 3862 B13R0.165 CCCCCCC(C)OC/C=C/C=O 8202ef89ed8967f10742d6b4fd4764df [0,2,0,0,0,0|0,0,2]=4 3863 B13R0.165 CCCCCCC(C)OCC=CC#N 21d5ac207c2e81026ae7b2642503d976 [0,2,0,0,0,0|1,0,1]=4 3864 B13R0.165 CCCCCCN(C)CCCCCO e28c3bc4134b4f3801d2457af143a9de [0,2,0,0,0,0|0,0,2]=4 3865 B13R0.165 CCCCCCN(C)CCOCCO c5d7931a7bddebf076935aaa8585385e [0,2,0,0,0,0|1,0,1]=4 3866 B13R0.165 CCCCCC[C@@H](C)NCC=CC#N 09743a4efc481cda78ac3a6c265e23be [0,2,0,0,0,0|1,0,1]=4 3867 B13R0.165 CCCCCC[C@@H](C)NCCCCO 73793ff0c45f78e06a7c68b4383611fd [0,2,0,0,0,0|0,0,2]=4 3868 B13R0.165 CCCCCC[C@@H](C)OCC=CC#N e5877d62a71bc56ca8b8e3c6e59f4c15 [0,2,0,0,0,0|1,0,1]=4 3869 B13R0.165 CCCCCC[C@H](C)NCC=CC#N 1be1f40d51ece558538367702ff17141 [0,2,0,0,0,0|1,0,1]=4 3870 B13R0.165 CCCCCC[C@H](C)NCCCCO e0d00f91d0a1286b11311b16bcd0b24b [0,2,0,0,0,0|0,0,2]=4 3871 B13R0.165 CCCCCC[C@H](C)OCC=CC#N e2d5f9a031d6884a84443f7eca47b311 [0,2,0,0,0,0|1,0,1]=4 3872 B13R0.336 C#CCCCCCCCCNCCO 956f6e80e031bbade7ec2f2e5bca624e [0,2,0,0,0,0|1,0,1]=4 3873 B13R0.336 C#CCCCCCCNC/C=C/CC 94016af83338ae89967a99532d799640 [0,2,0,0,0,0|1,0,1]=4 3874 B13R0.336 C#CCCCCCCOC/C=C/CC 7c620208842b5403741a394b76129814 [0,2,0,0,0,0|1,0,1]=4 3875 B13R0.336 C#CCCCCCCOC/C=C\CC 7dc4944b8ca06c54e0a18ac6cd8a9aca [0,2,0,0,0,0|1,0,1]=4 3876 B13R0.336 C#CCCCCCNCC/C=C\CC 62062975a131d1953ad53457e746b803 [0,2,0,0,0,0|1,0,1]=4 3877 B13R0.336 C#CCCCCCOCC/C=C/CC 6fc85c049e00321b4cdec7cb02940b6a [0,2,0,0,0,0|1,0,1]=4 3878 B13R0.336 C#CCCCCCOCC/C=C\CC 7fdb83c5270b939b2d4d061f6119f5cc [0,2,0,0,0,0|1,0,1]=4 3879 B13R0.336 C#CCCCCOCCC/C=C\CC 225a40edfb728bced77701e7ed810627 [0,2,0,0,0,0|1,0,1]=4 3880 B13R0.336 C#CCCCOCCCC/C=C\CC 2fc93383b5294d8875f9683d8610106d [0,2,0,0,0,0|1,0,1]=4 3881 B13R0.336 C#CCCNCCCCC/C=C\CC 2059e17ca1fa972c0f91861e7b34db59 [0,2,0,0,0,0|1,0,1]=4 3882 B13R0.336 C#CCCOCCCCC/C=C\CC 36f715c7eecd94b59f23ed2580744d3a [0,2,0,0,0,0|1,0,1]=4 3883 B13R0.336 C#CCCOCCCCCC=CCC c5568ed5bc45bbbb249b8983c90d5d57 [0,2,0,0,0,0|1,0,1]=4 3884 B13R0.336 C/C=C/C=C/COCCCCCCC 92ae2f66f7520412d54592648a069504 [0,2,0,0,0,0|1,0,1]=4 3885 B13R0.336 C/C=C/COCCCCC/C=C\CC d9d7aabb6d5276edac4791d97a6d28f6 [0,2,0,0,0,0|1,0,1]=4 3886 B13R0.336 C/C=C/COCCCCCC=CCC 35507172b2bf00720e716473e55a7cd4 [0,2,0,0,0,0|1,0,1]=4 3887 B13R0.336 C/C=C\CCCOCCC/C=C\CC 32e4b573aded593daddfe3a6546bccbe [0,2,0,0,0,0|1,0,1]=4 3888 B13R0.336 C/C=C\COCCCCC/C=C\CC c25b944b0ac4a62a4ff1d7e34390a9f5 [0,2,0,0,0,0|1,0,1]=4 3889 B13R0.336 C/C=C\COCCCCCC=CCC b1d3edb2d010b1ce904539cac9dc81c5 [0,2,0,0,0,0|1,0,1]=4 3890 B13R0.336 C=C/C=C/CCNCCCCCCC 67022bcc2149c01180d041bdf6bde282 [0,2,0,0,0,0|1,0,1]=4 3891 B13R0.336 C=C/C=C/CCNCCCCCCF ab65eb81d0be5fd406eb8bace14fee99 [0,2,0,0,0,0|1,0,1]=4 3892 B13R0.336 C=C/C=C/CCNCCCCCCO 06c9380f300519af4ebf590d79ebf939 [0,2,0,0,0,0|1,0,1]=4 3893 B13R0.336 C=C/C=C/CCNCCCCCOC e422c970a631c2876c57732443cd1a10 [0,2,0,0,0,0|1,0,1]=4 3894 B13R0.336 C=C/C=C/CCNCCCOCCC 295d28d99cdd6967f6c0329ab056c34d [0,2,0,0,0,0|1,0,1]=4 3895 B13R0.336 C=C/C=C/CCNCCOCCCC 535c7a513e580c22337bd38f2161f55c [0,2,0,0,0,0|1,0,1]=4 3896 B13R0.336 C=CCCCCCCCCCNCO ca1ed475341c5966b461544fdab023ec [0,2,0,0,0,0|1,0,1]=4 3897 B13R0.336 C=CCCCCCCCCNCCO ce70109d8996b6aafb40d99406092b14 [0,2,0,0,0,0|1,0,1]=4 3898 B13R0.336 C=CCCCCCCOC/C=C/CC ac8973c4a0ac66f44a9357246a66c655 [0,2,0,0,0,0|1,0,1]=4 3899 B13R0.336 C=CCCCCCCOC/C=C\CC ab5f5f5af5b81c90720b6239fc8ae534 [0,2,0,0,0,0|1,0,1]=4 3900 B13R0.336 C=CCCCCCNCC/C=C\CC bc11f58fb45b28ee34d9d67400a507be [0,2,0,0,0,0|1,0,1]=4 3901 B13R0.336 C=CCCCCCOCC/C=C/CC 5775dd51268644d3a48ca997ee3f7c0a [0,2,0,0,0,0|1,0,1]=4 3902 B13R0.336 C=CCCCCCOCC/C=C\CC e5b920795df2c3aba7a1a0607d985284 [0,2,0,0,0,0|1,0,1]=4 3903 B13R0.336 C=CCCCCOCCC/C=C\CC 7c8e47aefc6e91f7bf73c119cb46c111 [0,2,0,0,0,0|1,0,1]=4 3904 B13R0.336 C=CCCCOCCCC/C=C\CC efeedbc8226b71117376750ff9495c93 [0,2,0,0,0,0|1,0,1]=4 3905 B13R0.336 C=CCCNCCCCC/C=C\CC 9d72f25736a378e69bb03ace309b974a [0,2,0,0,0,0|1,0,1]=4 3906 B13R0.336 C=CCCOCCCCC/C=C\CC 32b59eaeca73c41b9b226d846e147843 [0,2,0,0,0,0|1,0,1]=4 3907 B13R0.336 C=CCCOCCCCCC=CCC 332503319fad7ae73779fb342a04f17b [0,2,0,0,0,0|1,0,1]=4 3908 B13R0.336 C=COCCNCCCCCCCC 32a602c96ce05e4dcb03605ff7719a99 [0,2,0,0,0,0|1,0,1]=4 3909 B13R0.336 C=COCCOCCCCCCCC d90e38e3c1b864d5d0c9f9a0cf91989c [0,2,0,0,0,0|1,0,1]=4 3910 B13R0.336 CC#CCCCOCCC/C=C\CC c88e4fca6bfed606f71f4e5991a74597 [0,2,0,0,0,0|1,0,1]=4 3911 B13R0.336 CC#CCNCCCCC/C=C\CC 9ec246bd6178f9a498b1290d9887d87e [0,2,0,0,0,0|1,0,1]=4 3912 B13R0.336 CC#CCOCCCCC/C=C\CC 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866ca2dd5c994e9beb8835fe56b924e6 [0,2,0,0,0,0|0,0,2]=4 4125 B13R0.336 CCCCCCCNCCCCON 17e7e958c366156e86ec8c372c2bb7c4 [0,2,0,0,0,0|0,0,2]=4 4126 B13R0.336 CCCCCCCNCCOCCO 361b73704d46a2a0d8389eaf015a7403 [0,2,0,0,0,0|0,0,2]=4 4127 B13R0.336 CCCCCCCNCCOCOC 3c3281bcec16ceead9b6d884db4f6242 [0,2,0,0,0,0|1,0,1]=4 4128 B13R0.336 CCCCCCCNCCSCCO 79bd9e06d977ad7dff18f31896e05a63 [0,2,0,0,0,0|0,0,2]=4 4129 B13R0.336 CCCCCCCNCOCCOC f95dbd5227eff2b30e592ba241679538 [0,2,0,0,0,0|1,0,1]=4 4130 B13R0.336 CCCCCCCOCC#CCOC 9379631c8bd8ddfd6055143ceda3e880 [0,2,0,0,0,0|0,0,2]=4 4131 B13R0.336 CCCCCCCOCCCCOC 8bc869f1d27732ebdfdfedbc6fd279e8 [0,2,0,0,0,0|0,0,2]=4 4132 B13R0.336 CCCCCCCOCCOCOC 0a45d8ec9a46db27e23e04ee7bb03e52 [0,2,0,0,0,0|1,0,1]=4 4133 B13R0.336 CCCCCCCOCOCCOC 146ce62a905a71eacc6a3f1246ed3f0f [0,2,0,0,0,0|1,0,1]=4 4134 B13R0.336 CCCCCCNCCCCCCO 92b9dee1a467489b8cef8f3d44f4f981 [0,2,0,0,0,0|0,0,2]=4 4135 B13R0.336 CCCCCCNCCCCCOC ec6f5e6f32906cc9e038bb5217d70a1a [0,2,0,0,0,0|0,0,2]=4 4136 B13R0.336 CCCCCCNCCCOCCO f4d0f9cca9acd227076a95f2772ce17c [0,2,0,0,0,0|0,0,2]=4 4137 B13R0.336 CCCCCCNCCOCCCO c5e3d922befb2a22cb8ad89585467ffb [0,2,0,0,0,0|0,0,2]=4 4138 B13R0.336 CCCCCCNCCOCCOC 5f24874bfde73c1405575818a858704e [0,2,0,0,0,0|1,0,1]=4 4139 B13R0.336 CCCCCCNCCOCCON 4a5b221eb921e2ac670ce0e2c81d797a [0,2,0,0,0,0|1,0,1]=4 4140 B13R0.336 CCCCCCOCCCCCOC e754be553c08f343eb413b6114d126fd [0,2,0,0,0,0|0,0,2]=4 4141 B13R0.336 CCCCCCOCCOCCOC 6a0af638b5faf8801fcc83118ff6ffaf [0,2,0,0,0,0|1,0,1]=4 4142 B13R0.336 CCCCCNCCCCCCCO 0e8f243a6688ed8db92ee3b90c9d74f4 [0,2,0,0,0,0|0,0,2]=4 4143 B13R0.336 CCCCCNCCCCCCOC bedbfae169b73274cf4c400a05d3aee4 [0,2,0,0,0,0|0,0,2]=4 4144 B13R0.336 CCCCCNCCCCSCCO 498ac53328ffb50bbe48795ee7b94b5f [0,2,0,0,0,0|0,0,2]=4 4145 B13R0.336 CCCCCNCCCOCCCO 45df70b6d612e2351fdcf035b10ce491 [0,2,0,0,0,0|0,0,2]=4 4146 B13R0.336 CCCCCNCCCOCCOC 24eecf809c5bd44bf5890480ef38e9b0 [0,2,0,0,0,0|1,0,1]=4 4147 B13R0.336 CCCCCOCCCCCCOC 06701e6a79c9cc2ce9af8e19559c53b0 [0,2,0,0,0,0|0,0,2]=4 4148 B13R0.336 CCCCCOCCCOCCOC 42946035a8e4db07c065c3be84bf6758 [0,2,0,0,0,0|1,0,1]=4 4149 B13R0.336 CCCCCOCCOCC=CC#N 5ca7a8ff7daf69379184286e7c449514 [0,2,0,0,0,0|1,0,1]=4 4150 B13R0.336 CCCCNCCCCCCCCO ece1477d2b5370044b427fd51d0ad02b [0,2,0,0,0,0|0,0,2]=4 4151 B13R0.336 CCCCNCCCCOCCOC 7267fc659ca1434a75c020d5c7095b43 [0,2,0,0,0,0|1,0,1]=4 4152 B13R0.336 CCCCNCCOCCOCCO 003c42f22eda20e6c6606fd596b3c363 [0,2,0,0,0,0|1,0,1]=4 4153 B13R0.336 CCCCOCCCNCC=CC#N 56b81b57d6e16af3d0374abac0fc7db4 [0,2,0,0,0,0|1,0,1]=4 4154 B13R0.336 CCCCOCCCNCCCCO 100e41286c748e72764fa99da5a32f4c [0,2,0,0,0,0|0,0,2]=4 4155 B13R0.336 CCCCOCCCOCC=CC#N ccb3647ff6b6c7a63b2fe7f2d174f3b0 [0,2,0,0,0,0|1,0,1]=4 4156 B13R0.336 CCCCOCCNCCCCCO b4ab07077c3f6afd2fc218563074408c [0,2,0,0,0,0|0,0,2]=4 4157 B13R0.336 CCCCOCCNCCOCCO 9b22f664721747cd5bb8c756738d0066 [0,2,0,0,0,0|1,0,1]=4 4158 B13R0.336 CCCCOCCNCCSCCO 08adf58f66933c9b8e49354e3d8f811e [0,2,0,0,0,0|1,0,1]=4 4159 B13R0.336 CCCCOCCOCCNCCO be6d1b38eff101c60e9a12614b99d6dc [0,2,0,0,0,0|1,0,1]=4 4160 B13R0.336 CCCCOCNCCCCCCO dd68441657b2cb96fe2bd34ab94b23e5 [0,2,0,0,0,0|0,0,2]=4 4161 B13R0.336 CCCCOCNCCCOCCO 8f852bac589c766799c7daea5a7240a6 [0,2,0,0,0,0|1,0,1]=4 4162 B13R0.336 CCCNCCCCCCCCCO d14dededfac30715d4efd5f81d71f284 [0,2,0,0,0,0|0,0,2]=4 4163 B13R0.336 CCCNCCCCCCOCCO fddc2fa57eeb5e0213eb8f4aa2ede801 [0,2,0,0,0,0|0,0,2]=4 4164 B13R0.336 CCCNCCCCOCCCCO b5a6bab6d5c9f14876ed693d0153db5e [0,2,0,0,0,0|0,0,2]=4 4165 B13R0.336 CCCNCCCOCCOCCO e268c55f90a00259bf0107198a72d3be [0,2,0,0,0,0|1,0,1]=4 4166 B13R0.336 CCCOCCCNCCCCCO c3b4ac6b91bc89e20955eecc19017021 [0,2,0,0,0,0|0,0,2]=4 4167 B13R0.336 CCCOCCCNCCOCCO 252e82b2a8674ab0119601b1bd818605 [0,2,0,0,0,0|1,0,1]=4 4168 B13R0.336 CCCOCCCNCCSCCO 01cc4027c5ec96685662891ba1cca162 [0,2,0,0,0,0|1,0,1]=4 4169 B13R0.336 CCCOCCNCCCCCCO b2b566d54b6cf2a7c8559d5809876d17 [0,2,0,0,0,0|0,0,2]=4 4170 B13R0.336 CCCOCCNCCCOCCO 8acd504573759195b6c3b61b43ee5265 [0,2,0,0,0,0|1,0,1]=4 4171 B13R0.336 CCCSCCCCNCC=CC#N 4b89d8c366938ab6a5ab9fd551b24068 [0,2,0,0,0,0|1,0,1]=4 4172 B13R0.336 CCCSCCCCNCCCCO fb7c1ed79e2e03520a533538af61de7c [0,2,0,0,0,0|0,0,2]=4 4173 B13R0.336 CCNCCCCCCCCCCO 2fb8c3ddad2b11919576e17ddfb56e84 [0,2,0,0,0,0|0,0,2]=4 4174 B13R0.336 CCOCCCNCCCCCCO 245e75da1ec3928f81eaae39e0976513 [0,2,0,0,0,0|0,0,2]=4 4175 B13R0.336 CCOCCCNCCCOCCO 3d325e1679cd1429781c00953711bf38 [0,2,0,0,0,0|1,0,1]=4 4176 B13R0.336 CCOCCNCCCCCCCO c31d16e0602718984a21a276ff1e06d1 [0,2,0,0,0,0|0,0,2]=4 4177 B13R0.336 CCOCCNCCCCSCCO 1838ed50325f1ec00b2231587a493ef0 [0,2,0,0,0,0|1,0,1]=4 4178 B13R0.336 CCOCNCCCCCCCCO 4b312ca131ebbf93fb866cda39ed2bb2 [0,2,0,0,0,0|0,0,2]=4 4179 B13R0.336 CCSCCCCNCCCCCO bd2c06a1e18016f10e001556f5df2f24 [0,2,0,0,0,0|0,0,2]=4 4180 B13R0.336 CCSCCCCNCCOCCO c195f5fe447dc03d121ee2a992c84ba0 [0,2,0,0,0,0|1,0,1]=4 4181 B13R0.336 CCSCCCNCCCCCCO 00950918814a0abbc669946344ba6dd9 [0,2,0,0,0,0|0,0,2]=4 4182 B13R0.336 CCSCCCNCCCOCCO 00d6a21b74c75efe7d8d20992b58817b [0,2,0,0,0,0|1,0,1]=4 4183 B13R0.336 CCSCCNCCCCCCCO b59b79dc9658f0db2ae6d71f57c151af [0,2,0,0,0,0|0,0,2]=4 4184 B13R0.336 CCSCCNCCCCSCCO ab86b14484935e2f47c9e02982d53802 [0,2,0,0,0,0|1,0,1]=4 4185 B13R0.336 COCCCCCCNCC#CCO 52b6456a422d66e5c6fce019f2b10ff9 [0,2,0,0,0,0|0,0,2]=4 4186 B13R0.336 COCCCCCCNCCCCO a356ed6bb30f0e3a2dc2185ffbad6e22 [0,2,0,0,0,0|0,0,2]=4 4187 B13R0.336 COCCCCCCOC/C=C/C=O b7841a47fe00b9ffe284019e119e3706 [0,2,0,0,0,0|0,0,2]=4 4188 B13R0.336 COCCCCCCOCC=CC#N c98c72ad5ea192ab960874b4948c0035 [0,2,0,0,0,0|1,0,1]=4 4189 B13R0.336 COCCCCCNCCCCCO 01f7e776084268f7e581a772707df194 [0,2,0,0,0,0|0,0,2]=4 4190 B13R0.336 COCCCCCNCCOCCO 2f0c1ec477ac57a99ce6ac2db8b96cb0 [0,2,0,0,0,0|1,0,1]=4 4191 B13R0.336 COCCCCCNCCSCCO 09e2cd174ce00faf9df76a25890803f3 [0,2,0,0,0,0|1,0,1]=4 4192 B13R0.336 COCCCCNCCCCCCO 90733e403856a7ccb384fde8b44ad322 [0,2,0,0,0,0|0,0,2]=4 4193 B13R0.336 COCCCCNCCCOCCO a5d82713e0a2680c833b657ea7e09973 [0,2,0,0,0,0|1,0,1]=4 4194 B13R0.336 COCCCNCCCCCCCO 805184fc79cc511b1e850e5b5096dffa [0,2,0,0,0,0|0,0,2]=4 4195 B13R0.336 COCCCNCCCCSCCO 523e02f11cd0774c5945e2604763b08a [0,2,0,0,0,0|1,0,1]=4 4196 B13R0.336 COCCNCCCCCCCCO 8d698630db11f6638c126bcfbf96905b [0,2,0,0,0,0|0,0,2]=4 4197 B13R0.336 COCNCCCCCCCCCO d78ed188161469d72b42b88f0041f606 [0,2,0,0,0,0|0,0,2]=4 4198 B13R0.336 COCOCCCCCCCCCS 75ed8da840d3e4986370923e35e734cc [0,2,0,0,0,0|1,0,1]=4 4199 B13R0.336 CSCCCCNCCCCCCO 732bef9a3669ed1d69cc1856d16e8f2a [0,2,0,0,0,0|0,0,2]=4 4200 B13R0.336 CSCCCNCCCCCCCO 0a1cf2a11460d3ab2cdcf233c2828ba2 [0,2,0,0,0,0|0,0,2]=4 4201 B13R0.336 CSCCCNCCCCSCCO d8e598492080f4c6e4c57584891fcc4a [0,2,0,0,0,0|1,0,1]=4 4202 B13R0.336 CSCCNCCCCCCCCO c4e008392b93e8f2198f7bc6de2b045c [0,2,0,0,0,0|0,0,2]=4 4203 B13R0.336 CSCNCCCCCCCCCO 6adc48a65f71909b5341604e113b5c0b [0,2,0,0,0,0|0,0,2]=4 4204 B13R0.336 N#CC=CCNCCCCCCCO 2e8782da43d8cc96695480e5348cfa70 [0,2,0,0,0,0|1,0,1]=4 4205 B13R0.336 NOCCNCCCCCCCCO 330a8bc4f202e93caea234bb1673a1c7 [0,2,0,0,0,0|1,0,1]=4 4206 B13R0.336 O/C=C\CNCCCCCCCCO 07659aa064efa17da6143be380539fd7 [0,2,0,0,0,0|0,0,2]=4 4207 B13R0.336 O=CCCCCCCCCNCCO 90d68d1322310ae0872a7121a7f84929 [0,2,0,0,0,0|1,0,1]=4 4208 B13R0.336 OCC#CCNCCCCCCCO b93eab035f738529ffe2c9fb63644eb0 [0,2,0,0,0,0|0,0,2]=4 4209 B13R0.336 OCCCCCCCCCCNCF 8bc747fef24cdad14e3a24dbbaeb0e1c [0,2,0,0,0,0|0,0,2]=4 4210 B13R0.336 OCCCCCCCCCCNCO d31c1d03eaed0860ed0bce426063f44b [0,2,0,0,0,0|0,0,2]=4 4211 B13R0.336 OCCCCCCCCCNCCBr 7651d2ed92e5c6686ea4ba651f89c9ff [0,2,0,0,0,0|0,0,2]=4 4212 B13R0.336 OCCCCCCCCCNCCF 4b7e75a35f990b601800c3cb3747f241 [0,2,0,0,0,0|0,0,2]=4 4213 B13R0.336 OCCCCCCCCCNCCI 1ca775a44274ffb68abfe02583842a67 [0,2,0,0,0,0|0,0,2]=4 4214 B13R0.336 OCCCCCCCCCNCCO d7e3501f035533d7292f5a6ca19e29ff [0,2,0,0,0,0|0,0,2]=4 4215 B13R0.336 OCCCCCCCCCNCCS 4868f95e3ac453cfe275f8703f40ecb2 [0,2,0,0,0,0|0,0,2]=4 4216 B13R0.336 OCCCCCCCCNCCCCl 9d565ef845a8e18bc037e5221fb1d335 [0,2,0,0,0,0|0,0,2]=4 4217 B13R0.336 OCCCCCCCCNCCCF bb056adcc0d8d46fcd24516173ad9137 [0,2,0,0,0,0|0,0,2]=4 4218 B13R0.336 OCCCCCCCCNCCCO 60ed91b39768a3fee13cc1e94c394d00 [0,2,0,0,0,0|0,0,2]=4 4219 B13R0.336 OCCCCCCCCNCCCS dda392f34b57ae1064e0571eb7897e42 [0,2,0,0,0,0|0,0,2]=4 4220 B13R0.336 OCCCCCCCNCCCCCl 96464624c8869505fc4db64f036aac55 [0,2,0,0,0,0|0,0,2]=4 4221 B13R0.336 OCCCCCCCNCCCCF 3b6239e5435340297ba81d979740d35e [0,2,0,0,0,0|0,0,2]=4 4222 B13R0.336 OCCCCCCCNCCCCO f4062c92e8334df983cda1111e683c6f [0,2,0,0,0,0|0,0,2]=4 4223 B13R0.336 OCCCCCCCNCCCCS 888669877845183113c2b96ebc3eb573 [0,2,0,0,0,0|0,0,2]=4 4224 B13R0.336 OCCCCCCNCCCCCCl 279fe431c5f20d31ed141731c50a41c9 [0,2,0,0,0,0|0,0,2]=4 4225 B13R0.336 OCCCCCCNCCCCCF e0fbc5e6bd1b1c887f0923464f159c26 [0,2,0,0,0,0|0,0,2]=4 4226 B13R0.336 OCCCCCCNCCCCCO 4666e286a93df8f3ec66001ee6fde419 [0,2,0,0,0,0|0,0,2]=4 4227 B13R0.336 OCCCCCCNCCOCCO a294d679ed766a31d5c01ce7b37f7fec [0,2,0,0,0,0|1,0,1]=4 4228 B13R0.336 OCCCCCCNCCSCCO 5770c506a8b1992a0c0a49e4cdeec48b [0,2,0,0,0,0|1,0,1]=4 4229 B13R0.336 OCCCCCNCCCCCCCl a30ea0df1d446bbe3ddf20ccc37ae226 [0,2,0,0,0,0|0,0,2]=4 4230 B13R0.336 OCCCCCNCCCCCCF 621d0debc0b348ab2b7b25b105c3d843 [0,2,0,0,0,0|0,0,2]=4 4231 B13R0.336 OCCCCCNCCCOCCO 7cce13f9a00dc4689593e1d979519e5b [0,2,0,0,0,0|1,0,1]=4 4232 B13R0.336 OCCCCNCCCCSCCO bb9143cfbb5f7b99bf666adc54734816 [0,2,0,0,0,0|1,0,1]=4 4233 B13R0.336 OCCCCOCCCCNCCO b352e9266eea6f4f37d7582bf92743f6 [0,2,0,0,0,0|1,0,1]=4 4234 B13R0.336 OCCNCCCCCCOCCO 769f3441a901c325b2936ee45ae55e18 [0,2,0,0,0,0|1,0,1]=4 4235 B13R0.336 OCCOCCCCCCNCCBr 8c569b803c4066eb492a16869b7ce6dd [0,2,0,0,0,0|1,0,1]=4 4236 B13R0.336 OCCOCCCCCCNCCF 5096236f4f0cc080a9791c681676095a [0,2,0,0,0,0|1,0,1]=4 4237 B13R0.336 OCCOCCCCCCNCCI f8f191b4bad4db20c9ac77ec1282536a [0,2,0,0,0,0|1,0,1]=4 4238 B13R0.336 OCCOCCCCCCNCCS 2d7ad263e19257e94e6d39b07d783278 [0,2,0,0,0,0|1,0,1]=4 4239 B13R0.336 OCCOCCCNCCCCCF 125df48d50d0d8487b02833b2c5f35f6 [0,2,0,0,0,0|1,0,1]=4 4240 B13R0.336 OCCOCCNCCCCCCCl 9b2174130b729bba2171c42afd2452b5 [0,2,0,0,0,0|1,0,1]=4 4241 B13R0.336 OCCOCCNCCCCCCF 1da93ec2661526012867d4d5f1bf0796 [0,2,0,0,0,0|1,0,1]=4 4242 B13R0.336 OCCSCCCCNCCCCF 8f9a1bb4486dde2553168820f1f753d5 [0,2,0,0,0,0|1,0,1]=4 4243 B13R0.336 OCCSCCNCCCCCCF 920907f1cc8b60cdd86eaf304c452ff3 [0,2,0,0,0,0|1,0,1]=4 4244 B13R0.338 C=C/C=C/CCNC(C)CCCCC 649a9e4b435f2dcac514614d6b008aa8 [0,2,0,0,0,0|1,0,1]=4 4245 B13R0.338 C=C/C=C/CCN[C@@H](C)CCCCC 4a33d4091b9f568f735c926fefdeffea [0,2,0,0,0,0|1,0,1]=4 4246 B13R0.338 CC/C=C/CC(=O)NCCCCCC d1276c8b39405c35a12244f8358c8934 [0,2,0,0,0,0|1,0,1]=4 4247 B13R0.338 CC/C=C/CCOC(C)CCCCC 1259b20c027c8ce10f28081731e65e30 [0,2,0,0,0,0|1,0,0]=3 4248 B13R0.338 CC/C=C/CCO[C@@H](C)CCCCC 307ff3551427530ffdc3fe714cbe0dbc [0,2,0,0,0,0|1,0,0]=3 4249 B13R0.338 CC/C=C/CN(C)CCCCCCC b4ca88f583b92dfe4208ec567d2609f7 [0,2,0,0,0,0|1,0,0]=3 4250 B13R0.338 CC/C=C/CN(C)CCCCCCO dc0c1e3fd88585f37d340b54fd14ef20 [0,2,0,0,0,0|2,0,0]=4 4251 B13R0.338 CC/C=C/COCC(=O)CCCCC 13e110c1f0393c1279e72774b74814d2 [0,2,0,0,0,0|1,0,1]=4 4252 B13R0.338 CC/C=C/COCC(C)CCCCC 41898af4b51adf21c05de06162964d5b [0,2,0,0,0,0|1,0,0]=3 4253 B13R0.338 CC/C=C/COCC(C)COCCC e88574ff5bdfc88753b3a5575d49566f [0,2,0,0,0,0|2,0,0]=4 4254 B13R0.338 CC/C=C\CC(=O)NCCCCCC c197ff76f41a350c12f7945cfe5b8779 [0,2,0,0,0,0|1,0,1]=4 4255 B13R0.338 CC/C=C\CCNC(C)CCCCC a0402c91bd538f60677efd5abcaf056c [0,2,0,0,0,0|1,0,0]=3 4256 B13R0.338 CC/C=C\CCN[C@@H](C)CCCCC 3a996b13205156ea678c7fdce6146af3 [0,2,0,0,0,0|1,0,0]=3 4257 B13R0.338 CC/C=C\CCOC(C)CCCCC d3c7cde3ee37939c42a3769e8b04d69a [0,2,0,0,0,0|1,0,0]=3 4258 B13R0.338 CC/C=C\CCOC(C)COCCC 935578fbe61bd23fcf8231659bb4772c [0,2,0,0,0,0|2,0,0]=4 4259 B13R0.338 CC/C=C\CCO[C@@H](C)CCCCC 496f7e9d29b684a4b9469a5244e703e5 [0,2,0,0,0,0|1,0,0]=3 4260 B13R0.338 CC/C=C\CCO[C@H](C)CCCCC be92706479168a156b716b8a6a98d7ef [0,2,0,0,0,0|1,0,0]=3 4261 B13R0.338 CC/C=C\COCC(=O)CCCCC 46dd05ae10da4916705268cdee357b3e [0,2,0,0,0,0|1,0,1]=4 4262 B13R0.338 CCC/C=C/CNC(C)CCCCC efd92365392e2d0d3d83c67bd7ecce3c [0,2,0,0,0,0|2,0,0]=4 4263 B13R0.338 CCC/C=C/CN[C@@H](C)CCCCC 66a928e9ac8aca0c6da196d6428c7c07 [0,2,0,0,0,0|2,0,0]=4 4264 B13R0.338 CCC/C=C/COC(C)CCCCC c0e2ca645d95ac12c9606d14e6d5fa1e [0,2,0,0,0,0|2,0,0]=4 4265 B13R0.338 CCC/C=C/CO[C@@H](C)CCCCC 4e3201f9ffab5174d3e76f2f8e5938f8 [0,2,0,0,0,0|2,0,0]=4 4266 B13R0.338 CCC/C=C/CO[C@H](C)CCCCC e208ca1abbb0800f00a3174ec6bf0100 [0,2,0,0,0,0|2,0,0]=4 4267 B13R0.338 CCC/C=C\CNC(C)CCCCC 6c5081dfd51922ecdeb96c07cec92a42 [0,2,0,0,0,0|2,0,0]=4 4268 B13R0.338 CCC/C=C\CN[C@@H](C)CCCCC ae9c54c2c40ccdfa2b55970eb617323d [0,2,0,0,0,0|2,0,0]=4 4269 B13R0.338 CCC/C=C\COC(C)CCCCC b944fed574a06ce1330d2fa827e96153 [0,2,0,0,0,0|2,0,0]=4 4270 B13R0.338 CCC/C=C\CO[C@@H](C)CCCCC f548da895485aec144eef2510f6d904f [0,2,0,0,0,0|2,0,0]=4 4271 B13R0.338 CCC/C=C\CO[C@H](C)CCCCC 51cd34dde466b49492b67c547f2275c3 [0,2,0,0,0,0|2,0,0]=4 4272 B13R0.338 CCC=CCC(=O)NCCCCCC 31a8ccabe5360fb7690923e47dd42cc6 [0,2,0,0,0,0|1,0,1]=4 4273 B13R0.338 CCCCCC(C)COCC=CC#N 5e05184f90c7e450107b1db0f1344581 [0,2,0,0,0,0|1,0,1]=4 4274 B13R0.338 CCCCCC(C)NCCCCCO be6da98c743e74b46db8b664284603f1 [0,2,0,0,0,0|0,0,2]=4 4275 B13R0.338 CCCCCC(C)NCCOCCO 1190aeddc95342767675fc6af8c1bb35 [0,2,0,0,0,0|1,0,1]=4 4276 B13R0.338 CCCCCC(C)NCCSCCO f8a437c67fa5c2764ea0472fbb7b8863 [0,2,0,0,0,0|1,0,1]=4 4277 B13R0.338 CCCCCCCC(C)COCOC 45c06883513a08e927a9f66f2d994ba5 [0,2,0,0,0,0|1,0,1]=4 4278 B13R0.338 CCCCCCCC(C)OCCOC 6541e548955a55c6f53ebc0cd8cac034 [0,2,0,0,0,0|1,0,1]=4 4279 B13R0.338 CCCCCCCN(C)CC#CCO 02355e738186d4125da59d0cc0f0199e [0,2,0,0,0,0|0,0,2]=4 4280 B13R0.338 CCCCCCCN(C)CC=CC#N 357dec9f274eacae2df92e74eec189f2 [0,2,0,0,0,0|1,0,1]=4 4281 B13R0.338 CCCCCCCN(C)CCCCO 126c40a4ec53ace1037ee8557e3edaea [0,2,0,0,0,0|0,0,2]=4 4282 B13R0.338 CCCCCCC[C@H](C)NC/C=C\O c6d046f8cb9fa9a531f5542de55e85d5 [0,2,0,0,0,0|0,0,2]=4 4283 B13R0.338 CCCCCCC[C@H](C)NCCCO 1409de635fcac5f43973545a410a5bd0 [0,2,0,0,0,0|0,0,2]=4 4284 B13R0.338 CCCCCCC[C@H](C)NCCOC a59f17b9cd6074b7be179fb93f9c6143 [0,2,0,0,0,0|1,0,1]=4 4285 B13R0.338 CCCCCCNC(=O)/C=C/COC cc397ee22fa71eb35e4773153a2ea7b4 [0,2,0,0,0,0|1,0,1]=4 4286 B13R0.338 CCCCCCNC(=O)C=CCOC 75528c97a0b6edc2d70baa8ee53b9090 [0,2,0,0,0,0|1,0,1]=4 4287 B13R0.338 CCCCCCNC(C)CCCCO 98cdd4c534b7ea9088a5883cc0c497b0 [0,2,0,0,0,0|0,0,2]=4 4288 B13R0.338 CCCCCN(C)CCCCCCO c9c95ae7f5468a93c5718f71b5cfe8c1 [0,2,0,0,0,0|0,0,2]=4 4289 B13R0.338 CCCCC[C@H](C)NCCCCCO 028a319407aa31259b7e8ffecccb5230 [0,2,0,0,0,0|0,0,2]=4 4290 B13R0.338 CCCCC[C@H](C)NCCOCCO 385efcb276ff2d3b96a64e99f1def15c [0,2,0,0,0,0|1,0,1]=4 4291 B13R0.338 CCCCC[C@H](C)NCCSCCO c3d3a69a196fb74557ef0afb52d410ec [0,2,0,0,0,0|1,0,1]=4 4292 B13R0.1 CC(C)CCCC(C)CCNCCO babd18b1313ee97542bcb53f00e7aae0 [0,2,0,0,0,0|1,0,1]=4 4293 B13R0.1 CC/C=C/CNC(C)CCCC(C)C b7f5c81d3d4c6dfdf0c8903a8886cf80 [0,2,0,0,0,0|2,0,0]=4 4294 B13R0.1 CC/C=C/COC(C)CCCC(C)C a97ff6a711ecd27b6660e3f03566ce09 [0,2,0,0,0,0|2,0,0]=4 4295 B13R0.1 CCCCCCN(C)C/C=C/C(=O)O e7e6d25f7217e85cbbf06731fc25b063 [0,2,0,0,0,0|1,0,1]=4 4296 B13R0.1 CCCCCCN(C)C/C=C/C(C)C 57cc3aa4740808d5fd30ddeb6020b323 [0,2,0,0,0,0|2,0,0]=4 4297 B13R0.1 CCCCCCN(C)CC=CC(=O)O 70853bcdd2e6854c89f78fb428eae782 [0,2,0,0,0,0|1,0,1]=4 4298 B13R0.188 CCCCCC(C)NC/C=C/C(=O)O 27a5799a7c5182c6cb1f71d3c8bc3de1 [0,2,0,0,0,0|1,0,1]=4 4299 B13R0.188 CCCCCC(C)NC/C=C/C(C)C fc6625f22df04f96979a3dea2e39aea4 [0,2,0,0,0,0|2,0,0]=4 4300 B13R0.188 CCCCCC(C)NCC=CC(=O)O c7d7c1e1ad774a6ff8b25847fc4179b1 [0,2,0,0,0,0|1,0,1]=4 4301 B13R0.188 CCCCCC(C)OC/C=C/C(=O)O 1862d0c97c240c7c9c8e67211c616070 [0,2,0,0,0,0|1,0,1]=4 4302 B13R0.188 CCCCCC(C)OC/C=C/C(C)C 6aa736d5f4504f132ed31ed00ae50abe [0,2,0,0,0,0|2,0,0]=4 4303 B13R0.188 CCCCCC(C)OCC=CC(=O)O 222eae13a3419ed70ef6fffd4509206f [0,2,0,0,0,0|1,0,1]=4 4304 B13R0.188 CCCCC[C@@H](C)OC/C=C/C(=O)O 25a8d9a7f120052c048505ad8692af2a [0,2,0,0,0,0|1,0,1]=4 4305 B13R0.188 CCCCC[C@@H](C)OC/C=C/C(C)C 34568ef508394d51254218a4f4657d3c [0,2,0,0,0,0|2,0,0]=4 4306 B13R0.188 CCCCC[C@@H](C)OCC=CC(=O)O 498a3269b1e37a71f83465df815c153e [0,2,0,0,0,0|1,0,1]=4 4307 B13R0.188 CCCCC[C@H](C)NC/C=C/C(=O)O 8f02ae160b21720bbb7aa40c4d6ffe6e [0,2,0,0,0,0|1,0,1]=4 4308 B13R0.188 CCCCC[C@H](C)NC/C=C/C(C)C 1cb1dc05e4334645c58e99bc7e13491b [0,2,0,0,0,0|2,0,0]=4 4309 B13R0.188 CCCCC[C@H](C)NCC=CC(=O)O dc06244db35aec73c6a007a08e99e761 [0,2,0,0,0,0|1,0,1]=4 4310 B13R0.188 CCCCC[C@H](C)OC/C=C/C(=O)O 16b90939ad1f288e3dcd2274f9fb97bf [0,2,0,0,0,0|1,0,1]=4 4311 B13R0.188 CCCCC[C@H](C)OC/C=C/C(C)C 22f1a4556a6e5be710cdb2347ba1d3c0 [0,2,0,0,0,0|2,0,0]=4 4312 B13R0.188 CCCCC[C@H](C)OCC=CC(=O)O 4e9d760eea3bb71671930852e1e382a9 [0,2,0,0,0,0|1,0,1]=4 4313 B13R0.195 CCCCCC(C)NC(=O)/C=C/CO 2bda44243c262948cf94e288d5742dde [0,2,0,0,0,0|1,0,1]=4 4314 B13R0.195 CCCCCC(C)NC(=O)C=CCO bd26b631b483bbd39040cc492134c926 [0,2,0,0,0,0|1,0,1]=4 4315 B13R0.195 CCCCC[C@H](C)NC(=O)/C=C/CO d5c9a9eeb4c88cc1d59f184a0c3e526b [0,2,0,0,0,0|1,0,1]=4 4316 B13R0.195 CCCCC[C@H](C)NC(=O)C=CCO 17e3ac133364a285b484da037e66aa1c [0,2,0,0,0,0|1,0,1]=4 4317 B13R0.278 C#CC(CCCCC)OC/C=C/CC b63327b85f82abea97a6ed6bef754c0a [0,2,0,0,0,0|2,0,0]=4 4318 B13R0.278 C#C[C@H](CCCCC)OC/C=C/CC 3151ea41091a02002fb5b642ea24bd53 [0,2,0,0,0,0|2,0,0]=4 4319 B13R0.278 C=CC(CCCCC)OC/C=C/CC 7b1ad962536ff6ec07eadc42587f9fe7 [0,2,0,0,0,0|2,0,0]=4 4320 B13R0.278 C=C[C@H](CCCCC)OC/C=C/CC 89c1a2585d114f67c0b689e54132e555 [0,2,0,0,0,0|2,0,0]=4 4321 B13R0.278 CC/C=C/COC(CC)CCCCC 694a672850903dd21424914eb1793090 [0,2,0,0,0,0|2,0,0]=4 4322 B13R0.278 CC/C=C/CO[C@@H](CC)CCCCC 4bacc686d992ca0b47188578136b94d2 [0,2,0,0,0,0|2,0,0]=4 4323 B13R0.1170 C=C(CO)CNC(C)CCCCCC de485b67c939dd2005ba1fde1409c11e [0,2,0,0,0,0|1,0,1]=4 4324 B13R0.1170 C=C(CO)CN[C@@H](C)CCCCCC 7c9d300dc4132a41dab1241ba31ae513 [0,2,0,0,0,0|1,0,1]=4 4325 B13R0.1170 C=C(CO)CN[C@H](C)CCCCCC 36a927de94273c85eb7e26d9f3302120 [0,2,0,0,0,0|1,0,1]=4 4326 B13R0.1170 CC/C=C/COC(C)CCC(C)CC 899f28113d929fdfdaf0b8ab5b302ffd [0,2,0,0,0,0|2,0,0]=4 4327 B13R0.1170 CCCCCCC(C)NCC(=O)CO b192be8f7838607ea80b4f114e4227eb [0,2,0,0,0,0|1,0,1]=4 4328 B13R0.1170 CCCCCC[C@@H](C)NCC(=O)CO 39b70728e3ae2207df8b29d86c550b19 [0,2,0,0,0,0|1,0,1]=4 4329 B13R0.1170 CCCCCC[C@H](C)NCC(=O)CO 4b097f0f4c6bdfdb9ace224148d536a3 [0,2,0,0,0,0|1,0,1]=4 4330 B13R0.1171 CCCCCCN(C)C(=O)/C=C/CO 845f7e7d95bf0e52cc62d3013c3ce3ee [0,2,0,0,0,0|1,0,1]=4 4331 B13R0.1171 CCCCCCN(C)C(=O)C=CCO 03ffa1f5adab1ca30b3b505820fd7af6 [0,2,0,0,0,0|1,0,1]=4 4332 B13R0.113 CCCCN(C)CCCNC(=O)CO 8296913e9e45847d57c0fa02c1de5f8a [0,2,0,0,0,0|2,0,0]=4 4333 B13R0.119 CCCCC(C)COC/C=C/C(=O)O a5b7543a1be07c37d40c2aa2fdcf4dd5 [0,2,0,0,0,0|1,0,1]=4 4334 B13R0.119 CCCCC(C)COC/C=C/C(C)C 6d56e5c77224b74aaf7bcfd34d3ea3fc [0,2,0,0,0,0|2,0,0]=4 4335 B13R0.119 CCCCC(C)COCC=CC(=O)O 731af08c89604226012057b12beef05b [0,2,0,0,0,0|1,0,1]=4 4336 B13R0.119 CCCCC(O)CNC/C=C/C(=O)O 55fcc6ca086842d8deaa339107d9cbff [0,2,0,0,0,0|1,0,1]=4 4337 B13R0.119 CCCCC(O)CNC/C=C/C(C)C a885da5708cc63832534252f790c6779 [0,2,0,0,0,0|2,0,0]=4 4338 B13R0.119 CCCCC(O)CNCC=CC(=O)O 70d50b904447f65c2e5ece89dec5004e [0,2,0,0,0,0|1,0,1]=4 4339 B13R0.154 CC/C=C/CCOC(C)CCC(C)C 7c9065f0f45a14b6640121142b3552ff [0,2,0,0,0,0|2,0,0]=4 4340 B13R0.154 CC/C=C/COCC(C)CCC(C)C 28b352bec68c1a67188e321df1516ff7 [0,2,0,0,0,0|2,0,0]=4 4341 B13R0.154 CC/C=C\CCNC(C)CCC(C)C 747f3a8f086d336e64228ca2b33faff8 [0,2,0,0,0,0|2,0,0]=4 4342 B13R0.154 CC/C=C\CCOC(C)CCC(C)C 248a7aec7235ec7edb143683a41bfaf6 [0,2,0,0,0,0|2,0,0]=4 4343 B13R0.154 CC/C=C\COCC(C)CCC(C)C 43449d6819fa002a99f4bbfe4c5d0876 [0,2,0,0,0,0|2,0,0]=4 4344 B13R0.154 CCCCCCC[C@H](C)NCC(C)O 00616b1dc9653066bcef139dcc0d6418 [0,2,0,0,0,0|1,0,1]=4 4345 B13R0.154 CCCCCCC[C@H](C)NC[C@@H](C)O bbfbef1ee9403742d79e7578fcb49e74 [0,2,0,0,0,0|1,0,1]=4 4346 B13R0.154 CCCCCCC[C@H](C)NC[C@H](C)O 01e536d648ccae417b04762758da853a [0,2,0,0,0,0|1,0,1]=4 4347 B13R0.176 CCCCC(O)CNC(=O)/C=C/CO 5a1b3cbc37c04f8fb5768fb54df8b9f3 [0,2,0,0,0,0|1,0,1]=4 4348 B13R0.176 CCCCC(O)CNC(=O)C=CCO 43c41bf08791d0b7200a98988098e5d4 [0,2,0,0,0,0|1,0,1]=4 4349 B13R0.272 C#CC(CCCC)OCC/C=C\CC 9ca336b539981ce5fa7c586e98781a25 [0,2,0,0,0,0|2,0,0]=4 4350 B13R0.272 C=CC(CCCC)OCC/C=C\CC b1ff7aff6247ed5f6844244c201c0043 [0,2,0,0,0,0|2,0,0]=4 4351 B13R0.272 CC/C=C/CCOC(CC)CCCC 57afa02ae6be7b8ff124746d3a43cfb8 [0,2,0,0,0,0|2,0,0]=4 4352 B13R0.272 CC/C=C/CNCC(CC)CCCC 861226a404ed8d9f8c4a4e0a70faabf7 [0,2,0,0,0,0|2,0,0]=4 4353 B13R0.272 CC/C=C/COCC(CC)CCCC c7b48d5285af59bf61e91996a5b7e875 [0,2,0,0,0,0|2,0,0]=4 4354 B13R0.272 CC/C=C/COC[C@H](CC)CCCC 9ed983a5b18b1dcf1c094f2b03f455ba [0,2,0,0,0,0|2,0,0]=4 4355 B13R0.272 CC/C=C\CCNC(CO)CCCC 3c0b82b8431cd59f93f0eb6a67d28e95 [0,2,0,0,0,0|2,0,0]=4 4356 B13R0.272 CC/C=C\CCN[C@@H](CO)CCCC 6eec2432c84591a3f406f778f96f5c93 [0,2,0,0,0,0|2,0,0]=4 4357 B13R0.272 CC/C=C\CCN[C@H](CO)CCCC 3e9eaa66ed1bf02c4bea0ca432c01867 [0,2,0,0,0,0|2,0,0]=4 4358 B13R0.272 CC/C=C\CCOC(CC)CCCC 83188b7450efaf240fdf2921acfc0073 [0,2,0,0,0,0|2,0,0]=4 4359 B13R0.272 CC/C=C\COCC(CC)CCCC 8c1806800fc7bc0dda04c9a391838d67 [0,2,0,0,0,0|2,0,0]=4 4360 B13R0.272 CC/C=C\COC[C@H](CC)CCCC 4fd99ee1f0673e33357240a59b56af26 [0,2,0,0,0,0|2,0,0]=4 4361 B13R0.274 C=C(CO)CN(C)CCCCCCC ea141adfe0981957c33c2077b1914089 [0,2,0,0,0,0|1,0,1]=4 4362 B13R0.274 CC/C=C\CCNC(C)CC(C)CC 899213e42e58f4b9395095b1e55c544b [0,2,0,0,0,0|2,0,0]=4 4363 B13R0.274 CCCCCCCN(C)CC(=O)CO d90ca473b76d176c312c1844550be300 [0,2,0,0,0,0|1,0,1]=4 4364 B13R0.274 CCCCCCC[C@H](C)NC(=O)CC 6dc234563280eced45be680a7bfa8678 [0,2,0,0,0,0|2,0,0]=4 4365 B13R0.274 CCCCCCC[C@H](C)NC(=O)CF 34d16bcc57124d05421d05a40b7c90c8 [0,2,0,0,0,0|2,0,0]=4 4366 B13R0.274 CCCCCCC[C@H](C)NC(=O)CO 7d6dd016a7543752d40c6bef3c1d6ce7 [0,2,0,0,0,0|1,0,0]=3 4367 B13R0.274 CCCCCCC[C@H](C)NC(=O)CS afc8559829ee5fcf6e06342314766d92 [0,2,0,0,0,0|1,1,0]=4 4368 B13R0.274 CCCCCCC[C@H](C)NC(C)CO ca76fc2a9b45277729631ba1422ad171 [0,2,0,0,0,0|1,0,1]=4 4369 B13R0.274 CCCCCCC[C@H](C)N[C@@H](C)CO 0df6637377365e3caf7f5eda1b499af9 [0,2,0,0,0,0|1,0,1]=4 4370 B13R0.274 CCCCCCC[C@H](C)N[C@H](C)CO d9bd6fa1f939218433a3eb6d5c5c711f [0,2,0,0,0,0|1,0,1]=4 4371 B13R0.150 CC(O)C(=O)NCCCCCCCO 0a63cd2e6a618c21b25385a113d15e7e [0,2,0,0,0,0|2,0,0]=4 4372 B13R0.150 CC/C=C\CCCCCN(C)C(C)C 6df5bce73503d9713915dec968dc374d [0,2,0,0,0,0|2,0,0]=4 4373 B13R0.150 CC/C=C\CCCCOC(C)C(C)C 2c394c4dd00e6f3f16c78c6ae8ddbef3 [0,2,0,0,0,0|2,0,0]=4 4374 B13R0.150 CC/C=C\CCCOCC(C)C(C)C ba6305cbb37a3860ff37f09bb6cade4b [0,2,0,0,0,0|2,0,0]=4 4375 B13R0.150 CC/C=C\CCOCCC(C)C(C)C 465d7dcad12fcb2b60c0afe0043f3480 [0,2,0,0,0,0|2,0,0]=4 4376 B13R0.150 CCCCCCCCNC(=O)C(C)F 07713a6c7977a543a6db7169019fca47 [0,2,0,0,0,0|2,0,0]=4 4377 B13R0.150 CCCCCCCCNC(=O)C(C)O f185ca071ff17d7f856ab232d8c5b59e [0,2,0,0,0,0|1,0,0]=3 4378 B13R0.150 CCCCCCCCNC(=O)C(C)S f44db3dff6aa35bdda12834f9f240325 [0,2,0,0,0,0|1,1,0]=4 4379 B13R0.150 CCCCCCCCNC(=O)C(F)F e59ceca883b0ab78a419ae959d357e19 [0,2,0,0,0,0|2,0,0]=4 4380 B13R0.150 CCCCCCCCNC(=O)C(O)O 58e54bf3a84435b63072b6ff45a30dad [0,2,0,0,0,0|1,0,0]=3 4381 B13R0.150 CCCCCCCCNC(=O)[C@@H](C)F cbf9adc913ddc642eb41ccd9d11877e4 [0,2,0,0,0,0|2,0,0]=4 4382 B13R0.150 CCCCCCCCNC(=O)[C@@H](C)O 0ad26fd6a6b567d0bc6fda38f7af2a80 [0,2,0,0,0,0|1,0,0]=3 4383 B13R0.150 CCCCCCCCNC(=O)[C@H](C)F 6f5314c007db2d3e0c5dcdaff5b4f56f [0,2,0,0,0,0|2,0,0]=4 4384 B13R0.150 CCCCCCCCNC(=O)[C@H](C)O cfe57bc7060da09c84e60ea2a5d79103 [0,2,0,0,0,0|1,0,0]=3 4385 B13R0.150 CCCCCCCCNC(C)C(C)O b62cd6976b8bc788bf42842f898deb68 [0,2,0,0,0,0|1,0,1]=4 4386 B13R0.150 CCCCOCCCNC(=O)C(C)O 05a3e621c8cf6118d6bea03fdae68a46 [0,2,0,0,0,0|2,0,0]=4 4387 B13R0.150 CCCCOCCCNC(=O)C(O)O ea409b738c0e5c75a17b25ba0bedbb6c [0,2,0,0,0,0|2,0,0]=4 4388 B13R0.150 CCCCOCCCNC(=O)[C@@H](C)O 9180bd3f09a6d6daedea754fbe6fa466 [0,2,0,0,0,0|2,0,0]=4 4389 B13R0.150 CCCCOCCCNC(=O)[C@H](C)O 44084305da0666dd316f94c404839c08 [0,2,0,0,0,0|2,0,0]=4 4390 B13R0.150 CCCSCCCCNC(=O)C(C)O e3234c07772f3a7e389fedde318b6e86 [0,2,0,0,0,0|2,0,0]=4 4391 B13R0.150 CCCSCCCCNC(=O)C(O)O 6ad764a7f44ad35187654885726debfd [0,2,0,0,0,0|2,0,0]=4 4392 B13R0.150 CCCSCCCCNC(=O)[C@@H](C)O 785a209803713b5e04e071f246a8b873 [0,2,0,0,0,0|2,0,0]=4 4393 B13R0.150 CCCSCCCCNC(=O)[C@H](C)O 4df59a116dee4fbdcfa827dd01ffa91b [0,2,0,0,0,0|2,0,0]=4 4394 B13R0.150 C[C@@H](O)C(=O)NCCCCCCCO 0ac15fad8b7f7c5793b4d0f31167519d [0,2,0,0,0,0|2,0,0]=4 4395 B13R0.150 C[C@H](O)C(=O)NCCCCCCCO 6eb3af4c83d74ac3345456e43244b979 [0,2,0,0,0,0|2,0,0]=4 4396 B13R0.150 O=C(NCCCCCCCO)C(O)O 5b77b7bb6c94d2bb881f3d9ebef9a2ee [0,2,0,0,0,0|2,0,0]=4 4397 B13R0.179 CC(C)/C=C/COCCCCC(C)C 84ddcf38a11d2d656bef6f6882ac1d3b [0,2,0,0,0,0|2,0,0]=4 4398 B13R0.179 CC(C)CCCCCCNCC(C)O 0b27d32dc82c303c963d0ec5c88faa4d [0,2,0,0,0,0|1,0,1]=4 4399 B13R0.179 CC(C)CCCCCCNC[C@@H](C)O 61f1d99a3fa169ff9afd061ef0dba9ab [0,2,0,0,0,0|1,0,1]=4 4400 B13R0.179 CC(C)CCCCCCNC[C@H](C)O 03daafd1e926349a505e84b477d7bb6f [0,2,0,0,0,0|1,0,1]=4 4401 B13R0.179 CC(C)CCCCNC/C=C/C(=O)O 7196261228ef4ea394aa1d421f738b7a [0,2,0,0,0,0|1,0,1]=4 4402 B13R0.179 CC(C)CCCCNCC=CC(=O)O 9cfcde4a0fd57de15132ce1d80d1c41c [0,2,0,0,0,0|1,0,1]=4 4403 B13R0.179 CC(C)CCCCOC/C=C/C(=O)O 098cb3091046c9149ba6bf5ed3ab526a [0,2,0,0,0,0|1,0,1]=4 4404 B13R0.179 CC(C)CCCCOCC=CC(=O)O 689a017c25291efdd857d26c9476ad89 [0,2,0,0,0,0|1,0,1]=4 4405 B13R0.179 CC(O)CCCCNC/C=C/C(=O)O b4258577c7fa32d3e2f961c6767e18b7 [0,2,0,0,0,0|1,0,1]=4 4406 B13R0.179 CC(O)CCCCNCC=CC(=O)O 857f06a172cfc6af2c5ae55a0f81ac55 [0,2,0,0,0,0|1,0,1]=4 4407 B13R0.179 C[C@@H](O)CCCCNC/C=C/C(=O)O c453062ef0f6d8847e1fb40c71d09c4c [0,2,0,0,0,0|1,0,1]=4 4408 B13R0.179 C[C@@H](O)CCCCNCC=CC(=O)O 2cc671a0eca192c959410ea0af9b4e06 [0,2,0,0,0,0|1,0,1]=4 4409 B13R0.202 C=C(CO)CNCCCCCC(C)C 9bfaaee8a07fb776c79853e00294c5e4 [0,2,0,0,0,0|1,0,1]=4 4410 B13R0.202 CC(C)CCCCCCNC(=O)CF 61b8e7141f45c2baa7307632fd39f03a [0,2,0,0,0,0|2,0,0]=4 4411 B13R0.202 CC(C)CCCCCCNC(=O)CO 4e8dec70d0d70f70b35b6b91cd451d22 [0,2,0,0,0,0|1,0,0]=3 4412 B13R0.202 CC(C)CCCCCCNC(=O)CS 18a9feb89416c058bf08834acd8f1900 [0,2,0,0,0,0|1,1,0]=4 4413 B13R0.202 CC(C)CCCCCCNC(C)CO 93731db6c5d9e164007ea8116bad1d71 [0,2,0,0,0,0|1,0,1]=4 4414 B13R0.202 CC(C)CCCCCCN[C@@H](C)CO 0ac4d09e782dd83001a74fbc3a37beb6 [0,2,0,0,0,0|1,0,1]=4 4415 B13R0.202 CC(C)CCCCCCN[C@H](C)CO bf2c60c95a3aa9d6ec66e02596fb2806 [0,2,0,0,0,0|1,0,1]=4 4416 B13R0.202 CC(C)CCCCCNCC(=O)CO 387e4224dd6810825baa395ef565d27a [0,2,0,0,0,0|1,0,1]=4 4417 B13R0.202 CC(C)CSCCCCNC(=O)CO 2c1e54a0363770d71298fe94f7d7a637 [0,2,0,0,0,0|2,0,0]=4 4418 B13R0.202 CCC(=O)NCCCCCCC(C)C eb2cf4b8f942fa40545e00d0f9280378 [0,2,0,0,0,0|2,0,0]=4 4419 B13R0.202 CCC(C)CCCOC/C=C/C(=O)O 7523b69918ad52db87509abb65ca585e [0,2,0,0,0,0|1,0,1]=4 4420 B13R0.202 CCC(C)CCCOC/C=C/C(C)C 716054edae29a7705dd29684cfc03b09 [0,2,0,0,0,0|2,0,0]=4 4421 B13R0.202 CCC(C)CCCOCC=CC(=O)O d04a592826ff474a6e164ff1b13cf357 [0,2,0,0,0,0|1,0,1]=4 4422 B13R0.202 CC[C@H](C)CCCOC/C=C/C(=O)O 9a12e70dbd5455fb43e979f9d0a82444 [0,2,0,0,0,0|1,0,1]=4 4423 B13R0.202 CC[C@H](C)CCCOC/C=C/C(C)C 9bf06b0ef1dff3cb670fce94580aab02 [0,2,0,0,0,0|2,0,0]=4 4424 B13R0.202 CC[C@H](C)CCCOCC=CC(=O)O 492dade2fbe01089d5009424a1f444a9 [0,2,0,0,0,0|1,0,1]=4 4425 B13R0.202 CN(C)CCCCCCNC(=O)CO 17509a5b1b81829a45b068bdcfdf8a15 [0,2,0,0,0,0|2,0,0]=4 4426 B13R0.280 CC/C=C/CCOCCCC(C)(C)O 8deede8a5a96575d557ef0c3a5fd61d9 [0,2,0,0,0,0|2,0,0]=4 4427 B13R0.280 CC/C=C/CCOCCCC(C)(F)F f03a642246f079907936d2b4ae9d2d65 [0,2,0,0,0,0|2,0,0]=4 4428 B13R0.280 CC/C=C/COCCCCC(C)(C)C 881fcf1351047bd305d3df381edc4c5c [0,2,0,0,0,0|2,0,0]=4 4429 B13R0.280 CC/C=C\CCCCCNC(C)(C)C 26b003f7315dd5f705483ff222c35196 [0,2,0,0,0,0|2,0,0]=4 4430 B13R0.280 CC/C=C\CCCCOCC(C)(C)C 35eea011d63765848c9dd20ddd0f0a74 [0,2,0,0,0,0|2,0,0]=4 4431 B13R0.280 CC/C=C\CCCCOCC(C)(C)F d207656fcf0e488ef5f54c936f6fe7a9 [0,2,0,0,0,0|2,0,0]=4 4432 B13R0.280 CC/C=C\CCCCOCC(C)(C)O f516936001f33947f82bd651ccb75edb [0,2,0,0,0,0|2,0,0]=4 4433 B13R0.280 CC/C=C\CCCCOCC(C)(F)F 11de41b5cc782308c9d9525523e3c6f7 [0,2,0,0,0,0|2,0,0]=4 4434 B13R0.280 CC/C=C\CCCOCCC(C)(C)C be339edca381c1a8adcceac8968ac270 [0,2,0,0,0,0|2,0,0]=4 4435 B13R0.280 CC/C=C\CCCOCCC(C)(C)O fbac977f99717acf95088b23a4394dbc [0,2,0,0,0,0|2,0,0]=4 4436 B13R0.280 CC/C=C\CCCOCCC(C)(F)F 426d0411907f8ada7fd50e26e2b37f3f [0,2,0,0,0,0|2,0,0]=4 4437 B13R0.280 CC/C=C\CCNCCCC(C)(C)C 06e0aac3bba2d8ff8da15774a69aec6d [0,2,0,0,0,0|2,0,0]=4 4438 B13R0.280 CC/C=C\CCNCCCC(C)(C)O 60ff9592e856a0d8033e872687c6627d [0,2,0,0,0,0|2,0,0]=4 4439 B13R0.280 CC/C=C\CCOCCCC(C)(C)C 2fb4da1e878f46db4d4fe06d33ad1417 [0,2,0,0,0,0|2,0,0]=4 4440 B13R0.280 CC/C=C\CCOCCCC(C)(C)O 88967780fd79081a6ab42871f76667ea [0,2,0,0,0,0|2,0,0]=4 4441 B13R0.280 CC/C=C\CCOCCCC(C)(F)F 5e95cff5b18ee256e523f20e607ad542 [0,2,0,0,0,0|2,0,0]=4 4442 B13R0.280 CCCCCCCCNCC(C)(C)O b823aedfe3a06bcead5007a02eefc446 [0,2,0,0,0,0|1,0,1]=4 4443 B13R0.280 CCCCCCCCOCC(C)(C)O 05f812bc8feaf8cd3631590e581a5767 [0,2,0,0,0,0|1,0,1]=4 4444 B13R0.280 CCCCCCOC/C=C/C(F)(F)F e4bcb26a0edc8cb4dd412df916bbed3a [0,2,0,0,0,0|2,0,0]=4 4445 B13R0.280 CCCCCCOC/C=C\C(F)(F)F 2c4fe9798692a39f11de6f6cbe20c9a5 [0,2,0,0,0,0|2,0,0]=4 4446 B13R0.280 CCCCCCOCC=CC(F)(F)F 518e0d9764fd1841ec23bbdd3bf6928b [0,2,0,0,0,0|2,0,0]=4 4447 B13R0.412 C=C[C@@H](CO)NCCCCCCCC 4c254d1a71a8cf7805ffd43f0146893a [0,2,0,0,0,0|1,0,1]=4 4448 B13R0.412 CC/C=C\CCCCOC(C=O)CC 3e271f12a4d1859ecc7a8526ea2df25d [0,2,0,0,0,0|2,0,0]=4 4449 B13R0.412 CC/C=C\CCCCOC(CC)CC 7276e1e4ab4769d3a452e13daddaeb44 [0,2,0,0,0,0|2,0,0]=4 4450 B13R0.412 CC/C=C\CCCOCC(CC)CC 32c9209f1c355e34c16d949f43377d4d [0,2,0,0,0,0|2,0,0]=4 4451 B13R0.412 CC/C=C\CCNCCC(CC)CC 16909ab6a5b3d0d765cf7da6cfef7220 [0,2,0,0,0,0|2,0,0]=4 4452 B13R0.412 CCCCCCCCNC(CC)CO 08780e0e860095efd07ff558ae9a68cf [0,2,0,0,0,0|1,0,1]=4 4453 B13R0.412 CCCCCCCCNC(CO)CO 5fd63855bf35cbdec1f9fffab0470581 [0,2,0,0,0,0|1,0,1]=4 4454 B13R0.412 CCCCCCCCN[C@@H](CC)CO bf0d2e700b57a6954458114063ca9949 [0,2,0,0,0,0|1,0,1]=4 4455 B13R0.412 CCCCCCCCN[C@H](CC)CO c60aad1734a391f9b4ecd97159d39821 [0,2,0,0,0,0|1,0,1]=4 4456 B13R0.412 CCCCCCCCOC(CO)CO e16e550f9be00a7ae092d383c4b180da [0,2,0,0,0,0|1,0,1]=4 4457 B13R0.412 CCCCCCOCC=C(CCl)CCl 7dc9a7a80f481d6bdbb54e650a9b5891 [0,2,0,0,0,0|2,0,0]=4 4458 B13R0.1215 CC/C=C/CCOCCC(C)(C)CC c11d3f26f1b591ecd8cc7382290db7d7 [0,2,0,0,0,0|2,0,0]=4 4459 B13R0.1215 CC/C=C\CCOCCC(C)(C)CC 4940189e8c63fb1f7954a95bb4d7a224 [0,2,0,0,0,0|2,0,0]=4 4460 B13R0.1215 CCCCCCCCNC(C)(C)CO ef76c2def9f9407a31b3b60b15a3e378 [0,2,0,0,0,0|1,0,1]=4 4461 B11R1.4 C/C=C/CCOC1CCCC1 0a6def5a8b60a42429a2046fa33bb9c0 [1,0,0,1,0,0|1,0,0]=3 4462 B11R1.4 C/C=C/CCOC1CCOC1 4543d60031d8f3acaf52279fd5a873fc [1,0,0,1,0,0|2,0,0]=4 4463 B11R1.4 C/C=C/CCO[C@@H]1CCOC1 4b363c9f7aa24c34ccd6c625869f87ba [1,0,0,1,0,0|2,0,0]=4 4464 B11R1.4 C/C=C/CCO[C@H]1CCOC1 5e1d82104b93c50492df86d75367bfa3 [1,0,0,1,0,0|2,0,0]=4 4465 B11R1.4 C/C=C/CNCC1CCCC1 0f0fa652065ab8d097b597b4506f85bf [1,0,0,1,0,0|1,0,0]=3 4466 B11R1.4 C/C=C/CNCC1CCCO1 222a6fc94a9973804a3ada1b4b93d4bb [1,0,0,1,0,0|2,0,0]=4 4467 B11R1.4 C/C=C/CNCC1CCOC1 4ef9a49cc9cf3d36fdf1bf5e0f4a14d5 [1,0,0,1,0,0|2,0,0]=4 4468 B11R1.4 C/C=C/CNC[C@@H]1CCCO1 289edb849788cb6743e17644bc8f7e9c [1,0,0,1,0,0|2,0,0]=4 4469 B11R1.4 C/C=C/CNC[C@@H]1CCOC1 626cbb94a88e423d6771a7dcc7e1a248 [1,0,0,1,0,0|2,0,0]=4 4470 B11R1.4 C/C=C/CNC[C@H]1CCCO1 609e919167fb26df9b3d0b71adf3ac1c [1,0,0,1,0,0|2,0,0]=4 4471 B11R1.4 C/C=C/CNC[C@H]1CCOC1 f71b8140a916d7bc3412baf46205bf01 [1,0,0,1,0,0|2,0,0]=4 4472 B11R1.4 C/C=C/COCC1CCCC1 a109e759f4dc3df0028b516281227c4b [1,0,0,1,0,0|1,0,0]=3 4473 B11R1.4 C/C=C/COCC1CCCO1 6a0d5331bd1a0f9b0bf753e5fb13b702 [1,0,0,1,0,0|2,0,0]=4 4474 B11R1.4 C/C=C/COCC1CCCS1 6cf06f833317a921f821b35f2bdb9744 [1,0,0,1,0,0|2,0,0]=4 4475 B11R1.4 C/C=C/COCC1CCOC1 907f9302849f6aa6bc57b8b159f75cb2 [1,0,0,1,0,0|2,0,0]=4 4476 B11R1.4 C/C=C/COCN1CCCC1 27ee1ea67f44d4f8a55a83464b5f2502 [1,0,0,1,0,0|2,0,0]=4 4477 B11R1.4 C/C=C/COC[C@@H]1CCCO1 1777ddcf43fce2627f7f3c7797620c9e [1,0,0,1,0,0|2,0,0]=4 4478 B11R1.4 C/C=C/COC[C@@H]1CCOC1 21077d6870dd360311845fc93460c657 [1,0,0,1,0,0|2,0,0]=4 4479 B11R1.4 C/C=C/COC[C@H]1CCCO1 c625a6602d9e2243dd1d747509d897bc [1,0,0,1,0,0|2,0,0]=4 4480 B11R1.4 C/C=C/COC[C@H]1CCOC1 31c47aea476ece8441d01a6afebbcb95 [1,0,0,1,0,0|2,0,0]=4 4481 B11R1.4 C/C=C\CCCN1CCSC1 f2de9953ccc17bd45e593eaa38ed3750 [1,0,0,1,0,0|2,0,0]=4 4482 B11R1.4 C/C=C\CNCC1CCCC1 310525fd94ad5f608d7cf661e17b82c9 [1,0,0,1,0,0|1,0,0]=3 4483 B11R1.4 C/C=C\CNCC1CCCO1 be618fa33e62aa7c5eab6f53f0d3278d [1,0,0,1,0,0|2,0,0]=4 4484 B11R1.4 C/C=C\CNCC1CCOC1 0f9f1cf203b088dab108acce73a56fd7 [1,0,0,1,0,0|2,0,0]=4 4485 B11R1.4 C/C=C\CNC[C@@H]1CCCO1 1f08db53f44b3b011a456bc3660fa5b7 [1,0,0,1,0,0|2,0,0]=4 4486 B11R1.4 C/C=C\CNC[C@@H]1CCOC1 d24512323e58804c3fe9a6fe22da7dd2 [1,0,0,1,0,0|2,0,0]=4 4487 B11R1.4 C/C=C\CNC[C@H]1CCCO1 2705e42569b3a168af63ee1c8d67105a [1,0,0,1,0,0|2,0,0]=4 4488 B11R1.4 C/C=C\CNC[C@H]1CCOC1 52f7d0588ba71ad8cca19d4bf5744541 [1,0,0,1,0,0|2,0,0]=4 4489 B11R1.4 C/C=C\COCC1CCCC1 b0c52cd416b1ccb88aeee041a9b13644 [1,0,0,1,0,0|1,0,0]=3 4490 B11R1.4 C/C=C\COCC1CCCO1 4bdffdae38377839b9babf38b80c4672 [1,0,0,1,0,0|2,0,0]=4 4491 B11R1.4 C/C=C\COCC1CCCS1 210c27e692d0b90316ea44f5db8af0eb [1,0,0,1,0,0|2,0,0]=4 4492 B11R1.4 C/C=C\COCC1CCOC1 5ebaa2616547062a905525800de2c9f9 [1,0,0,1,0,0|2,0,0]=4 4493 B11R1.4 C/C=C\COCN1CCCC1 7562eb192cd34f68e0d92dfeedae4110 [1,0,0,1,0,0|2,0,0]=4 4494 B11R1.4 C/C=C\COC[C@@H]1CCCO1 3b66c75ac0a7237e19b1d696907cb9c4 [1,0,0,1,0,0|2,0,0]=4 4495 B11R1.4 C/C=C\COC[C@@H]1CCOC1 3adaba5840c1a5d983fa6f445202db49 [1,0,0,1,0,0|2,0,0]=4 4496 B11R1.4 C/C=C\COC[C@H]1CCCO1 2ebc75f448e76e562e6a859ffd7b46cb [1,0,0,1,0,0|2,0,0]=4 4497 B11R1.4 C/C=C\COC[C@H]1CCOC1 7e95447e01fc7bc641a57d28494f0944 [1,0,0,1,0,0|2,0,0]=4 4498 B11R1.4 CC/C=C/CNC1CCCC1 59de48df724d02ca8afb579334e260e1 [1,0,0,1,0,0|2,0,0]=4 4499 B11R1.4 CC/C=C/COC1CCCC1 22f1a97617cf69c83dda239e5f114c0f [1,0,0,1,0,0|2,0,0]=4 4500 B11R1.4 CC/C=C\COC1CCCC1 091a743790bd53272236b12a8a7729cc [1,0,0,1,0,0|2,0,0]=4 4501 B11R1.4 CC=CCNCC1CCCC1 a1414e043d50a40814122887243e701d [1,0,0,1,0,0|1,0,0]=3 4502 B11R1.4 CC=CCNCC1CCCO1 a37df501a64cfc27f30b5b11b8c7085b [1,0,0,1,0,0|2,0,0]=4 4503 B11R1.4 CC=CCNCC1CCOC1 5604794ecea305811db21da9b2f6f059 [1,0,0,1,0,0|2,0,0]=4 4504 B11R1.4 CC=CCOCC1CCCC1 8d2de38ac431ab6769c703e25b42b621 [1,0,0,1,0,0|1,0,0]=3 4505 B11R1.4 CC=CCOCC1CCCO1 a8e4c778047dd0bae7dc052c50405b67 [1,0,0,1,0,0|2,0,0]=4 4506 B11R1.4 CC=CCOCC1CCOC1 1e51287aa59c34bc144250e67b3a5cb5 [1,0,0,1,0,0|2,0,0]=4 4507 B11R1.4 CCCCCCN1CC=CC1 4abbe8d658e90e6dbfe87f122641718f [1,0,0,1,0,0|1,0,0]=3 4508 B11R1.4 CCCCCNC1CC=CC1 35207c1c42f8a1dfb820291a117aad86 [1,0,0,1,0,0|1,0,0]=3 4509 B11R1.4 CCCCCOC1C=CCC1 78fd44d64a16456a5b7d49fce9337d5f [1,0,0,1,0,0|2,0,0]=4 4510 B11R1.4 CCCCCOC1CC=CC1 8431f303e1e8c1d1fffeb44a4ea74bd7 [1,0,0,1,0,0|1,0,0]=3 4511 B11R1.4 CCCCCOC1CCCO1 4fcbb7f6db51b6632373c914ef3e210b [1,0,0,1,0,0|1,0,1]=4 4512 B11R1.4 CCCCNCC1CC=CC1 fd8eb4604a0e8decac1179050c711f9d [1,0,0,1,0,0|1,0,0]=3 4513 B11R1.4 CCCCNCC1CCCO1 5d381b028ebc3f6431ec0eb23ad96dad [1,0,0,1,0,0|1,0,1]=4 4514 B11R1.4 CCCCNC[C@@H]1CCCO1 40dda0a054e0f6d4dfaa5e4acfc3764d [1,0,0,1,0,0|1,0,1]=4 4515 B11R1.4 CCCCNC[C@H]1CCCO1 853017986931ae50dc82e6512a1e6233 [1,0,0,1,0,0|1,0,1]=4 4516 B11R1.4 CCCCOCC1C=CCC1 c7fe9f926bfc5b0fa72df802a4f5efc0 [1,0,0,1,0,0|2,0,0]=4 4517 B11R1.4 CCCCOCC1CC=CC1 c42d35b69f62d10ebeefba12ad7edecd [1,0,0,1,0,0|1,0,0]=3 4518 B11R1.4 CCCCOCC1CCCO1 0862079b3487ea18c32c1e28ed491ec7 [1,0,0,1,0,0|1,0,1]=4 4519 B11R1.4 CCCCOCN1CC=CC1 957208bd43a52eb2c84a816d31dd671b [1,0,0,1,0,0|2,0,0]=4 4520 B11R1.4 CCCCOC[C@@H]1CCCO1 db05d7cd3184532e54140a366489df45 [1,0,0,1,0,0|1,0,1]=4 4521 B11R1.4 CCCCOC[C@H]1CCCO1 e5dcfa56095b26c5f6b49e16a96ea7d8 [1,0,0,1,0,0|1,0,1]=4 4522 B11R1.4 CCCNCCC1CCCO1 16ccc3766cb64abb779cf31870fdd1b1 [1,0,0,1,0,0|1,0,1]=4 4523 B11R1.4 CCCOCCC1CCCO1 0bafcd2daa31466cb920a9ddb84cb9da [1,0,0,1,0,0|1,0,1]=4 4524 B11R1.4 CCCOCCN1CC=CC1 35f9a7a185e7c65f6e3a1840d80c3209 [1,0,0,1,0,0|2,0,0]=4 4525 B11R1.4 CCNCCCC1CCCC1 bb38b69d7bc0534c0a37772ecaaa96d9 [1,0,0,1,0,0|1,0,1]=4 4526 B11R1.4 CCOCCCC1CCCC1 4c414e6d28e260b66dbefeb7947ff46e [1,0,0,1,0,0|1,0,1]=4 4527 B11R1.4 CCOCCCN1CC=CC1 43d0335dacf599952d9913683e28dd4f [1,0,0,1,0,0|2,0,0]=4 4528 B11R1.4 CCOCCNC1CC=CC1 94402392587285cbba3a13d9648f52e8 [1,0,0,1,0,0|2,0,0]=4 4529 B11R1.4 CCOCCOC1CC=CC1 cc93ad52f61d05c718cb1b87d276864a [1,0,0,1,0,0|2,0,0]=4 4530 B11R1.4 CCOCNCC1CC=CC1 01e5031f687daf9bb931dd4fb3fe457f [1,0,0,1,0,0|2,0,0]=4 4531 B11R1.4 CCOCOCC1CC=CC1 5a5d490fb0e025a806bda93c5fee1d3a [1,0,0,1,0,0|2,0,0]=4 4532 B11R1.4 CCSCCCN1CC=CC1 0bc37c9ff015550f025d517498bf2426 [1,0,0,1,0,0|2,0,0]=4 4533 B11R1.4 CCSCCNC1CC=CC1 b7c67d17e43e43bf862c320651c184c7 [1,0,0,1,0,0|2,0,0]=4 4534 B11R1.4 CCSCCOC1CC=CC1 dfc6fa3716b7cf4c0c1ca591d67c0d86 [1,0,0,1,0,0|2,0,0]=4 4535 B11R1.4 COCCCCN1CC=CC1 0dd57d981ed9b502ac3301c4527289a6 [1,0,0,1,0,0|2,0,0]=4 4536 B11R1.4 COCCCNC1CC=CC1 64d0f72210f5b934eeb5538d102b5c52 [1,0,0,1,0,0|2,0,0]=4 4537 B11R1.4 COCCCOC1CC=CC1 cdba3b9489a29744f5218e8382276785 [1,0,0,1,0,0|2,0,0]=4 4538 B11R1.4 COCCNCC1CC=CC1 79f161298bbef3402a07ca998788f75d [1,0,0,1,0,0|2,0,0]=4 4539 B11R1.4 COCCOCC1CC=CC1 e331f1caaf1fbf4666d962f8e5b9f900 [1,0,0,1,0,0|2,0,0]=4 4540 B11R1.4 CSCCCNC1CC=CC1 48fa96d3f28eef786772e702cda40417 [1,0,0,1,0,0|2,0,0]=4 4541 B11R1.4 CSCCCOC1CC=CC1 8be66a7f39b16a061b0202c31dff06b7 [1,0,0,1,0,0|2,0,0]=4 4542 B11R1.4 CSCCNCC1CC=CC1 2342fd863fbc123af0f3d3a718a5a219 [1,0,0,1,0,0|2,0,0]=4 4543 B11R1.4 CSCCOCC1CC=CC1 3fdb6b1725105dc88b3c2bc070d64c09 [1,0,0,1,0,0|2,0,0]=4 4544 B11R1.4 Cl/C=C/CNCC1CCCC1 b51cabe8cdeb90994153dbbe861d2cbb [1,0,0,1,0,0|2,0,0]=4 4545 B11R1.4 Cl/C=C/COCC1CCCC1 fc42cf827ad5a46802d5bdba84bd56fc [1,0,0,1,0,0|2,0,0]=4 4546 B11R1.4 Cl/C=C\CNCC1CCCC1 6273485a3a172446814d5534ee5dfb09 [1,0,0,1,0,0|2,0,0]=4 4547 B11R1.4 Cl/C=C\COCC1CCCC1 4fdd8a1bbd6fcf9093879917bc6ed45a [1,0,0,1,0,0|2,0,0]=4 4548 B11R1.4 ClC=CCOCC1CCCC1 b8e6093975fff1e5f827cf89450dfb6e [1,0,0,1,0,0|2,0,0]=4 4549 B11R1.4 ClCCCNCC1CC=CC1 807ba878f039142929e582354dfb711d [1,0,0,1,0,0|2,0,0]=4 4550 B11R1.4 FCCCCCN1CC=CC1 6ed5bbb0743d60b4143a85be4fe8079a [1,0,0,1,0,0|2,0,0]=4 4551 B11R1.4 FCCCCNC1CC=CC1 d7c69ed7d64ef651c466cc17bda61b61 [1,0,0,1,0,0|2,0,0]=4 4552 B11R1.4 FCCCCOC1CC=CC1 ce3a87fed2db51596fb51dd75d393dca [1,0,0,1,0,0|2,0,0]=4 4553 B11R1.4 FCCCNCC1CC=CC1 da5d8b682e03e1b846881e6492772850 [1,0,0,1,0,0|2,0,0]=4 4554 B11R1.4 FCCCOCC1CC=CC1 c5aef091e6afb9dc42257db385699a4a [1,0,0,1,0,0|2,0,0]=4 4555 B11R1.4 FCNCCCC1CCCC1 2fcb402bd4e77d8499306e6017d78b30 [1,0,0,1,0,0|2,0,0]=4 4556 B11R1.4 FCOCCCC1CCCC1 bcfbca514c5feb4a60a5612863f82310 [1,0,0,1,0,0|2,0,0]=4 4557 B11R1.4 O/C=C\CNCC1CCCC1 a311655b862880d4f0b4fbb1aaf16f43 [1,0,0,1,0,0|1,0,0]=3 4558 B11R1.4 O/C=C\CNCC1CCCO1 7a01f23f41072ad7e7e79cc13c2052f2 [1,0,0,1,0,0|2,0,0]=4 4559 B11R1.4 O/C=C\CNCC1CCOC1 0eb569a61062c188a084363a4c830014 [1,0,0,1,0,0|2,0,0]=4 4560 B11R1.4 O/C=C\CNC[C@@H]1CCCO1 1a26e79e4c4fbe7ffdf29ac251d0b61f [1,0,0,1,0,0|2,0,0]=4 4561 B11R1.4 O/C=C\CNC[C@@H]1CCOC1 acc6b953d54816cc69da03531e13fcda [1,0,0,1,0,0|2,0,0]=4 4562 B11R1.4 O/C=C\CNC[C@H]1CCCO1 ff68f9e593f4b696a2bcfcd7bec35c7c [1,0,0,1,0,0|2,0,0]=4 4563 B11R1.4 O/C=C\CNC[C@H]1CCOC1 ea1b60d215e517e2795fa032116b8bcc [1,0,0,1,0,0|2,0,0]=4 4564 B11R1.4 O=CNCCCC1CCCC1 2b6dfb05519c7313d1cd64e2c898d8b1 [1,0,0,1,0,0|1,0,1]=4 4565 B11R1.4 OCCCCCN1CC=CC1 63538fc316773bcaf8314766a8c1f54a [1,0,0,1,0,0|2,0,0]=4 4566 B11R1.4 OCCCCNC1CC=CC1 ba5ca2b6c04016cfba1bcaa4c7ed59ca [1,0,0,1,0,0|2,0,0]=4 4567 B11R1.4 OCCCCNC1CCCC1 10371cd3a6987b785ad3af8eb276fd84 [1,0,0,1,0,0|1,0,1]=4 4568 B11R1.4 OCCCNCC1CC=CC1 0aff73ded8aef35a8e156f7b0a98fd1f [1,0,0,1,0,0|2,0,0]=4 4569 B11R1.4 OCCCNCC1CCCC1 997e4a12a5ed94dc182d6e90055559b6 [1,0,0,1,0,0|1,0,1]=4 4570 B11R1.4 OCCNCCC1CCCC1 4c282b62d98e70540ae289d799539185 [1,0,0,1,0,0|1,0,1]=4 4571 B11R1.4 OCNCCCC1CCCC1 b06a04ed90cc0e692125de0652125c7f [1,0,0,1,0,0|1,0,0]=3 4572 B11R1.4 OCNCCCC1CCOC1 c91f03b58041380df292e9052c41e145 [1,0,0,1,0,0|2,0,0]=4 4573 B11R1.4 OCNCCCN1CCCC1 1630b31d9e9372313da8cefd7a885c78 [1,0,0,1,0,0|2,0,0]=4 4574 B11R1.4 OCNCCOC1CCCC1 4e7736874e8a0ccbcb758a3d34b0f32c [1,0,0,1,0,0|2,0,0]=4 4575 B11R1.4 OCNCCSC1CCCC1 8a6aca83eab267266d25e63d39a76719 [1,0,0,1,0,0|2,0,0]=4 4576 B11R1.4 SCCCNCC1CC=CC1 93f7823c94ceda6b7a9649ce24c5864c [1,0,0,1,0,0|2,0,0]=4 4577 B11R1.4 SCCCOCC1CC=CC1 ff1c8b00ee860e66b68aabe43c608bc8 [1,0,0,1,0,0|2,0,0]=4 4578 B11R1.5 CC1CCCCCN1CCO 057c6b87b8285708a5579f8fa31ee9f9 [1,0,0,1,0,0|1,0,1]=4 4579 B11R1.5 CCN[C@@H]1CCCCC[C@@H]1O deb26c7299ed6334e1a991f54447a9c5 [1,0,0,1,0,0|1,0,1]=4 4580 B11R1.5 CCN[C@@H]1CCCCC[C@H]1O 713169aeab8b05177be1f53d96a8599b [1,0,0,1,0,0|1,0,1]=4 4581 B11R1.5 CCN[C@H]1CCCCC[C@@H]1O 9b966678bef528ff6940b725ce3b16fe [1,0,0,1,0,0|1,0,1]=4 4582 B11R1.5 OCN[C@@H]1CCCCC[C@@H]1O 1baa89bf54227ebee6d797b86771f91b [1,0,0,1,0,0|2,0,0]=4 4583 B11R1.5 OCN[C@@H]1CCCCC[C@H]1O 586c460b1f2e244f5192beda10410e5c [1,0,0,1,0,0|2,0,0]=4 4584 B11R1.5 OCN[C@H]1CCCCC[C@@H]1O 005052a9017a3a25d5bbf0f153cb7c49 [1,0,0,1,0,0|2,0,0]=4 4585 B11R1.17 C/C=C/CN1CCCCC1C f686f0a6cb8b33c21c774e8d76e768fd [1,0,0,1,0,0|1,0,0]=3 4586 B11R1.17 C/C=C/CN1CCCC[C@@H]1C 120cbe9b47969d6a734700f415f58943 [1,0,0,1,0,0|1,0,0]=3 4587 B11R1.17 C/C=C/CN1CCCC[C@H]1C 8404bc39ee179632b805849105b2711a [1,0,0,1,0,0|1,0,0]=3 4588 B11R1.17 C/C=C/CN1CCOCC1C 8972543399b997305d47259382837cc5 [1,0,0,1,0,0|2,0,0]=4 4589 B11R1.17 C/C=C/CN1CCOC[C@@H]1C 78100e37a2b75d8c73b1acc262aafb34 [1,0,0,1,0,0|2,0,0]=4 4590 B11R1.17 C/C=C/CN1CCOC[C@H]1C c85898dd998b10fe6a9e9daf63608011 [1,0,0,1,0,0|2,0,0]=4 4591 B11R1.17 C/C=C\CN1CCCCC1C fec647b7e83ae38bf0bd0773133e5eeb [1,0,0,1,0,0|1,0,0]=3 4592 B11R1.17 C/C=C\CN1CCCC[C@@H]1C 17e6b3dd51d4c26f7340f326dc8f7e0a [1,0,0,1,0,0|1,0,0]=3 4593 B11R1.17 C/C=C\CN1CCCC[C@H]1C 60aee37b4d839cdfd9f99525b03fb089 [1,0,0,1,0,0|1,0,0]=3 4594 B11R1.17 C/C=C\CN1CCOCC1C 74ba1d29f9db77030356e84f58ce41bf [1,0,0,1,0,0|2,0,0]=4 4595 B11R1.17 C/C=C\CN1CCOC[C@@H]1C 18e7078d477902a5cb976d91f6ab2b15 [1,0,0,1,0,0|2,0,0]=4 4596 B11R1.17 C/C=C\CN1CCOC[C@H]1C 3b524fc9e7627e43421725ca6bd444b3 [1,0,0,1,0,0|2,0,0]=4 4597 B11R1.17 CC1CCCCC1CNC=O 258dd7a96deba7febdb8348ed4089e86 [1,0,0,1,0,0|1,0,1]=4 4598 B11R1.17 CC1CCCCC1CNCF cbe7e08942f504db6ac88cc822fa0eb2 [1,0,0,1,0,0|2,0,0]=4 4599 B11R1.17 CC1CCCCC1CNCO 69775eb9e35ab19ef3c7f4c19248721e [1,0,0,1,0,0|1,0,0]=3 4600 B11R1.17 CC1CCCCC1NCCO 52c6ad311f6fad2268e1eda79c81b36a [1,0,0,1,0,0|1,0,1]=4 4601 B11R1.17 CC1CCCCN1C/C=C/Cl e445e52d13b4bb4042b27b64874532e6 [1,0,0,1,0,0|2,0,0]=4 4602 B11R1.17 CC1CCCCN1C/C=C\Cl 0aa35a39943c70cb8382bee77384a50a [1,0,0,1,0,0|2,0,0]=4 4603 B11R1.17 CC1CCCCN1C/C=C\O 11ab161f1a6f3f9a776406ca27ecce57 [1,0,0,1,0,0|1,0,0]=3 4604 B11R1.17 CC1CCCCN1CCCO a0173451728ed2077ecde1c84d76b55a [1,0,0,1,0,0|1,0,1]=4 4605 B11R1.17 CC1COCCN1C/C=C\O ce9355761a76f54213ee0e4f99413a8c [1,0,0,1,0,0|2,0,0]=4 4606 B11R1.17 CCCNC1CCCCC1O a7a69cea9f0e251081de7c555541f76e [1,0,0,1,0,0|1,0,1]=4 4607 B11R1.17 CCCN[C@@H]1CCCC[C@H]1O 305c976006d68d744857563374a03bf7 [1,0,0,1,0,0|1,0,1]=4 4608 B11R1.17 CCCN[C@H]1CCCC[C@@H]1O d1feb4a032f6483fe5a8ed49ec4dc95c [1,0,0,1,0,0|1,0,1]=4 4609 B11R1.17 CCCN[C@H]1CCCC[C@H]1O daad993687adc821be8d24c275cce592 [1,0,0,1,0,0|1,0,1]=4 4610 B11R1.17 CCCOC1CCCC=C1Br 4b592f5b2b05c930ea5eb16acb9a11e3 [1,0,0,1,0,0|2,0,0]=4 4611 B11R1.17 CCNCC1CCCCC1C 3db2897bc02580041d74323dfcee9c77 [1,0,0,1,0,0|1,0,1]=4 4612 B11R1.17 CCNCC1CCCCC1O 6f9959cd04171fe590f2e6148374867d [1,0,0,1,0,0|1,0,1]=4 4613 B11R1.17 CN1CCCCC1CNCO 88c5efc57ca79c91123a67a83e8a9702 [1,0,0,1,0,0|2,0,0]=4 4614 B11R1.17 C[C@@H]1CCCCN1C/C=C/Cl ab08ca34b5281780ca4c221d2186592d [1,0,0,1,0,0|2,0,0]=4 4615 B11R1.17 C[C@@H]1CCCCN1C/C=C\Cl 1604458f9f9a4dcaece90eeb8fad065a [1,0,0,1,0,0|2,0,0]=4 4616 B11R1.17 C[C@@H]1CCCCN1C/C=C\O bb308b7d5c013737f5119d8892c6c70e [1,0,0,1,0,0|1,0,0]=3 4617 B11R1.17 C[C@@H]1CCCCN1CCCO 6fd84a4e3b169ec43015356a9027c3bc [1,0,0,1,0,0|1,0,1]=4 4618 B11R1.17 C[C@@H]1CCCC[C@@H]1NCCO 87fc70f547ddc2db47020bf411604945 [1,0,0,1,0,0|1,0,1]=4 4619 B11R1.17 C[C@@H]1CCCC[C@H]1NCCO b4b92dc556e26bd3055d19e7820d8afe [1,0,0,1,0,0|1,0,1]=4 4620 B11R1.17 C[C@@H]1COCCN1C/C=C\O bd9b0c651ffa2301bef5493eec0dd906 [1,0,0,1,0,0|2,0,0]=4 4621 B11R1.17 C[C@H]1CCCCN1C/C=C/Cl cca27324c2a59135e9c9671728929102 [1,0,0,1,0,0|2,0,0]=4 4622 B11R1.17 C[C@H]1CCCCN1C/C=C\Cl b69ac0fb86c4cd4315ff203efab6cd7d [1,0,0,1,0,0|2,0,0]=4 4623 B11R1.17 C[C@H]1CCCCN1C/C=C\O bfcc0e241126206ceb0837fc0e87a22c [1,0,0,1,0,0|1,0,0]=3 4624 B11R1.17 C[C@H]1CCCCN1CCCO 13ed03d551929cc9996e311ec7b70ce5 [1,0,0,1,0,0|1,0,1]=4 4625 B11R1.17 C[C@H]1CCCC[C@@H]1NCCO 5b3deeb81fb04710cff51b19df9244a1 [1,0,0,1,0,0|1,0,1]=4 4626 B11R1.17 C[C@H]1CCCC[C@H]1NCCO e07252d90a0c78830feaac80840cb6e3 [1,0,0,1,0,0|1,0,1]=4 4627 B11R1.17 C[C@H]1COCCN1C/C=C\O 2bfca6f75775de57c33999a617d9e4e4 [1,0,0,1,0,0|2,0,0]=4 4628 B11R1.17 OCNCC1CCCCC1O c2cdf6d7532b39fe16c5231943578b41 [1,0,0,1,0,0|2,0,0]=4 4629 B11R1.18 C/C=C/CN1CCCC1CC 1de474a6c7744fbdc4364e036cf64b8b [1,0,0,1,0,0|1,0,0]=3 4630 B11R1.18 C/C=C/CN1CCCC1CO 13ddd1f539b67b5935dd74ce08ae4b0c [1,0,0,1,0,0|2,0,0]=4 4631 B11R1.18 C/C=C/CN1CCCC1OC a849110a47bdba11867399231d9246b7 [1,0,0,1,0,0|2,0,0]=4 4632 B11R1.18 C/C=C/CN1CCC[C@@H]1CF 32557b25185433558fdc00bdbc403476 [1,0,0,1,0,0|2,0,0]=4 4633 B11R1.18 C/C=C/CN1CCC[C@@H]1CO 1cb05be85e9b51269e99f9bb92d9aedb [1,0,0,1,0,0|2,0,0]=4 4634 B11R1.18 C/C=C/CN1CCC[C@H]1CC 05d12efc6bb8480f6056a7055f2051ec [1,0,0,1,0,0|1,0,0]=3 4635 B11R1.18 C/C=C/CN1CCC[C@H]1CF 4b94972b0795a4356299a98f168731aa [1,0,0,1,0,0|2,0,0]=4 4636 B11R1.18 C/C=C/CN1CCC[C@H]1CO 8a8d754eb648122b670bf8a0f1d0512a [1,0,0,1,0,0|2,0,0]=4 4637 B11R1.18 C/C=C\CN1CCCC1CC 620962233067d40040ed4d84ef5050de [1,0,0,1,0,0|1,0,0]=3 4638 B11R1.18 C/C=C\CN1CCCC1CO e2a0266b60b2832a1f0334abc47f0076 [1,0,0,1,0,0|2,0,0]=4 4639 B11R1.18 C/C=C\CN1CCCC1OC 804d4afac76ad3e8c1aff1e64687db5f [1,0,0,1,0,0|2,0,0]=4 4640 B11R1.18 C/C=C\CN1CCC[C@@H]1CF dcde57c502349535d378f98cf991401c [1,0,0,1,0,0|2,0,0]=4 4641 B11R1.18 C/C=C\CN1CCC[C@@H]1CO 8aad8c08b8aaf592d8b55f809107e3c9 [1,0,0,1,0,0|2,0,0]=4 4642 B11R1.18 C/C=C\CN1CCC[C@H]1CC 4c6a80df18abf665aadd36776cf047a3 [1,0,0,1,0,0|1,0,0]=3 4643 B11R1.18 C/C=C\CN1CCC[C@H]1CF cf72182f62adb7a28ac0d294ad03029b [1,0,0,1,0,0|2,0,0]=4 4644 B11R1.18 C/C=C\CN1CCC[C@H]1CO 832a72c1935363174e70e4ff30617b54 [1,0,0,1,0,0|2,0,0]=4 4645 B11R1.18 CCC1CCCN1C/C=C/Cl ac297dda39eb63d822b48a4dd1030103 [1,0,0,1,0,0|2,0,0]=4 4646 B11R1.18 CCC1CCCN1C/C=C\Cl ecda3a6f7c45828eb6eef97c9bedb867 [1,0,0,1,0,0|2,0,0]=4 4647 B11R1.18 CCC1CCCN1C/C=C\O 8c63826698c8ed12bcac94650100699f [1,0,0,1,0,0|1,0,0]=3 4648 B11R1.18 CCC1CCCN1CCCO 803ebab82fbf275fabb90b1b0ce7fcdc [1,0,0,1,0,0|1,0,1]=4 4649 B11R1.18 CCCCC1CCCN1C=O f9fe6f1960c38f8e27c71435c0790d85 [1,0,0,1,0,0|1,0,1]=4 4650 B11R1.18 CCCCC1CCCN1CC 6c3b253cd7b75c3fe3c15ee12418cb92 [1,0,0,1,0,0|1,0,1]=4 4651 B11R1.18 CCCCC1CCCN1CF 5cdfbd32970a08a4b1b0fbab3273a0a3 [1,0,0,1,0,0|2,0,0]=4 4652 B11R1.18 CCCCC1CCCN1CO 1152907f1020b8b4004dacf8ec4bab60 [1,0,0,1,0,0|1,0,0]=3 4653 B11R1.18 CCCCN1CCCC1CO 83d221fbb3b16ae3b7a08929ebb75712 [1,0,0,1,0,0|1,0,1]=4 4654 B11R1.18 CCCCN1CCC[C@@H]1CO 2ab854d0a1cd0494d03c2c9c60b4dd9d [1,0,0,1,0,0|1,0,1]=4 4655 B11R1.18 CCCCN1CCC[C@H]1CO 9a57a266850776285275dd1df46f1f8a [1,0,0,1,0,0|1,0,1]=4 4656 B11R1.18 CCCN[C@H]1CCC[C@H]1CO 7f9e01219e173aa81717ebe34fce9daa [1,0,0,1,0,0|1,0,1]=4 4657 B11R1.18 CCN1CCCC1CNCO 762a80a16412307b26b04ed667ee3258 [1,0,0,1,0,0|2,0,0]=4 4658 B11R1.18 CCN1CCC[C@@H]1CNCO 817e83fb64ac98dcea64e04b5a88b307 [1,0,0,1,0,0|2,0,0]=4 4659 B11R1.18 CCN1CCC[C@H]1CNCO 4017dd6a61954f4bff979379e54ee843 [1,0,0,1,0,0|2,0,0]=4 4660 B11R1.18 CCOCC1CCCN1CO 2979feb73072f1b46b351e7db02d866a [1,0,0,1,0,0|2,0,0]=4 4661 B11R1.18 CCOC[C@@H]1CCCN1CO dcf7a810c3982b1ea2652a379201edd4 [1,0,0,1,0,0|2,0,0]=4 4662 B11R1.18 CC[C@@H]1CCCN1C/C=C/Cl 8967cf7b955696a9de93c957d884afc9 [1,0,0,1,0,0|2,0,0]=4 4663 B11R1.18 CC[C@@H]1CCCN1C/C=C\Cl 57b03369898a5052b7e29d2cf60d042b [1,0,0,1,0,0|2,0,0]=4 4664 B11R1.18 CC[C@@H]1CCCN1C/C=C\O ab545eb27e2b646c47c00c0adffe856f [1,0,0,1,0,0|1,0,0]=3 4665 B11R1.18 CC[C@@H]1CCCN1CCCO 5b187df5386c82d4eca96fb746f1d513 [1,0,0,1,0,0|1,0,1]=4 4666 B11R1.18 CC[C@@H]1CCC[C@H]1NCCO 41cde81dbb377171e1bff224d9430c1b [1,0,0,1,0,0|1,0,1]=4 4667 B11R1.18 COC1CCCN1C/C=C\O c6a8bc8d95c0c6016a6d7da62eaceb0b [1,0,0,1,0,0|2,0,0]=4 4668 B11R1.18 COCCC1CCCN1CO 8fc35a41be30252d963f426c02be7bb2 [1,0,0,1,0,0|2,0,0]=4 4669 B11R1.18 O/C=C\CN1CCCC1CO df545570aae0e5454b8ec96da908730b [1,0,0,1,0,0|2,0,0]=4 4670 B11R1.18 O/C=C\CN1CCC[C@@H]1CF 3684552bb28fb941d65de64b023f91a1 [1,0,0,1,0,0|2,0,0]=4 4671 B11R1.18 O/C=C\CN1CCC[C@@H]1CO 780c8ea8b9660992e742639b250634db [1,0,0,1,0,0|2,0,0]=4 4672 B11R1.18 O/C=C\CN1CCC[C@H]1CF 3f3b02796ef047e2f64e62e3f14d90d3 [1,0,0,1,0,0|2,0,0]=4 4673 B11R1.18 O/C=C\CN1CCC[C@H]1CO a7dd2fff2a56a0331796456ef36f07c6 [1,0,0,1,0,0|2,0,0]=4 4674 B11R1.28 BrCCNCC1CC=CCC1 1f7bb71047ffd478752347bc097c3f6f [1,0,0,1,0,0|2,0,0]=4 4675 B11R1.28 C/C=C/CNC1CCCOC1 879bb3c7c5495d7e25ba06cbc0f78683 [1,0,0,1,0,0|2,0,0]=4 4676 B11R1.28 C/C=C/CNC1CCOCC1 7afc8db9c385d6f3582762f3da7572da [1,0,0,1,0,0|2,0,0]=4 4677 B11R1.28 C/C=C/CNC1CCSCC1 e1c61a3c919aa28236575da0c5552ba7 [1,0,0,1,0,0|2,0,0]=4 4678 B11R1.28 C/C=C/CN[C@@H]1CCCOC1 e86acbd68170095e886c33cd3be9ca8d [1,0,0,1,0,0|2,0,0]=4 4679 B11R1.28 C/C=C/CN[C@H]1CCCOC1 1f743ac38af82be55fbd82c2ce300c4f [1,0,0,1,0,0|2,0,0]=4 4680 B11R1.28 C/C=C/COC1CCCCC1 929ecd73692c9696febdbd59282ef2b3 [1,0,0,1,0,0|1,0,0]=3 4681 B11R1.28 C/C=C/COC1CCCCO1 bbe35b3854027d1c26bfb013dbaefa8c [1,0,0,1,0,0|2,0,0]=4 4682 B11R1.28 C/C=C/COC1CCCOC1 0272c2e15a562ed4475329613f41b058 [1,0,0,1,0,0|2,0,0]=4 4683 B11R1.28 C/C=C/COC1CCCSC1 e63b070e43887ab1bae34c9dcd77b2cd [1,0,0,1,0,0|2,0,0]=4 4684 B11R1.28 C/C=C/COC1CCOCC1 e87194828c4ffa5a652b0de1501ef48c [1,0,0,1,0,0|2,0,0]=4 4685 B11R1.28 C/C=C/COC1CCSCC1 f53377ae9807ee7d8e6478f367fa13b3 [1,0,0,1,0,0|2,0,0]=4 4686 B11R1.28 C/C=C/CO[C@@H]1CCCOC1 03bd2f02b81499e64ae096caf8cdf898 [1,0,0,1,0,0|2,0,0]=4 4687 B11R1.28 C/C=C/CO[C@H]1CCCOC1 5b3fae202d46db0b2609376c0d83534c [1,0,0,1,0,0|2,0,0]=4 4688 B11R1.28 C/C=C\CNC1CCCOC1 732ecf707232de1fe170cdd33d67a8bc [1,0,0,1,0,0|2,0,0]=4 4689 B11R1.28 C/C=C\CNC1CCOCC1 2e01ae98e59f240ce52a84886f332263 [1,0,0,1,0,0|2,0,0]=4 4690 B11R1.28 C/C=C\CNC1CCSCC1 17e66413cfbacef99021053d9521dd09 [1,0,0,1,0,0|2,0,0]=4 4691 B11R1.28 C/C=C\CN[C@@H]1CCCOC1 7885cedc0977a7b38b08d5bf926f5464 [1,0,0,1,0,0|2,0,0]=4 4692 B11R1.28 C/C=C\CN[C@H]1CCCOC1 47d8dbbea7779a10d6eefa1764dc3f26 [1,0,0,1,0,0|2,0,0]=4 4693 B11R1.28 C/C=C\COC1CCCCC1 3707de72c593da9001217120b8b4a78b [1,0,0,1,0,0|1,0,0]=3 4694 B11R1.28 C/C=C\COC1CCCCO1 2ae319e9a1c7161249cd36158acd7af6 [1,0,0,1,0,0|2,0,0]=4 4695 B11R1.28 C/C=C\COC1CCCOC1 340344556799692eb96c30595da8247c [1,0,0,1,0,0|2,0,0]=4 4696 B11R1.28 C/C=C\COC1CCCSC1 9d4f7996bc431055b6af9720380cfe22 [1,0,0,1,0,0|2,0,0]=4 4697 B11R1.28 C/C=C\COC1CCOCC1 3c4cd4bc6e18bfe3faedc4b0142a8f8b [1,0,0,1,0,0|2,0,0]=4 4698 B11R1.28 C/C=C\COC1CCSCC1 b9aabdfc099651afd1d042489ab48196 [1,0,0,1,0,0|2,0,0]=4 4699 B11R1.28 C/C=C\CO[C@@H]1CCCOC1 f23f7f57be6aee259348197ccee5cd94 [1,0,0,1,0,0|2,0,0]=4 4700 B11R1.28 C/C=C\CO[C@H]1CCCOC1 04ffe0007229ebccba43127d6dbd3a85 [1,0,0,1,0,0|2,0,0]=4 4701 B11R1.28 CC=CCNC1CCCCC1 f6e1007c626d5999ef6d3ff82d3c9604 [1,0,0,1,0,0|1,0,0]=3 4702 B11R1.28 CC=CCNC1CCCCO1 921305549e665aafb73a6986af5ba1d1 [1,0,0,1,0,0|2,0,0]=4 4703 B11R1.28 CC=CCNC1CCCOC1 e235376c260aa7583cf9ea43f2249f33 [1,0,0,1,0,0|2,0,0]=4 4704 B11R1.28 CC=CCNC1CCOCC1 45c2614052eac63b8b201614feca9825 [1,0,0,1,0,0|2,0,0]=4 4705 B11R1.28 CC=CCNC1CCSCC1 ef4d6730fc4e19080cbcf6ebad93f2eb [1,0,0,1,0,0|2,0,0]=4 4706 B11R1.28 CC=CCOC1CCCCC1 e62fb7160e45dd6841ea554e026d6df2 [1,0,0,1,0,0|1,0,0]=3 4707 B11R1.28 CC=CCOC1CCCCO1 04e0b83d70bef3a500c4a0298da11b93 [1,0,0,1,0,0|2,0,0]=4 4708 B11R1.28 CC=CCOC1CCCOC1 535f00491724ddaac26716d84dd60727 [1,0,0,1,0,0|2,0,0]=4 4709 B11R1.28 CC=CCOC1CCOCC1 62f5aa7f1a18508a5eb1ba471f12d7da [1,0,0,1,0,0|2,0,0]=4 4710 B11R1.28 CC=CCOC1CCSCC1 48cebea7821905d84e02d11a3a75a81e [1,0,0,1,0,0|2,0,0]=4 4711 B11R1.28 CCCCCN1CC=CCC1 d500fffaf2826f4f41d6075397a993f5 [1,0,0,1,0,0|1,0,0]=3 4712 B11R1.28 CCCCNC1CCCCO1 3bd035030ae808d12bab4c5cba6dcb1f [1,0,0,1,0,0|1,0,1]=4 4713 B11R1.28 CCCCOC1CC=CCC1 f226528d6724a8c1c1c8e1176051e960 [1,0,0,1,0,0|1,0,0]=3 4714 B11R1.28 CCCCOC1CCCCO1 876a79fef12cc68fcbedfbd209aaa824 [1,0,0,1,0,0|1,0,1]=4 4715 B11R1.28 CCCNCC1CC=CCC1 763aa6fa8ba34f4e96e3238bdf993b89 [1,0,0,1,0,0|1,0,0]=3 4716 B11R1.28 CCCNCC1CCCCO1 fe32d4ffbdc5749c38e47cf869213fa5 [1,0,0,1,0,0|1,0,1]=4 4717 B11R1.28 CCCOCC1CC=CCC1 20721251404fcf4735a470d02c4ed9be [1,0,0,1,0,0|1,0,0]=3 4718 B11R1.28 CCCOCC1CCC=CO1 e89dcca9344c6e6ffe5fd85c14cfe540 [1,0,0,1,0,0|1,0,0]=3 4719 B11R1.28 CCCOCC1CCCCO1 90f98ba9e9eadc1d9df337afb14e5eef [1,0,0,1,0,0|1,0,1]=4 4720 B11R1.28 CCCOC[C@@H]1CC=CCC1 5401c46850d5ee0cccb01da9f735a1b8 [1,0,0,1,0,0|1,0,0]=3 4721 B11R1.28 CCCOC[C@@H]1CCCCO1 20a5d3e0feb8c992886908978ec6f96d [1,0,0,1,0,0|1,0,1]=4 4722 B11R1.28 CCCOC[C@H]1CC=CCC1 c5113d295c67d12716c407d70ecd31a0 [1,0,0,1,0,0|1,0,0]=3 4723 B11R1.28 CCCOC[C@H]1CCCCO1 6cb49fd295b71bf392a373607d504cfc [1,0,0,1,0,0|1,0,1]=4 4724 B11R1.28 CCNCCC1CCCCC1 2e867833c56674d23036d88c814c9550 [1,0,0,1,0,0|1,0,1]=4 4725 B11R1.28 CCNCCC1CCCCO1 0514cc2009abea27205eb2d4527ea2a3 [1,0,0,1,0,0|1,0,1]=4 4726 B11R1.28 CCOCCC1CCCCC1 41db2982246c499a6c04bf31353c607f [1,0,0,1,0,0|1,0,1]=4 4727 B11R1.28 CCOCCC1CCCCO1 0eb2e7b6ffe2601ad6e04d63bcdae13d [1,0,0,1,0,0|1,0,1]=4 4728 B11R1.28 CCOCCN1CC=CCC1 6db700707e4e6a22d640b42312ea8114 [1,0,0,1,0,0|2,0,0]=4 4729 B11R1.28 CCOCOC1CC=CCC1 465cfeabe804ad71944524a67da83bdb [1,0,0,1,0,0|2,0,0]=4 4730 B11R1.28 CCSCCN1CC=CCC1 5c238af046a6b38fa263d5efd9cfdc12 [1,0,0,1,0,0|2,0,0]=4 4731 B11R1.28 COCCCN1CC=CCC1 9b95daac7c611f5c8a4caa31465fb8aa [1,0,0,1,0,0|2,0,0]=4 4732 B11R1.28 COCCOC1CC=CCC1 41914223fcc3bc65b26e4c9c9cd4f48a [1,0,0,1,0,0|2,0,0]=4 4733 B11R1.28 COCNCC1CC=CCC1 02cc4aa538ec52c24ebf8107012c820e [1,0,0,1,0,0|2,0,0]=4 4734 B11R1.28 COCOCC1CC=CCC1 fba879ea7326e7bf66e618b54e33e320 [1,0,0,1,0,0|2,0,0]=4 4735 B11R1.28 COCOCC1CCC=CO1 73e9d4c76b8554c8507b4a7762514788 [1,0,0,1,0,0|2,0,0]=4 4736 B11R1.28 COCOC[C@@H]1CC=CCC1 7a37c327a1097613559e31e16bac68e4 [1,0,0,1,0,0|2,0,0]=4 4737 B11R1.28 COCOC[C@H]1CC=CCC1 00ab0483a989a0d81e128c9964d11ed6 [1,0,0,1,0,0|2,0,0]=4 4738 B11R1.28 CSCCCN1CC=CCC1 ae60ef6ba87ed89b0286701821a211ae [1,0,0,1,0,0|2,0,0]=4 4739 B11R1.28 CSCCOC1CC=CCC1 3bdbb472946d8a3f548870c8b4cba09b [1,0,0,1,0,0|2,0,0]=4 4740 B11R1.28 CSCNCC1CC=CCC1 ebdfb6c7d3dbb15d120f4298fba75b4e [1,0,0,1,0,0|2,0,0]=4 4741 B11R1.28 CSCOCC1CC=CCC1 6f3896a6d45441dc7956fbecbd5db050 [1,0,0,1,0,0|2,0,0]=4 4742 B11R1.28 CSCOCC1CCC=CO1 ae00d2192c086f07074cb215c28cf1bf [1,0,0,1,0,0|2,0,0]=4 4743 B11R1.28 CSCOC[C@@H]1CC=CCC1 8714835c61adbf9ea8fa325f9219dbad [1,0,0,1,0,0|2,0,0]=4 4744 B11R1.28 CSCOC[C@H]1CC=CCC1 39fb7be42386f374c319ea469268b443 [1,0,0,1,0,0|2,0,0]=4 4745 B11R1.28 Cl/C=C/COC1CCCCC1 ce2dde6fd054413ea15f2c1454632695 [1,0,0,1,0,0|2,0,0]=4 4746 B11R1.28 Cl/C=C\COC1CCCCC1 11cff04688039188dbb3465dcc5f92eb [1,0,0,1,0,0|2,0,0]=4 4747 B11R1.28 ClC=CCOC1CCCCC1 11f21a6bdd2c30a7735d799534dfa590 [1,0,0,1,0,0|2,0,0]=4 4748 B11R1.28 FCCCCN1CC=CCC1 60ca7184c9fc11c2e33c6560a8e96af4 [1,0,0,1,0,0|2,0,0]=4 4749 B11R1.28 FCCCOC1CC=CCC1 8080d7309a2fd4fbc0eb552c9f92d19b [1,0,0,1,0,0|2,0,0]=4 4750 B11R1.28 FCCNCC1CC=CCC1 615e4b171f52399a2c0d34914116618e [1,0,0,1,0,0|2,0,0]=4 4751 B11R1.28 FCCOCC1CC=CCC1 8c4fb099170ffea245bb9d6ed5e8d904 [1,0,0,1,0,0|2,0,0]=4 4752 B11R1.28 FCCOCC1CCC=CO1 c10a99c03e19c75bd5bde96de7bf5718 [1,0,0,1,0,0|2,0,0]=4 4753 B11R1.28 FCCOC[C@@H]1CC=CCC1 a5f78d4e7ac9b362ce1eb221bde4ca88 [1,0,0,1,0,0|2,0,0]=4 4754 B11R1.28 FCCOC[C@H]1CC=CCC1 f24e7bdee8b2ca64b480acedaaeff57c [1,0,0,1,0,0|2,0,0]=4 4755 B11R1.28 FCNCCC1CCCCC1 5bdf27448e2514e957a1dd6b1e39977e [1,0,0,1,0,0|2,0,0]=4 4756 B11R1.28 FCOCCC1CCCCC1 47d5c12944f0e4db7a16d1e5b9471e6e [1,0,0,1,0,0|2,0,0]=4 4757 B11R1.28 ICCNCC1CC=CCC1 b738375c971f49aba8a8e8f69dfe420f [1,0,0,1,0,0|2,0,0]=4 4758 B11R1.28 O/C=C\CNC1CCCOC1 4ada2595f3b4f313d900b09419a85b54 [1,0,0,1,0,0|2,0,0]=4 4759 B11R1.28 O/C=C\CNC1CCOCC1 f48c94a9ac178cb79101b9b9243eeab2 [1,0,0,1,0,0|2,0,0]=4 4760 B11R1.28 O/C=C\CNC1CCSCC1 81fea9659e7f15c29ced1262bf6859f7 [1,0,0,1,0,0|2,0,0]=4 4761 B11R1.28 O/C=C\CN[C@@H]1CCCOC1 6d07f4eb8f0848217c78d00f30fa9451 [1,0,0,1,0,0|2,0,0]=4 4762 B11R1.28 O/C=C\CN[C@H]1CCCOC1 119b77657051312407c280217ff25a0c [1,0,0,1,0,0|2,0,0]=4 4763 B11R1.28 O=CNCCC1CCCCC1 220c987def40116415ea87c985755b84 [1,0,0,1,0,0|1,0,1]=4 4764 B11R1.28 OCCCCN1CC=CCC1 0f89cd0f2b38bc542c78e48ae9d7bd23 [1,0,0,1,0,0|2,0,0]=4 4765 B11R1.28 OCCCNC1CCCCC1 11a7a7781105afae04cf0eaaf16b5aa1 [1,0,0,1,0,0|1,0,1]=4 4766 B11R1.28 OCCNCC1CC=CCC1 f3d2bd8077437f36996c6239fc1acfbe [1,0,0,1,0,0|2,0,0]=4 4767 B11R1.28 OCCNCC1CCCCC1 e116e6fe6cf50ae26cbc6aa1c79b1b6b [1,0,0,1,0,0|1,0,1]=4 4768 B11R1.28 OCNCCC1CCCCC1 5efc6e566b59ea85b5b691a2ceb88c55 [1,0,0,1,0,0|1,0,0]=3 4769 B11R1.28 OCNCCC1CCCCO1 2f862ebddde7e04bf751de49873bbb87 [1,0,0,1,0,0|2,0,0]=4 4770 B11R1.28 OCNCCC1CCCOC1 158fed6a57c4a46847cd3009200dc6c3 [1,0,0,1,0,0|2,0,0]=4 4771 B11R1.28 OCNCCC1CCOCC1 79f3f7e59929806d9714500e860e6963 [1,0,0,1,0,0|2,0,0]=4 4772 B11R1.28 OCNCCC1CCSCC1 3c1c0d1cb16132a52d5c1c2162fee760 [1,0,0,1,0,0|2,0,0]=4 4773 B11R1.28 OCNCCN1CCCCC1 5e5ae65c4abb32c7764f203f3ec93ad2 [1,0,0,1,0,0|2,0,0]=4 4774 B11R1.28 SCCCOC1CC=CCC1 9ff95b2f315b78f64fd8236005ad6c9d [1,0,0,1,0,0|2,0,0]=4 4775 B11R1.28 SCCNCC1CC=CCC1 699c941ca2e95db3cebacc72b7c3bc4d [1,0,0,1,0,0|2,0,0]=4 4776 B11R1.28 SCCOCC1CC=CCC1 346ef2335895e8b19554e7d7d6831e09 [1,0,0,1,0,0|2,0,0]=4 4777 B11R1.28 SCCOCC1CCC=CO1 b4ac48d7f2c577c15cf00202eb602049 [1,0,0,1,0,0|2,0,0]=4 4778 B11R1.28 SCCOC[C@@H]1CC=CCC1 5d8b45884ebc1a367b6fe7e719685368 [1,0,0,1,0,0|2,0,0]=4 4779 B11R1.28 SCCOC[C@H]1CC=CCC1 2ef68879c5e30e98946df4a1035affd0 [1,0,0,1,0,0|2,0,0]=4 4780 B11R1.41 CCC1CCCCC1OCF 1cd08105dd638695cc6af1465a6af2c4 [1,0,0,1,0,0|2,0,0]=4 4781 B11R1.41 CCC1CCCCN1CCO 0401c5f429c790b76a4d5dfa63345bf3 [1,0,0,1,0,0|1,0,1]=4 4782 B11R1.41 CCC1COCCC1NCO acdfd98bc489df6f183759ec4320cf0a [1,0,0,1,0,0|2,0,0]=4 4783 B11R1.41 CCCC1COCCN1CO 29798c431447159d66934e48fab9692d [1,0,0,1,0,0|2,0,0]=4 4784 B11R1.41 CCCN1CCCCC1CO cbdcf5ac41b8638f32db05ab0071fc53 [1,0,0,1,0,0|1,0,1]=4 4785 B11R1.41 CCCN1CCCC[C@@H]1CO 81bf1346884b73c414b8ca8dd7de270a [1,0,0,1,0,0|1,0,1]=4 4786 B11R1.41 CCCN1CCCC[C@H]1CO 634940ce88b6dfc96c3ac67ec2e69e71 [1,0,0,1,0,0|1,0,1]=4 4787 B11R1.41 CCN1CCCCC1CCO b9f5cf9d4760ab3b20f8fc4f4bd6c46c [1,0,0,1,0,0|1,0,1]=4 4788 B11R1.41 CCN1CCCC[C@@H]1CCO 40c75c3fe5c226eb0c040626ccf3ce44 [1,0,0,1,0,0|1,0,1]=4 4789 B11R1.41 CCN1CCCC[C@H]1CCO 8281549c53ce644ed205bf54245ed833 [1,0,0,1,0,0|1,0,1]=4 4790 B11R1.41 CCN[C@@H]1CCCC[C@@H]1CO 428345999db4a73120dd9126a2d5dc20 [1,0,0,1,0,0|1,0,1]=4 4791 B11R1.41 CCN[C@@H]1CCCC[C@H]1CO 220b704f10481bbeec7d5a9df2e4beb3 [1,0,0,1,0,0|1,0,1]=4 4792 B11R1.41 CCN[C@H]1CCCC[C@H]1CO 2aa408ffb74a00ab65ee745d9718ff38 [1,0,0,1,0,0|1,0,1]=4 4793 B11R1.41 CCOC1CCCCC1CC 810042b55fdd81b47fd5fb695851c34e [1,0,0,1,0,0|1,0,1]=4 4794 B11R1.41 CC[C@@H]1CCCCN1CCO 31c74c02e02d1431ecaa933f030f1164 [1,0,0,1,0,0|1,0,1]=4 4795 B11R1.41 CC[C@H]1CCCCN1CCO 4087292e87a1b50826328ff916748508 [1,0,0,1,0,0|1,0,1]=4 4796 B11R1.41 COC1CCCCC1NCO 39c2ec1814672e97624f63cda7264e5a [1,0,0,1,0,0|2,0,0]=4 4797 B11R1.41 COCC1CCCCN1CO 0e5f163e03ff4bc2694988574041429a [1,0,0,1,0,0|2,0,0]=4 4798 B11R1.41 CO[C@H]1CCCC[C@@H]1NCO f3747a3b58ec8a8552a2292d45208515 [1,0,0,1,0,0|2,0,0]=4 4799 B11R1.41 OCCC1CCCCN1CO 2f9edd733481a2150d5a135430557cd5 [1,0,0,1,0,0|2,0,0]=4 4800 B11R1.41 OCC[C@@H]1CCCCN1CO 95978ea09d57e2629e9b29a87ff96e33 [1,0,0,1,0,0|2,0,0]=4 4801 B11R1.41 OCC[C@H]1CCCCN1CO 531e7e5d43ad993f2cc626b44e0a03df [1,0,0,1,0,0|2,0,0]=4 4802 B11R1.41 OCN1CCCCC1CCCl 461f06055ee6fbd2ac4e1c73273da108 [1,0,0,1,0,0|2,0,0]=4 4803 B11R1.41 OCN[C@@H]1CCCC[C@@H]1CO 801f90cabe5c8f613435d159d4378b2e [1,0,0,1,0,0|2,0,0]=4 4804 B11R1.41 OCN[C@@H]1CCCC[C@H]1CO a89b3f0c7c50cff5c5f434de20145b86 [1,0,0,1,0,0|2,0,0]=4 4805 B11R1.41 OCN[C@H]1CCCC[C@H]1CO fc9b11efe264c94de043adc2c00969e2 [1,0,0,1,0,0|2,0,0]=4 4806 B11R1.46 C/C=C\CCCNC1CC1C e52b250fe855b10f6f2ec355bb541091 [1,0,0,1,0,0|1,0,0]=3 4807 B11R1.46 C/C=C\CCCN[C@@H]1C[C@H]1F eb8a48547ac234a93347e2bf90c2b4d1 [1,0,0,1,0,0|2,0,0]=4 4808 B11R1.46 C/C=C\CCCN[C@H]1C[C@@H]1F 6dbbffe27941555d71c134c48c71465c [1,0,0,1,0,0|2,0,0]=4 4809 B11R1.46 C/C=C\CCCN[C@H]1C[C@H]1F e61d5d309315ce2e5deda00c597dc627 [1,0,0,1,0,0|2,0,0]=4 4810 B11R1.46 CC/C=C/COCC1CC1C fe1240e00ddd0be80c566da621f404a2 [1,0,0,1,0,0|2,0,0]=4 4811 B11R1.46 CC/C=C/COC[C@@H]1C[C@@H]1C c0571d3b9b02af0140d0d58a196552c6 [1,0,0,1,0,0|2,0,0]=4 4812 B11R1.46 CC/C=C/COC[C@@H]1C[C@H]1C 1f2f68f96ba6719fd078c10e53006a5c [1,0,0,1,0,0|2,0,0]=4 4813 B11R1.46 CC/C=C/COC[C@H]1C[C@@H]1C 981ba8af5be086971d42f8f9ed879e43 [1,0,0,1,0,0|2,0,0]=4 4814 B11R1.46 CC/C=C\CCNC1CC1C e92c4e6b06443ae942fd34079c8559ea [1,0,0,1,0,0|2,0,0]=4 4815 B11R1.46 CC1CC1NCCCCCO bd299bc9720187b5316db39c71cbed76 [1,0,0,1,0,0|1,0,1]=4 4816 B11R1.47 C/C=C/CCCOC1CCC1 9e896d9b55e0b22aabd99e19f2da464d [1,0,0,1,0,0|1,0,0]=3 4817 B11R1.47 C/C=C/CCCOC1COC1 95393fa6033d74f9775c0607c5a4e007 [1,0,0,1,0,0|2,0,0]=4 4818 B11R1.47 C/C=C/CCOCC1CCC1 c1f5f98dc0915224ee43fc98b4b535a1 [1,0,0,1,0,0|1,0,0]=3 4819 B11R1.47 C/C=C/CCOCC1CCO1 52e3994f983a21997041f2e758cc2fce [1,0,0,1,0,0|2,0,0]=4 4820 B11R1.47 C/C=C/CCOCC1COC1 e0fa849c20ec0fdecfd23e350d170d07 [1,0,0,1,0,0|2,0,0]=4 4821 B11R1.47 C/C=C/CCOC[C@@H]1CCO1 054241f8ffb4f6050ebb2ba7118eba07 [1,0,0,1,0,0|2,0,0]=4 4822 B11R1.47 C/C=C/CCOC[C@H]1CCO1 c9ab56c26cb6df9c34e50aec165d18c7 [1,0,0,1,0,0|2,0,0]=4 4823 B11R1.47 C/C=C/CNCCC1CCC1 a10ec2321e5ab4fabcf8aeba6429eb62 [1,0,0,1,0,0|1,0,0]=3 4824 B11R1.47 C/C=C/CNCCC1CCO1 a6030bf49728c35399c9a2422e3c2f42 [1,0,0,1,0,0|2,0,0]=4 4825 B11R1.47 C/C=C/CNCCC1COC1 e8cf28424e56aca208c4da9d572ddab9 [1,0,0,1,0,0|2,0,0]=4 4826 B11R1.47 C/C=C/CNCCN1CCC1 254e1ccaa8c3a2723928ede6ae8ae3b4 [1,0,0,1,0,0|2,0,0]=4 4827 B11R1.47 C/C=C/CNCC[C@@H]1CCO1 3bf3d01b1f19071691e455a399f86f1f [1,0,0,1,0,0|2,0,0]=4 4828 B11R1.47 C/C=C/COCCC1CCC1 fe0a6d9fbe075974d572710ce3986852 [1,0,0,1,0,0|1,0,0]=3 4829 B11R1.47 C/C=C/COCCC1CCO1 50b4d47c1d1a2dba44c3d1c412956836 [1,0,0,1,0,0|2,0,0]=4 4830 B11R1.47 C/C=C/COCCC1COC1 ae6d95d6f701bb02a43fd1cd17cbda32 [1,0,0,1,0,0|2,0,0]=4 4831 B11R1.47 C/C=C/COCCN1CCC1 1295a211da5d28da4dab1e632cdcb99e [1,0,0,1,0,0|2,0,0]=4 4832 B11R1.47 C/C=C/COCC[C@@H]1CCO1 7fd145d787f8356aa1b082a0c5fca5b0 [1,0,0,1,0,0|2,0,0]=4 4833 B11R1.47 C/C=C/COCC[C@H]1CCO1 c3239ed91db7c9b56acd7813749c6957 [1,0,0,1,0,0|2,0,0]=4 4834 B11R1.47 C/C=C\CCCNC1CCC1 2055337a209d5fb95610201ccedf7bd2 [1,0,0,1,0,0|1,0,0]=3 4835 B11R1.47 C/C=C\CCCNC1COC1 a79fcc5f92550b48ec17c462899d33ac [1,0,0,1,0,0|2,0,0]=4 4836 B11R1.47 C/C=C\CCCOC1CCC1 f030152beea03ef37a1b159363ba0979 [1,0,0,1,0,0|1,0,0]=3 4837 B11R1.47 C/C=C\CCCOC1COC1 3914cb60148711aaf8b325a4da0184f1 [1,0,0,1,0,0|2,0,0]=4 4838 B11R1.47 C/C=C\CCCOC1CSC1 f3973548c07e81d5fa35b3512fa9c929 [1,0,0,1,0,0|2,0,0]=4 4839 B11R1.47 C/C=C\CNCCC1CCC1 16b4436c4b4dfdb5e4ddf0cfa2a9f8ab [1,0,0,1,0,0|1,0,0]=3 4840 B11R1.47 C/C=C\CNCCC1CCO1 1a3b830202f13d7f455bad39ca6e5f39 [1,0,0,1,0,0|2,0,0]=4 4841 B11R1.47 C/C=C\CNCCC1COC1 2e679efe84cec10db8e1e9598a3ccaba [1,0,0,1,0,0|2,0,0]=4 4842 B11R1.47 C/C=C\CNCCN1CCC1 27bc64f81b4a5f076a4249ff0245c5b9 [1,0,0,1,0,0|2,0,0]=4 4843 B11R1.47 C/C=C\CNCC[C@@H]1CCO1 9c2723b6f82cf9e9e9ba91c480635a49 [1,0,0,1,0,0|2,0,0]=4 4844 B11R1.47 C/C=C\COCCC1CCC1 bec4a40e2086f85b9b5d8389bde4a22b [1,0,0,1,0,0|1,0,0]=3 4845 B11R1.47 C/C=C\COCCC1CCO1 c60217f7958fc24bc260ac2de14e392e [1,0,0,1,0,0|2,0,0]=4 4846 B11R1.47 C/C=C\COCCC1COC1 dc3a1c63042adbf3670afec309208e92 [1,0,0,1,0,0|2,0,0]=4 4847 B11R1.47 C/C=C\COCCN1CCC1 851f97b41a5656c2192538d250488a46 [1,0,0,1,0,0|2,0,0]=4 4848 B11R1.47 C/C=C\COCC[C@@H]1CCO1 e407de2be8255f132c0a7703197f522f [1,0,0,1,0,0|2,0,0]=4 4849 B11R1.47 C/C=C\COCC[C@H]1CCO1 bbdefe3fb480b452c1fcd2307969af6a [1,0,0,1,0,0|2,0,0]=4 4850 B11R1.47 CC/C=C/CCOC1CCC1 9a47b4bbd1bbe69ba650d40280c1411c [1,0,0,1,0,0|2,0,0]=4 4851 B11R1.47 CC/C=C/CNCC1CCC1 b2a93de45df7702525c9dec8c6a0cd72 [1,0,0,1,0,0|2,0,0]=4 4852 B11R1.47 CC/C=C/COCC1CCC1 2779ebbc30efd0c8dfcdace37da6dbc6 [1,0,0,1,0,0|2,0,0]=4 4853 B11R1.47 CC/C=C\CCNC1CCC1 5d5e28d4c31214a27cb49649a75f2c3a [1,0,0,1,0,0|2,0,0]=4 4854 B11R1.47 CC/C=C\CCOC1CCC1 aff89e7de14f2f074264b9f52364134b [1,0,0,1,0,0|2,0,0]=4 4855 B11R1.47 CC/C=C\COCC1CCC1 94df9e27699fb0c2fe7f9154a6f213d8 [1,0,0,1,0,0|2,0,0]=4 4856 B11R1.47 CC=CCCCOC1CCC1 fbfac07409372df4595fb40489bcab5a [1,0,0,1,0,0|1,0,0]=3 4857 B11R1.47 CC=CCCCOC1COC1 cb110244088d8c067d8a1aa26bd2dd0e [1,0,0,1,0,0|2,0,0]=4 4858 B11R1.47 CC=CCNCCC1CCC1 a017f252fb9fa167bcbee804fa1b7cdc [1,0,0,1,0,0|1,0,0]=3 4859 B11R1.47 CC=CCNCCC1CCO1 5d6ed605f5f270ddf9bc4e8cd393ccef [1,0,0,1,0,0|2,0,0]=4 4860 B11R1.47 CC=CCNCCC1COC1 1b2d0ef756c441d7c27dd42083037800 [1,0,0,1,0,0|2,0,0]=4 4861 B11R1.47 CC=CCOCCC1CCC1 887062c4c4c56aad7c6761594ae77c31 [1,0,0,1,0,0|1,0,0]=3 4862 B11R1.47 CC=CCOCCC1CCO1 72ec497498c760e93bae75782ba143f9 [1,0,0,1,0,0|2,0,0]=4 4863 B11R1.47 CC=CCOCCC1COC1 ee7210575a05acf8caf6948816c67494 [1,0,0,1,0,0|2,0,0]=4 4864 B11R1.47 CCCCCNCC1CCO1 747d73e477ba3b14fd230fc000ba1d9d [1,0,0,1,0,0|1,0,1]=4 4865 B11R1.47 CCCCCNC[C@@H]1CCO1 392043285bd95ae0ff440cf219d169df [1,0,0,1,0,0|1,0,1]=4 4866 B11R1.47 CCCCCNC[C@H]1CCO1 41699c21d22797562e5382c98c16cc28 [1,0,0,1,0,0|1,0,1]=4 4867 B11R1.47 CCCCCOCC1CCO1 2e0bdffc82cf36dcae98e3535b3870ad [1,0,0,1,0,0|1,0,1]=4 4868 B11R1.47 CCCCCOC[C@@H]1CCO1 b570869864ddf9b5b97f907b686a338e [1,0,0,1,0,0|1,0,1]=4 4869 B11R1.47 CCCCCOC[C@H]1CCO1 90d4e592e9f8fd134e8b79d08ad995c8 [1,0,0,1,0,0|1,0,1]=4 4870 B11R1.47 CCCCNCCC1CCO1 67f965a722148d216740f7201bb6dc41 [1,0,0,1,0,0|1,0,1]=4 4871 B11R1.47 CCCCNCC[C@@H]1CCO1 aa789319497701350747a24114258a67 [1,0,0,1,0,0|1,0,1]=4 4872 B11R1.47 CCCCOCCC1CCO1 0d19e3cf6ded3e448b9a2892fc698aa6 [1,0,0,1,0,0|1,0,1]=4 4873 B11R1.47 CCCCOCC[C@@H]1CCO1 4c92bef55ca26b5a622f3bbe7b5f493e [1,0,0,1,0,0|1,0,1]=4 4874 B11R1.47 CCCCOCC[C@H]1CCO1 34694f9909c56c54c4a207264ca54746 [1,0,0,1,0,0|1,0,1]=4 4875 B11R1.47 Cl/C=C/CNCCC1CCC1 31af5f55b65b5ec84211973845423e18 [1,0,0,1,0,0|2,0,0]=4 4876 B11R1.47 Cl/C=C/COCCC1CCC1 27cc61e796323857a46ad0a78d544563 [1,0,0,1,0,0|2,0,0]=4 4877 B11R1.47 Cl/C=C\CNCCC1CCC1 c7d359edd0c3ca27bd336510adfc5ddb [1,0,0,1,0,0|2,0,0]=4 4878 B11R1.47 Cl/C=C\COCCC1CCC1 ba39e23457f2c3a100ec924b383645e7 [1,0,0,1,0,0|2,0,0]=4 4879 B11R1.47 ClC=CCOCCC1CCC1 c48f72a75efd35df6d903c90d28252fc [1,0,0,1,0,0|2,0,0]=4 4880 B11R1.47 O/C=C\CNCCC1CCC1 365baf71b35d4a972022ea2152fc3069 [1,0,0,1,0,0|1,0,0]=3 4881 B11R1.47 O/C=C\CNCCC1CCO1 f8f8e3c94eddb00a548a54cf3e4fb478 [1,0,0,1,0,0|2,0,0]=4 4882 B11R1.47 O/C=C\CNCCC1COC1 c3998d1f9e8352477aae57cd78624dfa [1,0,0,1,0,0|2,0,0]=4 4883 B11R1.47 O/C=C\CNCCN1CCC1 debe4f44ab65349dbe2c1cc4d47d09c7 [1,0,0,1,0,0|2,0,0]=4 4884 B11R1.47 O/C=C\CNCC[C@@H]1CCO1 632c7caa502aaf5517d5611751937f10 [1,0,0,1,0,0|2,0,0]=4 4885 B11R1.47 OCCCCCCN1CCC1 dfe981e98bf6d51c7c123615845307d8 [1,0,0,1,0,0|1,0,1]=4 4886 B11R1.47 OCCCCCNC1CCC1 29510c75b03d87ee75f1b9d5bd17ea59 [1,0,0,1,0,0|1,0,1]=4 4887 B11R1.47 OCCCCNCC1CCC1 b7e9410c195c187fafce32b9457cc986 [1,0,0,1,0,0|1,0,1]=4 4888 B11R1.47 OCCCNCCC1CCC1 85e191147830ea37186697a32920468c [1,0,0,1,0,0|1,0,1]=4 4889 B11R1.51 CCN1CCCCCC1CO 5b9c33c66c2a14262594aac64dae96e9 [1,0,0,1,0,0|1,0,1]=4 4890 B11R1.51 OCC1CCCCCN1CO e6edcd321a0314c5c9405ac25a95c290 [1,0,0,1,0,0|2,0,0]=4 4891 B11R1.52 C/C=C/CN[C@H]1C[C@@H]1COC a4a342b93c16d082c0393a8650e93dd0 [1,0,0,1,0,0|2,0,0]=4 4892 B11R1.52 C/C=C/CN[C@H]1C[C@H]1COC cb5474e78c0f639bde5733e6283a7611 [1,0,0,1,0,0|2,0,0]=4 4893 B11R1.52 C/C=C\CN[C@H]1C[C@@H]1COC 6645ffebb1d804c86a896600946cdfcb [1,0,0,1,0,0|2,0,0]=4 4894 B11R1.52 C/C=C\CN[C@H]1C[C@H]1COC 3f5a1b26f38b2516254f12fd19f44de0 [1,0,0,1,0,0|2,0,0]=4 4895 B11R1.52 COC[C@@H]1C[C@@H]1NC/C=C\O 48e3fe9f9110c7af4c4a6b184c95c777 [1,0,0,1,0,0|2,0,0]=4 4896 B11R1.52 COC[C@H]1C[C@@H]1NC/C=C\O 3410fe6f57d2a3c1f86d77cd8042b298 [1,0,0,1,0,0|2,0,0]=4 4897 B11R1.99 C/C=C/CCCOCC1CC1 d4749e9a229067cc741cc3ff45b28fa9 [1,0,0,1,0,0|1,0,0]=3 4898 B11R1.99 C/C=C/CCOCCC1CC1 a1dbd6fac48dc1acad62b2205f7eabe4 [1,0,0,1,0,0|1,0,0]=3 4899 B11R1.99 C/C=C/CNCCOC1CC1 f154ff6a464140561efa5c3b70022d08 [1,0,0,1,0,0|2,0,0]=4 4900 B11R1.99 C/C=C/COCCCC1CC1 fe80b85ffe2ee035088ada22c7108f25 [1,0,0,1,0,0|1,0,0]=3 4901 B11R1.99 C/C=C/COCCOC1CC1 28d93c956208d567823d7da6c984fbda [1,0,0,1,0,0|2,0,0]=4 4902 B11R1.99 C/C=C\CCCNCC1CC1 d18bf6f6a7846d955205e468458723c5 [1,0,0,1,0,0|1,0,0]=3 4903 B11R1.99 C/C=C\CCCOCC1CC1 d2f63b175b71e5c602a41c7866586a15 [1,0,0,1,0,0|1,0,0]=3 4904 B11R1.99 C/C=C\CNCCOC1CC1 2523e9cdd6ae9ccb6f358f595b9ed280 [1,0,0,1,0,0|2,0,0]=4 4905 B11R1.99 C/C=C\COCCCC1CC1 43b2696c9fd59e4d90577f2149fa76d7 [1,0,0,1,0,0|1,0,0]=3 4906 B11R1.99 C/C=C\COCCOC1CC1 5c42d5be3a03a6a549b61c8c666c5498 [1,0,0,1,0,0|2,0,0]=4 4907 B11R1.99 CC/C=C/CCOCC1CC1 294b7410b3559ceb13f45999d1d632f0 [1,0,0,1,0,0|2,0,0]=4 4908 B11R1.99 CC/C=C/CNCCC1CC1 7cfe514ab683e2072aef3cc2de73ac7d [1,0,0,1,0,0|2,0,0]=4 4909 B11R1.99 CC/C=C/COCCC1CC1 e60f718b4365dafcc26e4560f648dddc [1,0,0,1,0,0|2,0,0]=4 4910 B11R1.99 CC/C=C\CCCOC1CC1 227b2bc3279ea5e4c65b1c3efd9165f5 [1,0,0,1,0,0|2,0,0]=4 4911 B11R1.99 CC/C=C\CCNCC1CC1 1ad815cda3a906ca48f48c817cca453b [1,0,0,1,0,0|2,0,0]=4 4912 B11R1.99 CC/C=C\CCOCC1CC1 1ee9fb3aed74fc375d4b46d5a41dfafc [1,0,0,1,0,0|2,0,0]=4 4913 B11R1.99 CC/C=C\COCCC1CC1 045eaad199294c15189cf29975640228 [1,0,0,1,0,0|2,0,0]=4 4914 B11R1.99 CC=CCCCOCC1CC1 527654ad1b985a93ae396cc8fcc0f7a6 [1,0,0,1,0,0|1,0,0]=3 4915 B11R1.99 CC=CCNCCOC1CC1 3bf09e2fd9a84f2edc7f15b54c2686d4 [1,0,0,1,0,0|2,0,0]=4 4916 B11R1.99 CC=CCOCCOC1CC1 a516c9d45f2488ebf1666bf35e408768 [1,0,0,1,0,0|2,0,0]=4 4917 B11R1.99 CCCNCCCC=C1CC1 438ec4f990cabe2abefdad450931d6ef [1,0,0,1,0,0|2,0,0]=4 4918 B11R1.99 CCCOCCCC=C1CC1 9dc8f486e6f26e4fac5d7f1cdb95b9cc [1,0,0,1,0,0|2,0,0]=4 4919 B11R1.99 Cl/C=C/COCCCC1CC1 adc7c2af229baae18740378ba1f981b8 [1,0,0,1,0,0|2,0,0]=4 4920 B11R1.99 Cl/C=C\COCCCC1CC1 7ab37891a907770071069a543b1680de [1,0,0,1,0,0|2,0,0]=4 4921 B11R1.99 O/C=C\CNCCOC1CC1 ae9555f9ddb4141572df09006bb44481 [1,0,0,1,0,0|2,0,0]=4 4922 B11R1.99 OCCCCCCNC1CC1 0d1970ac99e9339481c8a0cf0b894a01 [1,0,0,1,0,0|1,0,1]=4 4923 B11R1.99 OCCCCCNCC1CC1 e5cd3e957103009dc20c2419554e43f0 [1,0,0,1,0,0|1,0,1]=4 4924 B11R1.99 OCCCCNCCC1CC1 3da49b01f3378b00997b4e889f8cde04 [1,0,0,1,0,0|1,0,1]=4 4925 B11R1.99 OCNCCCOCC1CC1 9021ba10b33b6b973510c5b6cee3ef4a [1,0,0,1,0,0|2,0,0]=4 4926 B11R1.109 CCCN1CCCC1CCO 0546c8bf6c6bab9276b0a60be9bf47e2 [1,0,0,1,0,0|1,0,1]=4 4927 B11R1.109 CCCN1CCC[C@@H]1CCO 4278d4edf676540698dba79e59f9ddee [1,0,0,1,0,0|1,0,1]=4 4928 B11R1.109 COC[C@@H]1CCC[C@@H]1NCO 1d37345dc9ef9e844608dd7a200d5955 [1,0,0,1,0,0|2,0,0]=4 4929 B11R1.109 COC[C@H]1CCC[C@H]1NCO ffb941df1af1be5a10674826ed773194 [1,0,0,1,0,0|2,0,0]=4 4930 B11R1.117 CCNC1CCCCCCC1 50d835a0fc710efafe0ab4df29e9a1e9 [1,0,0,1,0,0|1,0,1]=4 4931 B11R1.117 CCOC1CC/C=C/CCC1 dfbedb66b3c9957dc849e0852c7e305d [1,0,0,1,0,0|2,0,0]=4 4932 B11R1.117 CCOC1CC/C=C\CCC1 63e275c4a61ab775429a8cd0245cc2d7 [1,0,0,1,0,0|2,0,0]=4 4933 B11R1.117 CCOC1CCC=CCCC1 80d261f8a890bfa74e09757eb2e73342 [1,0,0,1,0,0|2,0,0]=4 4934 B11R1.117 CCOC1CCCCCCC1 8de234ac4018711f0809089a1dbd7f4d [1,0,0,1,0,0|1,0,1]=4 4935 B11R1.117 CCO[C@@H]1CCC=CCCC1 855fa20408fc85ff54969a954670dd51 [1,0,0,1,0,0|2,0,0]=4 4936 B11R1.117 FCNC1CCCCCCC1 7400798fb063a3f04c818515ca61aa4d [1,0,0,1,0,0|2,0,0]=4 4937 B11R1.117 FCOC1CCCCCCC1 a2ade3c88ec76dedf0ca21d312063bec [1,0,0,1,0,0|2,0,0]=4 4938 B11R1.117 O=CNC1CCCCCCC1 5c70e5da68cf4293563a7a3630027bae [1,0,0,1,0,0|1,0,1]=4 4939 B11R1.117 OCCN1CCCCCCC1 8113da9194205273e686fb6bd2d23931 [1,0,0,1,0,0|1,0,1]=4 4940 B11R1.117 OCNC1CCCCCCC1 b3518fc0dbe59b5227ec4eb3c1d3682c [1,0,0,1,0,0|1,0,0]=3 4941 B11R1.180 C/C=C/CNC1CCCC1O 7a8f134d0f3738b13d1c931269c42c21 [1,0,0,1,0,0|2,0,0]=4 4942 B11R1.180 C/C=C/CN[C@@H]1CCC[C@@H]1O 13cfd913d93c49af85888545e9cb6136 [1,0,0,1,0,0|2,0,0]=4 4943 B11R1.180 C/C=C/CN[C@@H]1CCC[C@H]1O a05420e1efe991b330d4da507420bd43 [1,0,0,1,0,0|2,0,0]=4 4944 B11R1.180 C/C=C/CN[C@H]1CCC[C@@H]1O 5b32ce8adf841cc3120552b1d970011e [1,0,0,1,0,0|2,0,0]=4 4945 B11R1.180 C/C=C/CN[C@H]1CCC[C@H]1O d429644ad6c6e7539fe3acca3dc46a3e [1,0,0,1,0,0|2,0,0]=4 4946 B11R1.180 C/C=C/COC1CCCC1C f14b65d135467ebf75b2c5f0dde6438a [1,0,0,1,0,0|1,0,0]=3 4947 B11R1.180 C/C=C/COC1COCC1C 0260255fdacc20aea41a75f183c58a22 [1,0,0,1,0,0|2,0,0]=4 4948 B11R1.180 C/C=C/CO[C@@H]1CCC[C@@H]1C 60a8408ce628f235ec450d67de8f40c5 [1,0,0,1,0,0|1,0,0]=3 4949 B11R1.180 C/C=C/CO[C@@H]1CCC[C@H]1C 4958320dc4ad1b2b6033a91c8da5e2a2 [1,0,0,1,0,0|1,0,0]=3 4950 B11R1.180 C/C=C/CO[C@@H]1CCC[C@H]1F f4f72e3620439cc52d140ef8787d0977 [1,0,0,1,0,0|2,0,0]=4 4951 B11R1.180 C/C=C/CO[C@@H]1COC[C@@H]1C d505e00fab96f66cb228b4d81abfb17d [1,0,0,1,0,0|2,0,0]=4 4952 B11R1.180 C/C=C/CO[C@H]1CCC[C@@H]1C 5e0a93ff30af4a3e722f5f711d577401 [1,0,0,1,0,0|1,0,0]=3 4953 B11R1.180 C/C=C/CO[C@H]1CCC[C@H]1C 3ff9d17212a951f29ee1f39caf8da739 [1,0,0,1,0,0|1,0,0]=3 4954 B11R1.180 C/C=C/CO[C@H]1COC[C@@H]1C fb52087a8c5057226f71406ec9f47144 [1,0,0,1,0,0|2,0,0]=4 4955 B11R1.180 C/C=C/CO[C@H]1COC[C@H]1C 06788e20565e78d65d535b23b96d66e8 [1,0,0,1,0,0|2,0,0]=4 4956 B11R1.180 C/C=C\CNC1CCCC1O ab33002276261bd896759c049727bd7f [1,0,0,1,0,0|2,0,0]=4 4957 B11R1.180 C/C=C\CN[C@@H]1CCC[C@@H]1O 697c83903b53876a68cfed6150a66227 [1,0,0,1,0,0|2,0,0]=4 4958 B11R1.180 C/C=C\CN[C@@H]1CCC[C@H]1O 6f23b4c3533b9cb69313481d05d6eb8a [1,0,0,1,0,0|2,0,0]=4 4959 B11R1.180 C/C=C\CN[C@H]1CCC[C@@H]1O 69640c8af2270719b42acd979896b868 [1,0,0,1,0,0|2,0,0]=4 4960 B11R1.180 C/C=C\CN[C@H]1CCC[C@H]1O 5c8bbf43c995047f0f3186375379d834 [1,0,0,1,0,0|2,0,0]=4 4961 B11R1.180 C/C=C\COC1CCCC1C 0487d04407d11e9183986c61f80ebb70 [1,0,0,1,0,0|1,0,0]=3 4962 B11R1.180 C/C=C\COC1COCC1C 7136579567930f890e708778127d318e [1,0,0,1,0,0|2,0,0]=4 4963 B11R1.180 C/C=C\CO[C@@H]1CCC[C@@H]1C 06b8edf8e2813b026a3b9cbc8598f4d7 [1,0,0,1,0,0|1,0,0]=3 4964 B11R1.180 C/C=C\CO[C@@H]1CCC[C@H]1C d831bcdd1fcc541f3350d00669274629 [1,0,0,1,0,0|1,0,0]=3 4965 B11R1.180 C/C=C\CO[C@@H]1CCC[C@H]1F b816faa08ce395d0291dc0395ac22e34 [1,0,0,1,0,0|2,0,0]=4 4966 B11R1.180 C/C=C\CO[C@@H]1COC[C@@H]1C dc42758fa29a5aa08e3adf4351cbbe0d [1,0,0,1,0,0|2,0,0]=4 4967 B11R1.180 C/C=C\CO[C@H]1CCC[C@@H]1C dd0cf210517d230bcab3f8d2208d4959 [1,0,0,1,0,0|1,0,0]=3 4968 B11R1.180 C/C=C\CO[C@H]1CCC[C@H]1C 0acf76a0d0a82e7797697ac4415bcb62 [1,0,0,1,0,0|1,0,0]=3 4969 B11R1.180 C/C=C\CO[C@H]1COC[C@@H]1C 88149656973965d6e294924b988febc6 [1,0,0,1,0,0|2,0,0]=4 4970 B11R1.180 C/C=C\CO[C@H]1COC[C@H]1C 0384c157ffc85a5a46f85020d39c570d [1,0,0,1,0,0|2,0,0]=4 4971 B11R1.180 CC/C=C/CN1CCCC1C 4c5b655e79e3f4fbdf4f420a3122049a [1,0,0,1,0,0|2,0,0]=4 4972 B11R1.180 CC/C=C/CN1CCC[C@@H]1C ed4bb17962041fd6aa5ddbb2efcf7842 [1,0,0,1,0,0|2,0,0]=4 4973 B11R1.180 CC/C=C/CN1CCC[C@H]1C 0ba68089ba3f37c679502c085af76bed [1,0,0,1,0,0|2,0,0]=4 4974 B11R1.180 CC1CCCC1OC/C=C/Cl a0d8e12676aa8f28611d2ac01bc3f541 [1,0,0,1,0,0|2,0,0]=4 4975 B11R1.180 CC1CCCC1OC/C=C\Cl e291b509232066198fc42867c9e56c3d [1,0,0,1,0,0|2,0,0]=4 4976 B11R1.180 CC1CCCN1CCCCO a673de70102c9ce1017d52deb044963b [1,0,0,1,0,0|1,0,1]=4 4977 B11R1.180 CC=CCNC1CCCC1O 9f7301c1ceb0e20b0095d568bad68bf7 [1,0,0,1,0,0|2,0,0]=4 4978 B11R1.180 CC=CCN[C@@H]1CCC[C@H]1O 2b0e1553cdbc21c8610c9152ab78f51f [1,0,0,1,0,0|2,0,0]=4 4979 B11R1.180 CC=CCN[C@H]1CCC[C@@H]1O 12248c2b5cdcbf34d3c816c0283c5345 [1,0,0,1,0,0|2,0,0]=4 4980 B11R1.180 CCCCCN1CCCC1O c398c8293942e8b6d8331839eac42dcd [1,0,0,1,0,0|1,0,1]=4 4981 B11R1.180 CCCCNC1CCCC1O 246f31f8097c61c8292d23ee442adf29 [1,0,0,1,0,0|1,0,1]=4 4982 B11R1.180 CCCCN[C@@H]1CCC[C@@H]1O 8e8e24cd1c7e98f8ca1808e722a25c2b [1,0,0,1,0,0|1,0,1]=4 4983 B11R1.180 CCCCN[C@@H]1CCC[C@H]1O 702179409785dfcf937fe4220b12fea6 [1,0,0,1,0,0|1,0,1]=4 4984 B11R1.180 CCCCN[C@H]1CCC[C@@H]1O 6d73b740216fb5fde874206510ff282a [1,0,0,1,0,0|1,0,1]=4 4985 B11R1.180 CCCCN[C@H]1CCC[C@H]1O 2945bb9484d0a3e284def0f3103a9fff [1,0,0,1,0,0|1,0,1]=4 4986 B11R1.180 CCCCOC1CCC=C1Br 8a3cb50e7aecbb405735ad686b7f8b9f [1,0,0,1,0,0|2,0,0]=4 4987 B11R1.180 CCCNCC1CCCC1O 92cff7131ea3a21e6f1efd4706322900 [1,0,0,1,0,0|1,0,1]=4 4988 B11R1.180 CN1CCCC1CCNCO d2a6824222e5326694bca846ec25ac24 [1,0,0,1,0,0|2,0,0]=4 4989 B11R1.180 CN1CCC[C@@H]1CCNCO 6811b6f644ef963721db8b18a4afc0bd [1,0,0,1,0,0|2,0,0]=4 4990 B11R1.180 CN1CCC[C@H]1CCNCO 515316e64c3097f61d0f42ea75b40978 [1,0,0,1,0,0|2,0,0]=4 4991 B11R1.180 C[C@@H]1CCCN1CCCCO 52b2ae2b2f26360d62d1d124caf59cc6 [1,0,0,1,0,0|1,0,1]=4 4992 B11R1.180 C[C@@H]1CCC[C@@H]1OC/C=C/Cl 87ed8bc7e63988f82519ad0512b9d33d [1,0,0,1,0,0|2,0,0]=4 4993 B11R1.180 C[C@@H]1CCC[C@@H]1OC/C=C\Cl 51267426fff77199f66a5d0599ea93a4 [1,0,0,1,0,0|2,0,0]=4 4994 B11R1.180 C[C@@H]1CCC[C@H]1OC/C=C/Cl 13ec0af170690e338ba9e4291ba0b61c [1,0,0,1,0,0|2,0,0]=4 4995 B11R1.180 C[C@@H]1CCC[C@H]1OC/C=C\Cl ec7dbb737f24b84d4183c0a4c83be82d [1,0,0,1,0,0|2,0,0]=4 4996 B11R1.180 C[C@H]1CCCN1CCCCO dec6a5199f71a07249a314463f71af58 [1,0,0,1,0,0|1,0,1]=4 4997 B11R1.180 C[C@H]1CCC[C@@H]1OC/C=C/Cl a3596b79294b1d3132de2888c0aa0694 [1,0,0,1,0,0|2,0,0]=4 4998 B11R1.180 C[C@H]1CCC[C@@H]1OC/C=C\Cl 5de45b91fa987b06ad2dd3fd54a24e96 [1,0,0,1,0,0|2,0,0]=4 4999 B11R1.180 C[C@H]1CCC[C@H]1OC/C=C/Cl a0c85ea0aadcc10ec2ef867e0baf2062 [1,0,0,1,0,0|2,0,0]=4 5000 B11R1.180 C[C@H]1CCC[C@H]1OC/C=C\Cl 298ce90370a3728bd97b16210d0d3661 [1,0,0,1,0,0|2,0,0]=4 5001 B11R1.180 O/C=C\CNC1CCCC1O ed03bdaebb892b26317830367972c3bc [1,0,0,1,0,0|2,0,0]=4 5002 B11R1.180 O/C=C\CN[C@@H]1CCC[C@@H]1O c62017ef62a1b3444c0ccc8a3c5fde55 [1,0,0,1,0,0|2,0,0]=4 5003 B11R1.180 O/C=C\CN[C@@H]1CCC[C@H]1O 58e347fde8e4e107e2cc3eb310c4f5c1 [1,0,0,1,0,0|2,0,0]=4 5004 B11R1.180 O/C=C\CN[C@H]1CCC[C@@H]1O 4c5a26de618ace7ecf651160c7fe9e94 [1,0,0,1,0,0|2,0,0]=4 5005 B11R1.180 O/C=C\CN[C@H]1CCC[C@H]1O aec024619f546609ba3cbb691344af2a [1,0,0,1,0,0|2,0,0]=4 5006 B11R1.181 C/C=C/CNC1CCC1OC 298cda18e0629655744f9099eac78c92 [1,0,0,1,0,0|2,0,0]=4 5007 B11R1.181 C/C=C/CN[C@@H]1CC[C@@H]1OC 13dc412fcebe34e814d4c754a6e61c3e [1,0,0,1,0,0|2,0,0]=4 5008 B11R1.181 C/C=C/CN[C@@H]1CC[C@H]1OC c06c9a489e6b08d917b6406b037c20ff [1,0,0,1,0,0|2,0,0]=4 5009 B11R1.181 C/C=C/CN[C@H]1CC[C@@H]1OC d20779271f343930c89ce2e4af2907d7 [1,0,0,1,0,0|2,0,0]=4 5010 B11R1.181 C/C=C/CN[C@H]1CC[C@H]1OC 671a30f4c12e3ba10070783690d629aa [1,0,0,1,0,0|2,0,0]=4 5011 B11R1.181 C/C=C\CNC1CCC1OC f87edf50671ef1ba8ff024da3441502f [1,0,0,1,0,0|2,0,0]=4 5012 B11R1.181 C/C=C\CN[C@@H]1CC[C@@H]1OC 7fbe18b8ad16036fd001591b7e27e7ed [1,0,0,1,0,0|2,0,0]=4 5013 B11R1.181 C/C=C\CN[C@@H]1CC[C@H]1OC c60c0666bee09c130b4c925c387e3ed5 [1,0,0,1,0,0|2,0,0]=4 5014 B11R1.181 C/C=C\CN[C@H]1CC[C@@H]1OC b305f05d903d648bf11fe7cf30acebf1 [1,0,0,1,0,0|2,0,0]=4 5015 B11R1.181 C/C=C\CN[C@H]1CC[C@H]1OC 2c30d393c3e30dea2a0806e7e62444f3 [1,0,0,1,0,0|2,0,0]=4 5016 B11R1.181 CC/C=C/CN1CCC1CC cfa2436c8d90e40269073e89f0d9d447 [1,0,0,1,0,0|2,0,0]=4 5017 B11R1.181 CCC1CCN1CCCCO 6dcefaab7839eafb56d4489f1ad59479 [1,0,0,1,0,0|1,0,1]=4 5018 B11R1.181 CCCCCN1CCC1CO 6df1327feaf83954da6b9a067cabb546 [1,0,0,1,0,0|1,0,1]=4 5019 B11R1.181 CCCCCN1CC[C@@H]1CO ea98adfd739b3f69e4fd108b2760c455 [1,0,0,1,0,0|1,0,1]=4 5020 B11R1.181 CCCCCN1CC[C@H]1CO 762996ba67c76ae98634a15c6d26763b [1,0,0,1,0,0|1,0,1]=4 5021 B11R1.181 COC1CCC1NC/C=C\O af2fce79188e7eefc83061aa0ff2a46b [1,0,0,1,0,0|2,0,0]=4 5022 B11R1.181 CO[C@@H]1CC[C@@H]1NC/C=C\O 6fcd30f92d8d04cb2dff6155617e0d19 [1,0,0,1,0,0|2,0,0]=4 5023 B11R1.181 CO[C@@H]1CC[C@H]1NC/C=C\O e408696777269302d7b07dbcd79f81b7 [1,0,0,1,0,0|2,0,0]=4 5024 B11R1.181 CO[C@H]1CC[C@@H]1NC/C=C\O fae2fee7494676ef15e9eaa37c97ce1f [1,0,0,1,0,0|2,0,0]=4 5025 B11R1.181 CO[C@H]1CC[C@H]1NC/C=C\O 5041c66903db6e714103439e413eabfc [1,0,0,1,0,0|2,0,0]=4 5026 B11R1.190 C/C=C/CNCC1CCN1C 873590ea9bdd57f345545ba543c4e9b6 [1,0,0,1,0,0|2,0,0]=4 5027 B11R1.190 C/C=C/COCC1CCC1F e0867ac0daff08a56da3de3468315b4b [1,0,0,1,0,0|2,0,0]=4 5028 B11R1.190 C/C=C/COCC1CCN1C 501d991611f8ba3f643683d80d1661c4 [1,0,0,1,0,0|2,0,0]=4 5029 B11R1.190 C/C=C/COC[C@@H]1CCN1C 4c6776a6771852f698c0440a9e1d662e [1,0,0,1,0,0|2,0,0]=4 5030 B11R1.190 C/C=C/COC[C@H]1CCN1C 211af37b7ff92616d784e6bebc505ca6 [1,0,0,1,0,0|2,0,0]=4 5031 B11R1.190 C/C=C\CNCC1CCN1C 27fe75147ef4facded55f995496aa7d6 [1,0,0,1,0,0|2,0,0]=4 5032 B11R1.190 C/C=C\COCC1CCC1F 5c9128d797012117516942fca6562279 [1,0,0,1,0,0|2,0,0]=4 5033 B11R1.190 C/C=C\COCC1CCN1C 71ebf0676a735fe3afa66f9a40738b0a [1,0,0,1,0,0|2,0,0]=4 5034 B11R1.190 C/C=C\COC[C@@H]1CCN1C e56859424f659d6858b35feee0ef5cde [1,0,0,1,0,0|2,0,0]=4 5035 B11R1.190 C/C=C\COC[C@H]1CCN1C 7b679ca7e6b0b641b25b08e4042f6d25 [1,0,0,1,0,0|2,0,0]=4 5036 B11R1.190 CC/C=C/CN[C@@H]1CC[C@H]1C 1faad789915f89670e5991a75456bc8e [1,0,0,1,0,0|2,0,0]=4 5037 B11R1.190 CC/C=C/CN[C@H]1CC[C@H]1C 69586106f34ad43fe495d59a38d2961e [1,0,0,1,0,0|2,0,0]=4 5038 B11R1.190 CCCCCNC1CCC1O 410aa34364c82b055bc5985073043c05 [1,0,0,1,0,0|1,0,1]=4 5039 B11R1.190 CCCCCN[C@@H]1CC[C@@H]1O 3bfddf88d98d6ab4994d6784c3fd6517 [1,0,0,1,0,0|1,0,1]=4 5040 B11R1.190 CCCCCN[C@@H]1CC[C@H]1O 34c028bce85047ac0c4cc16404f41087 [1,0,0,1,0,0|1,0,1]=4 5041 B11R1.190 CCCCCN[C@H]1CC[C@@H]1O 5ea4d0eba39dbdbad00d06d8e47d31a3 [1,0,0,1,0,0|1,0,1]=4 5042 B11R1.190 CCCCCN[C@H]1CC[C@H]1O cba60cfc8498948982fdaefc9b5ecaf9 [1,0,0,1,0,0|1,0,1]=4 5043 B11R1.190 CN1CCC1CNC/C=C\O e816450dfa81f1028dfe60bfd5f50fa3 [1,0,0,1,0,0|2,0,0]=4 5044 B11R1.190 C[C@@H]1CC[C@@H]1NCCCCO c2c4c81afcf85f006543b04a37b79bd9 [1,0,0,1,0,0|1,0,1]=4 5045 B11R1.190 C[C@@H]1CC[C@H]1NCCCCO a770862bc7b5c32bf6b9dd31ff6f528b [1,0,0,1,0,0|1,0,1]=4 5046 B11R1.203 C/C=C/CN1CCCCCC1 666c22a5090c39984e70ecd82c1946eb [1,0,0,1,0,0|1,0,0]=3 5047 B11R1.203 C/C=C/CN1CCCOCC1 c0ba71063d3afe9da8ef5920aaad2063 [1,0,0,1,0,0|2,0,0]=4 5048 B11R1.203 C/C=C\CN1CCCCCC1 e8c0232908e1eb1db98e848e6094ee28 [1,0,0,1,0,0|1,0,0]=3 5049 B11R1.203 C/C=C\CN1CCCOCC1 12ad9ecc2a40b6bf28c52eea31b16a3b [1,0,0,1,0,0|2,0,0]=4 5050 B11R1.203 CCCNC1CCC=CCC1 66b0fafa8f9e791c05b64af469ab8bf8 [1,0,0,1,0,0|2,0,0]=4 5051 B11R1.203 CCNCC1CCCCCC1 1aa480dec958b76c9e0d1e012a7b0c7e [1,0,0,1,0,0|1,0,1]=4 5052 B11R1.203 CCOCC1CCCCCC1 01b51887c2e87b16f92024e3ab52aa12 [1,0,0,1,0,0|1,0,1]=4 5053 B11R1.203 Cl/C=C/CN1CCCCCC1 24461ad4a6ffd117b720d61a61db7bc6 [1,0,0,1,0,0|2,0,0]=4 5054 B11R1.203 Cl/C=C\CN1CCCCCC1 f1e245d9def68f804bc8527fd328937a [1,0,0,1,0,0|2,0,0]=4 5055 B11R1.203 FCNCC1CCCCCC1 6b0a864b08319c0eb2cd929ab72f5c9a [1,0,0,1,0,0|2,0,0]=4 5056 B11R1.203 FCOCC1CCCCCC1 180d24b69547b24cf74154898667164f [1,0,0,1,0,0|2,0,0]=4 5057 B11R1.203 O/C=C\CN1CCCCCC1 65e5d9a6ee93480c1dc960e79cb08e59 [1,0,0,1,0,0|1,0,0]=3 5058 B11R1.203 O/C=C\CN1CCCOCC1 3aecf710be0941194a97f02f37f98562 [1,0,0,1,0,0|2,0,0]=4 5059 B11R1.203 O=CNCC1CCCCCC1 d98c7cfb82f8e40dc854108c9b87d8cb [1,0,0,1,0,0|1,0,1]=4 5060 B11R1.203 OCCCN1CCCCCC1 7f2d557aa733fe77dff5c07ecf424d3d [1,0,0,1,0,0|1,0,1]=4 5061 B11R1.203 OCCNC1CCCCCC1 c34d7831eecf639a92fdf0e477751492 [1,0,0,1,0,0|1,0,1]=4 5062 B11R1.203 OCNCC1CCCCCC1 e9833a8d1bf4aa3da84560a76f5e3a41 [1,0,0,1,0,0|1,0,0]=3 5063 B11R1.229 C/C=C/CNCC1CC1CO 8e861c8c351176542c3197fcebe812bb [1,0,0,1,0,0|2,0,0]=4 5064 B11R1.229 C/C=C\CNCC1CC1CO f42a1d18f6af68efa02467cf8c16167c [1,0,0,1,0,0|2,0,0]=4 5065 B11R1.229 CCCCCN[C@@H]1C[C@H]1CO 8b78761299fc677978c31200332d44e4 [1,0,0,1,0,0|1,0,1]=4 5066 B11R1.229 CCCCCN[C@H]1C[C@@H]1CO ad2e5841e2feda90ba186db0742959c3 [1,0,0,1,0,0|1,0,1]=4 5067 B11R1.229 CCCCCN[C@H]1C[C@H]1CO 966bfeaedb6c59f4f814c88b606b70dc [1,0,0,1,0,0|1,0,1]=4 5068 B11R1.229 CCCCNCC1CC1CO a1a4d242388b6021686f25289a5a519b [1,0,0,1,0,0|1,0,1]=4 5069 B11R1.229 O/C=C\CNCC1CC1CO 7c2f01222eaaaac36d06a6753857e393 [1,0,0,1,0,0|2,0,0]=4 5070 B11R1.232 C/C=C/CN1CCC1CCO c560260d23844cce457f68d4d37ede6e [1,0,0,1,0,0|2,0,0]=4 5071 B11R1.232 C/C=C/CN1CCC1COC 3838e9aeb364cc937d930c3f9c900b33 [1,0,0,1,0,0|2,0,0]=4 5072 B11R1.232 C/C=C/CN1CC[C@@H]1COC 4808527a07be663736d1a27d5ab7b24b [1,0,0,1,0,0|2,0,0]=4 5073 B11R1.232 C/C=C/CN1CC[C@H]1COC a3560b07185d8f8f545e1e715d2dc624 [1,0,0,1,0,0|2,0,0]=4 5074 B11R1.232 C/C=C\CN1CCC1CCO 066a0e5002044052527b6de48260be8c [1,0,0,1,0,0|2,0,0]=4 5075 B11R1.232 C/C=C\CN1CCC1COC 054320a2350d6e766ad6823b645277e0 [1,0,0,1,0,0|2,0,0]=4 5076 B11R1.232 C/C=C\CN1CC[C@@H]1COC de2b9fb5163bcf18965fb3eea19187d2 [1,0,0,1,0,0|2,0,0]=4 5077 B11R1.232 C/C=C\CN1CC[C@H]1COC 8d7d2b0f6bf1eeb19a825665f0c7215d [1,0,0,1,0,0|2,0,0]=4 5078 B11R1.232 CCCCN1CCC1CCO cf9681096b6146bae176348e6db94d0e [1,0,0,1,0,0|1,0,1]=4 5079 B11R1.232 COCC1CCN1C/C=C\O 12a6649a648ecc38009d2f513e921758 [1,0,0,1,0,0|2,0,0]=4 5080 B11R1.232 COC[C@@H]1CCN1C/C=C\O 1cea49411397fe99e2e27e29517bc5c0 [1,0,0,1,0,0|2,0,0]=4 5081 B11R1.232 COC[C@H]1CCN1C/C=C\O 18cf5971e140f4f3e9b5968ec92e6da9 [1,0,0,1,0,0|2,0,0]=4 5082 B11R1.232 O/C=C\CN1CCC1CCO 7aa21681d71a81fc38d8ce041d90e66b [1,0,0,1,0,0|2,0,0]=4 5083 B11R1.248 CCN1CCCCCCCC1 74e8e77a0fa5757a1cb015979f1ae5bd [1,0,0,1,0,0|1,0,1]=4 5084 B11R1.248 FCN1CCCCCCCC1 d12c1c9053a2b8e6a830250dbbb63442 [1,0,0,1,0,0|2,0,0]=4 5085 B11R1.248 O=CN1CCCCCCCC1 aa5653438fc641ddd8a731b0fd752d2f [1,0,0,1,0,0|1,0,1]=4 5086 B11R1.248 OCN1CCCCCCCC1 34093a305ba2dc113fc49a0d96d53af5 [1,0,0,1,0,0|1,0,0]=3 5087 B13R1.6 CC/C=C/CNC1CCCC(C1)C 64666cef207f98bcb46018c5bbd5765f [0,1,0,1,0,0|2,0,0]=4 5088 B13R1.6 CC/C=C/CNC1CCCC(C1)O 54a2f577de50bb95a7c48d7a7547a7be [0,1,0,1,0,0|2,0,0]=4 5089 B13R1.6 CC/C=C/CN[C@@H]1CCC[C@@H](C1)O ea0964af34f832e27c3144bb9e2c3740 [0,1,0,1,0,0|2,0,0]=4 5090 B13R1.6 CC/C=C/CN[C@@H]1CCC[C@H](C1)C dbf8f605da6a212cd348769e8cf4466a [0,1,0,1,0,0|2,0,0]=4 5091 B13R1.6 CC/C=C/CN[C@@H]1CCC[C@H](C1)O 6c0e7de98bbda8834762ed011070ffc7 [0,1,0,1,0,0|2,0,0]=4 5092 B13R1.6 CC/C=C/CN[C@H]1CCC[C@@H](C1)O 1e13566483a36ddf611f7df858dddba2 [0,1,0,1,0,0|2,0,0]=4 5093 B13R1.6 CC/C=C/CN[C@H]1CCC[C@H](C1)O 8f94589bfc76909154714d03970aaa21 [0,1,0,1,0,0|2,0,0]=4 5094 B13R1.6 CC/C=C/COC1CCCC(C1)C 35018dcf941c6543c6285316d6da7527 [0,1,0,1,0,0|2,0,0]=4 5095 B13R1.6 CC/C=C/CO[C@@H]1CCC[C@@H](C1)C 2669cddd75443da4ad443439ee7c8c9a [0,1,0,1,0,0|2,0,0]=4 5096 B13R1.6 CC/C=C/CO[C@H]1CCC[C@@H](C1)C a7c43aeaccd7a5e6c1a3fd673dc37871 [0,1,0,1,0,0|2,0,0]=4 5097 B13R1.6 CC/C=C/CO[C@H]1CCC[C@H](C1)C 787a49af8ac5bda90243b3a095f1f1e0 [0,1,0,1,0,0|2,0,0]=4 5098 B13R1.6 CC/C=C\CCN1CCCC(C1)C d66928dfa92447c1b99baef36eb2b16b [0,1,0,1,0,0|2,0,0]=4 5099 B13R1.6 CC/C=C\CCN1CCCC(C1)F c404369258829cc127f7a570ca54afb4 [0,1,0,1,0,0|2,0,0]=4 5100 B13R1.6 CC/C=C\CCN1CCCC(C1)O 541488be574780435ad9cec89f782118 [0,1,0,1,0,0|2,0,0]=4 5101 B13R1.6 CC/C=C\CCN1CCC[C@@H](C1)C 59d7501874eb109fc25d0e6f99d583e7 [0,1,0,1,0,0|2,0,0]=4 5102 B13R1.6 CC/C=C\CCN1CCC[C@@H](C1)F 335d456801e3116313d24e0d83c2c318 [0,1,0,1,0,0|2,0,0]=4 5103 B13R1.6 CC/C=C\CCN1CCC[C@@H](C1)O 567d1f12ae6fa842570256133a30e290 [0,1,0,1,0,0|2,0,0]=4 5104 B13R1.6 CC/C=C\CCN1CCC[C@H](C1)C 16a8852642e922ba567b6be40acf4b04 [0,1,0,1,0,0|2,0,0]=4 5105 B13R1.6 CC/C=C\CCN1CCC[C@H](C1)F d3f13396ad24dbac69589e43c20ebd17 [0,1,0,1,0,0|2,0,0]=4 5106 B13R1.6 CC/C=C\CCN1CCC[C@H](C1)O d8844eab3ba73baa1a0dadd8a9c5e178 [0,1,0,1,0,0|2,0,0]=4 5107 B13R1.6 CCCCCCN1CC=CC(C1)O 939493cab697a0c2199de82f72e1ca4c [0,1,0,1,0,0|1,0,0]=3 5108 B13R1.6 CCCCOCN1CC=CC(C1)O 1915bd52f415f03e00fe30d2fcdb9336 [0,1,0,1,0,0|2,0,0]=4 5109 B13R1.6 CCCOCCN1CC=CC(C1)O 0e2530ac6e8b37ab5bd12df7e98864f0 [0,1,0,1,0,0|2,0,0]=4 5110 B13R1.6 CCOCCCN1CC=CC(C1)O 190665197c48a0d1eca08a6985998b93 [0,1,0,1,0,0|2,0,0]=4 5111 B13R1.6 CCSCCCN1CC=CC(C1)O dff8710454f052bc167e15e2a32d1e95 [0,1,0,1,0,0|2,0,0]=4 5112 B13R1.6 COCCCCN1CC=CC(C1)O af647e5b3351da29b148f4dc821c76fa [0,1,0,1,0,0|2,0,0]=4 5113 B13R1.6 OC1C=CCN(C1)CCCCCF 42ff9c139aa485b77c2099a50c99722d [0,1,0,1,0,0|2,0,0]=4 5114 B13R1.6 OCCCCCN1CC=CC(C1)O 9cdc82a8fe839d11b69067d4d74b3feb [0,1,0,1,0,0|2,0,0]=4 5115 B13R1.42 CCCC(C)COC1CC=CCC1 8e6a940dacd9703d227f1f42cb6218ec [0,1,0,1,0,0|2,0,0]=4 5116 B13R1.42 CCCC(C)NCC1CC=CCC1 41b5170ab4c948b74a61ff2b092285b8 [0,1,0,1,0,0|2,0,0]=4 5117 B13R1.42 CCCC(C)OCC1CC=CCC1 7d32e83a8e0cd688414787ca7a6b242f [0,1,0,1,0,0|2,0,0]=4 5118 B13R1.42 CCCC(C)OC[C@@H]1CC=CCC1 b0f1905199147f85db5426e637c86092 [0,1,0,1,0,0|2,0,0]=4 5119 B13R1.42 CCCC(C)OC[C@H]1CC=CCC1 76fa5578b4d014ee7380ff20fb6de3c0 [0,1,0,1,0,0|2,0,0]=4 5120 B13R1.42 CCC[C@@H](C)OCC1CC=CCC1 0ba407036f44de630cd9900df6c3184a [0,1,0,1,0,0|2,0,0]=4 5121 B13R1.42 CCC[C@H](C)NCC1CC=CCC1 222ce00d88aad94b7ff63d3c1f54056c [0,1,0,1,0,0|2,0,0]=4 5122 B13R1.42 CCC[C@H](C)OCC1CC=CCC1 2292a92bb426103c5fb2de2edae83d7d [0,1,0,1,0,0|2,0,0]=4 5123 B13R1.42 CN(CCO)CCC1CCCCC1 3d86afa58a4b343e2827fe798f07ce9d [0,1,0,1,0,0|1,0,1]=4 5124 B13R1.42 O=C(CCO)NCC1CCCCC1 f14387b7fab588f8f722f8c4ac27b758 [0,1,0,1,0,0|1,0,1]=4 5125 B13R1.119 C=C/C=C/CCNCC1CCCC1 d37b9a5183ecf42299f12119480a7d15 [0,1,0,1,0,0|1,0,1]=4 5126 B13R1.119 CC/C=C/CCOCC1CCCC1 d9d4f866323b27688d46a5d0b5382956 [0,1,0,1,0,0|1,0,0]=3 5127 B13R1.119 CC/C=C/CCOCC1CCCO1 b92f55baa0ce821b6ccaac2b5aa6b1b7 [0,1,0,1,0,0|2,0,0]=4 5128 B13R1.119 CC/C=C/CCOCC1CCOC1 05d0a9b6c4e41a11ea0710e2cdfaf60c [0,1,0,1,0,0|2,0,0]=4 5129 B13R1.119 CC/C=C/CNCCC1CCCC1 0520f57090b3f60eb91aa275ad685871 [0,1,0,1,0,0|1,0,0]=3 5130 B13R1.119 CC/C=C/CNCCC1CCCO1 95b212f64c7b412768530ead0f1402e8 [0,1,0,1,0,0|2,0,0]=4 5131 B13R1.119 CC/C=C/CNCCC1CCOC1 2e18a91d111e5ef0a3cea76da574f9b7 [0,1,0,1,0,0|2,0,0]=4 5132 B13R1.119 CC/C=C/CNCCN1CCCC1 eca5cc7f1d20d7dbe34d2688755c5997 [0,1,0,1,0,0|2,0,0]=4 5133 B13R1.119 CC/C=C/COCCC1CCCC1 baa3d002dcfd2cdbd72ddc51bcaaaf33 [0,1,0,1,0,0|1,0,0]=3 5134 B13R1.119 CC/C=C/COCCC1CCCO1 bd1cdc72842206e85c6e3070ab3b0e2c [0,1,0,1,0,0|2,0,0]=4 5135 B13R1.119 CC/C=C/COCCC1CCOC1 e565156fc6ec4e5c27074254f045e515 [0,1,0,1,0,0|2,0,0]=4 5136 B13R1.119 CC/C=C/COCCN1CCCC1 2c50d3616ca3b5670763761f3d9960af [0,1,0,1,0,0|2,0,0]=4 5137 B13R1.119 CC/C=C\CCCOC1CCCC1 a27e9cbf67717acf8c3ab5ed0880c42f [0,1,0,1,0,0|1,0,0]=3 5138 B13R1.119 CC/C=C\CCCOC1CCOC1 11ee518737ef5385e3a0a5e448afd53c [0,1,0,1,0,0|2,0,0]=4 5139 B13R1.119 CC/C=C\CCCO[C@@H]1CCOC1 669dde1413ce0666722515c54821ac53 [0,1,0,1,0,0|2,0,0]=4 5140 B13R1.119 CC/C=C\CCCO[C@H]1CCOC1 fbabbf142f1dbb4aa2d5e169b324ed94 [0,1,0,1,0,0|2,0,0]=4 5141 B13R1.119 CC/C=C\CCNCC1CCCC1 7fb564f69d2d4d7e0e908f3f4db60e9a [0,1,0,1,0,0|1,0,0]=3 5142 B13R1.119 CC/C=C\CCNCC1CCCO1 63c62dce093a24d9b274c1b56eef8a26 [0,1,0,1,0,0|2,0,0]=4 5143 B13R1.119 CC/C=C\CCNCC1CCOC1 4d70236bdbdfec77162ab553b5bad320 [0,1,0,1,0,0|2,0,0]=4 5144 B13R1.119 CC/C=C\CCNC[C@@H]1CCCO1 adfb075beb98a01327c5713070fd3c33 [0,1,0,1,0,0|2,0,0]=4 5145 B13R1.119 CC/C=C\CCNC[C@@H]1CCOC1 948a1b0292938ba61ce73928b87cdd8b [0,1,0,1,0,0|2,0,0]=4 5146 B13R1.119 CC/C=C\CCNC[C@H]1CCCO1 dd446097f122e2a2fefd424b3f2e8722 [0,1,0,1,0,0|2,0,0]=4 5147 B13R1.119 CC/C=C\CCNC[C@H]1CCOC1 56fce19df941fd9cfde5ece560f3b2f1 [0,1,0,1,0,0|2,0,0]=4 5148 B13R1.119 CC/C=C\CCOCC1CCCC1 626a925f6dba193d7cbf8122e536767b [0,1,0,1,0,0|1,0,0]=3 5149 B13R1.119 CC/C=C\CCOCC1CCCO1 2f7c26c084e4b32d659d5e1b5808e05c [0,1,0,1,0,0|2,0,0]=4 5150 B13R1.119 CC/C=C\CCOCC1CCCS1 e510d83a2d7a93e5904e536fa1b61d35 [0,1,0,1,0,0|2,0,0]=4 5151 B13R1.119 CC/C=C\CCOCC1CCOC1 40aa31b0493daa8c47629ff97f1205a3 [0,1,0,1,0,0|2,0,0]=4 5152 B13R1.119 CC/C=C\CCOCN1CCCC1 e5dc3edf6cf6761ac76393ec3701bd9b [0,1,0,1,0,0|2,0,0]=4 5153 B13R1.119 CC/C=C\CCOC[C@@H]1CCCO1 6f875f69cdf3f0d7b72f0b05f7c0d661 [0,1,0,1,0,0|2,0,0]=4 5154 B13R1.119 CC/C=C\CCOC[C@@H]1CCOC1 a26417ba3200d2460c47fa86e6036fa4 [0,1,0,1,0,0|2,0,0]=4 5155 B13R1.119 CC/C=C\CCOC[C@H]1CCCO1 06a3e5fcb9cd6388d0df79177f13195a [0,1,0,1,0,0|2,0,0]=4 5156 B13R1.119 CC/C=C\CCOC[C@H]1CCOC1 3027b56f53a3e024d35f391c0a8e754e [0,1,0,1,0,0|2,0,0]=4 5157 B13R1.119 CC/C=C\COCCC1CCCC1 fc4f972576f26fab244a3f7b4bc9947d [0,1,0,1,0,0|1,0,0]=3 5158 B13R1.119 CC/C=C\COCCC1CCCO1 d7b6577d624c53985aa393b1ae95a72b [0,1,0,1,0,0|2,0,0]=4 5159 B13R1.119 CC/C=C\COCCC1CCOC1 a6648ddb755d2cd6c0879b45044c29cc [0,1,0,1,0,0|2,0,0]=4 5160 B13R1.119 CC/C=C\COCCN1CCCC1 257202a9e5454c59d26f0d17ecadd23d [0,1,0,1,0,0|2,0,0]=4 5161 B13R1.119 CCC/C=C/CNCC1CCCC1 c0feee2f4469eac3ee6bd896c6c3ddf1 [0,1,0,1,0,0|2,0,0]=4 5162 B13R1.119 CCC/C=C/COCC1CCCC1 6fe8a66c19098a022d8f60a49262c51f [0,1,0,1,0,0|2,0,0]=4 5163 B13R1.119 CCC/C=C\CCOC1CCCC1 f1945c55558202a2ddcf893d6310fcd1 [0,1,0,1,0,0|2,0,0]=4 5164 B13R1.119 CCC/C=C\CNCC1CCCC1 e0d4f56661f378b33d943cc5160fa12d [0,1,0,1,0,0|2,0,0]=4 5165 B13R1.119 CCC/C=C\COCC1CCCC1 a15f79bced1e0de02d9ad2795f1243b4 [0,1,0,1,0,0|2,0,0]=4 5166 B13R1.119 CCCCCCCNc1ccco1 5788a81603ae17fd232bf7cbf4016f1d [0,1,0,1,0,0|0,0,2]=4 5167 B13R1.119 CCCCCCCNc1ccno1 47390fa4f4288b3e658215fec1941f3c [0,1,0,1,0,0|1,0,1]=4 5168 B13R1.119 CCCCCCCNc1ccoc1 c3a3cd504462f0ac8109d6704f4bb6bd [0,1,0,1,0,0|1,0,1]=4 5169 B13R1.119 CCCCCCCNc1ccon1 82d61e2647e29b0d9bed24efd2e14b35 [0,1,0,1,0,0|1,0,1]=4 5170 B13R1.119 CCCCCCCNc1cnoc1 744b7b3708c06504c297d577a81f1c33 [0,1,0,1,0,0|2,0,0]=4 5171 B13R1.119 CCCCCCCNc1cnon1 be6a5da3ac49df416e326327deaaa7f6 [0,1,0,1,0,0|2,0,0]=4 5172 B13R1.119 CCCCCCCNc1ncco1 7881efee5d4e804b82f42c9bf08df9a4 [0,1,0,1,0,0|1,0,1]=4 5173 B13R1.119 CCCCCCCOC1C=CCC1 6ed881bf383c4d92d83ec249fba41280 [0,1,0,1,0,0|1,0,0]=3 5174 B13R1.119 CCCCCCCOC1CCCO1 60d76d0a411a02d83b5db3d64f570d28 [0,1,0,1,0,0|0,0,2]=4 5175 B13R1.119 CCCCCCCOc1ccco1 726b00606f6854cb2c29ab7ea112ba8d [0,1,0,1,0,0|0,0,2]=4 5176 B13R1.119 CCCCCCCOc1cnoc1 8818646284911e86429e5dbf7d7af0ac [0,1,0,1,0,0|2,0,0]=4 5177 B13R1.119 CCCCCCNCC1CCCO1 0083af242355725159eee24a506f9eba [0,1,0,1,0,0|0,0,2]=4 5178 B13R1.119 CCCCCCNC[C@@H]1CCCO1 cd1ac277f5d03786558d00554ceb60c3 [0,1,0,1,0,0|0,0,2]=4 5179 B13R1.119 CCCCCCNC[C@H]1CCCO1 b2b1e8132be0db4a43db47276f1da3be [0,1,0,1,0,0|0,0,2]=4 5180 B13R1.119 CCCCCCNCc1ccco1 0150c8e3304ab724aacea4de973ee0c1 [0,1,0,1,0,0|0,0,2]=4 5181 B13R1.119 CCCCCCNCc1ccno1 f394e10af9f684e7500ea4c187ae8fbb [0,1,0,1,0,0|1,0,1]=4 5182 B13R1.119 CCCCCCNCc1ccoc1 d600c0db14aea1023cae6cea49032a5f [0,1,0,1,0,0|1,0,1]=4 5183 B13R1.119 CCCCCCNCc1ccon1 160e893042427b638e178590f6de4b12 [0,1,0,1,0,0|1,0,1]=4 5184 B13R1.119 CCCCCCNCc1cnco1 c01ab5b579d3c076a882f557b304c0e7 [0,1,0,1,0,0|1,0,1]=4 5185 B13R1.119 CCCCCCNCc1cnoc1 d62119fe1b1eda6b6b3938ed24bdc8d7 [0,1,0,1,0,0|2,0,0]=4 5186 B13R1.119 CCCCCCNCc1ncco1 5552b74332755a1d0e2c7cbbffb8d546 [0,1,0,1,0,0|1,0,1]=4 5187 B13R1.119 CCCCCCOCC1C=CCC1 bc3c32d071f68a8ac35148528a296c70 [0,1,0,1,0,0|1,0,0]=3 5188 B13R1.119 CCCCCCOCC1CCCO1 b4dfa5b9c6259abf3606cc9f3061eb2d [0,1,0,1,0,0|0,0,2]=4 5189 B13R1.119 CCCCCCOC[C@@H]1CCCO1 495aae42d801fa8da4b59dc86549f3dd [0,1,0,1,0,0|0,0,2]=4 5190 B13R1.119 CCCCCCOC[C@H]1CCCO1 29ac48e9c26dc1ca1507f8bf67191c50 [0,1,0,1,0,0|0,0,2]=4 5191 B13R1.119 CCCCCCOCc1ccco1 66099577a7dfad5eafbed3dc6f1dd4d0 [0,1,0,1,0,0|0,0,2]=4 5192 B13R1.119 CCCCCCOCc1ccno1 54d6086ea98c6afb46b7135ea29178f5 [0,1,0,1,0,0|1,0,1]=4 5193 B13R1.119 CCCCCCOCc1ccon1 e2c74e3daf51692e34395be4627adbfa [0,1,0,1,0,0|1,0,1]=4 5194 B13R1.119 CCCCCCOCc1cnoc1 4f3cd320f0c0cbba15f316f7953dbe4c [0,1,0,1,0,0|2,0,0]=4 5195 B13R1.119 CCCCCCOCc1ncco1 c51d8eff22e9347796c99d52618da68b [0,1,0,1,0,0|1,0,1]=4 5196 B13R1.119 CCCCCCOCc1ncno1 d0d2445c09788b26b7a792a3d0a6692c [0,1,0,1,0,0|2,0,0]=4 5197 B13R1.119 CCCCCNCCC1CCCO1 cde6d0f0b6039e64d2a022ac8068ace7 [0,1,0,1,0,0|0,0,2]=4 5198 B13R1.119 CCCCCNCCc1ccco1 885015107107112ed8577d57f4cacca3 [0,1,0,1,0,0|0,0,2]=4 5199 B13R1.119 CCCCCNCCc1cnoc1 2bb25c319616d3982b251bde2c8ea445 [0,1,0,1,0,0|2,0,0]=4 5200 B13R1.119 CCCCCOCCC1CCCO1 f74b6be34673ba35479f51837f090178 [0,1,0,1,0,0|0,0,2]=4 5201 B13R1.119 CCCCCOCCc1ccco1 5261ffd255a619a2ad6edd192915018b [0,1,0,1,0,0|0,0,2]=4 5202 B13R1.119 CCCCCOCCc1ccoc1 8c5bf8113bcdac844260455866fc8788 [0,1,0,1,0,0|1,0,1]=4 5203 B13R1.119 CCCCCOCCc1ccon1 f9b3c835fb15ffe789823fd95389c6ff [0,1,0,1,0,0|1,0,1]=4 5204 B13R1.119 CCCCCOCCc1cnoc1 056a9c3aa47f817987c2e20d9d5d4932 [0,1,0,1,0,0|2,0,0]=4 5205 B13R1.119 CCCCNCCCc1ccco1 74377bf01cb28334677c4a0759d73c76 [0,1,0,1,0,0|0,0,2]=4 5206 B13R1.119 CCCCOCCCc1ccco1 ec547c4f5f74682d68c926c116d3d038 [0,1,0,1,0,0|0,0,2]=4 5207 B13R1.119 CCCCOCCCc1cnoc1 1e6aa5a0cbac4788579b7a5d332785c3 [0,1,0,1,0,0|2,0,0]=4 5208 B13R1.119 CCCCOCCOC1C=CCC1 aea292651364c784550df095b96f26d0 [0,1,0,1,0,0|2,0,0]=4 5209 B13R1.119 CCCCOCOCC1C=CCC1 421609ccb551c99ae1b6aee05dc6d078 [0,1,0,1,0,0|2,0,0]=4 5210 B13R1.119 CCCOCCCOC1C=CCC1 1f972924773281aa42de86b1dd6133bf [0,1,0,1,0,0|2,0,0]=4 5211 B13R1.119 CCCOCCOCC1C=CCC1 1c0f1dc55ba0272d630b77f4720807a6 [0,1,0,1,0,0|2,0,0]=4 5212 B13R1.119 CCOCCCOCC1C=CCC1 c77672afea19661ae8a35d7d3ee64b45 [0,1,0,1,0,0|2,0,0]=4 5213 B13R1.119 CCSCCCOCC1C=CCC1 d62fc5ed30bca59558459bbca5c05ea0 [0,1,0,1,0,0|2,0,0]=4 5214 B13R1.119 COCCCCCOC1C=CCC1 49573cfc0235b1bc4ddb9b9ab604b1c0 [0,1,0,1,0,0|2,0,0]=4 5215 B13R1.119 COCCCCOCC1C=CCC1 d9bd9711532c36bedc90ba55c58f02d4 [0,1,0,1,0,0|2,0,0]=4 5216 B13R1.119 COCCNCCCC1CCCC1 0de88b37726ee1ac1608c9f782f55b79 [0,1,0,1,0,0|1,0,1]=4 5217 B13R1.119 COCCOCCCC1CCCC1 6499d3071fd338fe21cefd9c2138fb81 [0,1,0,1,0,0|1,0,1]=4 5218 B13R1.119 COCNCCCCC1CCCC1 96d2ad1e7bbaedab63ab8bcdc19ba2ad [0,1,0,1,0,0|1,0,1]=4 5219 B13R1.119 FCCCCCCOC1C=CCC1 eea75386e8f05581ea8a7a155aa6183c [0,1,0,1,0,0|2,0,0]=4 5220 B13R1.119 FCCCCCOCC1C=CCC1 3d88a31b635f0429e5f38abfc3c3bf22 [0,1,0,1,0,0|2,0,0]=4 5221 B13R1.119 N#CC=CCNCCC1CCCC1 f5f7969777beed3a712322d3bd035636 [0,1,0,1,0,0|1,0,1]=4 5222 B13R1.119 N#CC=CCOCCC1CCCC1 902a548e59a0ed1f83d92db6b94f9677 [0,1,0,1,0,0|1,0,1]=4 5223 B13R1.119 NOCCNCCCC1CCCC1 6e56944f43a9c4bd3a48098e31642146 [0,1,0,1,0,0|1,0,1]=4 5224 B13R1.119 O/C=C\CNCCCC1CCCC1 01cff5502ff728201328e2666beaa6a2 [0,1,0,1,0,0|0,0,2]=4 5225 B13R1.119 O=C/C=C/COCCC1CCCC1 a2e1c77d324cfcb33a040c0662ef2742 [0,1,0,1,0,0|0,0,2]=4 5226 B13R1.119 OCC#CCNCCC1CCCC1 894f1dd839d46a850dff2038da135a36 [0,1,0,1,0,0|0,0,2]=4 5227 B13R1.119 OCCCCCCNC1CCCC1 0c0db0a723115a979a4d1e339717c3c5 [0,1,0,1,0,0|0,0,2]=4 5228 B13R1.119 OCCCCCNCC1CCCC1 7b549b6692ee1dc4e4559958c02fd4fd [0,1,0,1,0,0|0,0,2]=4 5229 B13R1.119 OCCCCNCCC1CCCC1 919ba19dd13e74fe37d35765b582283e [0,1,0,1,0,0|0,0,2]=4 5230 B13R1.119 OCCCNCCCC1CCCC1 15afac2f43535639a4b8dea2d3cb3190 [0,1,0,1,0,0|0,0,2]=4 5231 B13R1.119 OCCNCCCCC1CCCC1 383c5781d68361eb3489db7fd1968a42 [0,1,0,1,0,0|0,0,2]=4 5232 B13R1.119 OCCNCCCCN1CCCC1 6b3772eb8aead02d1dc4cb9c2bb671e3 [0,1,0,1,0,0|1,0,1]=4 5233 B13R1.119 OCCNCCCOC1CCCC1 be075ad6cfdacc527ace80b9740a06e7 [0,1,0,1,0,0|1,0,1]=4 5234 B13R1.119 OCCOCCCNC1CCCC1 46f1e22a37ec5472ed5bb696469f3d33 [0,1,0,1,0,0|1,0,1]=4 5235 B13R1.119 OCCOCCNCC1CCCC1 aa73b3e5a705b3aa0dc6c223fc4dc435 [0,1,0,1,0,0|1,0,1]=4 5236 B13R1.119 OCCSCCNCC1CCCC1 8d729836db2598ab4b7af833bc0bf46d [0,1,0,1,0,0|1,0,1]=4 5237 B13R1.119 OCNCCCCCN1CCCC1 03ff2d5a92abeee49b382d6dd0c32db0 [0,1,0,1,0,0|1,0,1]=4 5238 B13R1.188 CC/C=C\CCNCC1CC1CO af0b94997f33888f5be249ea15023500 [0,1,0,1,0,0|2,0,0]=4 5239 B13R1.188 CCCCCCCN[C@@H]1C[C@H]1CO 633ac9cdebcea7ec4d73888579cf9ccf [0,1,0,1,0,0|0,0,2]=4 5240 B13R1.188 CCCCCCCN[C@H]1C[C@@H]1CO 1a3217beba87b0ef4e4ebbc55230fcf5 [0,1,0,1,0,0|0,0,2]=4 5241 B13R1.188 CCCCCCCN[C@H]1C[C@H]1CO 56076ba00d6a8cc6b884d10c73e28ae4 [0,1,0,1,0,0|0,0,2]=4 5242 B13R1.188 CCCCCCNCC1CC1CO 483d5754e4006d0abb2875161410508b [0,1,0,1,0,0|0,0,2]=4 5243 B13R1.190 CC/C=C\CCN1C[C@@H](C[C@@H]1C)F bb3b3fa60d4ec373ed0f650b98a76957 [0,1,0,1,0,0|2,0,0]=4 5244 B13R1.190 CC/C=C\CCN1C[C@@H](C[C@@H]1C)O bfcda7d4cd172be20ed1c06fcbcea3ad [0,1,0,1,0,0|2,0,0]=4 5245 B13R1.190 CC/C=C\CCN1C[C@@H](C[C@H]1C)F a6d1f892a3e6b2d04b1f7f7242340ff3 [0,1,0,1,0,0|2,0,0]=4 5246 B13R1.190 CC/C=C\CCN1C[C@@H](C[C@H]1C)O 47dfc6460ab1a428f9ae1b5601806171 [0,1,0,1,0,0|2,0,0]=4 5247 B13R1.190 CC/C=C\CCN1C[C@H](C[C@@H]1C)F 61dcccce62810d4ae0656c0cc84a147a [0,1,0,1,0,0|2,0,0]=4 5248 B13R1.190 CC/C=C\CCN1C[C@H](C[C@@H]1C)O c2b3ac7372f985087c6037c1d91e3041 [0,1,0,1,0,0|2,0,0]=4 5249 B13R1.190 CC/C=C\CCN1C[C@H](C[C@H]1C)F 000761afa957b3746b7a663f6090c77f [0,1,0,1,0,0|2,0,0]=4 5250 B13R1.190 CC/C=C\CCN1C[C@H](C[C@H]1C)O a6049c52e16e9f71cda83d851c83231b [0,1,0,1,0,0|2,0,0]=4 5251 B13R1.362 CC/C=C/CCOCC1CC(C1)C 5b6fbb2de3bf500aaa7cdcb9cba5ae02 [0,1,0,1,0,0|2,0,0]=4 5252 B13R1.362 CC/C=C/CCOC[C@H]1C[C@H](C1)F 65b85376373c6ff3ae440f2a57f622fe [0,1,0,1,0,0|2,0,0]=4 5253 B13R1.362 CC/C=C\CCNCC1CC(C1)O e0c2c1f87aba3fde966475a3eea4700d [0,1,0,1,0,0|2,0,0]=4 5254 B13R1.362 CC/C=C\CCNC[C@H]1C[C@@H](C1)O c84a72cce4bc7d8b9a4868c283334347 [0,1,0,1,0,0|2,0,0]=4 5255 B13R1.362 CC/C=C\CCNC[C@H]1C[C@H](C1)O defd7a107c0180e94b4b82bbb7076661 [0,1,0,1,0,0|2,0,0]=4 5256 B13R1.362 CC/C=C\CCOCC1CC(C1)C 9122eaeda4fa419c28d49024e5e3288c [0,1,0,1,0,0|2,0,0]=4 5257 B13R1.362 CC/C=C\CCOCC1CC(C1)F 7d56e9a58372b81d4b6fe1dd430c44d7 [0,1,0,1,0,0|2,0,0]=4 5258 B13R1.362 CC/C=C\CCOC[C@H]1C[C@@H](C1)C 8eb776d2c5c795918b291fdb17ce292c [0,1,0,1,0,0|2,0,0]=4 5259 B13R1.362 CC/C=C\CCOC[C@H]1C[C@H](C1)F f4dd619ee876855e7355cd47df78a62d [0,1,0,1,0,0|2,0,0]=4 5260 B13R1.362 CCCCCCCCN1CC(C1)O 299d311f3f092e82d77f84f108bc2aad [0,1,0,1,0,0|1,0,1]=4 5261 B13R1.369 CC/C=C/CN1CCC(CC1C)C 5660f58050dfd823976b3024c28f0a7a [0,1,0,1,0,0|2,0,0]=4 5262 B13R1.369 CC/C=C/CN1CCC(CC1C)O f43ae07926fca4f5167b1d26b6ddfcf9 [0,1,0,1,0,0|2,0,0]=4 5263 B13R1.369 CC/C=C/CN1CC[C@@H](C[C@@H]1C)C b92ec1061658461f050c258e31b4f1c8 [0,1,0,1,0,0|2,0,0]=4 5264 B13R1.369 CC/C=C/CN1CC[C@@H](C[C@H]1C)O ec41fd0fb3511d172fcc1d15bc372007 [0,1,0,1,0,0|2,0,0]=4 5265 B13R1.369 CC/C=C/CN1CC[C@H](C[C@H]1C)C 5f96050c621b152de015c36ca1ab0daf [0,1,0,1,0,0|2,0,0]=4 5266 B13R1.369 CC/C=C/CN1CC[C@H](C[C@H]1C)O b21cf4ba801dfebc4014913c30ab7e60 [0,1,0,1,0,0|2,0,0]=4 5267 B13R1.404 CCCC(C)COCC1C=CCC1 23bb4a9ca242939626cd5bd98064b2a1 [0,1,0,1,0,0|2,0,0]=4 5268 B13R1.404 CN(CCO)CCCC1CCCC1 7af1f0040d412d81adfecb47e91828f1 [0,1,0,1,0,0|1,0,1]=4 5269 B13R1.404 O=C(CCO)NCCC1CCCC1 9b33c03ab6fcfeb6ab1d95f8df8f06fe [0,1,0,1,0,0|1,0,1]=4 5270 B13R1.404 O=C(CNCC1CCCC1)NCO e8eb1ba6f91fa897502b6560fc14b815 [0,1,0,1,0,0|2,0,0]=4 5271 B13R1.443 CCC1CCCN1CC(=O)NCO 64ad2fd6c56f05031790a4f3b8841ca8 [0,1,0,1,0,0|2,0,0]=4 5272 B13R1.443 CC[C@@H]1CCCN1CC(=O)NCO f9749d31498c0aaaa0048ad4131f4143 [0,1,0,1,0,0|2,0,0]=4 5273 B13R1.443 CC[C@@H]1CCC[C@H]1NC(=O)CCO 45e91526503dccffb9bad39a1a9ed15a [0,1,0,1,0,0|1,0,1]=4 5274 B13R1.448 O=C(CNCCC1CCC1)NCO 69c18adfd07663dd93344a02888131ab [0,1,0,1,0,0|2,0,0]=4 5275 B13R1.453 CCCC(C)NCCCC=C1CC1 7fd20b4a31411c1bfa729ecea0e4daee [0,1,0,1,0,0|2,0,0]=4 5276 B13R1.453 CCCC(C)OCCCC=C1CC1 3f8eb10cb18ab29c5fd7a9ef9e32556a [0,1,0,1,0,0|2,0,0]=4 5277 B13R1.453 CCC[C@@H](C)OCCCC=C1CC1 b0098ccf37a9dd68cde9d0912c99a0ec [0,1,0,1,0,0|2,0,0]=4 5278 B13R1.453 CCC[C@H](C)NCCCC=C1CC1 b2edbac1a537c187e765899fcab185ff [0,1,0,1,0,0|2,0,0]=4 5279 B13R1.453 CCC[C@H](C)OCCCC=C1CC1 2bee51141303d505a164ddaf065e9f72 [0,1,0,1,0,0|2,0,0]=4 5280 B13R1.463 CC1CCCCCN1C(=O)CCO 6154346fa7d934c408e8bdf16cb625bb [0,1,0,1,0,0|1,0,1]=4 5281 B13R1.464 CCC1CCCCN1C(=O)CCO 012128402af08d9ff5bae91266969651 [0,1,0,1,0,0|1,0,1]=4 5282 B13R1.464 CC[C@@H]1CCCCN1C(=O)CCO 20a03c4784c652faa7c24496e1e5025b [0,1,0,1,0,0|1,0,1]=4 5283 B13R1.464 CC[C@H]1CCCCN1C(=O)CCO a511d29b5e44016ed89ff647112ea820 [0,1,0,1,0,0|1,0,1]=4 5284 B13R1.470 CC1CCCCC1NC(=O)CCO 57d0f2e8930cfa4088024a28deabe665 [0,1,0,1,0,0|1,0,1]=4 5285 B13R1.470 CC1CCCCN1CC(=O)NCO 4da94acce981731b2eca5ac914d556cb [0,1,0,1,0,0|2,0,0]=4 5286 B13R1.470 C[C@@H]1CCCCN1CC(=O)NCO 9b9c7049ca22856994e409923d53d78f [0,1,0,1,0,0|2,0,0]=4 5287 B13R1.470 C[C@@H]1CCCC[C@@H]1NC(=O)CCO 73ae97845e0d668bbd70b6ca52f057b5 [0,1,0,1,0,0|1,0,1]=4 5288 B13R1.470 C[C@@H]1CCCC[C@H]1NC(=O)CCO 6ee02beaa99603f0f86a39b1a3d194ba [0,1,0,1,0,0|1,0,1]=4 5289 B13R1.470 C[C@H]1CCCCN1CC(=O)NCO 47c2b16f468399a2363ec2534d93d0a4 [0,1,0,1,0,0|2,0,0]=4 5290 B13R1.470 C[C@H]1CCCC[C@@H]1NC(=O)CCO c1ca7941d814b489cd2f9c7d81539235 [0,1,0,1,0,0|1,0,1]=4 5291 B13R1.470 C[C@H]1CCCC[C@H]1NC(=O)CCO 95dfe46562189bd70dcb2533dd637411 [0,1,0,1,0,0|1,0,1]=4 5292 B13R1.571 CC/C=C\CCN[C@H]1C[C@@H]1COC faa759ce7faeed1fadcd027ec5346aab [0,1,0,1,0,0|2,0,0]=4 5293 B13R1.571 CC/C=C\CCN[C@H]1C[C@H]1COC 603b504da210f3449c236a17c3aaf372 [0,1,0,1,0,0|2,0,0]=4 5294 B13R1.654 CC/C=C/CNCC1CCCC1O a923f158c371c3ce377aabaa680104d9 [0,1,0,1,0,0|2,0,0]=4 5295 B13R1.654 CC/C=C/CNCC1CCCN1C 9d553ae9890001606473f49bc9c18d29 [0,1,0,1,0,0|2,0,0]=4 5296 B13R1.654 CC/C=C/CNC[C@@H]1CCCN1C a148d12097aa3da365cee85e2d0c6498 [0,1,0,1,0,0|2,0,0]=4 5297 B13R1.654 CC/C=C/CNC[C@H]1CCCN1C ff83a82cbb15fb78b53bfb191f52249d [0,1,0,1,0,0|2,0,0]=4 5298 B13R1.654 CC/C=C/COCC1CCCC1C caee133ce9b65d26b9dc189bac24a3c6 [0,1,0,1,0,0|1,0,0]=3 5299 B13R1.654 CC/C=C/COCC1CCCN1C c027b97db0ddedd01af8c97b8329f70f [0,1,0,1,0,0|2,0,0]=4 5300 B13R1.654 CC/C=C/COCC1COCC1C 868782e47797e3c6ebc8de57e0c7a94f [0,1,0,1,0,0|2,0,0]=4 5301 B13R1.654 CC/C=C/COCC1OCCC1C 37e22bd479c8838b00a9cff6ec4ad518 [0,1,0,1,0,0|2,0,0]=4 5302 B13R1.654 CC/C=C/COC[C@@H]1CCCN1C dbf931c679a1cf8287f88ef4a872d0b4 [0,1,0,1,0,0|2,0,0]=4 5303 B13R1.654 CC/C=C/COC[C@@H]1CCC[C@H]1F ba2176b74c69b5fbb126b31e673ad6d6 [0,1,0,1,0,0|2,0,0]=4 5304 B13R1.654 CC/C=C/COC[C@@H]1CCO[C@@H]1C 25fd720be0502ee73938cf58874c3fb2 [0,1,0,1,0,0|2,0,0]=4 5305 B13R1.654 CC/C=C/COC[C@H]1CCCN1C 3e4a5340f202a1612915db0311590851 [0,1,0,1,0,0|2,0,0]=4 5306 B13R1.654 CC/C=C\CCNC1CCCC1O 692152957f5615c70326d038217207f6 [0,1,0,1,0,0|2,0,0]=4 5307 B13R1.654 CC/C=C\CCN[C@@H]1CCC[C@@H]1O 2a12bfff18855c3bc47b0e36d21bef5d [0,1,0,1,0,0|2,0,0]=4 5308 B13R1.654 CC/C=C\CCN[C@@H]1CCC[C@H]1O f1b775770eeb45c3bcfa84f50006cd0a [0,1,0,1,0,0|2,0,0]=4 5309 B13R1.654 CC/C=C\CCN[C@H]1CCC[C@@H]1O c0ea672cbf87122f967e928822c78b16 [0,1,0,1,0,0|2,0,0]=4 5310 B13R1.654 CC/C=C\CCN[C@H]1CCC[C@H]1O cee555c0e0119d582b51a58fa3530b6d [0,1,0,1,0,0|2,0,0]=4 5311 B13R1.654 CC/C=C\CCOC1CCCC1C 2b656d8b10d291c1a65ea258dd8ec0f4 [0,1,0,1,0,0|1,0,0]=3 5312 B13R1.654 CC/C=C\CCOC1COCC1C 4884de3e5fca9288b11fa8d081b0f036 [0,1,0,1,0,0|2,0,0]=4 5313 B13R1.654 CC/C=C\CCO[C@@H]1CCC[C@@H]1C 7dfd39974cb2e33a399e2d1378a84e98 [0,1,0,1,0,0|1,0,0]=3 5314 B13R1.654 CC/C=C\CCO[C@@H]1CCC[C@H]1C c4c94ba8f73060bf6eb5fb8c75c26ae6 [0,1,0,1,0,0|1,0,0]=3 5315 B13R1.654 CC/C=C\CCO[C@@H]1CCC[C@H]1F 0080b5a0e6576367471d2136e8cced14 [0,1,0,1,0,0|2,0,0]=4 5316 B13R1.654 CC/C=C\CCO[C@@H]1COC[C@@H]1C 72e6a449a6a260b7d46dbbbeea8d46b2 [0,1,0,1,0,0|2,0,0]=4 5317 B13R1.654 CC/C=C\CCO[C@H]1CCC[C@@H]1C 1067887e11f4bb0855984d8170957526 [0,1,0,1,0,0|1,0,0]=3 5318 B13R1.654 CC/C=C\CCO[C@H]1CCC[C@H]1C 72f8d896c77a26acfe87952551ffb983 [0,1,0,1,0,0|1,0,0]=3 5319 B13R1.654 CC/C=C\CCO[C@H]1COC[C@@H]1C 79af715586e4a215b55d57668cd9cc70 [0,1,0,1,0,0|2,0,0]=4 5320 B13R1.654 CC/C=C\CCO[C@H]1COC[C@H]1C 336dfaef14fb30db0aea988b8cc91742 [0,1,0,1,0,0|2,0,0]=4 5321 B13R1.654 CC/C=C\COCC1COCC1C edc422a1d00d57ed607d03e62fd7d8df [0,1,0,1,0,0|2,0,0]=4 5322 B13R1.654 CC1CCCC1COCC=CC#N b5ed0fb5507faf47d7cdd18e5e0d4173 [0,1,0,1,0,0|1,0,1]=4 5323 B13R1.654 CC1CCCN1CCCCCCO cda7ff68cb87f0539e265683bd43f5c8 [0,1,0,1,0,0|0,0,2]=4 5324 B13R1.654 CCC/C=C/COC1CCCC1C 71d734bbd9ca52dc73c13e5b35b59b46 [0,1,0,1,0,0|2,0,0]=4 5325 B13R1.654 CCC/C=C/CO[C@@H]1CCC[C@@H]1C a63aa3df1396a2cb16d4e208d083a0fd [0,1,0,1,0,0|2,0,0]=4 5326 B13R1.654 CCC/C=C/CO[C@@H]1CCC[C@H]1C 879d50605d2dd57ef3f868c0bfeb903b [0,1,0,1,0,0|2,0,0]=4 5327 B13R1.654 CCC/C=C/CO[C@H]1CCC[C@@H]1C 0d539f571c56cb878a0afb53b11471f7 [0,1,0,1,0,0|2,0,0]=4 5328 B13R1.654 CCC/C=C/CO[C@H]1CCC[C@H]1C 0567ef6e55147d793fe39e3eaca92c35 [0,1,0,1,0,0|2,0,0]=4 5329 B13R1.654 CCC/C=C\COC1CCCC1C 44d5d283bd29df485a4a939acb286b76 [0,1,0,1,0,0|2,0,0]=4 5330 B13R1.654 CCC/C=C\CO[C@@H]1CCC[C@@H]1C a9346f0ab87782b0ede7a68103d1c365 [0,1,0,1,0,0|2,0,0]=4 5331 B13R1.654 CCC/C=C\CO[C@@H]1CCC[C@H]1C bea6c6ce7da5513bd502c886ba11b208 [0,1,0,1,0,0|2,0,0]=4 5332 B13R1.654 CCC/C=C\CO[C@H]1CCC[C@@H]1C 7eaa80addf5df22164401b813ebbad2b [0,1,0,1,0,0|2,0,0]=4 5333 B13R1.654 CCC/C=C\CO[C@H]1CCC[C@H]1C 81e1976dcf57d142596416cf8e927175 [0,1,0,1,0,0|2,0,0]=4 5334 B13R1.654 CCCCCCCN1CCCC1O 5b5764819a19201eb1e6f083d386325e [0,1,0,1,0,0|0,0,2]=4 5335 B13R1.654 CCCCCCNC1CCCC1O 7d6c8cef8477fc84bc2964bbffcdf711 [0,1,0,1,0,0|0,0,2]=4 5336 B13R1.654 CCCCCCNC1COCC1O 96295969e5844a31da4b8558e69cea9f [0,1,0,1,0,0|1,0,1]=4 5337 B13R1.654 CCCCCCN[C@@H]1CCC[C@@H]1O 2d05b3ce545fc77c6a65756cfdf7345f [0,1,0,1,0,0|0,0,2]=4 5338 B13R1.654 CCCCCCN[C@@H]1CCC[C@H]1O c67ed0d6da3007da0f11620e36ac5a47 [0,1,0,1,0,0|0,0,2]=4 5339 B13R1.654 CCCCCCN[C@@H]1COC[C@@H]1O 7e7b98c4fcb5d0d38279c9bc1d4e19c9 [0,1,0,1,0,0|1,0,1]=4 5340 B13R1.654 CCCCCCN[C@@H]1COC[C@H]1O 3bd1e7dbecc46310009b612fbdb7e070 [0,1,0,1,0,0|1,0,1]=4 5341 B13R1.654 CCCCCCN[C@H]1CCC[C@@H]1O e8babf6e290cdd2af1f55b15a57f5745 [0,1,0,1,0,0|0,0,2]=4 5342 B13R1.654 CCCCCCN[C@H]1CCC[C@H]1O 9f7e5170c2f2329220874ac407c3e99d [0,1,0,1,0,0|0,0,2]=4 5343 B13R1.654 CCCCCCN[C@H]1COC[C@@H]1O 8c3e71343b50c4af6999bbf095f737df [0,1,0,1,0,0|1,0,1]=4 5344 B13R1.654 CCCCCCN[C@H]1COC[C@H]1O c48024e1b186f68c5450b714b14a190e [0,1,0,1,0,0|1,0,1]=4 5345 B13R1.654 CCCCCNCC1CCCC1O 288e7c34f29533183cddbdc88e6ad2cc [0,1,0,1,0,0|0,0,2]=4 5346 B13R1.654 CCCCCNC[C@@H]1COC[C@@H]1O 1363255f498219a4d71019011f83a88a [0,1,0,1,0,0|1,0,1]=4 5347 B13R1.654 C[C@@H]1CCCN1CCCCCCO a9726267b20a29c38d892f970e2b1cd7 [0,1,0,1,0,0|0,0,2]=4 5348 B13R1.654 C[C@H]1CCCN1CCCCCCO 9ba59ded57c7a66cbf07551b369feb7c [0,1,0,1,0,0|0,0,2]=4 5349 B13R1.657 CC/C=C/CN1CCC(C1)CCC e2aa5265a574ec923e2f1dad27242394 [0,1,0,1,0,0|2,0,0]=4 5350 B13R1.1149 CC/C=C/CN1CCCC(CC1)C a4575c627908e9c6834cf40250328b23 [0,1,0,1,0,0|2,0,0]=4 5351 B13R1.1149 CC/C=C/CN1CCCC(CC1)F 21af35ca04abc35da28a4a9486909c6e [0,1,0,1,0,0|2,0,0]=4 5352 B13R1.1149 CC/C=C/CN1CCCC(CC1)O fda8fb2081aa9e88b43ed863412958f5 [0,1,0,1,0,0|2,0,0]=4 5353 B13R1.1149 CC/C=C/CN1CCC[C@@H](CC1)O 655708ddb12a02a8dc632050aa43ce63 [0,1,0,1,0,0|2,0,0]=4 5354 B13R1.1149 CC/C=C/CN1CCC[C@H](CC1)O 194ea642cd088e87f5021a6c50287473 [0,1,0,1,0,0|2,0,0]=4 5355 B13R1.1149 CCCOCC1CCNC(=O)CO1 a7bdc3f9a63b9b92d001653018f9563d [0,1,0,1,0,0|2,0,0]=4 5356 B13R1.1464 CCCN(C)C1CC/C=C\CCC1 f7de2175ea08681eddec6c0d7f4f501c [0,1,0,1,0,0|2,0,0]=4 5357 B13R1.1464 CN(CCO)C1CCCCCCC1 8d00d6cfd207a324135e5c7e78f23778 [0,1,0,1,0,0|1,0,1]=4 5358 B13R1.1464 O=C(CCO)N1CCCCCCC1 b896065a67e83a6c1f26714669c0eece [0,1,0,1,0,0|1,0,1]=4 5359 B13R1.1575 CCCC(C)NC1CCC=CCC1 d4c2682ba0fd526beb564b1ccad516c1 [0,1,0,1,0,0|2,0,0]=4 5360 B13R1.1575 CN(CCO)CC1CCCCCC1 42837799b98b876ccc3f658de3cb58cf [0,1,0,1,0,0|1,0,1]=4 5361 B13R1.1575 O=C(CCO)NC1CCCCCC1 69e35ab6eb75f9593de3551f71b33c54 [0,1,0,1,0,0|1,0,1]=4 5362 B13R1.1575 O=C(CN1CCCCCC1)NCO 25f67049481ba9475c5b43bd49d38b4a [0,1,0,1,0,0|2,0,0]=4 5363 B13R1.1892 CC/C=C\CCN1CC(C1)CCC d8f3f24e1cf123c99e38c43afc00436c [0,1,0,1,0,0|2,0,0]=4 5364 B13R1.3151 CC/C=C\CCCOC(C)C1CC1 5be0b8a58d10900b16573adf9cf0cc62 [0,1,0,1,0,0|2,0,0]=4 5365 B13R1.3151 CC/C=C\CCNCC(O)C1CC1 9cdefa867f4a96c500a0bcfc58cea49c [0,1,0,1,0,0|2,0,0]=4 5366 B13R1.3151 CC/C=C\CCOCC(C)C1CC1 18412f4be26dfa2cfeb69e7f0888e298 [0,1,0,1,0,0|2,0,0]=4 5367 B13R1.3673 CC/C=C/CCOCC1(CCC1)C a7f489bec8024cf673f85e86199c1295 [0,1,0,1,0,0|2,0,0]=4 5368 B13R1.3673 CC/C=C/CNCCC1(CCC1)O 5ddc3771efcd192fdb9c0e479fe1b6ef [0,1,0,1,0,0|2,0,0]=4 5369 B13R1.3673 CC/C=C\CCNCC1(CCC1)O 52563624bd6692b2d3698661ad0ba95a [0,1,0,1,0,0|2,0,0]=4 5370 B13R1.3673 CC/C=C\CCOCC1(CCC1)C 11182bf4e65008ad34320c67c51c7c0e [0,1,0,1,0,0|2,0,0]=4 5371 B13R1.3673 CC/C=C\CCOCC1(CCC1)F 0e4d249ce99705633185007e73445866 [0,1,0,1,0,0|2,0,0]=4 5372 B13R1.28 C=C/C=C/CCNC1CCCCC1 f927654ab7d0dc20fd1a7bbccc7251ba [0,1,0,1,0,0|1,0,1]=4 5373 B13R1.28 CC/C=C/CCOC1CCCCC1 9ca622c45283076ac83fd0d2dfe9b2dd [0,1,0,1,0,0|1,0,0]=3 5374 B13R1.28 CC/C=C/CCOC1CCCCO1 0e848e76743fb3be9d3a37dab34a4b2e [0,1,0,1,0,0|2,0,0]=4 5375 B13R1.28 CC/C=C/CCOC1CCCOC1 1fcab7c42c780871352fb28f85ac1f8a [0,1,0,1,0,0|2,0,0]=4 5376 B13R1.28 CC/C=C/CCOC1CCOCC1 0518ab7832732d580f6cac7e6b716f08 [0,1,0,1,0,0|2,0,0]=4 5377 B13R1.28 CC/C=C/CCOC1CCSCC1 9577d000fcd7605a9f2befea57bc1a18 [0,1,0,1,0,0|2,0,0]=4 5378 B13R1.28 CC/C=C/CNCC1CCCCC1 2888b32d1df8235dc761c302e41af7f2 [0,1,0,1,0,0|1,0,0]=3 5379 B13R1.28 CC/C=C/CNCC1CCCCO1 48d744478a0b9892eb19c844b3ff5a39 [0,1,0,1,0,0|2,0,0]=4 5380 B13R1.28 CC/C=C/CNCC1CCCOC1 0c87f06e98266f0b4b3d7fba74b0db6a [0,1,0,1,0,0|2,0,0]=4 5381 B13R1.28 CC/C=C/CNCC1CCOCC1 9c4174ca1997726a0349f35d1dc9642b [0,1,0,1,0,0|2,0,0]=4 5382 B13R1.28 CC/C=C/CNCC1CCSCC1 8485b3a5f416122e7793dfedab76deac [0,1,0,1,0,0|2,0,0]=4 5383 B13R1.28 CC/C=C/CNC[C@@H]1CCCOC1 b3afd41accb2d918931a9d4abad1714d [0,1,0,1,0,0|2,0,0]=4 5384 B13R1.28 CC/C=C/CNC[C@H]1CCCOC1 1e7efbe34565dbd9b8c651beba7238fc [0,1,0,1,0,0|2,0,0]=4 5385 B13R1.28 CC/C=C/COCC1CCCCC1 e5e878e7379f0496e25f77d3f4918145 [0,1,0,1,0,0|1,0,0]=3 5386 B13R1.28 CC/C=C/COCC1CCCCO1 f2113b69bba0a07f6366bb719abc912f [0,1,0,1,0,0|2,0,0]=4 5387 B13R1.28 CC/C=C/COCC1CCCOC1 777e543e37516d88f548d38667b59c48 [0,1,0,1,0,0|2,0,0]=4 5388 B13R1.28 CC/C=C/COCC1CCOCC1 066d3cafbf132ff4988a0643417ea424 [0,1,0,1,0,0|2,0,0]=4 5389 B13R1.28 CC/C=C/COCC1CCSCC1 e13c80f2c610d1c08512281a20444a20 [0,1,0,1,0,0|2,0,0]=4 5390 B13R1.28 CC/C=C/COC[C@@H]1CCCCO1 66dcc10e431c946258203e343fb7089d [0,1,0,1,0,0|2,0,0]=4 5391 B13R1.28 CC/C=C/COC[C@@H]1CCCOC1 e8497a5cb04134190461cc41aef06576 [0,1,0,1,0,0|2,0,0]=4 5392 B13R1.28 CC/C=C/COC[C@H]1CCCCO1 0247b8b722053f030e8aa6d77c93051a [0,1,0,1,0,0|2,0,0]=4 5393 B13R1.28 CC/C=C/COC[C@H]1CCCOC1 c31607eb035e4d49d37634bdaee095ff [0,1,0,1,0,0|2,0,0]=4 5394 B13R1.28 CC/C=C\CCNC1CCCOC1 4b89c08d889b3d4ca069a1d1d3e6717a [0,1,0,1,0,0|2,0,0]=4 5395 B13R1.28 CC/C=C\CCNC1CCOCC1 a2ac7ebdf22e801246ff6ef2895b3cd9 [0,1,0,1,0,0|2,0,0]=4 5396 B13R1.28 CC/C=C\CCNC1CCSCC1 4327a886a48d6d9b53b4dcacdb2c1882 [0,1,0,1,0,0|2,0,0]=4 5397 B13R1.28 CC/C=C\CCN[C@@H]1CCCOC1 fffdd68882bc7759591a2b4e23efff5f [0,1,0,1,0,0|2,0,0]=4 5398 B13R1.28 CC/C=C\CCN[C@H]1CCCOC1 770698650afcb3f5a42004fbc11b9569 [0,1,0,1,0,0|2,0,0]=4 5399 B13R1.28 CC/C=C\CCOC1CCCCC1 1d54da448c1d69c18b60ff08d119517d [0,1,0,1,0,0|1,0,0]=3 5400 B13R1.28 CC/C=C\CCOC1CCCCO1 cf6b4f2157e5b8b0c96521bf05251e98 [0,1,0,1,0,0|2,0,0]=4 5401 B13R1.28 CC/C=C\CCOC1CCCOC1 d0075f04ed3a7677f879625296b3d1d3 [0,1,0,1,0,0|2,0,0]=4 5402 B13R1.28 CC/C=C\CCOC1CCCSC1 44affacaf556dd6e835c272c27b28428 [0,1,0,1,0,0|2,0,0]=4 5403 B13R1.28 CC/C=C\CCOC1CCOCC1 f0f4c9e3719627bc8d5055f635517068 [0,1,0,1,0,0|2,0,0]=4 5404 B13R1.28 CC/C=C\CCOC1CCSCC1 a08b69b286a11227b3087a4badeaaee4 [0,1,0,1,0,0|2,0,0]=4 5405 B13R1.28 CC/C=C\CCO[C@@H]1CCCOC1 39bcaa9f037b229ed3c0826d70831af7 [0,1,0,1,0,0|2,0,0]=4 5406 B13R1.28 CC/C=C\CCO[C@H]1CCCOC1 a4e501cb034d6474b5a6f39823e52c37 [0,1,0,1,0,0|2,0,0]=4 5407 B13R1.28 CC/C=C\COCC1CCCCC1 a388b9aff0ee1998361cabfe1775dddb [0,1,0,1,0,0|1,0,0]=3 5408 B13R1.28 CC/C=C\COCC1CCCCO1 d3c911d92dfce3383df2a93ce916202a [0,1,0,1,0,0|2,0,0]=4 5409 B13R1.28 CC/C=C\COCC1CCCOC1 6a10bddadf66bb5481df44d6dab4cdd1 [0,1,0,1,0,0|2,0,0]=4 5410 B13R1.28 CC/C=C\COCC1CCOCC1 0fb48431b57c094ba1b16abcca07f695 [0,1,0,1,0,0|2,0,0]=4 5411 B13R1.28 CC/C=C\COCC1CCSCC1 856490635122d6e3d32b78c615434317 [0,1,0,1,0,0|2,0,0]=4 5412 B13R1.28 CCC/C=C/COC1CCCCC1 b688654db9cff5965e60392bcc61ae0f [0,1,0,1,0,0|2,0,0]=4 5413 B13R1.28 CCC/C=C\COC1CCCCC1 2e2267eacabf7bbea607b1759edfe650 [0,1,0,1,0,0|2,0,0]=4 5414 B13R1.28 CCCCCCCN1CC=CCC1 8a4cd649c3250994396a8071d57bbb98 [0,1,0,1,0,0|1,0,0]=3 5415 B13R1.28 CCCCCCNC1C=CCCC1 602de8dbf899b5dde06d6122dfa68264 [0,1,0,1,0,0|2,0,0]=4 5416 B13R1.28 CCCCCCNC1CCCCO1 294a6f55dd55253b4a99d3e64ba39363 [0,1,0,1,0,0|0,0,2]=4 5417 B13R1.28 CCCCCCOC1C=CCCC1 ff73fe5be598e22d82da57c6da79e0f9 [0,1,0,1,0,0|2,0,0]=4 5418 B13R1.28 CCCCCCOC1CC=CCC1 eb8ff596b44930cf9b59f0d879db3819 [0,1,0,1,0,0|1,0,0]=3 5419 B13R1.28 CCCCCCOC1CCCCO1 b3a5eba44eef20e00df29acd37a377cc [0,1,0,1,0,0|0,0,2]=4 5420 B13R1.28 CCCCCNCC1CC=CCC1 65ef3edf52e94748b071b48379855c9c [0,1,0,1,0,0|1,0,0]=3 5421 B13R1.28 CCCCCNCC1CCCCO1 91bf0bbba6c44e016b3f8385f2aabaab [0,1,0,1,0,0|0,0,2]=4 5422 B13R1.28 CCCCCNCC1COCCO1 afeac512808e427f6ba9b4e65951c2f9 [0,1,0,1,0,0|1,0,1]=4 5423 B13R1.28 CCCCCNC[C@H]1COCCO1 0a57bc40b75f4711e0c1de9303ee9e84 [0,1,0,1,0,0|1,0,1]=4 5424 B13R1.28 CCCCCOCC1CC=CCC1 afbb1dd0effd8e5a5fc7548c34f37d37 [0,1,0,1,0,0|1,0,0]=3 5425 B13R1.28 CCCCCOCC1CCC=CO1 f1fa2cb915751658af2ecb5844a57740 [0,1,0,1,0,0|0,0,2]=4 5426 B13R1.28 CCCCCOCC1CCCCO1 53a89221bd344a269e636bdf81ee9edb [0,1,0,1,0,0|0,0,2]=4 5427 B13R1.28 CCCCCOCC1COCCO1 d6102a483f15337e9fe34623dcc017fe [0,1,0,1,0,0|1,0,1]=4 5428 B13R1.28 CCCCCOC[C@@H]1CC=CCC1 037db310d07fe176b4e6ceacb2e7d1ea [0,1,0,1,0,0|1,0,0]=3 5429 B13R1.28 CCCCCOC[C@@H]1CCCCO1 73f0375e83669a7e45d7607727c37a7c [0,1,0,1,0,0|0,0,2]=4 5430 B13R1.28 CCCCCOC[C@@H]1COCCO1 545632a6d305fa5e8f59a928f8bcb890 [0,1,0,1,0,0|1,0,1]=4 5431 B13R1.28 CCCCCOC[C@H]1CC=CCC1 79073d058f09b89c9f6293083caa847d [0,1,0,1,0,0|1,0,0]=3 5432 B13R1.28 CCCCCOC[C@H]1CCCCO1 372563b096403516f1d8d4cea0acfdfc [0,1,0,1,0,0|0,0,2]=4 5433 B13R1.28 CCCCCOC[C@H]1COCCO1 f677616df2ef101aa1a82c2ffd7e71ae [0,1,0,1,0,0|1,0,1]=4 5434 B13R1.28 CCCCNCCC1CCCCO1 8f3f04a9ec065fc210006a2d1d24fb4b [0,1,0,1,0,0|0,0,2]=4 5435 B13R1.28 CCCCNCCC1COCCO1 ef8d8c248b1bbf2f1a821a5fb9f331ce [0,1,0,1,0,0|1,0,1]=4 5436 B13R1.28 CCCCOCCC1CCCCO1 a31b791fe7670ba45e163927f1740049 [0,1,0,1,0,0|0,0,2]=4 5437 B13R1.28 CCCCOCCC1COCCO1 e84ad61e2de35bbc4c9b62b5f654ec47 [0,1,0,1,0,0|1,0,1]=4 5438 B13R1.28 CCCCOCCN1CC=CCC1 c2e18667b98d34b5fb855aa6ff7ddeba [0,1,0,1,0,0|2,0,0]=4 5439 B13R1.28 CCCCOCC[C@@H]1COCCO1 cf75c82fcbb1af02383f4e66611a7d76 [0,1,0,1,0,0|1,0,1]=4 5440 B13R1.28 CCCCOCC[C@H]1COCCO1 e0c8ba4f8eb5a674b1787ced1ab89d2a [0,1,0,1,0,0|1,0,1]=4 5441 B13R1.28 CCCCOCOC1CC=CCC1 4f25f8c048360090584dcb0bf61b234a [0,1,0,1,0,0|2,0,0]=4 5442 B13R1.28 CCCOCCCC1=CCC=CC1 0e618e7d081ca3a205e1b9c0bc3c6605 [0,1,0,1,0,0|1,0,1]=4 5443 B13R1.28 CCCOCCCN1CC=CCC1 99a7c8a6f6789811ffa22f4950a7ef0f [0,1,0,1,0,0|2,0,0]=4 5444 B13R1.28 CCCOCCOC1CC=CCC1 204411206434f3e466502a8b7c06b509 [0,1,0,1,0,0|2,0,0]=4 5445 B13R1.28 CCOCCCOC1CC=CCC1 31763e3bd94cb6a75d2f86ea84933aec [0,1,0,1,0,0|2,0,0]=4 5446 B13R1.28 CCOCCNCC1CC=CCC1 a5b7e15223afb9520c63ca13caf35b9f [0,1,0,1,0,0|2,0,0]=4 5447 B13R1.28 CCOCCOCC1CC=CCC1 c3d3cc89377e992c574110509ff16987 [0,1,0,1,0,0|2,0,0]=4 5448 B13R1.28 CCOCCOC[C@@H]1CC=CCC1 7205e47db90b75a2d2d867c90c8b7715 [0,1,0,1,0,0|2,0,0]=4 5449 B13R1.28 CCOCCOC[C@H]1CC=CCC1 817d81f8b66a8b9074e643bed5e7af81 [0,1,0,1,0,0|2,0,0]=4 5450 B13R1.28 CCSCCCOC1CC=CCC1 62a80250ec1d6d19e92731341bda6ada [0,1,0,1,0,0|2,0,0]=4 5451 B13R1.28 CCSCCNCC1CC=CCC1 c26e28a969d7ee202a52aca38f7f71fd [0,1,0,1,0,0|2,0,0]=4 5452 B13R1.28 CCSCCOCC1CC=CCC1 92110fa6480e16c550d775c94cf9cc0d [0,1,0,1,0,0|2,0,0]=4 5453 B13R1.28 CCSCCOC[C@@H]1CC=CCC1 f55ebe5f16172dd90f9a84cd9c53b5ec [0,1,0,1,0,0|2,0,0]=4 5454 B13R1.28 CCSCCOC[C@H]1CC=CCC1 3261bd30643bdc8e30e4c4949ab4fbd8 [0,1,0,1,0,0|2,0,0]=4 5455 B13R1.28 COCCCCCN1CC=CCC1 40be69a3e073f5b41b3b4056e7ef4185 [0,1,0,1,0,0|2,0,0]=4 5456 B13R1.28 COCCCCOC1CC=CCC1 949a4caca0475c0f7c1e44493b3ffe0f [0,1,0,1,0,0|2,0,0]=4 5457 B13R1.28 COCCCNCC1CC=CCC1 17069a7ee756ad864f1a8d862d7a9452 [0,1,0,1,0,0|2,0,0]=4 5458 B13R1.28 COCCCOCC1CC=CCC1 0226bf08de8799244b50e7b92095621e [0,1,0,1,0,0|2,0,0]=4 5459 B13R1.28 COCCCOC[C@@H]1CC=CCC1 20ba435be649baef8cd947c8411fcd52 [0,1,0,1,0,0|2,0,0]=4 5460 B13R1.28 COCCCOC[C@H]1CC=CCC1 512120463a478504abf3f8b9093e9858 [0,1,0,1,0,0|2,0,0]=4 5461 B13R1.28 COCCNCCC1CCCCC1 91bee6f5cf87441fa6b78bb4c2a6fd72 [0,1,0,1,0,0|1,0,1]=4 5462 B13R1.28 COCCOCCC1CCCCC1 670f6061f8782210665f1f1fd49b3847 [0,1,0,1,0,0|1,0,1]=4 5463 B13R1.28 COCNCCCC1CCCCC1 759015463615768256c637684e90b1fb [0,1,0,1,0,0|1,0,1]=4 5464 B13R1.28 COCOCCCC1CCCCC1 72256f858ddc13cff56d27058dffb6b6 [0,1,0,1,0,0|1,0,1]=4 5465 B13R1.28 CSCCCNCC1CC=CCC1 10baf459a13ac724063a20518a508ac7 [0,1,0,1,0,0|2,0,0]=4 5466 B13R1.28 CSCCCOCC1CC=CCC1 af0849c06951d78b0109aecebd6cb5d7 [0,1,0,1,0,0|2,0,0]=4 5467 B13R1.28 CSCCCOC[C@@H]1CC=CCC1 e4b67fa4feff9895f44fd15a7d4b9683 [0,1,0,1,0,0|2,0,0]=4 5468 B13R1.28 CSCCCOC[C@H]1CC=CCC1 7bc1d70f43ed9ca298afde0869bb1be1 [0,1,0,1,0,0|2,0,0]=4 5469 B13R1.28 ClCCCCNCC1CC=CCC1 e3df91a7db89208f6c09c9e0641b2ba7 [0,1,0,1,0,0|2,0,0]=4 5470 B13R1.28 FCCCCCCN1CC=CCC1 df5f7e1e4cc6f83f6246d858412e374a [0,1,0,1,0,0|2,0,0]=4 5471 B13R1.28 FCCCCCOC1CC=CCC1 0b9cbd01afa2a09fd8c5c247718964a6 [0,1,0,1,0,0|2,0,0]=4 5472 B13R1.28 FCCCCNCC1CC=CCC1 b2115ee32254fecd9f63b0f697d5db0f [0,1,0,1,0,0|2,0,0]=4 5473 B13R1.28 FCCCCOCC1CC=CCC1 de7a069d11ae5ae36c3773ac448b9b9f [0,1,0,1,0,0|2,0,0]=4 5474 B13R1.28 FCCCCOC[C@@H]1CC=CCC1 ef356755788b3984700035cea26e8d73 [0,1,0,1,0,0|2,0,0]=4 5475 B13R1.28 FCCCCOC[C@H]1CC=CCC1 1a8b1c84c3e30b206fd884b17233002e [0,1,0,1,0,0|2,0,0]=4 5476 B13R1.28 N#CC=CCNCC1CCCCC1 043f17e962be868846a0e0e113b8bc83 [0,1,0,1,0,0|1,0,1]=4 5477 B13R1.28 N#CC=CCOCC1CCCCC1 f52de2ff24282c0221994dbed71ef4f1 [0,1,0,1,0,0|1,0,1]=4 5478 B13R1.28 NOCCNCCC1CCCCC1 2d568a0d8b04e6234bf0f168c7446e21 [0,1,0,1,0,0|1,0,1]=4 5479 B13R1.28 O/C=C\CNCCC1CCCCC1 4c84f88aa976b01d6f069964a32404a2 [0,1,0,1,0,0|0,0,2]=4 5480 B13R1.28 O=C/C=C/COCC1CCCCC1 29aa9f5860ea3879c857944e97444103 [0,1,0,1,0,0|0,0,2]=4 5481 B13R1.28 OCC#CCNCC1CCCCC1 0aa57ae1613c0c4c2538d679e8868d69 [0,1,0,1,0,0|0,0,2]=4 5482 B13R1.28 OCCCCCCN1CC=CCC1 d0bd95e7be349b8cc125761e7f2e5d88 [0,1,0,1,0,0|2,0,0]=4 5483 B13R1.28 OCCCCCNC1CCCCC1 a27e43cfd7b4917a106bd8dee7fca098 [0,1,0,1,0,0|0,0,2]=4 5484 B13R1.28 OCCCCNCC1CC=CCC1 d8d6180fb249c3f58f7dc5e71d7639a8 [0,1,0,1,0,0|2,0,0]=4 5485 B13R1.28 OCCCCNCC1CCCCC1 bf631c19e88d681fb4136fbaaba5b752 [0,1,0,1,0,0|0,0,2]=4 5486 B13R1.28 OCCCNCCC1CCCCC1 2ec09612c8b326b196ff9639143705ea [0,1,0,1,0,0|0,0,2]=4 5487 B13R1.28 OCCNCCCC1CCCCC1 3e1d53e6bfdc64a6804ff246ca5086ad [0,1,0,1,0,0|0,0,2]=4 5488 B13R1.28 OCCNCCCC1CCOCC1 23c2383ae92383a802d2715f7cc07dd1 [0,1,0,1,0,0|1,0,1]=4 5489 B13R1.28 OCCNCCCN1CCCCC1 8dd9a563d0e2347b5bd80031287247f1 [0,1,0,1,0,0|1,0,1]=4 5490 B13R1.28 OCCNCCOC1CCCCC1 95b4b2dda74e5ee0ee5b11b98578155c [0,1,0,1,0,0|1,0,1]=4 5491 B13R1.28 OCCNCCSC1CCCCC1 69b34ee40161d76f05e1e8a86eb0f59f [0,1,0,1,0,0|1,0,1]=4 5492 B13R1.28 OCCOCCNC1CCCCC1 3e32a5db203cb2f513ba3cf5ef282c8b [0,1,0,1,0,0|1,0,1]=4 5493 B13R1.28 OCCSCCNC1CCCCC1 4607b71def5402e71ee5733ac1bed46f [0,1,0,1,0,0|1,0,1]=4 5494 B13R1.28 OCNCCCCC1CCCCC1 a480099fe5bb76e014f691ff2f2be5a2 [0,1,0,1,0,0|0,0,2]=4 5495 B13R1.28 OCNCCCCN1CCCCC1 11bc84beb4d35623f8a2525306e42ace [0,1,0,1,0,0|1,0,1]=4 5496 B13R1.28 OCNCCCOC1CCCCC1 8cd817e71a34d05f75868256cf1bc4fa [0,1,0,1,0,0|1,0,1]=4 5497 B13R1.28 SCCCCNCC1CC=CCC1 21022cbc4bc9ec0360e4282650f5f2be [0,1,0,1,0,0|2,0,0]=4 5498 B13R1.28 SCCCCOCC1CC=CCC1 2c703f1bd27731ebcfc08a3564ebc825 [0,1,0,1,0,0|2,0,0]=4 5499 B13R1.34 CC/C=C/CN1CCCCCC1C 21d825c45c523ea92abc61ca96212e03 [0,1,0,1,0,0|1,0,0]=3 5500 B13R1.34 CC/C=C/CN1CCCOCC1C 2ade23b9629962b37d7d30614a18a908 [0,1,0,1,0,0|2,0,0]=4 5501 B13R1.34 CC/C=C/CN1CCOCCC1C 7de7fb3a5b8d6f8e516deb9c85a0a2f4 [0,1,0,1,0,0|2,0,0]=4 5502 B13R1.34 CC/C=C/CN1CCSCCC1C 5d8b52d7f216df329ab95537b11bcd2a [0,1,0,1,0,0|2,0,0]=4 5503 B13R1.34 CC1CCCCCN1CC=CC#N 680a79243ca3f21b67eb6b545049fe85 [0,1,0,1,0,0|1,0,1]=4 5504 B13R1.34 CC1CCCCCN1CCCCO 2ffbf434dc2d48c7646bbd2b2ae94aef [0,1,0,1,0,0|0,0,2]=4 5505 B13R1.34 CCCCN[C@@H]1CCCCC[C@@H]1O a76bb40222aaad35b7d60b58c552dee0 [0,1,0,1,0,0|0,0,2]=4 5506 B13R1.34 CCCCN[C@@H]1CCCCC[C@H]1O 943d64e518f077700d43f1deae187674 [0,1,0,1,0,0|0,0,2]=4 5507 B13R1.34 CCCCN[C@H]1CCCCC[C@@H]1O 4cc0cf24947e74371e8dedfea2a82dde [0,1,0,1,0,0|0,0,2]=4 5508 B13R1.84 CC/C=C/CN1CCCCC1CC 031c8b3b745735c57e7a1f51c3e714b0 [0,1,0,1,0,0|1,0,0]=3 5509 B13R1.84 CC/C=C/CN1CCCCC1CO 08fd22a8b5956393f2aca5cc1254a8f2 [0,1,0,1,0,0|2,0,0]=4 5510 B13R1.84 CC/C=C/CN1CCCC[C@@H]1CC ad3469ad02c7662c6702c66595186b14 [0,1,0,1,0,0|1,0,0]=3 5511 B13R1.84 CC/C=C/CN1CCCC[C@@H]1CO 107b6691869ff28da286405b03a1f0cb [0,1,0,1,0,0|2,0,0]=4 5512 B13R1.84 CC/C=C/CN1CCCC[C@H]1CC 1de2ef1d6f123d25ac7f14932fb26017 [0,1,0,1,0,0|1,0,0]=3 5513 B13R1.84 CC/C=C/CN1CCCC[C@H]1CO 93d6723235c13e44181cf8f67571e2b5 [0,1,0,1,0,0|2,0,0]=4 5514 B13R1.84 CC/C=C/CN1CCOCC1CC dcdf9f98921d0490452696100ad3bc8a [0,1,0,1,0,0|2,0,0]=4 5515 B13R1.84 CC/C=C/CN1CCOC[C@@H]1CC 631742b32af033f51c58d68cf5644970 [0,1,0,1,0,0|2,0,0]=4 5516 B13R1.84 CC/C=C/CN1CCOC[C@H]1CC b469eb843ad55c9adfa9facc48874b1f [0,1,0,1,0,0|2,0,0]=4 5517 B13R1.84 CCC1CCCCC1OCCOC 0387f3f8b39d481dbff7fd61c91740ef [0,1,0,1,0,0|1,0,1]=4 5518 B13R1.84 CCC1CCCCN1CC=CC#N dfff67827c3cc189a58a87f99bea7599 [0,1,0,1,0,0|1,0,1]=4 5519 B13R1.84 CCC1CCCCN1CCCCO 197e5c3f473492373d1c6badbe571eb1 [0,1,0,1,0,0|0,0,2]=4 5520 B13R1.84 CCC1CCCCN1CCNCO 677a5e3e4fd71383b53d5c894f0fc694 [0,1,0,1,0,0|1,0,1]=4 5521 B13R1.84 CCCCCN1CCCCC1CO 596a34957e87525db9af958246ec5b07 [0,1,0,1,0,0|0,0,2]=4 5522 B13R1.84 CCCCCN1CCCC[C@@H]1CO 4ba845eb0d351e4f9d1d9167bc65c334 [0,1,0,1,0,0|0,0,2]=4 5523 B13R1.84 CCCCCN1CCCC[C@H]1CO 3dd80985b40d93d5a85030a83713224e [0,1,0,1,0,0|0,0,2]=4 5524 B13R1.84 CCCCN[C@@H]1CCCC[C@@H]1CO 07b95f38bbc6b1e027bfb81203e30c1d [0,1,0,1,0,0|0,0,2]=4 5525 B13R1.84 CCCCN[C@@H]1CCCC[C@H]1CO 259bf10f0902610ab16e4fea98473c33 [0,1,0,1,0,0|0,0,2]=4 5526 B13R1.84 CCCCN[C@H]1CCCC[C@H]1CO 465c7334fe2c0bbf47685d06b981a05b [0,1,0,1,0,0|0,0,2]=4 5527 B13R1.84 CCN1CCCCC1CCCCO a193930e1b156e3983df273fe2d90e63 [0,1,0,1,0,0|0,0,2]=4 5528 B13R1.84 CCN1CCCCC1CNCCO 2d2e5eee21bd6a0c976905a02a57e590 [0,1,0,1,0,0|1,0,1]=4 5529 B13R1.84 CC[C@@H]1CCCCN1CC=CC#N 3cb8a74006bec0eab642b8a90bde8daf [0,1,0,1,0,0|1,0,1]=4 5530 B13R1.84 CC[C@@H]1CCCCN1CCCCO 603cdc6a73fb290b14442ad5045ef39e [0,1,0,1,0,0|0,0,2]=4 5531 B13R1.84 CC[C@H]1CCCCN1CC=CC#N f2093de4c6cff861180c5bdf91a589bd [0,1,0,1,0,0|1,0,1]=4 5532 B13R1.84 CC[C@H]1CCCCN1CCCCO 19bb20bb1396c2d0e816994a1ab3f0f5 [0,1,0,1,0,0|0,0,2]=4 5533 B13R1.84 COCCCC1CCCCN1CO 3b3b4d72d51a5e3acaed2774a5bc9828 [0,1,0,1,0,0|1,0,1]=4 5534 B13R1.84 OCCCCC1CCCCN1CO 6c65d33536aa7fee80b516701f0f61ae [0,1,0,1,0,0|1,0,1]=4 5535 B13R1.137 CC/C=C/CNC1CCCC1OC d06a49f41a09254564765e6ad605f508 [0,1,0,1,0,0|2,0,0]=4 5536 B13R1.137 CC/C=C/CN[C@@H]1CCC[C@H]1CC 17947637ee9c857a1fcc6f8c59b13fa2 [0,1,0,1,0,0|1,0,0]=3 5537 B13R1.137 CC/C=C/CN[C@@H]1CCC[C@H]1OC 38347bd8755c4915ed0d8bcb91279537 [0,1,0,1,0,0|2,0,0]=4 5538 B13R1.137 CC/C=C/CN[C@H]1CCC[C@@H]1OC 8b35ec3f873240ab7c4cc521954b20d2 [0,1,0,1,0,0|2,0,0]=4 5539 B13R1.137 CC/C=C/CN[C@H]1CCC[C@H]1CO 1641437cdd7a7d3a18561fd26f9dbcbe [0,1,0,1,0,0|2,0,0]=4 5540 B13R1.137 CC/C=C/CN[C@H]1CCC[C@H]1OC 6b04668040e5ea8b5fc5708fa8cdd854 [0,1,0,1,0,0|2,0,0]=4 5541 B13R1.137 CC/C=C\CCN1CCCC1CC 4ac41bc38c6de9bef9cf051f42c760ce [0,1,0,1,0,0|1,0,0]=3 5542 B13R1.137 CC/C=C\CCN1CCCC1CO 5bfc1fda8ee3030b3897b53a302b6867 [0,1,0,1,0,0|2,0,0]=4 5543 B13R1.137 CC/C=C\CCN1CCCC1OC ba1578324065649e8a24478cbaad357e [0,1,0,1,0,0|2,0,0]=4 5544 B13R1.137 CC/C=C\CCN1CCC[C@@H]1CF f6c0b63c06744d0b671514ce740b6224 [0,1,0,1,0,0|2,0,0]=4 5545 B13R1.137 CC/C=C\CCN1CCC[C@@H]1CO 6013ab40f06732d05a3ad17924dcf73b [0,1,0,1,0,0|2,0,0]=4 5546 B13R1.137 CC/C=C\CCN1CCC[C@H]1CC d42560260b5f77dee61b00720ac5aa9d [0,1,0,1,0,0|1,0,0]=3 5547 B13R1.137 CC/C=C\CCN1CCC[C@H]1CF 60b47269dd77e22b62eb73171791aecb [0,1,0,1,0,0|2,0,0]=4 5548 B13R1.137 CC/C=C\CCN1CCC[C@H]1CO 78c9ddef9cce68611fa22c5d394e0604 [0,1,0,1,0,0|2,0,0]=4 5549 B13R1.137 CCC/C=C/CN1CCCC1CC 7269c606dfca2fa243be846196b7f8db [0,1,0,1,0,0|2,0,0]=4 5550 B13R1.137 CCC/C=C/CN1CCC[C@H]1CC 850b3387cf871d1a6d22ae85f4a6b2f9 [0,1,0,1,0,0|2,0,0]=4 5551 B13R1.137 CCC/C=C\CN1CCCC1CC 181179b02aaec1718bcf1c197a532ca1 [0,1,0,1,0,0|2,0,0]=4 5552 B13R1.137 CCC/C=C\CN1CCC[C@H]1CC a3d0d4b915c583af5705c9a29351f319 [0,1,0,1,0,0|2,0,0]=4 5553 B13R1.137 CCC1CCCN1CCCCCO 628c16104f4a1f2f09b845bba6f42f2a [0,1,0,1,0,0|0,0,2]=4 5554 B13R1.137 CCC1CCCN1CCOCCO b5fa6ba349c297209ddc38e99dd41631 [0,1,0,1,0,0|1,0,1]=4 5555 B13R1.137 CCCCCCN1CC=CC1CO f6270e910985a4df18e0b78eb36d4ba9 [0,1,0,1,0,0|1,0,0]=3 5556 B13R1.137 CCCCCCN1CCCC1CO 8600fc401222f1e1edc2aaf3e301c2d0 [0,1,0,1,0,0|0,0,2]=4 5557 B13R1.137 CCCCCCN1CCC[C@@H]1CO 094e41c89024f753329b51ad66065428 [0,1,0,1,0,0|0,0,2]=4 5558 B13R1.137 CCCCCCN1CCC[C@H]1CO 0e1317bfd8d25ac8cdae20a809e4e0d5 [0,1,0,1,0,0|0,0,2]=4 5559 B13R1.137 CCCCCN[C@H]1CCC[C@H]1CO 05d60c788e2ae5326ba4da7ec27f7382 [0,1,0,1,0,0|0,0,2]=4 5560 B13R1.137 CCCCOCN1CC=CC1CO 272b25d8a079d63971fd057227bed067 [0,1,0,1,0,0|2,0,0]=4 5561 B13R1.137 CCCOCCN1CC=CC1CO 9dcb0b6173c9aba262445780d640c202 [0,1,0,1,0,0|2,0,0]=4 5562 B13R1.137 CCOCCCN1CC=CC1CO 6a8225c78a8796d15572d3f203124b0a [0,1,0,1,0,0|2,0,0]=4 5563 B13R1.137 CCSCCCN1CC=CC1CO eee47f8526e2adc61b4942b1640a57f8 [0,1,0,1,0,0|2,0,0]=4 5564 B13R1.137 CC[C@@H]1CCCN1CCCCCO 311252e10cf0019e9c62605f7d0b6127 [0,1,0,1,0,0|0,0,2]=4 5565 B13R1.137 CC[C@@H]1CCCN1CCOCCO 77b60f06a0f2c7ec9a7c4267cb12abe2 [0,1,0,1,0,0|1,0,1]=4 5566 B13R1.137 CC[C@@H]1CCC[C@H]1NCC=CC#N 4e789ad534ae02b64f3a743094dcc0d3 [0,1,0,1,0,0|1,0,1]=4 5567 B13R1.137 CC[C@@H]1CCC[C@H]1NCCCCO 4e1d9712a671e12f2cdca10d9d122aad [0,1,0,1,0,0|0,0,2]=4 5568 B13R1.137 COCCCCN1CC=CC1CO afdb3b6d2fde3d2a84c6f77dfe01fc6f [0,1,0,1,0,0|2,0,0]=4 5569 B13R1.137 OCC1C=CCN1CCCCCF 1f59a34047c8b5fe94922b06a7435bec [0,1,0,1,0,0|2,0,0]=4 5570 B13R1.137 OCCCCCN1CC=CC1CO fed5a7022c9b85aa0d192766ec9b17b9 [0,1,0,1,0,0|2,0,0]=4 5571 B13R1.154 CCCN[C@H]1CCCCCC[C@@H]1O 216323beb74ad1ea5282f587e4b8ee5b [0,1,0,1,0,0|0,0,2]=4 5572 B13R1.154 OCCN[C@H]1CCCCCC[C@@H]1O 72a961773e02bb81443110b0d85d2be8 [0,1,0,1,0,0|1,0,1]=4 5573 B13R1.192 CC/C=C\CCN1CCC1CCO eace1633aa5bf47963edb38238a5dc4a [0,1,0,1,0,0|2,0,0]=4 5574 B13R1.192 CC/C=C\CCN1CCC1COC 0bd0fefcbf8bdc1f8777111a2ebf4e9f [0,1,0,1,0,0|2,0,0]=4 5575 B13R1.192 CC/C=C\CCN1CC[C@@H]1COC 0af9b0c4b9c2a2cfd79d1d51e64ad2d7 [0,1,0,1,0,0|2,0,0]=4 5576 B13R1.192 CC/C=C\CCN1CC[C@H]1COC ccac5c9ef1d2ba2ac7cc4f36f824bafa [0,1,0,1,0,0|2,0,0]=4 5577 B13R1.192 CCCCCCN1CCC1CCO eab765660cab938af912cf2112a139f0 [0,1,0,1,0,0|0,0,2]=4 5578 B13R1.485 CCCC1CCCCC1OCOC b773168f78de02bd8cbbcdf7acd35f39 [0,1,0,1,0,0|1,0,1]=4 5579 B13R1.485 CCCCN1CCCCC1CCO 48836b622689ce71813f014ebabf3dfe [0,1,0,1,0,0|0,0,2]=4 5580 B13R1.485 CCCCN1CCCC[C@@H]1CCO 66880e14a4b92e7c65f0397f299aca75 [0,1,0,1,0,0|0,0,2]=4 5581 B13R1.485 CCCCN1CCCC[C@H]1CCO 67c3eddc246eb6cf82a2b5465de22316 [0,1,0,1,0,0|0,0,2]=4 5582 B13R1.485 CCCN1CCCCC1CCCO 4b34f9db0b26c8c32ca29b21de54416d [0,1,0,1,0,0|0,0,2]=4 5583 B13R1.485 COCCC1CCCCN1CCO 83aa535dd84a1f042351a3cf2ec8c13a [0,1,0,1,0,0|1,0,1]=4 5584 B13R1.485 OCCCC1CCCCN1CCO b583ad85c80185190795aa326cd9fcad [0,1,0,1,0,0|1,0,1]=4 5585 B13R1.489 COCCN1CCCCCCCC1 ccd7577168a09f8e2dc684694c1da802 [0,1,0,1,0,0|1,0,1]=4 5586 B13R1.489 O/C=C\CN1CCCCCCCC1 5f9cfebbf63234eb664c9ec25391eeb3 [0,1,0,1,0,0|0,0,2]=4 5587 B13R1.489 OCCCN1CCCCCCCC1 c71dc01ce316e40d54aefc9bac7c72b9 [0,1,0,1,0,0|0,0,2]=4 5588 B13R1.555 CC/C=C/CNC1CCCCC1C 608237ab33083046cf782c1a798a4db3 [0,1,0,1,0,0|1,0,0]=3 5589 B13R1.555 CC/C=C/CNC1CCCCC1O cdf4864774a1dd93114b5d5765f474e4 [0,1,0,1,0,0|2,0,0]=4 5590 B13R1.555 CC/C=C/CNC1CCOCC1C d92a8c0fb6a186353e1b58b6dd9fdafc [0,1,0,1,0,0|2,0,0]=4 5591 B13R1.555 CC/C=C/CN[C@@H]1CCCC[C@@H]1C 0b12e9c1c91d2b2ac22b4b444566cc2c [0,1,0,1,0,0|1,0,0]=3 5592 B13R1.555 CC/C=C/CN[C@@H]1CCCC[C@H]1C 31eae36c8476ccf03ce38a54e325560d [0,1,0,1,0,0|1,0,0]=3 5593 B13R1.555 CC/C=C/CN[C@@H]1CCCC[C@H]1O d47ae60e78a91367551f5c1195ff957a [0,1,0,1,0,0|2,0,0]=4 5594 B13R1.555 CC/C=C/CN[C@@H]1CCOC[C@@H]1C e7ab96129a99f913ab7702a2b6da442f [0,1,0,1,0,0|2,0,0]=4 5595 B13R1.555 CC/C=C/CN[C@H]1CCCC[C@@H]1C 3e087820866a8551d6fa8fb345d17e53 [0,1,0,1,0,0|1,0,0]=3 5596 B13R1.555 CC/C=C/CN[C@H]1CCCC[C@@H]1O 05788b09f8db2fa11d839ca460dc2ce8 [0,1,0,1,0,0|2,0,0]=4 5597 B13R1.555 CC/C=C/CN[C@H]1CCCC[C@H]1C be4e9d850122849bb03750b62e7812ad [0,1,0,1,0,0|1,0,0]=3 5598 B13R1.555 CC/C=C/CN[C@H]1CCCC[C@H]1O df76e89eb615f1378c9b244e9d59f6fd [0,1,0,1,0,0|2,0,0]=4 5599 B13R1.555 CC/C=C/CN[C@H]1CCOC[C@H]1C d2a015bbf06feb6e3f8c7d9f1d8ac129 [0,1,0,1,0,0|2,0,0]=4 5600 B13R1.555 CC/C=C/COC1CCCCC1C 3db543b8f18600e50dd9016f619aad9c [0,1,0,1,0,0|1,0,0]=3 5601 B13R1.555 CC/C=C/COC1CCCCC1F bc81df4f0c3a4fe2da7845377110c4e4 [0,1,0,1,0,0|2,0,0]=4 5602 B13R1.555 CC/C=C/COC1CCOCC1C 8498b5f9951fe554bcdadbe37e5a8d38 [0,1,0,1,0,0|2,0,0]=4 5603 B13R1.555 CC/C=C/CO[C@@H]1CCCC[C@@H]1C 5e4287b7b691c129a5f47112c09ab766 [0,1,0,1,0,0|1,0,0]=3 5604 B13R1.555 CC/C=C/CO[C@@H]1CCCC[C@H]1F 5c7109049acfd2152ca9a83f56226557 [0,1,0,1,0,0|2,0,0]=4 5605 B13R1.555 CC/C=C/CO[C@H]1CCCC[C@@H]1C 7bf629c0a8d3de43675fd210662e1c6e [0,1,0,1,0,0|1,0,0]=3 5606 B13R1.555 CC/C=C/CO[C@H]1CCCC[C@H]1C c8e0e9112b0d2d6473847c1492af5e01 [0,1,0,1,0,0|1,0,0]=3 5607 B13R1.555 CC/C=C\CCN1CCCCC1C 35236e8eec6a9a50590baa932ae3dd35 [0,1,0,1,0,0|1,0,0]=3 5608 B13R1.555 CC/C=C\CCN1CCCC[C@@H]1C f9273d954ce4df3add9efa1be663e875 [0,1,0,1,0,0|1,0,0]=3 5609 B13R1.555 CC/C=C\CCN1CCCC[C@H]1C 8104f7435bd077b3ef49da6ecfd5d5ce [0,1,0,1,0,0|1,0,0]=3 5610 B13R1.555 CC/C=C\CCN1CCOCC1C 9c91ae5b04179df52b1cd0b6618a8fbd [0,1,0,1,0,0|2,0,0]=4 5611 B13R1.555 CC/C=C\CCN1CCOC[C@@H]1C 057b5ae164492efea00805bbdf3ced1d [0,1,0,1,0,0|2,0,0]=4 5612 B13R1.555 CC/C=C\CCN1CCOC[C@H]1C a4f30717bfff3d9c6541dde3ad8e05ef [0,1,0,1,0,0|2,0,0]=4 5613 B13R1.555 CC/C=C\COC1CCCCC1F a242657243f7b3d2db600bd235145805 [0,1,0,1,0,0|2,0,0]=4 5614 B13R1.555 CC/C=C\CO[C@H]1CCCC[C@H]1C c266c80eb7b5e4d9fbf5df70c66813f8 [0,1,0,1,0,0|1,0,0]=3 5615 B13R1.555 CC1CCCCC1CNC/C=C\O b15739921d4028d6272b6b55463d23cc [0,1,0,1,0,0|0,0,2]=4 5616 B13R1.555 CC1CCCCC1CNCCCO 74e5d64db3cf22391e77ab250fb8d0b8 [0,1,0,1,0,0|0,0,2]=4 5617 B13R1.555 CC1CCCCC1NCC=CC#N a31dcf07b628e31d3cd57f92a5ba9345 [0,1,0,1,0,0|1,0,1]=4 5618 B13R1.555 CC1CCCCC1NCCCCO 3854a2b2a4268ad5c49391d54e229d00 [0,1,0,1,0,0|0,0,2]=4 5619 B13R1.555 CC1CCCCC1OCC=CC#N fdf1d68cfdcb7417c8b150e74a4d3a9d [0,1,0,1,0,0|1,0,1]=4 5620 B13R1.555 CC1CCCCC1OCCNCO 472b8127198ddaf1467abf8924cbbad3 [0,1,0,1,0,0|1,0,1]=4 5621 B13R1.555 CC1CCCCN1CCCCCO 09a5e16418aebbe0f727fc8064012a95 [0,1,0,1,0,0|0,0,2]=4 5622 B13R1.555 CC1CCCCN1CCCNCO 7c26a3fc69e312563ba3037e3d11bfee [0,1,0,1,0,0|1,0,1]=4 5623 B13R1.555 CC1CCCCN1CCNCCO 89f968707af13d472235897b39df08b6 [0,1,0,1,0,0|1,0,1]=4 5624 B13R1.555 CC1CCCCN1CCOCCO 175ec6bb4d64f216fd0357a967bf69e4 [0,1,0,1,0,0|1,0,1]=4 5625 B13R1.555 CCC/C=C/CN1CCCCC1C 5a672fba4323e3efaec0e5920fd8d7ce [0,1,0,1,0,0|2,0,0]=4 5626 B13R1.555 CCC/C=C/CN1CCCC[C@@H]1C e54b39b8792d730532785df7c344b43e [0,1,0,1,0,0|2,0,0]=4 5627 B13R1.555 CCC/C=C/CN1CCCC[C@H]1C d3ac5f9961589b4f83129230b4591451 [0,1,0,1,0,0|2,0,0]=4 5628 B13R1.555 CCC/C=C\CN1CCCCC1C 626b20d041189744111d4725947cdbad [0,1,0,1,0,0|2,0,0]=4 5629 B13R1.555 CCC/C=C\CN1CCCC[C@@H]1C b897fb72389d21b922402caa56184596 [0,1,0,1,0,0|2,0,0]=4 5630 B13R1.555 CCC/C=C\CN1CCCC[C@H]1C d2fb43f87f4f1f6f090200efd8c89517 [0,1,0,1,0,0|2,0,0]=4 5631 B13R1.555 CCCCCNC1CCCCC1O 9f04f3957875544014ff70236481212e [0,1,0,1,0,0|0,0,2]=4 5632 B13R1.555 CCCCCNC1CCOCC1O d0e8ea64f5456f19d7f26270f6b5ef99 [0,1,0,1,0,0|1,0,1]=4 5633 B13R1.555 CCCCCN[C@@H]1CCCC[C@H]1O 442af33c9cb574a905915c3c9f6f5635 [0,1,0,1,0,0|0,0,2]=4 5634 B13R1.555 CCCCCN[C@@H]1CCOC[C@@H]1O fea9d6bd962423d033b4977cee79246e [0,1,0,1,0,0|1,0,1]=4 5635 B13R1.555 CCCCCN[C@@H]1CCOC[C@H]1O b82e1fb92b50328ea57b320d599afbac [0,1,0,1,0,0|1,0,1]=4 5636 B13R1.555 CCCCCN[C@H]1CCCC[C@@H]1O 4f1d29552c3c9005c9516d7a78fadaef [0,1,0,1,0,0|0,0,2]=4 5637 B13R1.555 CCCCCN[C@H]1CCCC[C@H]1O b6bf0162bcced5307881f1a7cca9975e [0,1,0,1,0,0|0,0,2]=4 5638 B13R1.555 CCCCCN[C@H]1CCOC[C@@H]1O 2be4b6edb6f31f0c94d043e03d3e90ef [0,1,0,1,0,0|1,0,1]=4 5639 B13R1.555 CCCCCN[C@H]1CCOC[C@H]1O deb020f418bf62ce98c71df417f8ceeb [0,1,0,1,0,0|1,0,1]=4 5640 B13R1.555 CCCCNCC1CCCCC1O 59be7866a62ec8719dcda6626e8041b9 [0,1,0,1,0,0|0,0,2]=4 5641 B13R1.555 CCCCOCC1CC=CCC1C f21526f8992fa2478e8c95eb21bc19ba [0,1,0,1,0,0|2,0,0]=4 5642 B13R1.555 CN1CCCCC1CCNCCO 9674c0df754e5ac3b35b0a0793670519 [0,1,0,1,0,0|1,0,1]=4 5643 B13R1.555 COCCNCC1CCCCC1C 685db001af1711900856eedea9ca066f [0,1,0,1,0,0|1,0,1]=4 5644 B13R1.555 C[C@@H]1CCCCN1CCCCCO 0405aa89e6b92451e87f657169c4a79c [0,1,0,1,0,0|0,0,2]=4 5645 B13R1.555 C[C@@H]1CCCCN1CCOCCO dc82b73297db5a317e5d6427dad04625 [0,1,0,1,0,0|1,0,1]=4 5646 B13R1.555 C[C@@H]1CCCC[C@@H]1NCC#CCO 84764207016585c9f50f864562a667ef [0,1,0,1,0,0|0,0,2]=4 5647 B13R1.555 C[C@@H]1CCCC[C@@H]1NCC=CC#N f14ff09d42e75af959ab3bed421181db [0,1,0,1,0,0|1,0,1]=4 5648 B13R1.555 C[C@@H]1CCCC[C@@H]1NCCCCO ed5d2ed4193f579d1f5c58bf99fc31f8 [0,1,0,1,0,0|0,0,2]=4 5649 B13R1.555 C[C@@H]1CCCC[C@@H]1OC/C=C/C=O d7b6bcdbe8a4bf4aad4436e2cc7365b1 [0,1,0,1,0,0|0,0,2]=4 5650 B13R1.555 C[C@@H]1CCCC[C@@H]1OCC=CC#N 73d7f8e84d763f8ef7e76832f5e66e19 [0,1,0,1,0,0|1,0,1]=4 5651 B13R1.555 C[C@@H]1CCCC[C@H]1NCC=CC#N 20ded30a037e4fd0385f729493d836cb [0,1,0,1,0,0|1,0,1]=4 5652 B13R1.555 C[C@@H]1CCCC[C@H]1NCCCCO cb20972e23808594dd4d4e23c576b7e8 [0,1,0,1,0,0|0,0,2]=4 5653 B13R1.555 C[C@H]1CCCCN1CCCCCO a8b956eb918f44fe1e101c6bd34cdde9 [0,1,0,1,0,0|0,0,2]=4 5654 B13R1.555 C[C@H]1CCCCN1CCOCCO ee5d6e194132b7a568c8b0bfb3a0ed11 [0,1,0,1,0,0|1,0,1]=4 5655 B13R1.555 C[C@H]1CCCC[C@@H]1NCC=CC#N eae788f410b142fc22ede3dea9eb8878 [0,1,0,1,0,0|1,0,1]=4 5656 B13R1.555 C[C@H]1CCCC[C@@H]1NCCCCO 49267ca25165637110bae439d4d15980 [0,1,0,1,0,0|0,0,2]=4 5657 B13R1.555 C[C@H]1CCCC[C@@H]1OCC=CC#N b02a98b39495e85cd1d020b7b9fd6a61 [0,1,0,1,0,0|1,0,1]=4 5658 B13R1.555 C[C@H]1CCCC[C@H]1NCC=CC#N 4e60b6aceb61fbc823ce0f97ca7ad894 [0,1,0,1,0,0|1,0,1]=4 5659 B13R1.555 C[C@H]1CCCC[C@H]1NCCCCO cb2cbad8288a1814abf172ba2724e616 [0,1,0,1,0,0|0,0,2]=4 5660 B13R1.555 C[C@H]1CCCC[C@H]1OCC=CC#N be771b3ed5e4cf79f34cac5e1158449b [0,1,0,1,0,0|1,0,1]=4 5661 B13R1.559 CC1CC1NCCCCCCCO 8aa3ae35662187ae00f2d2d88bee4c91 [0,1,0,1,0,0|0,0,2]=4 5662 B13R1.560 C=C/C=C/CCNCCC1CCC1 5d8c4d7432cc5534cf213e7cd9970bfb [0,1,0,1,0,0|1,0,1]=4 5663 B13R1.560 CC/C=C/CCOCCC1CCC1 e500548a1dd2ebc04ec4717625d2f7b3 [0,1,0,1,0,0|1,0,0]=3 5664 B13R1.560 CC/C=C/CCOCCC1CCO1 b87cf4db0d2daef216bbfe76c5091b80 [0,1,0,1,0,0|2,0,0]=4 5665 B13R1.560 CC/C=C/CCOCCC1COC1 6da45ae75f48870ca2290b0329aa97e5 [0,1,0,1,0,0|2,0,0]=4 5666 B13R1.560 CC/C=C/CNCCCN1CCC1 1896aa491faddec0d92371a30aa3c8ac [0,1,0,1,0,0|2,0,0]=4 5667 B13R1.560 CC/C=C/COCCCC1CCC1 835a6fc63fa1917bbd185a2bcc6c885c [0,1,0,1,0,0|1,0,0]=3 5668 B13R1.560 CC/C=C/COCCCC1COC1 83aa7808e55d1ab075153a0b2fe0680e [0,1,0,1,0,0|2,0,0]=4 5669 B13R1.560 CC/C=C/COCCCN1CCC1 3e77dd5f2400514264e07f1c4be5440b [0,1,0,1,0,0|2,0,0]=4 5670 B13R1.560 CC/C=C/COCCOC1CCC1 462c6b6fa73e8d6b1482d8cc4ace515e [0,1,0,1,0,0|2,0,0]=4 5671 B13R1.560 CC/C=C\CCCCCN1CCC1 38a54894ad0ba8f2392bbd1b16b12892 [0,1,0,1,0,0|1,0,0]=3 5672 B13R1.560 CC/C=C\CCCCOC1CCC1 daac8c50797aed1d8b2763d93a363140 [0,1,0,1,0,0|1,0,0]=3 5673 B13R1.560 CC/C=C\CCCCOC1COC1 c4db39e8f521dceed050a0154a771d2d [0,1,0,1,0,0|2,0,0]=4 5674 B13R1.560 CC/C=C\CCCOCC1CCC1 34e9a3656463087ebd018c3f9c836a2b [0,1,0,1,0,0|1,0,0]=3 5675 B13R1.560 CC/C=C\CCCOCC1CCO1 acc28f0e011927be36782eae1aefc00c [0,1,0,1,0,0|2,0,0]=4 5676 B13R1.560 CC/C=C\CCCOCC1COC1 ba99fe546f932d669923e40344cd431e [0,1,0,1,0,0|2,0,0]=4 5677 B13R1.560 CC/C=C\CCCOC[C@@H]1CCO1 c5ba8a90a714aebd3ef22b1616affd20 [0,1,0,1,0,0|2,0,0]=4 5678 B13R1.560 CC/C=C\CCCOC[C@H]1CCO1 965e945285e859d5d6dc0ca46f6917d5 [0,1,0,1,0,0|2,0,0]=4 5679 B13R1.560 CC/C=C\CCNCCC1CCC1 4cfe11a331d741d867b451ead9ef7f5f [0,1,0,1,0,0|1,0,0]=3 5680 B13R1.560 CC/C=C\CCNCCC1CCO1 874d8fdb9f01c4a61f6a0137a2b32ed1 [0,1,0,1,0,0|2,0,0]=4 5681 B13R1.560 CC/C=C\CCNCCC1COC1 fb9db3d4f521735b2359d5ae746381bf [0,1,0,1,0,0|2,0,0]=4 5682 B13R1.560 CC/C=C\CCNCCN1CCC1 fb97d2bd7be094ed28a258c5c82e4c15 [0,1,0,1,0,0|2,0,0]=4 5683 B13R1.560 CC/C=C\CCNCC[C@@H]1CCO1 e6d73bfb48dcc1995d3c9c9b49db966a [0,1,0,1,0,0|2,0,0]=4 5684 B13R1.560 CC/C=C\CCOCCC1CCC1 3348b7f1cf7cfca0c582459f66f0598d [0,1,0,1,0,0|1,0,0]=3 5685 B13R1.560 CC/C=C\CCOCCC1CCO1 810b9e30765d98b2fbfd940956dd8604 [0,1,0,1,0,0|2,0,0]=4 5686 B13R1.560 CC/C=C\CCOCCC1COC1 6428ff1803234817603e7e3771d116b1 [0,1,0,1,0,0|2,0,0]=4 5687 B13R1.560 CC/C=C\CCOCCN1CCC1 0763fcf64a212d72855e1ced5d2b1188 [0,1,0,1,0,0|2,0,0]=4 5688 B13R1.560 CC/C=C\CCOCC[C@@H]1CCO1 dcd68398e5e2aac9c0aad65ba7f14c03 [0,1,0,1,0,0|2,0,0]=4 5689 B13R1.560 CC/C=C\CCOCC[C@H]1CCO1 ec60f3932049182a3dcdd94bd02d1a28 [0,1,0,1,0,0|2,0,0]=4 5690 B13R1.560 CC/C=C\COCCOC1CCC1 c0220fef73c0bc0327c4bc844cca4d20 [0,1,0,1,0,0|2,0,0]=4 5691 B13R1.560 CCC/C=C/CCCOC1CCC1 d85ee931ffaf06faa50d66d85429cf5a [0,1,0,1,0,0|2,0,0]=4 5692 B13R1.560 CCC/C=C/CNCCC1CCC1 f387bd7638edf4b5ad14ea003fc2155f [0,1,0,1,0,0|2,0,0]=4 5693 B13R1.560 CCC/C=C/COCCC1CCC1 114db84bc3587cbe2c61006e054d01d5 [0,1,0,1,0,0|2,0,0]=4 5694 B13R1.560 CCC/C=C\CCCOC1CCC1 13b398e6f7b3dc8a3fb9b99c46d29ac9 [0,1,0,1,0,0|2,0,0]=4 5695 B13R1.560 CCC/C=C\CCOCC1CCC1 276efe66fb909600a14ae6c500b966c0 [0,1,0,1,0,0|2,0,0]=4 5696 B13R1.560 CCC/C=C\CNCCC1CCC1 8bb201da17643265a8d53dfe65a81eb2 [0,1,0,1,0,0|2,0,0]=4 5697 B13R1.560 CCC/C=C\COCCC1CCC1 55605342d3e214aba74a80f8aa9bf44f [0,1,0,1,0,0|2,0,0]=4 5698 B13R1.560 CCCCCCCCNC1COC1 60cfe7f0e9c1bcc5b314cc8db9d4b356 [0,1,0,1,0,0|1,0,1]=4 5699 B13R1.560 CCCCCCCCOC1COC1 a3ffbf28d331d7e068094b07301330e7 [0,1,0,1,0,0|1,0,1]=4 5700 B13R1.560 CCCCCCCNCC1CCO1 8182d1e4f2838622b2ef14fd641b92c5 [0,1,0,1,0,0|0,0,2]=4 5701 B13R1.560 CCCCCCCNC[C@@H]1CCO1 3d3f804269ccbf34d21ef11e438ef062 [0,1,0,1,0,0|0,0,2]=4 5702 B13R1.560 CCCCCCCNC[C@H]1CCO1 1d454962b4a9f076c464c3b27acd43f7 [0,1,0,1,0,0|0,0,2]=4 5703 B13R1.560 CCCCCCCOCC1CCO1 3173a822462bbb023d0bd87a1ba66315 [0,1,0,1,0,0|0,0,2]=4 5704 B13R1.560 CCCCCCCOC[C@@H]1CCO1 655ef5d64b3ab653ee569b4a721a41c3 [0,1,0,1,0,0|0,0,2]=4 5705 B13R1.560 CCCCCCCOC[C@H]1CCO1 857b17a6f7c2048d870aaa4598d5bd37 [0,1,0,1,0,0|0,0,2]=4 5706 B13R1.560 CCCCCCNCCC1CCO1 9ead18049a5dac566e95277d14108301 [0,1,0,1,0,0|0,0,2]=4 5707 B13R1.560 CCCCCCNCC[C@@H]1CCO1 a10e56292a1033aa6ada3c3fee992b71 [0,1,0,1,0,0|0,0,2]=4 5708 B13R1.560 CCCCCCOCCC1CCO1 9965d245d12c84ab30b3f204c2e37d64 [0,1,0,1,0,0|0,0,2]=4 5709 B13R1.560 CCCCCCOCC[C@@H]1CCO1 2cee67cfa86c76f322e164507d9ba2bd [0,1,0,1,0,0|0,0,2]=4 5710 B13R1.560 CCCCCCOCC[C@H]1CCO1 01732b06b15baed90a35c83504743a31 [0,1,0,1,0,0|0,0,2]=4 5711 B13R1.560 N#CC=CCOCCCC1CCC1 a2bc1f6d53a8cc133e2d2d5918045d6a [0,1,0,1,0,0|1,0,1]=4 5712 B13R1.560 OCCCCCCCCN1CCC1 2784c53c0c613c1809b57ab2c48000c7 [0,1,0,1,0,0|0,0,2]=4 5713 B13R1.560 OCCCCCCCNC1CCC1 cbe64f4e314580db8f5d5b64cf78fd35 [0,1,0,1,0,0|0,0,2]=4 5714 B13R1.560 OCCCCCCNCC1CCC1 1f29ab25bbc178e9c67b9484bd0d6186 [0,1,0,1,0,0|0,0,2]=4 5715 B13R1.560 OCCCCCNCCC1CCC1 f0ae8ad49d4453b9ef2cb1d41f3afbc3 [0,1,0,1,0,0|0,0,2]=4 5716 B13R1.560 OCCOCCCNCC1CCC1 f978d122b53dd41cfa0d8e5b48a37969 [0,1,0,1,0,0|1,0,1]=4 5717 B13R1.560 OCCOCCNCCC1CCC1 4a3f96f7b9fc415ca889aef25df275c0 [0,1,0,1,0,0|1,0,1]=4 5718 B13R1.560 OCCSCCCCNC1CCC1 b0a13dfd8c17c63bf552a508b6f849e6 [0,1,0,1,0,0|1,0,1]=4 5719 B13R1.560 OCCSCCNCCC1CCC1 94885b8a93c6fe532d37239cdd65d87f [0,1,0,1,0,0|1,0,1]=4 5720 B13R1.570 CCCCN1CCCCCC1CO c89e0076bd5b089e8c5f87f1b6c3f110 [0,1,0,1,0,0|0,0,2]=4 5721 B13R1.579 CCCCC1CCCC1NCCO 94df5acd4f30d856cc74f1f0485e6046 [0,1,0,1,0,0|0,0,2]=4 5722 B13R1.579 CCCCC1CCCC1NCOC 31c2e93e5c52834fb887f17c47127029 [0,1,0,1,0,0|1,0,1]=4 5723 B13R1.579 CCCCC1CCCN1C/C=C\O 82991326d52eb0b075ca7af9eb8f0efb [0,1,0,1,0,0|0,0,2]=4 5724 B13R1.579 CCCCC1CCCN1CCCO 377e9329ae8c5e8f11bc079a6ea173de [0,1,0,1,0,0|0,0,2]=4 5725 B13R1.579 CCCCC1CCCN1CCOC 77b9ed213ff4d1a39302d819b8d9e77a [0,1,0,1,0,0|1,0,1]=4 5726 B13R1.655 CC/C=C/COCC1CCC1OC 44d054cf6e7e8c76b5b6bb9014cf0f08 [0,1,0,1,0,0|2,0,0]=4 5727 B13R1.655 CC/C=C/COC[C@@H]1CC[C@H]1OC 4e1a49a2f11fd85c41f9138749ca7187 [0,1,0,1,0,0|2,0,0]=4 5728 B13R1.655 CC/C=C/COC[C@H]1CC[C@H]1OC 4a0530f39a66b3a950c7c250ec817e3c [0,1,0,1,0,0|2,0,0]=4 5729 B13R1.655 CC/C=C\CCNC1CCC1OC cc5a575eb24ea6bac73276a2ed53e87e [0,1,0,1,0,0|2,0,0]=4 5730 B13R1.655 CC/C=C\CCN[C@@H]1CC[C@@H]1OC 78a531ddc9d1d873bde8b6529c23ab48 [0,1,0,1,0,0|2,0,0]=4 5731 B13R1.655 CC/C=C\CCN[C@@H]1CC[C@H]1OC 3c35baaa11c6a1bdb149e8ced1a04dbf [0,1,0,1,0,0|2,0,0]=4 5732 B13R1.655 CC/C=C\CCN[C@H]1CC[C@@H]1OC a6ce9688c77f8a8e306c22e9032da4ba [0,1,0,1,0,0|2,0,0]=4 5733 B13R1.655 CC/C=C\CCN[C@H]1CC[C@H]1OC 30e811e14f2845fc421f35087d0f2aed [0,1,0,1,0,0|2,0,0]=4 5734 B13R1.655 CCC1CCN1CCCCCCO d01552bea7144bff52b8f0ffe5b65c74 [0,1,0,1,0,0|0,0,2]=4 5735 B13R1.655 CCCCCCCN1CCC1CO 05ba8c81e37f8af046047d98fee294c9 [0,1,0,1,0,0|0,0,2]=4 5736 B13R1.655 CCCCCCCN1CC[C@@H]1CO b99d7e567e545f0906552cc714a069e2 [0,1,0,1,0,0|0,0,2]=4 5737 B13R1.655 CCCCCCCN1CC[C@H]1CO cfb1d04a2b9688bec84fa3eee3f7d32b [0,1,0,1,0,0|0,0,2]=4 5738 B13R1.659 CC/C=C/CCOCCOC1CC1 f73bb4c6b8d93eb22bf8d1ee590c60bd [0,1,0,1,0,0|2,0,0]=4 5739 B13R1.659 CC/C=C/CNCCSCC1CC1 c2d1397cf5fb4f56328480f809601338 [0,1,0,1,0,0|2,0,0]=4 5740 B13R1.659 CC/C=C/COCCCSC1CC1 475e7a156ebda9099bf9c6ba928e03e4 [0,1,0,1,0,0|2,0,0]=4 5741 B13R1.659 CC/C=C/COCCOCC1CC1 1d3c17e57202345cf8cdaf7b67b5b542 [0,1,0,1,0,0|2,0,0]=4 5742 B13R1.659 CC/C=C\CCCCCNC1CC1 a251db06e7e6ebb376f201c047f760c8 [0,1,0,1,0,0|1,0,0]=3 5743 B13R1.659 CC/C=C\CCCCCOC1CC1 0f082e44fbbd109227d26f218dafdff4 [0,1,0,1,0,0|1,0,0]=3 5744 B13R1.659 CC/C=C\CCCCOCC1CC1 5c43195d56488fbe379c63563fd6fa52 [0,1,0,1,0,0|1,0,0]=3 5745 B13R1.659 CC/C=C\CCCOCCC1CC1 dd1774a8773cbf1f71f3a6c16b241844 [0,1,0,1,0,0|1,0,0]=3 5746 B13R1.659 CC/C=C\CCNCCOC1CC1 a32076dff0dea5899ea893b38d5d7418 [0,1,0,1,0,0|2,0,0]=4 5747 B13R1.659 CC/C=C\CCOCCCC1CC1 ebb3a396cb13eb80711e915467aca633 [0,1,0,1,0,0|1,0,0]=3 5748 B13R1.659 CC/C=C\CCOCCOC1CC1 0ad137a89cbdba2e244a2d262d59c1be [0,1,0,1,0,0|2,0,0]=4 5749 B13R1.659 CCC/C=C/CCCOCC1CC1 befee6872fd63ba3b965c13b27f4ca6f [0,1,0,1,0,0|2,0,0]=4 5750 B13R1.659 CCC/C=C/COCCCC1CC1 68a0e557f6fac1536d54013a70d2022d [0,1,0,1,0,0|2,0,0]=4 5751 B13R1.659 CCC/C=C\CCCOCC1CC1 4cdccad181e804dfc580dbc806727f40 [0,1,0,1,0,0|2,0,0]=4 5752 B13R1.659 CCC/C=C\CCOCCC1CC1 5bd5ff90524545e4c312e86fb082ca8a [0,1,0,1,0,0|2,0,0]=4 5753 B13R1.659 CCC/C=C\COCCCC1CC1 5289b0a3a5b8e020f4cf54ca0fa8551f [0,1,0,1,0,0|2,0,0]=4 5754 B13R1.659 CCC=CCCCCCOC1CC1 b1ecf7a9b132b80b24b3b40d973395b8 [0,1,0,1,0,0|1,0,0]=3 5755 B13R1.659 CCCCCCOC/C=C/C1CC1 5187179d46d242ca2cf4852c778ee1c9 [0,1,0,1,0,0|2,0,0]=4 5756 B13R1.659 CCCCCNCCCC=C1CC1 d88eb502cd2908344444d14d5af6c95d [0,1,0,1,0,0|1,0,0]=3 5757 B13R1.659 CCCCCOCCCC=C1CC1 11b83f738c34061ec27e734cb5b2d464 [0,1,0,1,0,0|1,0,0]=3 5758 B13R1.659 CCOCCNCCCC=C1CC1 38f784417ca51b7249234e05a81e32a3 [0,1,0,1,0,0|2,0,0]=4 5759 B13R1.659 CCOCCOCCCC=C1CC1 0eb82dfd32a99dbde517c082cbdaeb8c [0,1,0,1,0,0|2,0,0]=4 5760 B13R1.659 CCSCCNCCCC=C1CC1 912a49c8e424236a1c97176f8c9dbfff [0,1,0,1,0,0|2,0,0]=4 5761 B13R1.659 CCSCCOCCCC=C1CC1 a65e01390a8cd6e143e9d2a003c711de [0,1,0,1,0,0|2,0,0]=4 5762 B13R1.659 COCCCNCCCC=C1CC1 37a7a685834bf4d3ac68260885fd17c8 [0,1,0,1,0,0|2,0,0]=4 5763 B13R1.659 COCCCOCCCC=C1CC1 1ee0d84cbfa22948c8b47aca16739349 [0,1,0,1,0,0|2,0,0]=4 5764 B13R1.659 CSCCCNCCCC=C1CC1 ec3d092277af400e340687575338dcd3 [0,1,0,1,0,0|2,0,0]=4 5765 B13R1.659 CSCCCOCCCC=C1CC1 10955de8e69592fc913388682240ed5d [0,1,0,1,0,0|2,0,0]=4 5766 B13R1.659 ClCCCCNCCCC=C1CC1 49382e94a3aa128029be63b84723b4ea [0,1,0,1,0,0|2,0,0]=4 5767 B13R1.659 FCCCCOCCCC=C1CC1 0b1391f72851d62f5e98954354b41c7a [0,1,0,1,0,0|2,0,0]=4 5768 B13R1.659 OCCCCCCCCNC1CC1 b6dcba2321730a5203b388c0daff4d90 [0,1,0,1,0,0|0,0,2]=4 5769 B13R1.659 OCCCCCCCNCC1CC1 f0cafebdda1243cf53ffd450587365cc [0,1,0,1,0,0|0,0,2]=4 5770 B13R1.659 OCCCCCCNCCC1CC1 7a811e568850038a2c682b73493833f3 [0,1,0,1,0,0|0,0,2]=4 5771 B13R1.659 OCCCCNCCCC=C1CC1 de26df3b59a3548245461866e0f97c84 [0,1,0,1,0,0|2,0,0]=4 5772 B13R1.659 OCCOCCCNCCC1CC1 8b7358f018c318f92e8ec01036ea5f51 [0,1,0,1,0,0|1,0,1]=4 5773 B13R1.659 OCCSCCCCNCC1CC1 96ea99c4fbb55f1d8599236448cc9360 [0,1,0,1,0,0|1,0,1]=4 5774 B13R1.659 SCCCCNCCCC=C1CC1 b5a642a1ffdb9dd04b073f54e9468974 [0,1,0,1,0,0|2,0,0]=4 5775 B13R1.659 SCCCCOCCCC=C1CC1 efd041c0657fca1667cd4dbc34865836 [0,1,0,1,0,0|2,0,0]=4 5776 B13R1.667 CC/C=C\CCNCC1CCN1C 8ee25ad73fa875c6bef3c221f91906a1 [0,1,0,1,0,0|2,0,0]=4 5777 B13R1.667 CC/C=C\CCOCC1CCC1F 466fd1fd6c9640efe3918e49a61addc2 [0,1,0,1,0,0|2,0,0]=4 5778 B13R1.667 CC/C=C\CCOCC1CCN1C 959e375e54d6dce558e501d3767a83ae [0,1,0,1,0,0|2,0,0]=4 5779 B13R1.667 CC/C=C\CCOC[C@@H]1CCN1C db377c4999866a81aad0726c3bdbd839 [0,1,0,1,0,0|2,0,0]=4 5780 B13R1.667 CC/C=C\CCOC[C@H]1CCN1C ec3122a446a5d759f6d39abc333a3948 [0,1,0,1,0,0|2,0,0]=4 5781 B13R1.667 CCCCCCCNC1CCC1O 52345f84a61d1e6a9673cc0bcdff1c6c [0,1,0,1,0,0|0,0,2]=4 5782 B13R1.667 CCCCCCCN[C@@H]1CC[C@@H]1O 9ee43441e03b6a27a2614a73b7e8e14d [0,1,0,1,0,0|0,0,2]=4 5783 B13R1.667 CCCCCCCN[C@@H]1CC[C@H]1O 2e248f3e5ac598e889458c155a8760e2 [0,1,0,1,0,0|0,0,2]=4 5784 B13R1.667 CCCCCCCN[C@H]1CC[C@@H]1O bba50a5002a47cfc2d1988df16e0cb4a [0,1,0,1,0,0|0,0,2]=4 5785 B13R1.667 CCCCCCCN[C@H]1CC[C@H]1O cc7d4a3742ac21aea6229a8432ae45e8 [0,1,0,1,0,0|0,0,2]=4 5786 B13R1.667 C[C@@H]1CC[C@@H]1NCCCCCCO f96e1563948ad348d7b82badd23885c8 [0,1,0,1,0,0|0,0,2]=4 5787 B13R1.667 C[C@@H]1CC[C@H]1NCCCCCCO 5f4ac3889d8c8bbb3bbe39de9ec29bfc [0,1,0,1,0,0|0,0,2]=4 5788 B13R1.671 CC/C=C/CN1CCCC1CCO 4945c0c5819a48812fed1985f122995d [0,1,0,1,0,0|2,0,0]=4 5789 B13R1.671 CC/C=C/CN1CCCC1COC 3fb7fbfaef174259ce05650535144add [0,1,0,1,0,0|2,0,0]=4 5790 B13R1.671 CC/C=C/CN1CCCC1CSC 03d4882cf652b386eedfdd82dc3d7e52 [0,1,0,1,0,0|2,0,0]=4 5791 B13R1.671 CC/C=C/CN1CCC[C@@H]1CCO 0912cac386a38b61225d832f81ec23f8 [0,1,0,1,0,0|2,0,0]=4 5792 B13R1.671 CC/C=C/CN1CCC[C@@H]1COC 8fc4d1b921da1a69da6499edd251ea36 [0,1,0,1,0,0|2,0,0]=4 5793 B13R1.671 CC/C=C/CN1CCC[C@H]1COC 1c1602a5dbf87c05cd2db0a3f7aac64b [0,1,0,1,0,0|2,0,0]=4 5794 B13R1.671 CC/C=C/CN1CCSC1CCC f727e6e647f553cb6af1fc8205b8cd89 [0,1,0,1,0,0|2,0,0]=4 5795 B13R1.671 CCCCCN1CCCC1CCO 3918d29f54556717b5a865f5dfcf7a70 [0,1,0,1,0,0|0,0,2]=4 5796 B13R1.671 CCCCCN1CCC[C@@H]1CCO de27b2f07f2d89370a37a10c5c02408d [0,1,0,1,0,0|0,0,2]=4 5797 B13R1.1150 CC/C=C/CN1CCCCCCC1 23b30e270b31caf3ceaa640aeed04f0d [0,1,0,1,0,0|1,0,0]=3 5798 B13R1.1150 CCCCNC1CC/C=C\CCC1 ecd7bb0df536c86033c273113f1d4370 [0,1,0,1,0,0|1,0,0]=3 5799 B13R1.1150 CCCCOC1CC/C=C/CCC1 9f5c67d99ccd1d318078fe3bd978a6a5 [0,1,0,1,0,0|1,0,0]=3 5800 B13R1.1150 CCCCOC1CC/C=C\CCC1 141372c95d3156f8ab2dbc784ccbb2af [0,1,0,1,0,0|1,0,0]=3 5801 B13R1.1150 CCCCOC1CCC=CCCC1 a2b45b4a5008f22a9d2a798cbd35380a [0,1,0,1,0,0|1,0,0]=3 5802 B13R1.1150 CCCCO[C@@H]1CCC=CCCC1 b9d049e20285021443b672bfbe9b6617 [0,1,0,1,0,0|1,0,0]=3 5803 B13R1.1150 CCOCOC1CC/C=C/CCC1 d607a9dc3e638f2c3b20b361cc46d078 [0,1,0,1,0,0|2,0,0]=4 5804 B13R1.1150 CCOCOC1CC/C=C\CCC1 311615238bb420d9de5a1f574f54cce1 [0,1,0,1,0,0|2,0,0]=4 5805 B13R1.1150 CCOCOC1CCC=CCCC1 2922e62a35e77cba978b0baa7e8656e5 [0,1,0,1,0,0|2,0,0]=4 5806 B13R1.1150 CCOCO[C@@H]1CCC=CCCC1 97c1c23c65bc88216fafab0c9f76aaa0 [0,1,0,1,0,0|2,0,0]=4 5807 B13R1.1150 COCCNC1CC/C=C\CCC1 93629c8399a7d78c5ba662954aa70779 [0,1,0,1,0,0|2,0,0]=4 5808 B13R1.1150 COCCNC1CCCCCCC1 047b2215e6b702bf280e5ebaa929967d [0,1,0,1,0,0|1,0,1]=4 5809 B13R1.1150 COCCOC1CC/C=C/CCC1 e99ca744761fb3cb73911e3c4a57802b [0,1,0,1,0,0|2,0,0]=4 5810 B13R1.1150 COCCOC1CC/C=C\CCC1 15b89ca5becc85e7bac4b6b903200b73 [0,1,0,1,0,0|2,0,0]=4 5811 B13R1.1150 COCCOC1CCC=CCCC1 48a390424569169e2f6b0e1dc2746b01 [0,1,0,1,0,0|2,0,0]=4 5812 B13R1.1150 COCCOC1CCCCCCC1 c181298a5aba62e70269c6886a035417 [0,1,0,1,0,0|1,0,1]=4 5813 B13R1.1150 COCCO[C@@H]1CCC=CCCC1 2d7689546c03fe74dd799828b9b36235 [0,1,0,1,0,0|2,0,0]=4 5814 B13R1.1150 COCOCC1CCCCCCC1 12beb4c4082ae5a15ea09de9448aaf92 [0,1,0,1,0,0|1,0,1]=4 5815 B13R1.1150 CSCCNC1CC/C=C\CCC1 3ade1769b21c71e820f47ebe094e9503 [0,1,0,1,0,0|2,0,0]=4 5816 B13R1.1150 CSCCOC1CC/C=C/CCC1 552698561d789e442d0aac7fc8650841 [0,1,0,1,0,0|2,0,0]=4 5817 B13R1.1150 CSCCOC1CC/C=C\CCC1 0163b7bd028b4262d98e8aa60690d76b [0,1,0,1,0,0|2,0,0]=4 5818 B13R1.1150 CSCCOC1CCC=CCCC1 cd93ac935736baf435f6b85734adadac [0,1,0,1,0,0|2,0,0]=4 5819 B13R1.1150 CSCCO[C@@H]1CCC=CCCC1 5bd08e22a837944e40071ead54f0af62 [0,1,0,1,0,0|2,0,0]=4 5820 B13R1.1150 ClCCCNC1CC/C=C\CCC1 142009e73010b87421a0a5a86def2324 [0,1,0,1,0,0|2,0,0]=4 5821 B13R1.1150 FCCCOC1CC/C=C/CCC1 2ba00863844276c64baa4c940c263cc9 [0,1,0,1,0,0|2,0,0]=4 5822 B13R1.1150 FCCCOC1CC/C=C\CCC1 b709925a1584b09440f06149b5d25cf5 [0,1,0,1,0,0|2,0,0]=4 5823 B13R1.1150 FCCCOC1CCC=CCCC1 1ac9b8535c8befcc1acdc3012704d0b1 [0,1,0,1,0,0|2,0,0]=4 5824 B13R1.1150 FCCCO[C@@H]1CCC=CCCC1 88d95b7721575f4809e3f5693c2d76bc [0,1,0,1,0,0|2,0,0]=4 5825 B13R1.1150 N#CC=CCN1CCCCCCC1 cb2265e5a80eec4e354655cbf70745fd [0,1,0,1,0,0|1,0,1]=4 5826 B13R1.1150 O/C=C\CNC1CCCCCCC1 4be0cec917b9392ea932359ad2459f65 [0,1,0,1,0,0|0,0,2]=4 5827 B13R1.1150 OCCCCN1CCCCCCC1 0d5e12f710f4fc6178208b99a596d52b [0,1,0,1,0,0|0,0,2]=4 5828 B13R1.1150 OCCCNC1CC/C=C\CCC1 1857b845e0cb9e906917dcd675d9ab4a [0,1,0,1,0,0|2,0,0]=4 5829 B13R1.1150 OCCCNC1CCCCCCC1 8d1c545cea0de1b80d883cd80c3648e1 [0,1,0,1,0,0|0,0,2]=4 5830 B13R1.1150 OCNCCC1CCCCCCC1 297e5b21962276048060d4b07abfa21a [0,1,0,1,0,0|0,0,2]=4 5831 B13R1.1150 SCCCOC1CC/C=C/CCC1 c4bd446019ab017bcf4eeedf269fb53b [0,1,0,1,0,0|2,0,0]=4 5832 B13R1.1150 SCCCOC1CC/C=C\CCC1 c6e9b60cfc650f77a5f545dd67935a3d [0,1,0,1,0,0|2,0,0]=4 5833 B13R1.1150 SCCCOC1CCC=CCCC1 2096be51e5a5a59e614da88ff55ec263 [0,1,0,1,0,0|2,0,0]=4 5834 B13R1.1150 SCCCO[C@@H]1CCC=CCCC1 c3c64bd0009438e47f4b9a23e356ee07 [0,1,0,1,0,0|2,0,0]=4 5835 B13R1.1887 CC/C=C/CNC1CCCCCC1 751e7ebfd6588de6928a372065485957 [0,1,0,1,0,0|1,0,0]=3 5836 B13R1.1887 CC/C=C/CNC1CCCOCC1 619cca42a08ebfdbf607425ca6252c3c [0,1,0,1,0,0|2,0,0]=4 5837 B13R1.1887 CC/C=C/COC1CCCCCC1 8904c67002ca6ea7db158959d68ccd1b [0,1,0,1,0,0|1,0,0]=3 5838 B13R1.1887 CC/C=C/COC1CCCOCC1 f9754d8d0a0e2cb6657787ad95a9c70d [0,1,0,1,0,0|2,0,0]=4 5839 B13R1.1887 CC/C=C\CCN1CCCCCC1 92f754fb0b33ae6a97b9b685a9168a75 [0,1,0,1,0,0|1,0,0]=3 5840 B13R1.1887 CC/C=C\CCN1CCCOCC1 8cc82f7f3107a8a365e8affbf112ce7c [0,1,0,1,0,0|2,0,0]=4 5841 B13R1.1887 CC/C=C\COC1CCCCCC1 9f0da3c87c89fd7158ec8bf215aab7d0 [0,1,0,1,0,0|1,0,0]=3 5842 B13R1.1887 CC/C=C\COC1CCCOCC1 d92f375449379a31f349f7297835c20d [0,1,0,1,0,0|2,0,0]=4 5843 B13R1.1887 CCC/C=C/CN1CCCCCC1 96788f7c9b3c43cb1437a554f841e248 [0,1,0,1,0,0|2,0,0]=4 5844 B13R1.1887 CCC/C=C\CN1CCCCCC1 5b4368dfff2c2304955981f7b0dc49c0 [0,1,0,1,0,0|2,0,0]=4 5845 B13R1.1887 CCCCCNC1CCC=CCC1 7657630bba650fedd43944774307fac0 [0,1,0,1,0,0|1,0,0]=3 5846 B13R1.1887 CCOCCNC1CCC=CCC1 0a5c3a2d2bfbed2d1dafbdf7a2724049 [0,1,0,1,0,0|2,0,0]=4 5847 B13R1.1887 CCSCCNC1CCC=CCC1 f4a01fcc2c175557e85ee90b26ab7bb7 [0,1,0,1,0,0|2,0,0]=4 5848 B13R1.1887 COCCCNC1CCC=CCC1 3d221d0561a7fe051fb1029525eca6cd [0,1,0,1,0,0|2,0,0]=4 5849 B13R1.1887 COCCNCC1CCCCCC1 86c3a6d9f67c4202891d1ba62055d6ed [0,1,0,1,0,0|1,0,1]=4 5850 B13R1.1887 COCCOCC1CCCCCC1 04e11cf51fdc2351f08474a88215d26d [0,1,0,1,0,0|1,0,1]=4 5851 B13R1.1887 COCNCCC1CCCCCC1 6902d52f20c6424bab3aafdeedd7d002 [0,1,0,1,0,0|1,0,1]=4 5852 B13R1.1887 CSCCCNC1CCC=CCC1 6dfda35050a28b14d754c772d3bb77d1 [0,1,0,1,0,0|2,0,0]=4 5853 B13R1.1887 FCCCCNC1CCC=CCC1 04b8fa2ad94f949e2538dcfd2a7c2696 [0,1,0,1,0,0|2,0,0]=4 5854 B13R1.1887 N#CC=CCNC1CCCCCC1 0623fdf5fa7d3a31c07f2d0c527344a3 [0,1,0,1,0,0|1,0,1]=4 5855 B13R1.1887 N#CC=CCOC1CCCCCC1 60d52589d7693342142f3366ab0faa7c [0,1,0,1,0,0|1,0,1]=4 5856 B13R1.1887 NOCCNCC1CCCCCC1 55fe121a9b3cace6c9bef420df6a64b1 [0,1,0,1,0,0|1,0,1]=4 5857 B13R1.1887 O/C=C\CNCC1CCCCCC1 3bc567416f31813bfe97e89bb156844f [0,1,0,1,0,0|0,0,2]=4 5858 B13R1.1887 O=C/C=C/COC1CCCCCC1 5fddf68fcfdfd06fe099c93375b0ddd2 [0,1,0,1,0,0|0,0,2]=4 5859 B13R1.1887 OCC#CCNC1CCCCCC1 df21d32aa55469fa2adf0067b9f38a12 [0,1,0,1,0,0|0,0,2]=4 5860 B13R1.1887 OCCCCCN1CCCCCC1 652c24e4eea4d91d74d94ec146312b60 [0,1,0,1,0,0|0,0,2]=4 5861 B13R1.1887 OCCCCNC1CCC=CCC1 fd9851789a0a10b9ad2b276b8616d918 [0,1,0,1,0,0|2,0,0]=4 5862 B13R1.1887 OCCCCNC1CCCCCC1 d12e602086cfcecb35dd9780fff52165 [0,1,0,1,0,0|0,0,2]=4 5863 B13R1.1887 OCCCNCC1CCCCCC1 196463a1b45c9f2a8d40d50c881dc20e [0,1,0,1,0,0|0,0,2]=4 5864 B13R1.1887 OCCNCCC1CCCCCC1 6d1b072d0a7620454041d51b0888f341 [0,1,0,1,0,0|0,0,2]=4 5865 B13R1.1887 OCCNCCN1CCCCCC1 3f7d40b077d57e82022a72ef12a3d009 [0,1,0,1,0,0|1,0,1]=4 5866 B13R1.1887 OCCOCCN1CCCCCC1 71e03b55c264f439498dcaa2f0470607 [0,1,0,1,0,0|1,0,1]=4 5867 B13R1.1887 OCNCCCN1CCCCCC1 f8cb1b443e52b8aa96fb6d699a20f85c [0,1,0,1,0,0|1,0,1]=4 5868 B13R1.24 CC/C=C/CN(C)C1CCCCC1 67161f981b8ef59407a05a5c8a8539f7 [0,1,0,1,0,0|2,0,0]=4 5869 B13R1.24 CCCCCC(C)N1CC=CCC1 296297ad0e809cdd5c38ab817493119c [0,1,0,1,0,0|2,0,0]=4 5870 B13R1.24 CCCCC[C@H](C)N1CC=CCC1 d1a7d3f71fb2152899a30f786d191014 [0,1,0,1,0,0|2,0,0]=4 5871 B13R1.24 CCCCNC(=O)C1CC=CCO1 7e81fd15917bf97b2581540df5b2b646 [0,1,0,1,0,0|1,0,1]=4 5872 B13R1.24 OCCNCC(O)C1CCCCC1 2b57898c187da528703288e16b4d44a5 [0,1,0,1,0,0|1,0,1]=4 5873 B13R1.48 CC/C=C/CNC(C)C1CCCC1 dbe109bfe0bb388196be4e1ed37b94fa [0,1,0,1,0,0|2,0,0]=4 5874 B13R1.48 CC/C=C/COC(C)C1CCCC1 7a1ce66e812e620fb5027532ec264962 [0,1,0,1,0,0|2,0,0]=4 5875 B13R1.48 CC/C=C\CCN(C)C1CCCC1 d5cc36fd10842ba12a8aede66c07a375 [0,1,0,1,0,0|2,0,0]=4 5876 B13R1.156 CC/C=C/CN(C)CC1CCCC1 e30dccaf5ade70ad9d4a7e1ba14845d6 [0,1,0,1,0,0|2,0,0]=4 5877 B13R1.156 CCCCCC(C)OC1C=CCC1 b34f5d0ac439aab8dd5b4393f10f83ae [0,1,0,1,0,0|2,0,0]=4 5878 B13R1.156 CCCCC[C@H](C)OC1C=CCC1 bb59719a225d95cda2b451b496738131 [0,1,0,1,0,0|2,0,0]=4 5879 B13R1.189 CC/C=C\CCN1CCC(C1)CC d4842f12988cc29466fcfd277e50bcbe [0,1,0,1,0,0|2,0,0]=4 5880 B13R1.666 CC/C=C/CN1CCCC(C1)CC 9ffee2a483011ccc3ac6bcb35f0c205f [0,1,0,1,0,0|2,0,0]=4 5881 B13R1.728 CC/C=C/CN(C)CCC1CCC1 577210ca9722f7202cb63e1a97648fe7 [0,1,0,1,0,0|2,0,0]=4 5882 B13R1.1148 CC/C=C/CN1CCCCC(C1)O 1c687eb6049c018cc489026ad7987774 [0,1,0,1,0,0|2,0,0]=4 5883 B13R1.1148 CC/C=C/CN1CCCC[C@H](C1)O 3981fbf144ed3efd5d7346ce548b8a53 [0,1,0,1,0,0|2,0,0]=4 5884 B13R1.2465 OCCNCC1(CCCCCC1)O 0878065de5e0cf7e2ec3a928a1cc784d [0,1,0,1,0,0|1,0,1]=4 5885 B13R1.2916 CC/C=C\CCN(C)CC1CCC1 64c9e2f5c39def42d42153e3ef2142d0 [0,1,0,1,0,0|2,0,0]=4 5886 B13R1.3674 CC/C=C/CNC1(CCCCC1)C e71b92c04b1b603a77ae4e72386ebd65 [0,1,0,1,0,0|2,0,0]=4 5887 B13R1.3674 OCCNCCC1(CCCCC1)O cb10f8ab37dcd57fce0eb2775264dc26 [0,1,0,1,0,0|1,0,1]=4 5888 B13R1.8919 CC/C=C/CN1C(CCCC1C)C 81671e1170e176fe94bc5ecd7abc23b0 [0,1,0,1,0,0|2,0,0]=4 5889 B13R1.8919 CC/C=C/CN1[C@@H](CCC[C@@H]1C)C 96c001b59f0abd8f4fcbbbf61afc3e21 [0,1,0,1,0,0|2,0,0]=4 5890 B13R1.8919 CC/C=C/CN1[C@@H](CCC[C@H]1C)C 3cd36ed1fea66cdcb14e32ca6516a609 [0,1,0,1,0,0|2,0,0]=4 5891 B13R1.8919 CC/C=C/CN1[C@H](CCC[C@@H]1C)C 749730c71c2b2a73090b92e67bd40fe1 [0,1,0,1,0,0|2,0,0]=4 5892 B13R1.27 CC/C=C/CNCC1CCC(C1)O c243cfe1928807fee2f067ebd745a945 [0,1,0,1,0,0|2,0,0]=4 5893 B13R1.27 CC/C=C/COCC1CCC(C1)C a80b72100530c3df6e273171c3868062 [0,1,0,1,0,0|2,0,0]=4 5894 B13R1.27 CC/C=C/COCC1CCC(C1)F cd54c52acb5feac40667c5c6e2763c01 [0,1,0,1,0,0|2,0,0]=4 5895 B13R1.27 CC/C=C/COCC1CCC(O1)C 8e377fd7f38f351fee283416d1ca493e [0,1,0,1,0,0|2,0,0]=4 5896 B13R1.27 CC/C=C/COC[C@@H]1CC[C@@H](O1)C 61ba98d563f5414cfb918bbdab356be4 [0,1,0,1,0,0|2,0,0]=4 5897 B13R1.27 CC/C=C/COC[C@@H]1CC[C@H](C1)F f84e0b849ca87251594f8574ddd3df86 [0,1,0,1,0,0|2,0,0]=4 5898 B13R1.27 CC/C=C/COC[C@H]1CC[C@H](C1)F c1a742f64d0e7d0d9c9bda3c19a2cbfb [0,1,0,1,0,0|2,0,0]=4 5899 B13R1.27 CC/C=C\CCNC1CCC(C1)C b6897d19957892fa09e9941692419506 [0,1,0,1,0,0|2,0,0]=4 5900 B13R1.27 CC/C=C\CCNC1CCC(C1)O 589f1a8148f119efb7069b8ba0ae5b72 [0,1,0,1,0,0|2,0,0]=4 5901 B13R1.27 CC/C=C\CCN[C@@H]1CC[C@@H](C1)O 055271f89d48d0ed8d98b621100d77f3 [0,1,0,1,0,0|2,0,0]=4 5902 B13R1.27 CC/C=C\CCN[C@@H]1CC[C@H](C1)O fc57783316c84daa6cc864632bf3ee5b [0,1,0,1,0,0|2,0,0]=4 5903 B13R1.27 CC/C=C\CCN[C@H]1CC[C@@H](C1)O 6142c69716cbac7263760be48763a51e [0,1,0,1,0,0|2,0,0]=4 5904 B13R1.27 CC/C=C\CCN[C@H]1CC[C@H](C1)O fd3c38b79160b79ea788d5a9b1a6ef2c [0,1,0,1,0,0|2,0,0]=4 5905 B13R1.27 CC/C=C\CCOC1CCC(C1)C d553909a12424bcf41914b4b58b17cfa [0,1,0,1,0,0|2,0,0]=4 5906 B13R1.27 CC/C=C\CCOC1CCC(C1)F 480c6e2f3ed7f3225be9b62016660ecd [0,1,0,1,0,0|2,0,0]=4 5907 B13R1.27 CCCCCCN[C@@H]1C=C[C@@H](C1)O 3f12222e69d639844cc42339c7a19fd1 [0,1,0,1,0,0|1,0,0]=3 5908 B13R1.27 CCCCCCN[C@H]1C=C[C@H](C1)O 535f062982461970d571aa55e3bc62c8 [0,1,0,1,0,0|1,0,0]=3 5909 B13R1.27 CCCCCCOC1C=CC(=O)O1 4c75861667e49d221eb42d7b40191daf [0,1,0,1,0,0|1,0,1]=4 5910 B13R1.27 CCCCCOCC1C=CC(=O)O1 bc0ecd4edbc62d2bfb0d92069e2120c7 [0,1,0,1,0,0|1,0,1]=4 5911 B13R1.27 CCCCCOC[C@@H]1C=CC(=O)O1 04c6ca34b2c17a52859ab98a19aae8ad [0,1,0,1,0,0|1,0,1]=4 5912 B13R1.27 CCCCOCN[C@@H]1C=C[C@@H](C1)O 60ab049963a39e189b60710cc1213024 [0,1,0,1,0,0|2,0,0]=4 5913 B13R1.27 CCCCOCN[C@H]1C=C[C@H](C1)O 67bfc2bdfac453f7db80e08785b5e73a [0,1,0,1,0,0|2,0,0]=4 5914 B13R1.27 CCCOCCN[C@@H]1C=C[C@@H](C1)O d5d600220760928c0a04188fe59ef056 [0,1,0,1,0,0|2,0,0]=4 5915 B13R1.27 CCCOCCN[C@H]1C=C[C@H](C1)O 4cfdf04da01de4d1d5ec24b241b511a3 [0,1,0,1,0,0|2,0,0]=4 5916 B13R1.27 CCOCCCN[C@@H]1C=C[C@@H](C1)O e42940d1ffaba2f253768c13de980e36 [0,1,0,1,0,0|2,0,0]=4 5917 B13R1.27 CCOCCCN[C@H]1C=C[C@H](C1)O 6c51d982daa3e25738bb2b3bfab48975 [0,1,0,1,0,0|2,0,0]=4 5918 B13R1.27 CCSCCCN[C@@H]1C=C[C@@H](C1)O 44babc210fab6d261a8082fe9f1d32e0 [0,1,0,1,0,0|2,0,0]=4 5919 B13R1.27 CCSCCCN[C@H]1C=C[C@H](C1)O 33a79a1aa65487edc04c56b44813f767 [0,1,0,1,0,0|2,0,0]=4 5920 B13R1.27 COCCCCN[C@@H]1C=C[C@@H](C1)O 3376ec70d95140626e54ef6255bc96b5 [0,1,0,1,0,0|2,0,0]=4 5921 B13R1.27 COCCCCN[C@H]1C=C[C@H](C1)O 072777f93aa68c715531cf94b6b99a5a [0,1,0,1,0,0|2,0,0]=4 5922 B13R1.27 OCCCCCN[C@@H]1C=C[C@@H](C1)O c8a162e6915915ae159a5ac19bdf8046 [0,1,0,1,0,0|2,0,0]=4 5923 B13R1.27 OCCCCCN[C@H]1C=C[C@H](C1)O 2622ca170e0510197ca45d873d6d3139 [0,1,0,1,0,0|2,0,0]=4 5924 B13R1.27 O[C@@H]1C=C[C@@H](C1)NCCCCCF d3798c71813275234d7c69a89f1539f7 [0,1,0,1,0,0|2,0,0]=4 5925 B13R1.27 O[C@H]1C=C[C@H](C1)NCCCCCF 1e9344c2d2d0ef565d70b41d2518ce78 [0,1,0,1,0,0|2,0,0]=4 5926 B13R1.44 CC(CC1CCCCC1)NCCO 6ecc7fd891405f0b821b56f22caf9e17 [0,1,0,1,0,0|1,0,1]=4 5927 B13R1.44 CCCCC(C)OC1CC=CCC1 085ea3f3c58a11bcd98e21cf795309f5 [0,1,0,1,0,0|2,0,0]=4 5928 B13R1.44 CCCCN(C)CC1CC=CCC1 d1b28e837d282281cc3d1eaa74aa136d [0,1,0,1,0,0|2,0,0]=4 5929 B13R1.153 CCCCC(C)OCC1C=CCC1 296066b07587bd1d860bf09d925fcb27 [0,1,0,1,0,0|2,0,0]=4 5930 B13R1.153 O=C(/C=C/CO)NCC1CCCC1 10a19b3b671bd846175d2c3eeeb40265 [0,1,0,1,0,0|1,0,1]=4 5931 B13R1.153 O=C(C=CCO)NCC1CCCC1 c4327986a59e2f03f1305ed2525e0399 [0,1,0,1,0,0|1,0,1]=4 5932 B13R1.656 CC/C=C/CN1CC(CCC1C)O 9ebe863378b94017f3da50db0b21cd0c [0,1,0,1,0,0|2,0,0]=4 5933 B13R1.656 CC/C=C/CN1C[C@@H](CC[C@H]1C)O 316565ba8124ccebb1390dd923042c39 [0,1,0,1,0,0|2,0,0]=4 5934 B13R1.674 CC1CCCCN1C(=O)/C=C/CO 019ccd4963e7f94992ea20e24f7c1719 [0,1,0,1,0,0|1,0,1]=4 5935 B13R1.674 CC1CCCCN1C(=O)C=CCO b3a76153ce355d2caf4e30e25ee6bf7c [0,1,0,1,0,0|1,0,1]=4 5936 B13R1.674 C[C@@H]1CCCCN1C(=O)/C=C/CO 1503122da3b4b69c118f8f8fc338a158 [0,1,0,1,0,0|1,0,1]=4 5937 B13R1.674 C[C@@H]1CCCCN1C(=O)C=CCO d3d48640eb06ea975c1168027d04e4dd [0,1,0,1,0,0|1,0,1]=4 5938 B13R1.674 C[C@H]1CCCCN1C(=O)/C=C/CO 364500ffd832a07428c4ca1089e7cf4b [0,1,0,1,0,0|1,0,1]=4 5939 B13R1.674 C[C@H]1CCCCN1C(=O)C=CCO b4f191b84fefa830279b651bce6db541 [0,1,0,1,0,0|1,0,1]=4 5940 B13R1.676 CCCCN(C)CCCC=C1CC1 f8d0e0ccf8f842025cc76e430b089adf [0,1,0,1,0,0|2,0,0]=4 5941 B13R1.683 O=C(/C=C/CO)NCCC1CCC1 9d2a13ea9889f7c7f8450d2881570dc1 [0,1,0,1,0,0|1,0,1]=4 5942 B13R1.683 O=C(C=CCO)NCCC1CCC1 cda5c5964b051171993532f98f5ee223 [0,1,0,1,0,0|1,0,1]=4 5943 B13R1.684 CCC1CCCN1C(=O)/C=C/CO 68df9240d360ade50d90e6775b303dfa [0,1,0,1,0,0|1,0,1]=4 5944 B13R1.684 CCC1CCCN1C(=O)C=CCO 25038dcddfd12e6e924f1ffa1d5c94ba [0,1,0,1,0,0|1,0,1]=4 5945 B13R1.684 CC[C@@H]1CCCN1C(=O)/C=C/CO 7b4f28514c23e0665bd800471667c437 [0,1,0,1,0,0|1,0,1]=4 5946 B13R1.684 CC[C@@H]1CCCN1C(=O)C=CCO 6deb4d49eb85e9d30961301578697334 [0,1,0,1,0,0|1,0,1]=4 5947 B13R1.1133 CC/C=C\CCN1C(CCC1C)C 8ddc7a9418e10e5afb0dce6933999bf9 [0,1,0,1,0,0|2,0,0]=4 5948 B13R1.1133 CC/C=C\CCN1[C@@H](CC[C@@H]1C)C ab51c892b4e35c8c0287387c82043e03 [0,1,0,1,0,0|2,0,0]=4 5949 B13R1.1133 CC/C=C\CCN1[C@@H](CC[C@H]1C)C 0bdd3ab96e418525f9c52ade877fceeb [0,1,0,1,0,0|2,0,0]=4 5950 B13R1.1133 CC/C=C\CCN1[C@H](CC[C@@H]1C)C 101a90a82eb61c1574a72a4a201b5e50 [0,1,0,1,0,0|2,0,0]=4 5951 B13R1.1959 OCNCC1(CCCCCCC1)O f48cabf2752aa7d4f37fa5371f61f550 [0,1,0,1,0,0|1,0,1]=4 5952 B13R1.2436 CC/C=C/CNCC1(CCCC1)C 01dd302bf09b04b4f0e99d0e82d7795d [0,1,0,1,0,0|2,0,0]=4 5953 B13R1.2436 CC/C=C/CNCC1(CCCC1)F c5ebca9fdf2d4fce45dd411a3c24c676 [0,1,0,1,0,0|2,0,0]=4 5954 B13R1.2436 CC/C=C/CNCC1(CCCC1)O eb7e1b365b303002dd7bada4005e295e [0,1,0,1,0,0|2,0,0]=4 5955 B13R1.2436 CC/C=C/COCC1(CCCC1)C a90823997d5e3bafbf15d827f9a02749 [0,1,0,1,0,0|2,0,0]=4 5956 B13R1.2436 CC/C=C/COCC1(CCCC1)F 97a1b2aa53ae4bebb756465113e6668a [0,1,0,1,0,0|2,0,0]=4 5957 B13R1.2436 CC/C=C\CCNC1(CCCC1)C 3d92a744d52a0cf6c2fac3bac2be8b4e [0,1,0,1,0,0|2,0,0]=4 5958 B13R1.2436 CC/C=C\COCC1(CCCC1)C 3008b7f654558ef9b2109d3287ec9564 [0,1,0,1,0,0|2,0,0]=4 5959 B13R1.2436 CC/C=C\COCC1(CCCC1)F d90e9a3650affd7cfe440fc1eca41530 [0,1,0,1,0,0|2,0,0]=4 5960 B13R1.2488 O=C(/C=C/CO)N1CCCCCC1 1dbb768bef897d660b378abffb5546db [0,1,0,1,0,0|1,0,1]=4 5961 B13R1.2488 O=C(C=CCO)N1CCCCCC1 cfe4ac3a2578affc6530ab1dd93bd888 [0,1,0,1,0,0|1,0,1]=4 5962 B13R1.3572 CC/C=C\CCOC(C)C1CCC1 ff038fc91cbe9b4733c610d443192d49 [0,1,0,1,0,0|2,0,0]=4 5963 B13R1.3572 CC/C=C\CCO[C@@H](C)C1CCC1 4ee7d808b3cb37c5bca09d6c95ef270c [0,1,0,1,0,0|2,0,0]=4 5964 B13R1.3574 CC/C=C\CCOC(C)CC1CC1 3e893fc772a4873a116819130b1d4997 [0,1,0,1,0,0|2,0,0]=4 5965 B13R1.103 CCC1CCCN1C/C=C/C(=O)O a26ce1fa1602c1009a474dac2adf77f9 [0,1,0,1,0,0|1,0,1]=4 5966 B13R1.103 CCC1CCCN1C/C=C/C(C)C ed5e48898d859f13d62797a625ed7e3c [0,1,0,1,0,0|2,0,0]=4 5967 B13R1.103 CCC1CCCN1CC=CC(=O)O a2e35922fd5003242e687c1e3ff0ad29 [0,1,0,1,0,0|1,0,1]=4 5968 B13R1.103 CC[C@@H]1CCCN1C/C=C/C(=O)O faaa72b1cbf35260cdc87097399f7a42 [0,1,0,1,0,0|1,0,1]=4 5969 B13R1.103 CC[C@@H]1CCCN1C/C=C/C(C)C 4837a59e00e40db062755458da076873 [0,1,0,1,0,0|2,0,0]=4 5970 B13R1.103 CC[C@@H]1CCCN1CC=CC(=O)O 469bed11b5255a37a9c6bfd1665bdcb9 [0,1,0,1,0,0|1,0,1]=4 5971 B13R1.158 CC(C)/C=C/CN1CCCCC1C da38b1235598c0b2743c0e9dad85f54f [0,1,0,1,0,0|2,0,0]=4 5972 B13R1.158 CC(C)/C=C/CN1CCCC[C@@H]1C c087e0eceb8ed89104591f7de36fbfcf [0,1,0,1,0,0|2,0,0]=4 5973 B13R1.158 CC(C)/C=C/CN1CCCC[C@H]1C a85fc8000695d0b49c164ce8b2989b26 [0,1,0,1,0,0|2,0,0]=4 5974 B13R1.158 CC(O)CNCC1CCCCC1C e3954a63248cbcd7f99ec878e27b3490 [0,1,0,1,0,0|1,0,1]=4 5975 B13R1.158 CC1CCCCC1CNC[C@@H](C)O e06ff9a7781b8090e9f285823485c2dc [0,1,0,1,0,0|1,0,1]=4 5976 B13R1.158 CC1CCCCC1CNC[C@H](C)O 93d672d2a449a8767771c86768228866 [0,1,0,1,0,0|1,0,1]=4 5977 B13R1.158 CC1CCCCN1C/C=C/C(=O)O 40cfc9adfa6d72d7b49b2ae63fcac813 [0,1,0,1,0,0|1,0,1]=4 5978 B13R1.158 CC1CCCCN1CC=CC(=O)O cefe32af09f693787c95f4e49bc93ee3 [0,1,0,1,0,0|1,0,1]=4 5979 B13R1.158 C[C@@H]1CCCCN1C/C=C/C(=O)O 06eafc1455081c6d787643bf3aeecf79 [0,1,0,1,0,0|1,0,1]=4 5980 B13R1.158 C[C@@H]1CCCCN1CC=CC(=O)O 26a4c4ae18c126b14cf72bd34d085d1b [0,1,0,1,0,0|1,0,1]=4 5981 B13R1.158 C[C@H]1CCCCN1C/C=C/C(=O)O 962d24e05a3311f43480c9017ea1e4e2 [0,1,0,1,0,0|1,0,1]=4 5982 B13R1.158 C[C@H]1CCCCN1CC=CC(=O)O 0b5162efdc593feaeadfcece90b54132 [0,1,0,1,0,0|1,0,1]=4 5983 B13R1.167 CC(C)/C=C/COC1CCCC1C 711ccbd7701bcb0951e77227b7b2d1fa [0,1,0,1,0,0|2,0,0]=4 5984 B13R1.167 CC(C)/C=C/CO[C@@H]1CCC[C@@H]1C 7c7cb9cdc0d170ec39df7111f231f985 [0,1,0,1,0,0|2,0,0]=4 5985 B13R1.167 CC(C)/C=C/CO[C@@H]1CCC[C@H]1C ec3af5e0b0599acd069459b7aa22c900 [0,1,0,1,0,0|2,0,0]=4 5986 B13R1.167 CC(C)/C=C/CO[C@H]1CCC[C@@H]1C da6f6bcf1bcda9884ce62200dab5e033 [0,1,0,1,0,0|2,0,0]=4 5987 B13R1.167 CC(C)/C=C/CO[C@H]1CCC[C@H]1C 56ed0b66ae75c100b6a5914fc8c0801f [0,1,0,1,0,0|2,0,0]=4 5988 B13R1.167 CC1CCCC1OC/C=C/C(=O)O 07b7f61df39d48faf0528ad68423148f [0,1,0,1,0,0|1,0,1]=4 5989 B13R1.167 CC1CCCC1OCC=CC(=O)O 292424a3f2a8d59fff6f3976a8516cee [0,1,0,1,0,0|1,0,1]=4 5990 B13R1.167 C[C@@H]1CCC[C@@H]1OC/C=C/C(=O)O b08c297a4d7f3fb1c01102e1a9e4e1db [0,1,0,1,0,0|1,0,1]=4 5991 B13R1.167 C[C@@H]1CCC[C@@H]1OCC=CC(=O)O 0b7c1c6b8b4f04f0456657a60bcfe473 [0,1,0,1,0,0|1,0,1]=4 5992 B13R1.167 C[C@@H]1CCC[C@H]1OC/C=C/C(=O)O 8a86c86c0b623cc12bd1c88ea945efcb [0,1,0,1,0,0|1,0,1]=4 5993 B13R1.167 C[C@@H]1CCC[C@H]1OCC=CC(=O)O 4b6ec5e6b39f4bb3a24f2483b01b71b6 [0,1,0,1,0,0|1,0,1]=4 5994 B13R1.167 C[C@H]1CCC[C@@H]1OC/C=C/C(=O)O 5857b9f3fa0fd3e71b844f1d0b69d94f [0,1,0,1,0,0|1,0,1]=4 5995 B13R1.167 C[C@H]1CCC[C@@H]1OCC=CC(=O)O c87752bf547b50cb0db3f8d73f0eef5b [0,1,0,1,0,0|1,0,1]=4 5996 B13R1.167 C[C@H]1CCC[C@H]1OC/C=C/C(=O)O ba80f479ce88414e92922d95889f6dd6 [0,1,0,1,0,0|1,0,1]=4 5997 B13R1.167 C[C@H]1CCC[C@H]1OCC=CC(=O)O 5257dc01af3eb4afc5660e230a60f443 [0,1,0,1,0,0|1,0,1]=4 5998 B13R1.193 CC/C=C/CNC1CCCC1(C)C b0846246afeed0f49b324d6cf2029394 [0,1,0,1,0,0|2,0,0]=4 5999 B13R1.193 CC/C=C/CNC1CCCC1(C)O d85c956a1d93d375a64513593bb46e72 [0,1,0,1,0,0|2,0,0]=4 6000 B13R1.193 CC/C=C/CN[C@@H]1CCC[C@@]1(C)O cec34645221f2ed06db79d5057ecada1 [0,1,0,1,0,0|2,0,0]=4 6001 B13R1.193 CC/C=C/CN[C@H]1CCC[C@]1(C)O 9cc902ec94cf4e8c8eb0498fb880296c [0,1,0,1,0,0|2,0,0]=4 6002 B13R1.193 CC/C=C/COC1CCCC1(C)C e61a35b3fa7b6b325d46a0df86ae4aa1 [0,1,0,1,0,0|2,0,0]=4 6003 B13R1.193 CC/C=C/CO[C@@H]1CCCC1(C)C bce8a3368a5d821a4bf3faa3ecf70dca [0,1,0,1,0,0|2,0,0]=4 6004 B13R1.193 CC/C=C/CO[C@H]1CCCC1(C)C 20395d9e62900f456edc1b04c36048cb [0,1,0,1,0,0|2,0,0]=4 6005 B13R1.193 CC/C=C\CCN1CCCC1(C)C 8247bd6b719e2943993e09db1ced792a [0,1,0,1,0,0|2,0,0]=4 6006 B13R1.337 CC(C)/C=C/COC1CCCCC1 7574c075820ae0a8d9131a3268f52588 [0,1,0,1,0,0|2,0,0]=4 6007 B13R1.337 CC(C)CCCCN1CC=CCC1 697f5f2e8d75b3cd7a002d4ae3f5c114 [0,1,0,1,0,0|2,0,0]=4 6008 B13R1.337 CC(C)CCCOC1CC=CCC1 cbb3fab55f4a0e6137d9d13fbda5b518 [0,1,0,1,0,0|2,0,0]=4 6009 B13R1.337 CC(C)CCNCC1CC=CCC1 9fc7d928ef04cccb41aac1d4d651a1a6 [0,1,0,1,0,0|2,0,0]=4 6010 B13R1.337 CC(C)CCOCC1CC=CCC1 b2145b71faafe772971c1539ae91024b [0,1,0,1,0,0|2,0,0]=4 6011 B13R1.337 CC(C)CCOC[C@@H]1CC=CCC1 a00949843e6f69df4c96b445582b5e4b [0,1,0,1,0,0|2,0,0]=4 6012 B13R1.337 CC(C)CCOC[C@H]1CC=CCC1 ab571e1f7981a323a8e8d0d5f0f14f05 [0,1,0,1,0,0|2,0,0]=4 6013 B13R1.337 CC(O)CCCCN1CC=CCC1 2577ce5327c5586e6c517bb5bae8b604 [0,1,0,1,0,0|2,0,0]=4 6014 B13R1.337 CC(O)CCNCC1CC=CCC1 cb15f2d0e5793378bea6919b2ab3387f [0,1,0,1,0,0|2,0,0]=4 6015 B13R1.337 CC(O)CNCCC1CCCCC1 ff36c113951703d24575b0d1948a60a9 [0,1,0,1,0,0|1,0,1]=4 6016 B13R1.337 C[C@@H](O)CCCCN1CC=CCC1 1cee3ee3285eb1e6109c2c39e3a371f3 [0,1,0,1,0,0|2,0,0]=4 6017 B13R1.337 C[C@@H](O)CCNCC1CC=CCC1 754c07fa59cd97497880de780870ee1e [0,1,0,1,0,0|2,0,0]=4 6018 B13R1.337 C[C@@H](O)CNCCC1CCCCC1 c476ea8872dc4b71946dfacf5ed3db83 [0,1,0,1,0,0|1,0,1]=4 6019 B13R1.337 C[C@H](O)CCNCC1CC=CCC1 d0f2c1abcfd70f5e5932152d85e75a6e [0,1,0,1,0,0|2,0,0]=4 6020 B13R1.337 C[C@H](O)CNCCC1CCCCC1 1974e8d69ca558789317ffeffba1b7ff [0,1,0,1,0,0|1,0,1]=4 6021 B13R1.337 O=C(O)/C=C/CNC1CCCCC1 bf665206e854606d4919a3d8db98d5a3 [0,1,0,1,0,0|1,0,1]=4 6022 B13R1.337 O=C(O)/C=C/COC1CCCCC1 1cb6444fb6febf81ad65f6ff89f56bfb [0,1,0,1,0,0|1,0,1]=4 6023 B13R1.337 O=C(O)C=CCNC1CCCCC1 885c048393cf2678257c0ac6803e12df [0,1,0,1,0,0|1,0,1]=4 6024 B13R1.337 O=C(O)C=CCOC1CCCCC1 dbd9b6504d6681fcbec50ac5887ffa87 [0,1,0,1,0,0|1,0,1]=4 6025 B13R1.343 CC(C)/C=C/CNCC1CCCC1 e37356592966258dbefb9a51e2eba193 [0,1,0,1,0,0|2,0,0]=4 6026 B13R1.343 CC(C)/C=C/COCC1CCCC1 0afb8ce796da44fb094e680fdc39d835 [0,1,0,1,0,0|2,0,0]=4 6027 B13R1.343 CC(C)CCCCOC1C=CCC1 380ceb530e206698c120e61e56898978 [0,1,0,1,0,0|2,0,0]=4 6028 B13R1.343 CC(C)CCCOCC1C=CCC1 190400554771248d172ca6ed0ae7dd5a [0,1,0,1,0,0|2,0,0]=4 6029 B13R1.343 CC(O)CNCCCC1CCCC1 46fbfd1478c9195a2aa522fc8da81b59 [0,1,0,1,0,0|1,0,1]=4 6030 B13R1.343 C[C@@H](O)CNCCCC1CCCC1 27b23b27315df7d078c422a3e77aef84 [0,1,0,1,0,0|1,0,1]=4 6031 B13R1.343 C[C@H](O)CNCCCC1CCCC1 6f4d8fb06effe2387ffc181b7b58ae91 [0,1,0,1,0,0|1,0,1]=4 6032 B13R1.343 O=C(O)/C=C/CNCC1CCCC1 f37cf10455820c8d72fa9db073036149 [0,1,0,1,0,0|1,0,1]=4 6033 B13R1.343 O=C(O)/C=C/COCC1CCCC1 eee790dcd5c66b4a168f1e51b4de1f06 [0,1,0,1,0,0|1,0,1]=4 6034 B13R1.343 O=C(O)C=CCNCC1CCCC1 5cf263a25b0ffeb4da45c6cc4b823d5c [0,1,0,1,0,0|1,0,1]=4 6035 B13R1.343 O=C(O)C=CCOCC1CCCC1 4e80353359829d2c639d4403e99ac3a6 [0,1,0,1,0,0|1,0,1]=4 6036 B13R1.578 CCCCC1CCCN1CC(C)O d40615023bf406cb9ae25d40f0969a5e [0,1,0,1,0,0|1,0,1]=4 6037 B13R1.578 CCCCC1CCCN1C[C@@H](C)O 51c10d405454efb93acbe8ff37d03382 [0,1,0,1,0,0|1,0,1]=4 6038 B13R1.578 CCCCC1CCCN1C[C@H](C)O 26b1ba7877b11739c7309e8b952ffc9a [0,1,0,1,0,0|1,0,1]=4 6039 B13R1.586 CC(C)/C=C/CNCCC1CCC1 ac5c4a627ab2ce072adf4d32bf63a754 [0,1,0,1,0,0|2,0,0]=4 6040 B13R1.586 CC(C)/C=C/COCCC1CCC1 69344ce6eaec4aa7ab30f70f8733c0a8 [0,1,0,1,0,0|2,0,0]=4 6041 B13R1.586 O=C(O)/C=C/CNCCC1CCC1 dd5a482b54a06ec2350e924d43d294f3 [0,1,0,1,0,0|1,0,1]=4 6042 B13R1.586 O=C(O)/C=C/COCCC1CCC1 f74f19b3b9519dc95880b46834d17807 [0,1,0,1,0,0|1,0,1]=4 6043 B13R1.586 O=C(O)C=CCNCCC1CCC1 2c9fae2b9b61c0553accd0e5d9ccc102 [0,1,0,1,0,0|1,0,1]=4 6044 B13R1.586 O=C(O)C=CCOCCC1CCC1 d2d76aa124da51e0fa4ff928947aef43 [0,1,0,1,0,0|1,0,1]=4 6045 B13R1.610 CC(C)CC1CCCCCN1CO 5eed387245f50abb259e79d9414f5925 [0,1,0,1,0,0|1,0,1]=4 6046 B13R1.668 CC/C=C/CN1CCCCC1(C)C ab6fd3db89b7ecf383d7a82f50941edc [0,1,0,1,0,0|2,0,0]=4 6047 B13R1.670 CC/C=C/CN1CCCC1C(C)C bb342624edfc295aa72d6b88fdce748f [0,1,0,1,0,0|2,0,0]=4 6048 B13R1.670 CC/C=C/CN1CCCC1C(C)O 77aa5c2f9803675a0dcf80366d078064 [0,1,0,1,0,0|2,0,0]=4 6049 B13R1.670 CC/C=C/CN1CCC[C@@H]1C(C)O 01b24db0b708a363c85266241ca14a3d [0,1,0,1,0,0|2,0,0]=4 6050 B13R1.670 CC/C=C/CN1CCC[C@H]1C(C)C bf7be6e03c89df83f1300d00d242b8f1 [0,1,0,1,0,0|2,0,0]=4 6051 B13R1.670 CC/C=C/CN1CCC[C@H]1[C@H](C)O f1af3e60fde82bfde4acc47b1b3817c4 [0,1,0,1,0,0|2,0,0]=4 6052 B13R1.1022 CC(C)CNC1CC/C=C\CCC1 577c2e35f5fa7517a91368abe1031047 [0,1,0,1,0,0|2,0,0]=4 6053 B13R1.1022 CC(C)COC1CC/C=C/CCC1 416aa55f21d61c986eb84a2f9225b848 [0,1,0,1,0,0|2,0,0]=4 6054 B13R1.1022 CC(C)COC1CC/C=C\CCC1 b6471fc1f4aabdfd0a1ffc87102b581a [0,1,0,1,0,0|2,0,0]=4 6055 B13R1.1022 CC(C)COC1CCC=CCCC1 192767345784283481acf0d40366dcb7 [0,1,0,1,0,0|2,0,0]=4 6056 B13R1.1022 CC(C)CO[C@@H]1CCC=CCCC1 4416943631df34fdbbdd159862d500f9 [0,1,0,1,0,0|2,0,0]=4 6057 B13R1.1022 CC(F)COC1CC/C=C\CCC1 01456cfd640a500a5d6aa23d95f02e86 [0,1,0,1,0,0|2,0,0]=4 6058 B13R1.1022 CC(O)CNC1CC/C=C\CCC1 e8f16f9d8915f4e3b3e7801c9681ca8d [0,1,0,1,0,0|2,0,0]=4 6059 B13R1.1022 CC(O)CNC1CCCCCCC1 17ecc1eb0d03a2b5130a9ccf5d117efb [0,1,0,1,0,0|1,0,1]=4 6060 B13R1.1022 CC(S)COC1CC/C=C\CCC1 f876986718e009e83b85bb0ef0e43ac2 [0,1,0,1,0,0|2,0,0]=4 6061 B13R1.1022 C[C@@H](F)COC1CC/C=C\CCC1 575cb4364b239ac5728c8db22d5ed188 [0,1,0,1,0,0|2,0,0]=4 6062 B13R1.1022 C[C@@H](O)CNC1CC/C=C\CCC1 c4b1ea3268d4ba308874d20ea5f85168 [0,1,0,1,0,0|2,0,0]=4 6063 B13R1.1022 C[C@@H](O)CNC1CCCCCCC1 640fbb2fe694d32be7b4b8512cb17ae1 [0,1,0,1,0,0|1,0,1]=4 6064 B13R1.1022 C[C@H](F)COC1CC/C=C\CCC1 cbe64e26c4efb6660ea81507b2d0bc02 [0,1,0,1,0,0|2,0,0]=4 6065 B13R1.1022 C[C@H](O)CNC1CC/C=C\CCC1 3ce5d73ef60a238ce95b0d2f9646aa9f [0,1,0,1,0,0|2,0,0]=4 6066 B13R1.1022 C[C@H](O)CNC1CCCCCCC1 f9b71f245c21c2aeaf68e1aa25358244 [0,1,0,1,0,0|1,0,1]=4 6067 B13R1.1052 CC(C)/C=C/COCCCC1CC1 d71d64977cc09dbaea86e0914042c906 [0,1,0,1,0,0|2,0,0]=4 6068 B13R1.1052 CC(C)CCNCCCC=C1CC1 58ecc2c7c9df10817f4851dff0246648 [0,1,0,1,0,0|2,0,0]=4 6069 B13R1.1052 CC(C)CCOCCCC=C1CC1 dee1216d2ed362fccd259f0872bce38b [0,1,0,1,0,0|2,0,0]=4 6070 B13R1.1052 CC(O)CCNCCCC=C1CC1 0359440c0b846ecd357f7e8778463ef1 [0,1,0,1,0,0|2,0,0]=4 6071 B13R1.1052 C[C@@H](O)CCNCCCC=C1CC1 53c1e46048554c9513fbee93acec7588 [0,1,0,1,0,0|2,0,0]=4 6072 B13R1.1052 C[C@H](O)CCNCCCC=C1CC1 1ed569c8884ee1052937a31b88e3d021 [0,1,0,1,0,0|2,0,0]=4 6073 B13R1.1052 O=C(O)/C=C/COCCCC1CC1 6e2279157e13124229fb652dadf929fd [0,1,0,1,0,0|1,0,1]=4 6074 B13R1.1052 O=C(O)C=CCOCCCC1CC1 a98bb41d32e7df1ac3bdd4475675879a [0,1,0,1,0,0|1,0,1]=4 6075 B13R1.1107 CC(O)CN1CCCCCCCC1 d5fedefb41998d6d9c5220580b1e1886 [0,1,0,1,0,0|1,0,1]=4 6076 B13R1.1107 C[C@@H](O)CN1CCCCCCCC1 6261692d5dbc18490cbc4f9baddcf49f [0,1,0,1,0,0|1,0,1]=4 6077 B13R1.1107 C[C@H](O)CN1CCCCCCCC1 36737c72c61605e8f5ab7f0b76e1bf18 [0,1,0,1,0,0|1,0,1]=4 6078 B13R1.1988 CC(C)/C=C/CN1CCCCCC1 65d3c631da6cfaa102f67f37d6a0f907 [0,1,0,1,0,0|2,0,0]=4 6079 B13R1.1988 CC(C)CCNC1CCC=CCC1 6ff8e646f522d70f5738ead561a52d44 [0,1,0,1,0,0|2,0,0]=4 6080 B13R1.1988 CC(O)CCNC1CCC=CCC1 c8b0182362280114a806fb315373e386 [0,1,0,1,0,0|2,0,0]=4 6081 B13R1.1988 CC(O)CNCC1CCCCCC1 691e6ec02206fc582c49fee1a3ae7b03 [0,1,0,1,0,0|1,0,1]=4 6082 B13R1.1988 C[C@@H](O)CNCC1CCCCCC1 48415738e536ac8e2b1a337918a27be6 [0,1,0,1,0,0|1,0,1]=4 6083 B13R1.1988 C[C@H](O)CNCC1CCCCCC1 bbb758185a80c0a63aff2e6e97985379 [0,1,0,1,0,0|1,0,1]=4 6084 B13R1.1988 O=C(O)/C=C/CN1CCCCCC1 9beeb129d8fc364d6a06f2ce479f8a3b [0,1,0,1,0,0|1,0,1]=4 6085 B13R1.1988 O=C(O)C=CCN1CCCCCC1 5e37a7b6e44714d351a56993a7130b71 [0,1,0,1,0,0|1,0,1]=4 6086 B13R1.2970 CC/C=C\CCOC1CCC1(C)C 460c099e35b45ff4559d520d1c8dd4be [0,1,0,1,0,0|2,0,0]=4 6087 B13R1.3672 CC/C=C\CCCOC1CC1(C)C 4803a3dd5e8253b13bc0443c9450b7b4 [0,1,0,1,0,0|2,0,0]=4 6088 B13R1.3672 CC/C=C\CCNC[C@@H]1CC1(C)C 29e29e6bd1320e3e76be9e5625b46830 [0,1,0,1,0,0|2,0,0]=4 6089 B13R1.3672 CC/C=C\CCNC[C@H]1CC1(C)C 28817417071173e58a6b4aa090b3abb1 [0,1,0,1,0,0|2,0,0]=4 6090 B13R1.3672 CC/C=C\CCOCC1CC1(C)C 4ec2bc1bfbd3f7f200f55e1aa18bb340 [0,1,0,1,0,0|2,0,0]=4 6091 B13R1.3672 CC/C=C\CCOC[C@@H]1CC1(C)C fe984bc60da2ce6d37160b110d14f3ec [0,1,0,1,0,0|2,0,0]=4 6092 B13R1.3672 CC/C=C\CCOC[C@H]1CC1(C)C be93608b85b266a66492014f02ccc06b [0,1,0,1,0,0|2,0,0]=4 6093 B13R1.9 CC/C=C/CNC1CCC(CC1)C 0c3f23e3e025b2eba5eab461edad9cd0 [0,1,0,1,0,0|2,0,0]=4 6094 B13R1.9 CC/C=C/CNC1CCC(CC1)Cl 138788f20b9cb47ee1ce0a6ba6b05c04 [0,1,0,1,0,0|2,0,0]=4 6095 B13R1.9 CC/C=C/CNC1CCC(CC1)O 3e3ee2ba5cf501b38dc9bd445a5a04e8 [0,1,0,1,0,0|2,0,0]=4 6096 B13R1.9 CC/C=C/CN[C@H]1CC[C@@H](CC1)C 1bfb01b41b92c6c3eb89dfd3053c2453 [0,1,0,1,0,0|2,0,0]=4 6097 B13R1.9 CC/C=C/CN[C@H]1CC[C@@H](CC1)Cl c80da5d011471b0313a7a9a0d764254b [0,1,0,1,0,0|2,0,0]=4 6098 B13R1.9 CC/C=C/CN[C@H]1CC[C@@H](CC1)O e26f8c3045194d79323fa4e26c0a4a62 [0,1,0,1,0,0|2,0,0]=4 6099 B13R1.9 CC/C=C/CN[C@H]1CC[C@H](CC1)C 4b705daa7a87616f693e369777d0e7e9 [0,1,0,1,0,0|2,0,0]=4 6100 B13R1.9 CC/C=C/CN[C@H]1CC[C@H](CC1)Cl ea4916db2fa506fab4ed54ca7c2826c3 [0,1,0,1,0,0|2,0,0]=4 6101 B13R1.9 CC/C=C/CN[C@H]1CC[C@H](CC1)O d77cc5ab1b99d8184e1725cc5384f29c [0,1,0,1,0,0|2,0,0]=4 6102 B13R1.9 CC/C=C/COC1CCC(CC1)C 703d154234e1b64d967cfb85cbfa53e5 [0,1,0,1,0,0|2,0,0]=4 6103 B13R1.9 CC/C=C/COC1CCC(CC1)F 197d079c0101613cbd1f624a26ca7b34 [0,1,0,1,0,0|2,0,0]=4 6104 B13R1.9 CC/C=C/CO[C@H]1CC[C@@H](CC1)C 7a6c13f7f4620ddb402fe9bd9a077ad3 [0,1,0,1,0,0|2,0,0]=4 6105 B13R1.9 CC/C=C/CO[C@H]1CC[C@H](CC1)C 3a815522b080e8b5adf277c0d7bf3e86 [0,1,0,1,0,0|2,0,0]=4 6106 B13R1.9 CC/C=C\CCN1CCC(CC1)C 868984328a29cee037af4421d3419c90 [0,1,0,1,0,0|2,0,0]=4 6107 B13R1.9 CC/C=C\CCN1CCC(CC1)Cl 157bdc166f13200142fb4611428853cc [0,1,0,1,0,0|2,0,0]=4 6108 B13R1.9 CC/C=C\CCN1CCC(CC1)F ce059dbc36d8092d853644353eb18fea [0,1,0,1,0,0|2,0,0]=4 6109 B13R1.9 CC/C=C\CCN1CCC(CC1)I 7c0e722638075951f9c8685e4fc44bc2 [0,1,0,1,0,0|2,0,0]=4 6110 B13R1.9 CC/C=C\CCN1CCC(CC1)O acab08de2ca1c55367ceb8ac01be7d00 [0,1,0,1,0,0|2,0,0]=4 6111 B13R1.9 CC/C=C\COC1CCC(CC1)C cc190c35a30310e09c29c66817b53cb9 [0,1,0,1,0,0|2,0,0]=4 6112 B13R1.9 CCCCCOC1C=CC(=O)CO1 18d600dee2d9d1575200448fe0717ad3 [0,1,0,1,0,0|1,0,1]=4 6113 B13R1.9 CCCCCOC1CC=C(CC1)Br 577f180909a488c8e7279a2c2a97788b [0,1,0,1,0,0|2,0,0]=4 6114 B13R1.9 CCCCNCC1CNC(=O)CO1 75c09c2951de1c40c3d8e20636f7ebeb [0,1,0,1,0,0|2,0,0]=4 6115 B13R1.9 CCCCOCC1CC=C(CC1)C 670311150bb7320ca29682411c8eb5fe [0,1,0,1,0,0|2,0,0]=4 6116 B13R1.9 CCCCOCC1CNC(=O)CO1 de94592e2e75856dd7b2157c303d0768 [0,1,0,1,0,0|2,0,0]=4 6117 B13R1.9 CCCCOC[C@@H]1CNC(=O)CO1 8a872f0e4b9d7737130ac3fa3e0b6cce [0,1,0,1,0,0|2,0,0]=4 6118 B13R1.9 CCCCOC[C@H]1CNC(=O)CO1 debcf1ab93d7162f16bf83d734f3a18b [0,1,0,1,0,0|2,0,0]=4 6119 B13R1.9 OCCNCCC1CCC(CC1)O f75f26680c56f4760648d7e89c919d9c [0,1,0,1,0,0|1,0,1]=4 6120 B13R1.16 CC/C=C/CN1CCCC(C1C)O ee99f52905496f2e590c02282a40c578 [0,1,0,1,0,0|2,0,0]=4 6121 B13R1.16 CC/C=C/CN1CCC[C@@H]([C@H]1C)O 81ec71d7d732d87b9b44c3eaf09f8996 [0,1,0,1,0,0|2,0,0]=4 6122 B13R1.16 CC/C=C/CN1CCC[C@H]([C@@H]1C)O 8f4e83f24a7b337376a041bf5c906187 [0,1,0,1,0,0|2,0,0]=4 6123 B13R1.91 C=C(CO)CN1CCCCC1CC 577e1f89282647614a5ab41980610781 [0,1,0,1,0,0|1,0,1]=4 6124 B13R1.91 C=C(CO)CN1CCCC[C@@H]1CC 39eab1e8952717e9df255aa06ca81460 [0,1,0,1,0,0|1,0,1]=4 6125 B13R1.91 C=C(CO)CN1CCCC[C@H]1CC 995a3b4937535c1fe26dc91a6cdbe7d6 [0,1,0,1,0,0|1,0,1]=4 6126 B13R1.91 CCC1CCCCN1CC(=O)CO 4f9b9084142e240a6dcb9dd351fcd4ad [0,1,0,1,0,0|1,0,1]=4 6127 B13R1.91 CCC1COCCC1NC(=O)CO a1d6e64e5ca740a11143cb195c4e0ae0 [0,1,0,1,0,0|2,0,0]=4 6128 B13R1.91 CC[C@@H]1CCCCN1CC(=O)CO e91a1d6d868c948e4eff2a823f81f93b [0,1,0,1,0,0|1,0,1]=4 6129 B13R1.91 CC[C@H]1CCCCN1CC(=O)CO 2061939cb7b0aadbe82180338e092c70 [0,1,0,1,0,0|1,0,1]=4 6130 B13R1.91 COC1CCCCC1NC(=O)CO 0dfd2700b8e4c53e761f9162add2328a [0,1,0,1,0,0|2,0,0]=4 6131 B13R1.91 CO[C@H]1CCCC[C@@H]1NC(=O)CO 363e90581fa391ecab2caaa222433a2a [0,1,0,1,0,0|2,0,0]=4 6132 B13R1.91 O=C(CO)N[C@@H]1CCCC[C@@H]1CO 7c49a0707a399f3c44d5d5f7b10837ba [0,1,0,1,0,0|2,0,0]=4 6133 B13R1.91 O=C(CO)N[C@@H]1CCCC[C@H]1CO 55289095b2ceabd31a7f5235bf0a9ba5 [0,1,0,1,0,0|2,0,0]=4 6134 B13R1.91 O=C(CO)N[C@H]1CCCC[C@H]1CO 84258fc75f782cf2a9b46066b4a06485 [0,1,0,1,0,0|2,0,0]=4 6135 B13R1.382 CCCC1COCCN1C(=O)CO 5f5fe9b13773a609756df874213e5199 [0,1,0,1,0,0|2,0,0]=4 6136 B13R1.382 COCC1CCCCN1C(=O)CO 61012e5c9bb6827bae19a1150c58598d [0,1,0,1,0,0|2,0,0]=4 6137 B13R1.382 O=C(CO)N1CCCCC1CCCl 0df5b293b3a60ef700bb52ab82e0f3c0 [0,1,0,1,0,0|2,0,0]=4 6138 B13R1.382 O=C(CO)N1CCCCC1CCO 2a298babb57ef33d18cb700cc53436ed [0,1,0,1,0,0|2,0,0]=4 6139 B13R1.382 O=C(CO)N1CCCC[C@@H]1CCO d5fddb3cea90495dbac3ea5734863127 [0,1,0,1,0,0|2,0,0]=4 6140 B13R1.382 O=C(CO)N1CCCC[C@H]1CCO e8b736caf710bc5ab879053103ceb8f1 [0,1,0,1,0,0|2,0,0]=4 6141 B13R1.393 COC[C@@H]1CCC[C@@H]1NC(=O)CO e03fe301a7e215aee64ab67f83e83d10 [0,1,0,1,0,0|2,0,0]=4 6142 B13R1.393 COC[C@H]1CCC[C@H]1NC(=O)CO a815908e041b664b3a9654e5f771a3d2 [0,1,0,1,0,0|2,0,0]=4 6143 B13R1.527 C=C(CO)CN1CCCCCC1C bd7bc26fc87e61bbad0b72e3e6acd93f [0,1,0,1,0,0|1,0,1]=4 6144 B13R1.527 CC1CCCCCN1CC(=O)CO 83e60b6fd7fd53b97320fc3da2c37e5f [0,1,0,1,0,0|1,0,1]=4 6145 B13R1.527 O=C(CO)N[C@@H]1CCCCC[C@@H]1O ce767c08be9c1a23c934000aaa1243e4 [0,1,0,1,0,0|2,0,0]=4 6146 B13R1.527 O=C(CO)N[C@@H]1CCCCC[C@H]1O 051ed940ba5a850d46ca77cb513f732e [0,1,0,1,0,0|2,0,0]=4 6147 B13R1.527 O=C(CO)N[C@H]1CCCCC[C@@H]1O e04f8e46d9db127eb97a47dd626a3358 [0,1,0,1,0,0|2,0,0]=4 6148 B13R1.528 C=C(CO)CNC1CCCCC1C 1172390d951b87c66c62f361000b05f6 [0,1,0,1,0,0|1,0,1]=4 6149 B13R1.528 C=C(CO)CN[C@@H]1CCCC[C@@H]1C 30e43adf90a3770890dbdd0cbdac3867 [0,1,0,1,0,0|1,0,1]=4 6150 B13R1.528 C=C(CO)CN[C@@H]1CCCC[C@H]1C 83c65f763bf9e9aae8944d1a09488d91 [0,1,0,1,0,0|1,0,1]=4 6151 B13R1.528 C=C(CO)CN[C@H]1CCCC[C@@H]1C 09c4275404226d63ef902e73b8c2e5be [0,1,0,1,0,0|1,0,1]=4 6152 B13R1.528 C=C(CO)CN[C@H]1CCCC[C@H]1C b33698477a6b4b7c85d1e546892ae404 [0,1,0,1,0,0|1,0,1]=4 6153 B13R1.528 CC(CO)NCC1CCCCC1C d3d49ba7fbab14f81f472005b4806fa6 [0,1,0,1,0,0|1,0,1]=4 6154 B13R1.528 CC1CCCCC1CNC(=O)CF f3a7719750f0cf64b658939eb2774e93 [0,1,0,1,0,0|2,0,0]=4 6155 B13R1.528 CC1CCCCC1CNC(=O)CO 8075fa3420ab61d1d9e533cffc97d11a [0,1,0,1,0,0|1,0,0]=3 6156 B13R1.528 CC1CCCCC1CNC(=O)CS fe0ae415d062ba81441433acde22b749 [0,1,0,1,0,0|1,1,0]=4 6157 B13R1.528 CC1CCCCC1CN[C@@H](C)CO 670822e5e8350c88313605f35abe1fe5 [0,1,0,1,0,0|1,0,1]=4 6158 B13R1.528 CC1CCCCC1CN[C@H](C)CO 88a1ae91852dd00f84bb49e76e4bbd89 [0,1,0,1,0,0|1,0,1]=4 6159 B13R1.528 CC1CCCCC1NCC(=O)CO 515a416376d38c107a574e9829824a90 [0,1,0,1,0,0|1,0,1]=4 6160 B13R1.528 CCC(=O)NCC1CCCCC1C 9d00a1ed14ce7970e3d353c5132bcfa1 [0,1,0,1,0,0|2,0,0]=4 6161 B13R1.528 CN1CCCCC1CNC(=O)CO 2bc632b7041e80f0edf3b3d38341199b [0,1,0,1,0,0|2,0,0]=4 6162 B13R1.528 C[C@@H]1CCCC[C@@H]1NCC(=O)CO 4a3c1570a6acd3a7e2198011b775acc0 [0,1,0,1,0,0|1,0,1]=4 6163 B13R1.528 C[C@@H]1CCCC[C@H]1NCC(=O)CO dfd067c88ebdb0cff3596eca54ac99ee [0,1,0,1,0,0|1,0,1]=4 6164 B13R1.528 C[C@H]1CCCC[C@@H]1NCC(=O)CO 14fcf562b3b407bb45ddff2d1b2d9305 [0,1,0,1,0,0|1,0,1]=4 6165 B13R1.528 C[C@H]1CCCC[C@H]1NCC(=O)CO fe0249ebd13b615bfb615dece8775f1e [0,1,0,1,0,0|1,0,1]=4 6166 B13R1.528 O=C(CO)NCC1CCCCC1O 0bba8dd218ef8873b5272978ec075e07 [0,1,0,1,0,0|2,0,0]=4 6167 B13R1.536 C=C(CO)CNCCC1CCCC1 f7c73c987987179d83c3853067ada215 [0,1,0,1,0,0|1,0,1]=4 6168 B13R1.536 CC(CO)NCCCC1CCCC1 de2da13511a023fdb0cb8f9323747f6d [0,1,0,1,0,0|1,0,1]=4 6169 B13R1.536 CCC(=O)NCCCC1CCCC1 78401252e8e9003b046e46509e85fda0 [0,1,0,1,0,0|2,0,0]=4 6170 B13R1.536 CCC(C)CCOCC1C=CCC1 24dd27f3431c63282ed06e7faf1e156b [0,1,0,1,0,0|2,0,0]=4 6171 B13R1.536 C[C@@H](CO)NCCCC1CCCC1 fb3b04c88ec4c9f798386705833087a5 [0,1,0,1,0,0|1,0,1]=4 6172 B13R1.536 C[C@H](CO)NCCCC1CCCC1 abe2322d870f5150b5c76af599e83531 [0,1,0,1,0,0|1,0,1]=4 6173 B13R1.536 O=C(CF)NCCCC1CCCC1 0085f8bf9bf7b98e23dd2fea743400e8 [0,1,0,1,0,0|2,0,0]=4 6174 B13R1.536 O=C(CO)CNCCC1CCCC1 fa9c4b1a1f4ec3d9aee2eb77e63d6675 [0,1,0,1,0,0|1,0,1]=4 6175 B13R1.536 O=C(CO)NCCCC1CCCC1 efd762021c6fe3598c876cd3d926d26c [0,1,0,1,0,0|1,0,0]=3 6176 B13R1.536 O=C(CO)NCCCC1CCOC1 6a393698f03b75edabd0c1fae7698906 [0,1,0,1,0,0|2,0,0]=4 6177 B13R1.536 O=C(CO)NCCCN1CCCC1 09e7a17a6a23f46a0b4770baa52211bb [0,1,0,1,0,0|2,0,0]=4 6178 B13R1.536 O=C(CO)NCCOC1CCCC1 aa6c00830fa862a103b6ceb37b273737 [0,1,0,1,0,0|2,0,0]=4 6179 B13R1.536 O=C(CO)NCCSC1CCCC1 6c0a25f5aac7fbb0f6867c2930299abd [0,1,0,1,0,0|2,0,0]=4 6180 B13R1.536 O=C(CS)NCCCC1CCCC1 137d7fd6501e63242371a4623d1e4fc9 [0,1,0,1,0,0|1,1,0]=4 6181 B13R1.581 CCCCC1CCCN1C(=O)CC 9374a581160934cabcc3d5c33727d268 [0,1,0,1,0,0|2,0,0]=4 6182 B13R1.581 CCCCC1CCCN1C(=O)CF 36108ffcb891e8f6683d611d8618c02d [0,1,0,1,0,0|2,0,0]=4 6183 B13R1.581 CCCCC1CCCN1C(=O)CO 87f51fe97d3da1a3790ffa1cdf822cec [0,1,0,1,0,0|1,0,0]=3 6184 B13R1.581 CCCCC1CCCN1C(=O)CS f3f35f5f63307163cbe25c134d871d11 [0,1,0,1,0,0|1,1,0]=4 6185 B13R1.581 CCCCC1CCCN1C(C)CO 7a6d7a3bc573d6bb6f5075f278db0407 [0,1,0,1,0,0|1,0,1]=4 6186 B13R1.581 CCCCC1CCCN1[C@@H](C)CO 034f033e3f0285f3e71b3abf06c2589d [0,1,0,1,0,0|1,0,1]=4 6187 B13R1.581 CCCCC1CCCN1[C@H](C)CO 08c451931885e5c86e7a07d71ac45018 [0,1,0,1,0,0|1,0,1]=4 6188 B13R1.581 CCOCC1CCCN1C(=O)CO 44a020a637f515ebe58706b61350bb62 [0,1,0,1,0,0|2,0,0]=4 6189 B13R1.581 CCOC[C@@H]1CCCN1C(=O)CO 00a08a6a0c61d463ae071045b310380e [0,1,0,1,0,0|2,0,0]=4 6190 B13R1.581 COCCC1CCCN1C(=O)CO 1ff0c251d48e98312059ce095ee33b2d [0,1,0,1,0,0|2,0,0]=4 6191 B13R1.594 CCC(C)CNCCCC=C1CC1 d4a55291709c23a9bf2ca09c9016f058 [0,1,0,1,0,0|2,0,0]=4 6192 B13R1.594 CCC(C)COCCCC=C1CC1 34278c55dd5350bad780d70ba4814fa7 [0,1,0,1,0,0|2,0,0]=4 6193 B13R1.594 CCC(O)CNCCCC=C1CC1 46b3875d9118bf3a7500eba7a46b349a [0,1,0,1,0,0|2,0,0]=4 6194 B13R1.594 CC[C@@H](C)COCCCC=C1CC1 6fb487938a87d0e14e61d0fbfa0abd84 [0,1,0,1,0,0|2,0,0]=4 6195 B13R1.594 CC[C@@H](O)CNCCCC=C1CC1 4f7f8b1ba4e17f387b4646856558e938 [0,1,0,1,0,0|2,0,0]=4 6196 B13R1.594 CC[C@H](C)CNCCCC=C1CC1 7869f81b84a44d4413d8281c87e5b740 [0,1,0,1,0,0|2,0,0]=4 6197 B13R1.594 CC[C@H](C)COCCCC=C1CC1 596ca55ac79ffdf4f56dd5dbfab74cba [0,1,0,1,0,0|2,0,0]=4 6198 B13R1.594 O=C(CO)NCCCOCC1CC1 77141961d8531ce797a5e793e0ef7dd8 [0,1,0,1,0,0|2,0,0]=4 6199 B13R1.599 CN1CCCC1CCNC(=O)CO 5dda63f67a0ebf650d207abbba1bc76e [0,1,0,1,0,0|2,0,0]=4 6200 B13R1.599 CN1CCC[C@@H]1CCNC(=O)CO 32c302a70eca1b63d72fba2b88953b4a [0,1,0,1,0,0|2,0,0]=4 6201 B13R1.599 CN1CCC[C@H]1CCNC(=O)CO b72fd119b341c229e222ebe929c4c4d7 [0,1,0,1,0,0|2,0,0]=4 6202 B13R1.611 O=C(CO)N1CCCCCC1CO 43d5e97ddb28a38b2004484c2b85bbba [0,1,0,1,0,0|2,0,0]=4 6203 B13R1.613 C=C(CO)CN[C@@H]1CCC[C@H]1CC 9fcde6d3acbf2d6c303341aed3744910 [0,1,0,1,0,0|1,0,1]=4 6204 B13R1.613 CCN1CCCC1CNC(=O)CO cfc94bf168efec64871569314282ab67 [0,1,0,1,0,0|2,0,0]=4 6205 B13R1.613 CCN1CCC[C@@H]1CNC(=O)CO 2398d8afcf2a22c9818e0e6df7355b9d [0,1,0,1,0,0|2,0,0]=4 6206 B13R1.613 CCN1CCC[C@H]1CNC(=O)CO cdf16a269f724effea9758099aa559e2 [0,1,0,1,0,0|2,0,0]=4 6207 B13R1.613 CC[C@@H]1CCC[C@H]1NCC(=O)CO cc513dbc4920b5d48d426d9d3b877e5c [0,1,0,1,0,0|1,0,1]=4 6208 B13R1.718 C=C(CO)CNCC1CCCCC1 65c943221ce09b74d2b9832e2a81ef29 [0,1,0,1,0,0|1,0,1]=4 6209 B13R1.718 CC(CO)NCCC1CCCCC1 f295d6a7721d9f95136065ab278e9a6d [0,1,0,1,0,0|1,0,1]=4 6210 B13R1.718 CCC(=O)NCCC1CCCCC1 db2a24049601c08006277d56d6513d9c [0,1,0,1,0,0|2,0,0]=4 6211 B13R1.718 CCC(C)CCOC1CC=CCC1 34b092bf0f6104feb9b7015caaa202c8 [0,1,0,1,0,0|2,0,0]=4 6212 B13R1.718 CCC(C)CNCC1CC=CCC1 370e3c3560b185c021a294f195d55523 [0,1,0,1,0,0|2,0,0]=4 6213 B13R1.718 CCC(C)COCC1CC=CCC1 72e0a67952d56757b694a6152a1c6710 [0,1,0,1,0,0|2,0,0]=4 6214 B13R1.718 CCC(C)COC[C@@H]1CC=CCC1 f6d866fe0bf866df4300f6a005dc1bbc [0,1,0,1,0,0|2,0,0]=4 6215 B13R1.718 CCC(C)COC[C@H]1CC=CCC1 da1c0af9e83f27d600313d85fecffab8 [0,1,0,1,0,0|2,0,0]=4 6216 B13R1.718 CCC(O)CNCC1CC=CCC1 3c0658cd3443d134b292aa7f6889f3e5 [0,1,0,1,0,0|2,0,0]=4 6217 B13R1.718 CC[C@@H](C)CNCC1CC=CCC1 b670d82b6eefc587bbfd2ae829626927 [0,1,0,1,0,0|2,0,0]=4 6218 B13R1.718 CC[C@@H](C)COCC1CC=CCC1 08e4b75582eb30393889266d4371ea41 [0,1,0,1,0,0|2,0,0]=4 6219 B13R1.718 CC[C@@H](C)COC[C@@H]1CC=CCC1 2e162afa2857038819d2f05d989d85f4 [0,1,0,1,0,0|2,0,0]=4 6220 B13R1.718 CC[C@@H](C)COC[C@H]1CC=CCC1 25b671790a736fde36ee4392f784127b [0,1,0,1,0,0|2,0,0]=4 6221 B13R1.718 CC[C@@H](O)CNCC1CC=CCC1 ef08d044aa5fbf94f58e240d27605a96 [0,1,0,1,0,0|2,0,0]=4 6222 B13R1.718 CC[C@H](C)CNCC1CC=CCC1 f4ec9e022358c78d58431b31dc0a2f10 [0,1,0,1,0,0|2,0,0]=4 6223 B13R1.718 CC[C@H](C)COCC1CC=CCC1 4321f1786bc69fff55c2c5e2b7a6a943 [0,1,0,1,0,0|2,0,0]=4 6224 B13R1.718 CC[C@H](C)COC[C@@H]1CC=CCC1 2fae3a97ee2ea7fe27f8f4ca9c75a82a [0,1,0,1,0,0|2,0,0]=4 6225 B13R1.718 CC[C@H](C)COC[C@H]1CC=CCC1 7e3e674c2726541d12be033a7a0e5fba [0,1,0,1,0,0|2,0,0]=4 6226 B13R1.718 C[C@@H](CO)NCCC1CCCCC1 c306c71ebe5f7fcec87563275f191b20 [0,1,0,1,0,0|1,0,1]=4 6227 B13R1.718 C[C@H](CO)NCCC1CCCCC1 db6fde76fa0615699cb0f317f664229f [0,1,0,1,0,0|1,0,1]=4 6228 B13R1.718 O=C(CF)NCCC1CCCCC1 84a3fab0d6a7f15c20332e1245718355 [0,1,0,1,0,0|2,0,0]=4 6229 B13R1.718 O=C(CO)CNCC1CCCCC1 b520922cf58d5bf178eefa1b2dbe6f13 [0,1,0,1,0,0|1,0,1]=4 6230 B13R1.718 O=C(CO)NCCC1CCCCC1 9af9e1dfdeb542a46012504e4585fb25 [0,1,0,1,0,0|1,0,0]=3 6231 B13R1.718 O=C(CO)NCCC1CCCCO1 8c5193bb9f0d21ebc8fd73a02220ea14 [0,1,0,1,0,0|2,0,0]=4 6232 B13R1.718 O=C(CO)NCCC1CCCOC1 82e32fb6fd792b6380ce6eb10ff0cbb1 [0,1,0,1,0,0|2,0,0]=4 6233 B13R1.718 O=C(CO)NCCC1CCOCC1 b6a188b268f17569b8b66690b2bed6c7 [0,1,0,1,0,0|2,0,0]=4 6234 B13R1.718 O=C(CO)NCCC1CCSCC1 5b9b4e19f92e1bc07291e8f6e1929c26 [0,1,0,1,0,0|2,0,0]=4 6235 B13R1.718 O=C(CO)NCCN1CCCCC1 d5ad2c45bf2524b92c0957b4e33b53a6 [0,1,0,1,0,0|2,0,0]=4 6236 B13R1.718 O=C(CS)NCCC1CCCCC1 0354568d594ff1c7e0828f6620e12d2c [0,1,0,1,0,0|1,1,0]=4 6237 B13R1.1689 CC(CO)N1CCCCCCCC1 b375b4c18b260a9df173c75a085c0116 [0,1,0,1,0,0|1,0,1]=4 6238 B13R1.1689 CCC(=O)N1CCCCCCCC1 7d4dde5ba9065f555b25df273d7eeda0 [0,1,0,1,0,0|2,0,0]=4 6239 B13R1.1689 C[C@@H](CO)N1CCCCCCCC1 ca34842cf37eee5aebfa85cace6305df [0,1,0,1,0,0|1,0,1]=4 6240 B13R1.1689 C[C@H](CO)N1CCCCCCCC1 9afab610419f1a0de6d369f7db1ed0e0 [0,1,0,1,0,0|1,0,1]=4 6241 B13R1.1689 O=C(CF)N1CCCCCCCC1 606d596fd5128a2ac71c8bde692f9fbc [0,1,0,1,0,0|2,0,0]=4 6242 B13R1.1689 O=C(CO)N1CCCCCCCC1 691da00b5cd90950b10bfd5624b7c16f [0,1,0,1,0,0|1,0,0]=3 6243 B13R1.1689 O=C(CS)N1CCCCCCCC1 355e830ea9ee85ad3e779d5d6cc5f2c4 [0,1,0,1,0,0|1,1,0]=4 6244 B13R1.1711 C=C(CO)CNC1CCCCCC1 cefe9b866d0e2dd6eb33aaff2063464f [0,1,0,1,0,0|1,0,1]=4 6245 B13R1.1711 CC(CO)NCC1CCCCCC1 ba232a47839348c6c784325683a2a57e [0,1,0,1,0,0|1,0,1]=4 6246 B13R1.1711 CCC(=O)NCC1CCCCCC1 859e07a71e58618209b39a2dae6ff918 [0,1,0,1,0,0|2,0,0]=4 6247 B13R1.1711 CCC(C)CNC1CCC=CCC1 1599331b34142c062b61be867f0c6bf9 [0,1,0,1,0,0|2,0,0]=4 6248 B13R1.1711 CCC(O)CNC1CCC=CCC1 a7b926ec32ad99cd4f54189fc008e614 [0,1,0,1,0,0|2,0,0]=4 6249 B13R1.1711 CC[C@@H](C)CNC1CCC=CCC1 97ed6e0e3ee6688bf4dbdb8aade4072d [0,1,0,1,0,0|2,0,0]=4 6250 B13R1.1711 CC[C@H](C)CNC1CCC=CCC1 8535288def3f673a4fbe36626f4706eb [0,1,0,1,0,0|2,0,0]=4 6251 B13R1.1711 C[C@@H](CO)NCC1CCCCCC1 36edfb66250ed727d3edecfd4f093bc5 [0,1,0,1,0,0|1,0,1]=4 6252 B13R1.1711 C[C@H](CO)NCC1CCCCCC1 e0ba1761b5f04a933e7c0e5d1096ec51 [0,1,0,1,0,0|1,0,1]=4 6253 B13R1.1711 O=C(CF)NCC1CCCCCC1 ba2ae6feec9bd0387af584bd7fe097e9 [0,1,0,1,0,0|2,0,0]=4 6254 B13R1.1711 O=C(CO)CNC1CCCCCC1 d8ea6f3c52b0e34a8d8fdf6ef1c6bdc5 [0,1,0,1,0,0|1,0,1]=4 6255 B13R1.1711 O=C(CO)NCC1CCCCCC1 af259b7eb3df4f7e74f11c22b42e2a94 [0,1,0,1,0,0|1,0,0]=3 6256 B13R1.1711 O=C(CS)NCC1CCCCCC1 c9d6f8fd3e8ea5f3ac8d50c707fc322f [0,1,0,1,0,0|1,1,0]=4 6257 B13R1.1870 C=C(CO)CN1CCCCCCC1 c972abf751661e706ca336545636790b [0,1,0,1,0,0|1,0,1]=4 6258 B13R1.1870 CC(CO)NC1CCCCCCC1 8f0aa723b281cc1ccd8b0388710a4c03 [0,1,0,1,0,0|1,0,1]=4 6259 B13R1.1870 CCC(=O)NC1CCCCCCC1 a37ae918b6b43998214f68445fe9bcbe [0,1,0,1,0,0|2,0,0]=4 6260 B13R1.1870 CCC(C)NC1CC/C=C\CCC1 32d28dcf7bad25db330f8a4b1701c0cd [0,1,0,1,0,0|2,0,0]=4 6261 B13R1.1870 CCC(C)OC1CC/C=C/CCC1 f6ac3dfd7008d0aafa34cab4e071d2e5 [0,1,0,1,0,0|2,0,0]=4 6262 B13R1.1870 CCC(C)OC1CC/C=C\CCC1 446a74ca5beee2580cb9b23479e06be6 [0,1,0,1,0,0|2,0,0]=4 6263 B13R1.1870 CCC(C)OC1CCC=CCCC1 996b0c5d428ce783522d10241f6e7e0d [0,1,0,1,0,0|2,0,0]=4 6264 B13R1.1870 CCC(C)O[C@@H]1CCC=CCCC1 ba27b0897dde51bcb153702c6de39dbc [0,1,0,1,0,0|2,0,0]=4 6265 B13R1.1870 CC[C@@H](C)NC1CC/C=C\CCC1 54be0a541803e6a71bcf7b20819da692 [0,1,0,1,0,0|2,0,0]=4 6266 B13R1.1870 CC[C@@H](C)OC1CC/C=C\CCC1 7ccff94af554c7d21890596352061b6e [0,1,0,1,0,0|2,0,0]=4 6267 B13R1.1870 CC[C@H](C)NC1CC/C=C\CCC1 16a9ced668e3b9f28894a6af50cd8f15 [0,1,0,1,0,0|2,0,0]=4 6268 B13R1.1870 CC[C@H](C)OC1CC/C=C\CCC1 989aa9def4b85dc5a91b55a8aabcd5e5 [0,1,0,1,0,0|2,0,0]=4 6269 B13R1.1870 C[C@@H](CO)NC1CCCCCCC1 16c2b9e33f78424f6d3b9b0b3c4eee37 [0,1,0,1,0,0|1,0,1]=4 6270 B13R1.1870 C[C@H](CO)NC1CCCCCCC1 9f50cd78ff7d3c4ca2fa9dbaaf8e0fb2 [0,1,0,1,0,0|1,0,1]=4 6271 B13R1.1870 O=C(CF)NC1CCCCCCC1 dffd42a45938ad6ad3e5704759f48d23 [0,1,0,1,0,0|2,0,0]=4 6272 B13R1.1870 O=C(CO)CN1CCCCCCC1 0bc5ac610ed0d9e37c906f177a987c8b [0,1,0,1,0,0|1,0,1]=4 6273 B13R1.1870 O=C(CO)NC1CCCCCCC1 1b6fe7d3a6f038d14db621fc543dab0c [0,1,0,1,0,0|1,0,0]=3 6274 B13R1.1870 O=C(CS)NC1CCCCCCC1 dc00c0ebc5db6e8e0604fabe3c539b65 [0,1,0,1,0,0|1,1,0]=4 6275 B13R1.2938 CC/C=C\CCCOCC1(CC1)C 564d23094c04e53f615d2e7a01d86be0 [0,1,0,1,0,0|2,0,0]=4 6276 B13R1.2938 CC/C=C\CCCOCC1(CC1)F 7329f642d856f51d746ac49225d10e47 [0,1,0,1,0,0|2,0,0]=4 6277 B13R1.2938 CC/C=C\CCNCCC1(CC1)O b347ee40eccd011126c25a6748cf2d0b [0,1,0,1,0,0|2,0,0]=4 6278 B13R1.2938 CC/C=C\CCOCCC1(CC1)C 66bbe6c5bb2bfced061f7299806e7d55 [0,1,0,1,0,0|2,0,0]=4 6279 B13R1.3440 CC/C=C\CCN1CCC(C1C)O d02bf6d6440df5a4206d2abe743db645 [0,1,0,1,0,0|2,0,0]=4 6280 B13R1.3440 CC/C=C\CCN1CC[C@@H]([C@@H]1C)O 765eb2d4ee8d7dd88c06aee932fccb18 [0,1,0,1,0,0|2,0,0]=4 6281 B13R1.3440 CC/C=C\CCN1CC[C@H]([C@H]1C)O 0dd2c957cacb40ef3f0d282eddc3c808 [0,1,0,1,0,0|2,0,0]=4 6282 B13R2.1 OCCN1CCC2C1CCCC2 e7ab5ec21f0ea00ae279de67af1380c6 [0,0,0,2,0,0|1,0,1]=4 6283 B13R2.3 C1=CCN(CC1)C2CCCCC2 e99716786cca834c69a014f70432b8fa [0,0,0,2,0,0|2,0,0]=4 6284 B13R2.6 OCN1CCCC12CCCCC2 5842010d1cb7a0eb7e6bd18316a09be1 [0,0,0,2,0,0|1,0,1]=4 6285 B13R2.17 CC1CC1NCC2CC=CCC2 777ec46ade1a5609463fa661f45c6c8b [0,0,0,2,0,0|2,0,0]=4 6286 B13R2.20 OCCN1CCC12CCCCC2 abce309addeba31f5f94af4c656330ed [0,0,0,2,0,0|1,0,1]=4 6287 B13R2.40 OCNCC1CC12CCCCC2 dc896739dce90aca080813ecbc1a802e [0,0,0,2,0,0|1,0,1]=4 6288 B13R2.64 C1=CC(CC1)OC2CCCCC2 a09859877cb117b7f377a1fb80120cbe [0,0,0,2,0,0|2,0,0]=4 6289 B13R2.64 C1=CCC(CC1)OC2CCCC2 64b4f8feb33aafd5106616c5da632e5d [0,0,0,2,0,0|2,0,0]=4 6290 B13R2.64 C1=CCN(CC1)CC2CCCC2 3c006571af28cc5520bab3a39aaca5bd [0,0,0,2,0,0|2,0,0]=4 6291 B13R2.745 CC/C=C/COC1CC2CC2C1 21a3bb7d0008f08702603a1639b6e79f [0,0,0,2,0,0|2,0,0]=4 6292 B13R2.745 CC/C=C/COC1C[C@@H]2C[C@@H]2C1 e658da736510d4a842073c44166e5107 [0,0,0,2,0,0|2,0,0]=4 6293 B13R2.745 CC/C=C/CO[C@@H]1C[C@@H]2C[C@@H]2C1 8ef3b6c95b088216e6df5bf47feee4d7 [0,0,0,2,0,0|2,0,0]=4 6294 B13R2.745 CC/C=C/CO[C@H]1C[C@@H]2C[C@@H]2C1 15ed097eff50d03fdd632c3ee7af7879 [0,0,0,2,0,0|2,0,0]=4 6295 B13R2.745 CC/C=C\CCN1CC2CC2C1 94814a0439a1b55005e61ff856f5b7aa [0,0,0,2,0,0|2,0,0]=4 6296 B13R2.1234 CC/C=C\CCN1C2C1CCC2 a4d8c2a050d416fc718c5083c3f1da5e [0,0,0,2,0,0|2,0,0]=4 6297 B13R2.1613 OCN1CCCC2C1CCCC2 3ab6e7b81bef1662dfcf64b8e0fff4d2 [0,0,0,2,0,0|1,0,1]=4 6298 B13R2.1613 OCN1CCC[C@@H]2[C@@H]1CCCC2 c86c68049051f8c01a1fb21bc5358573 [0,0,0,2,0,0|1,0,1]=4 6299 B13R2.1613 OCN1CCC[C@@H]2[C@H]1CCCC2 77030cba9d4b13a8e43cae5f2bf70789 [0,0,0,2,0,0|1,0,1]=4 6300 B13R2.2382 C1=CCC(CC1)CNCC2CC2 d5cff5667971c8f7a54ff9368d5dc1f3 [0,0,0,2,0,0|2,0,0]=4 6301 B13R2.2382 C1=CCC(CC1)COCC2CC2 894dc24caa8239e8d43f9fd07bd1dcf1 [0,0,0,2,0,0|2,0,0]=4 6302 B13R2.2382 C1=CCC(CC1)OCCC2CC2 ccd40c087573befbb0f57ffb95d6ea59 [0,0,0,2,0,0|2,0,0]=4 6303 B13R2.2382 C1=CC[C@@H](CC1)COCC2CC2 8de4d8443c3fb26fb0d38bb89a370b91 [0,0,0,2,0,0|2,0,0]=4 6304 B13R2.2382 C1=CC[C@H](CC1)COCC2CC2 34487c4e0fb40405e09969bce8dfa402 [0,0,0,2,0,0|2,0,0]=4 6305 B13R2.2383 C1=CCC(CC1)CNC2CCC2 6fa53914e85852a8c3cda60c6ad1e164 [0,0,0,2,0,0|2,0,0]=4 6306 B13R2.2383 C1=CCC(CC1)COC2CCC2 c3e800d9fb33b0c8aeda5a3c1e5cc744 [0,0,0,2,0,0|2,0,0]=4 6307 B13R2.2383 C1=CCC(CC1)OCC2CCC2 13b599c27adf2573e770e46ebf37edf8 [0,0,0,2,0,0|2,0,0]=4 6308 B13R2.2383 C1=CCN(CC1)CCC2CCC2 5d996c88a6bf8734ee63b2fb55d40d3f [0,0,0,2,0,0|2,0,0]=4 6309 B13R2.2383 C1=CC[C@@H](CC1)COC2CCC2 eff9013a7dfa1cf07828353a1d19409a [0,0,0,2,0,0|2,0,0]=4 6310 B13R2.2383 C1=CC[C@H](CC1)COC2CCC2 8060439f4bc036c166a010c8e9961ff1 [0,0,0,2,0,0|2,0,0]=4 6311 B13R2.2388 CC/C=C/CN1C2CCC1CC2 39c22bf439e3ef0dc1f64c1855c0408a [0,0,0,2,0,0|2,0,0]=4 6312 B13R2.2388 CC/C=C/CN1[C@H]2CC[C@@H]1CC2 c016bde5575eff65bf1cb7be6b281a4a [0,0,0,2,0,0|2,0,0]=4 6313 B13R2.3194 CC/C=C/COC1CCC2C1C2 d21584c8f87d7919fd884631cb87744c [0,0,0,2,0,0|2,0,0]=4 6314 B13R2.3194 CC/C=C/CO[C@@H]1CC[C@@H]2[C@H]1C2 354812f8368dd1abd8cb3b1c0b8340d8 [0,0,0,2,0,0|2,0,0]=4 6315 B13R2.3194 CC/C=C\CCN1CCC2C1C2 73ba4c85d8d2032a003d56b4047a38fa [0,0,0,2,0,0|2,0,0]=4 6316 B13R2.7978 CC/C=C/CN1C2C1CCCC2 9c1ae283e75056e65bcfc27160b00122 [0,0,0,2,0,0|2,0,0]=4 6317 B13R2.5 OCN1CCCCC12CCCC2 e865e6c8ac2d25d39cde1aed5607a632 [0,0,0,2,0,0|1,0,1]=4 6318 B13R2.37 OCCN1CCCC12CCCC2 0cb04e990fb399286dbb884695a97e3c [0,0,0,2,0,0|1,0,1]=4 6319 B13R2.39 OCCNC1CCC12CCCC2 d8de156fc5d2709d94136ffe28424ebb [0,0,0,2,0,0|1,0,1]=4 6320 B13R2.61 OCN1CCCC1C2CCCC2 01e3ae2b2484b374ce1630d525db1fcb [0,0,0,2,0,0|1,0,1]=4 6321 B13R2.183 C1=CC(CC1)COC2CCCC2 7f0380da20341275f000d8f78d185200 [0,0,0,2,0,0|2,0,0]=4 6322 B13R2.183 C1=CC(CC1)OCC2CCCC2 52af792bd6a354f87b24abbdb7620d6c [0,0,0,2,0,0|2,0,0]=4 6323 B13R2.292 OCCN1CCCC2C1CCC2 3b8dd7521ec4d47c485caeb637c5bd3f [0,0,0,2,0,0|1,0,1]=4 6324 B13R2.468 OCCN[C@@H]1CC[C@@H]2[C@H]1CCC2 afd46909d918571def4ec6766087c21c [0,0,0,2,0,0|1,0,1]=4 6325 B13R2.468 OCCN[C@H]1CC[C@H]2[C@@H]1CCC2 7d8e68fdf6aa2b2aac9ce789fa7eed49 [0,0,0,2,0,0|1,0,1]=4 6326 B13R2.701 CC/C=C/CN1CC2C1CCC2 765a3b381167260cabb71c944be1ebd6 [0,0,0,2,0,0|2,0,0]=4 6327 B13R2.701 CC/C=C/CN1C[C@H]2[C@@H]1CCC2 0fb51b1b1686ce0eb4865610a54a730b [0,0,0,2,0,0|2,0,0]=4 6328 B13R2.2181 CC/C=C/COCC12CCC1C2 2f5bf81606ab68860e6a2f26502c0d84 [0,0,0,2,0,0|2,0,0]=4 6329 B13R2.2380 C1=CC(CC1)COCCC2CC2 d364295fa26bb8ce3b818e244955b8da [0,0,0,2,0,0|2,0,0]=4 6330 B13R2.2381 C1=CC(CC1)COCC2CCC2 5946124bea242a9b415ec22035879b29 [0,0,0,2,0,0|2,0,0]=4 6331 B13R2.2381 C1=CC(CC1)OCCC2CCC2 dc7157ddacdb876ac0f7147f39054597 [0,0,0,2,0,0|2,0,0]=4 6332 B13R2.2520 CC/C=C/CN1CC2CCC1C2 ea12826656168a39bfcddc078d373a53 [0,0,0,2,0,0|2,0,0]=4 6333 B13R2.2520 CC/C=C/CN1C[C@@H]2CC[C@H]1C2 e23d817bc1d234284e18d318f852a7b5 [0,0,0,2,0,0|2,0,0]=4 6334 B13R2.2520 CC/C=C/CN1C[C@H]2CC[C@@H]1C2 1123a7d64e0f76cda9c0707580d90654 [0,0,0,2,0,0|2,0,0]=4 6335 B13R2.2520 CCCCCN1CC2C=CC1C2 f721b40bb76980168e59bfa2a7084407 [0,0,0,2,0,0|2,0,0]=4 6336 B13R2.2520 CCCCCN1C[C@H]2C=C[C@@H]1C2 95b2036c034a0721dc0f372c2023259f [0,0,0,2,0,0|2,0,0]=4 6337 B13R2.2520 CCCCNC1CC2C=CC1C2 c521768c708838cefac73985ebcc928f [0,0,0,2,0,0|2,0,0]=4 6338 B13R2.2520 CCCCNC1C[C@H]2C=C[C@@H]1C2 03f68e51d1dbe3ba32ca4a5085f90228 [0,0,0,2,0,0|2,0,0]=4 6339 B13R2.2520 CCCCOC1CC2C=CC1C2 67e9b0c698f4e3cad648a4a775457fdf [0,0,0,2,0,0|2,0,0]=4 6340 B13R2.2520 CCCCOC1C[C@H]2C=C[C@@H]1C2 466bb08b76fb67489879d5fb6ac16d09 [0,0,0,2,0,0|2,0,0]=4 6341 B13R2.2520 CCCNCC1CC2C=CC1C2 5586f223ca7d7836e5023855dbac8f35 [0,0,0,2,0,0|2,0,0]=4 6342 B13R2.2520 CCCNCC1C[C@@H]2C=C[C@H]1C2 85106ebeb4d2c61f65dd8473c3734ae7 [0,0,0,2,0,0|2,0,0]=4 6343 B13R2.2520 CCCOCC1CC2C=CC1C2 400abd3ec7ad27e0cb7d916e39afda5d [0,0,0,2,0,0|2,0,0]=4 6344 B13R2.2520 CCCOCC1C[C@H]2C=C[C@@H]1C2 81ff8a5dd5c470cc13f83b252df7fc44 [0,0,0,2,0,0|2,0,0]=4 6345 B13R2.2520 CCCOCC1C[C@H]2C=C[C@H]1C2 8f5c78ed8ecc4ad0b5f2664210d4327e [0,0,0,2,0,0|2,0,0]=4 6346 B13R2.2520 CCCOC[C@@H]1C[C@@H]2C=C[C@H]1C2 0bb43c1e1be4dd2de1d5a64114f9c8fd [0,0,0,2,0,0|2,0,0]=4 6347 B13R2.2520 CCNCC[C@@H]1C[C@@H]2C=C[C@H]1C2 6e8b032ddeb161104be094e63955a08c [0,0,0,2,0,0|2,0,0]=4 6348 B13R2.2520 OCCNCC1CC2CCC1C2 74b6d9f68b27238dc25fa33374a855e4 [0,0,0,2,0,0|1,0,1]=4 6349 B13R2.2520 OCNCCC1CC2CCC1C2 5aa314e0e1c65da31b5811ea9c1157b2 [0,0,0,2,0,0|1,0,1]=4 6350 B13R2.449 OCCN1CC[C@H]2CCC[C@H]2C1 8d060c5c018124a83de64f04ffda9423 [0,0,0,2,0,0|1,0,1]=4 6351 B13R2.57 OCN1CCC2CCCCC2C1 52b0d2853fe76db6e99a777cfa8d395b [0,0,0,2,0,0|1,0,1]=4 6352 B13R2.57 OCN1CC[C@@H]2CCCC[C@@H]2C1 7323a58a41418b384d65d4a4600c1dbb [0,0,0,2,0,0|1,0,1]=4 6353 B13R2.57 OCN1CC[C@H]2CCCC[C@H]2C1 f0966ac7e39769a89a891741241f062a [0,0,0,2,0,0|1,0,1]=4 6354 B13R2.539 OCCNC1CCCCC12CC2 486ac5998930d05d69302cccbae8bfe2 [0,0,0,2,0,0|1,0,1]=4 6355 B13R2.4079 OCCN1[C@H]2CCC[C@@H]1CCC2 a3e28dc27ccdbce289aaba92adf30381 [0,0,0,2,0,0|1,0,1]=4 6356 B13R2.26 OCCN1CC2CCCCC2C1 289eeaf97b3d2add558417612d267fdd [0,0,0,2,0,0|1,0,1]=4 6357 B13R2.26 OCCN1C[C@H]2CCCC[C@H]2C1 dab06b3e6ee8ebdbe7c191174408ace3 [0,0,0,2,0,0|1,0,1]=4 6358 B13R2.2188 CC/C=C/CN1CCC2CC2C1 f2b3889d098df9beb559aed6cdf01946 [0,0,0,2,0,0|2,0,0]=4 6359 B13R2.3410 CC1CC1NCCCC=C2CC2 9115b162f0448be21117805bf499f3b8 [0,0,0,2,0,0|2,0,0]=4 6360 B13R2.1227 CC/C=C\CCN1CC2CC1C2 95b53a989ef97618f8cf54cbc8e6f294 [0,0,0,2,0,0|2,0,0]=4 6361 B13R2.3159 C(=C1CC1)CCCNC2CCC2 163d1adfdb9809e8a0ea4ad85d494db7 [0,0,0,2,0,0|2,0,0]=4 6362 B13R2.3159 C(=C1CC1)CCCOC2CCC2 2286e40f9f9e24dccd13b9281abf72bb [0,0,0,2,0,0|2,0,0]=4 6363 B13R2.5731 CC/C=C/COC1CC12CCC2 cef8a8d73fdc4f7f9e518cf7f943dc32 [0,0,0,2,0,0|2,0,0]=4 6364 B13R2.5731 CC/C=C\COC1CC12CCC2 900e22e290e8f206e611a2062aeb28bf [0,0,0,2,0,0|2,0,0]=4 6365 B13R2.6840 C1=CCCC(CC1)NC2CCC2 cc43a52d28ff22d59a454d127a37e6cc [0,0,0,2,0,0|2,0,0]=4 6366 B13R2.6844 C\1=C\CCC(CCC1)N2CCC2 519b4061b396a08e95e1d91ca7e08c11 [0,0,0,2,0,0|2,0,0]=4 6367 B13R2.472 OCCNC1CCC2CC2CC1 28864f4a8f5e6ab6f59134840c1141f2 [0,0,0,2,0,0|1,0,1]=4 6368 B13R2.6839 C1=CCCC(CCC1)OC2CC2 8d9d0c779b908c123cca772240cea8f9 [0,0,0,2,0,0|2,0,0]=4 6369 B13R2.6839 C1=CCC[C@H](CCC1)OC2CC2 3329355608cd9bc803af2c22a3c23174 [0,0,0,2,0,0|2,0,0]=4 6370 B13R2.6839 C\1=C/CCC(CCC1)OC2CC2 52d6e29c23c43816976385eb0ee58c21 [0,0,0,2,0,0|2,0,0]=4 6371 B13R2.6839 C\1=C\CCC(CCC1)NC2CC2 17296f6463021b7dbe8bc0a40e7097d1 [0,0,0,2,0,0|2,0,0]=4 6372 B13R2.6839 C\1=C\CCC(CCC1)OC2CC2 63b50f28e905ab064d836d8ee1aa7779 [0,0,0,2,0,0|2,0,0]=4 6373 B13R2.2994 CC/C=C/COC1CCC12CC2 594400b1d4ee2bad0f959d018e2418c6 [0,0,0,2,0,0|2,0,0]=4 6374 B13R2.2180 CC/C=C/COCC1CC12CC2 0bd770a780b7215f264dc02574407db7 [0,0,0,2,0,0|2,0,0]=4 6375 B13R2.2180 CC/C=C\COCC1CC12CC2 ffefa8525c7d4aae95cefc1e0a565791 [0,0,0,2,0,0|2,0,0]=4 6376 B13R2.2290 C(=C1CC1)CCCNCC2CC2 6a61984bddfb875fcbc4ee9dde79062c [0,0,0,2,0,0|2,0,0]=4 6377 B13R2.2290 C(=C1CC1)CCCOCC2CC2 b8f7c5966c6ba4dbacb8b2b4a32c5923 [0,0,0,2,0,0|2,0,0]=4 6378 B13R2.6841 C1=CCCC(CC1)NCC2CC2 b249f704e46f33aae4f0a57a5c286281 [0,0,0,2,0,0|2,0,0]=4 6379 B13R2.2514 CC/C=C/CN1CC2CCC2C1 900f3c45272eb21d33e2e3766584fb28 [0,0,0,2,0,0|2,0,0]=4