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O=CN[C@@H]1CCC(=O)NC1 9847345e966f9edf97f6cc4338684cd6 [0,1,0,0,0,0|2,0,1]=4 111 B10R1.1 O=CN[C@H]1CCC(=O)NC1 4370ca681341305b2f814da5310d1c7d [0,1,0,0,0,0|2,0,1]=4 112 B10R1.1 O=CN[C@H]1CC[C@@H](CC1)Cl 464f7c9c757bbf4b5094a995c3936139 [0,1,0,0,0,0|1,0,0]=2 113 B10R1.1 O=CN[C@H]1CC[C@@H](CC1)O d6c30b9eedd638affbdd8dbfa14d3532 [0,1,0,0,0,0|1,0,0]=2 114 B10R1.1 O=CN[C@H]1CC[C@H](CC1)Cl a2d2eb6869558ffb8e8c032c7ca77b62 [0,1,0,0,0,0|1,0,0]=2 115 B10R1.1 O=CN[C@H]1CC[C@H](CC1)O 69d43dcd77798c743c4f1d4468f85616 [0,1,0,0,0,0|1,0,0]=2 116 B10R1.1 OC1CCC(CC1)NCF 173941c078315b0b62a125e136946135 [0,1,0,0,0,0|2,0,1]=4 117 B10R1.1 OCNC1CCC(CC1)Cl 14ddfd4e42c900b9ccebe27362de4ea8 [0,1,0,0,0,0|1,0,2]=4 118 B10R1.1 OCNC1CCC(CC1)O 563a1e3160aa08d43754abf204c4f93b [0,1,0,0,0,0|1,0,2]=4 119 B10R1.1 OCN[C@H]1CC[C@@H](CC1)Cl fb81ad86a8c3425c2ad2f852061d9cbf [0,1,0,0,0,0|1,0,2]=4 120 B10R1.1 OCN[C@H]1CC[C@@H](CC1)O 72a8642bbc5861441fdeacab8df3982d [0,1,0,0,0,0|1,0,2]=4 121 B10R1.1 OCN[C@H]1CC[C@H](CC1)Cl dc9b9015a4f0d208329ff7ed4eb4384a [0,1,0,0,0,0|1,0,2]=4 122 B10R1.1 OCN[C@H]1CC[C@H](CC1)O f2d05954ab0e7cc9388ae785a7ea5f83 [0,1,0,0,0,0|1,0,2]=4 123 B10R1.1 O[C@H]1CC[C@@H](CC1)NCF 1a1bb6ed9b17af03c027aaa18f7571d4 [0,1,0,0,0,0|2,0,1]=4 124 B10R1.1 O[C@H]1CC[C@H](CC1)NCF c823bb0f45c2feefcd322eefe5192838 [0,1,0,0,0,0|2,0,1]=4 125 B10R1.4 C=CCN1CCCCC1C da41b4be3a80a7e44cf967326b087219 [0,1,0,0,0,0|3,0,0]=4 126 B10R1.4 C=CCN1CCCC[C@@H]1C c52ed1f4b4871d94ee71015af59b5b20 [0,1,0,0,0,0|3,0,0]=4 127 B10R1.4 C=CCN1CCCC[C@H]1C 8ca0a1913c3b1d54079130b87b47e568 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.4 CC1CCCCC1NC=O 4fd9fa7a65ca398ed79f81ac509c8018 [0,1,0,0,0,0|1,0,0]=2 129 B10R1.4 CC1CCCCC1NCF c203a73038ae4c8562b3e3f4f4e7597a [0,1,0,0,0,0|2,0,1]=4 130 B10R1.4 CC1CCCCC1NCO 0e3762ab7ee63ac783585aca2f7ed5e4 [0,1,0,0,0,0|1,0,2]=4 131 B10R1.4 CC1CCCCC1OCF c019e894d67eaa147137c1ce65162cdf [0,1,0,0,0,0|1,0,1]=3 132 B10R1.4 CC1CCCCN1CC=O 62c0bbb8af52ea1fa506ef64adafd791 [0,1,0,0,0,0|2,0,0]=3 133 B10R1.4 CC1COCCC1NC=O 2f51139ff2cf0ebede7d7b0028173a2e [0,1,0,0,0,0|2,0,0]=3 134 B10R1.4 CC1COCCC1OCF 2cb07ab3f42ff5b75f05d30a7361e5f9 [0,1,0,0,0,0|2,0,1]=4 135 B10R1.4 CC1COCCN1CC=O c485fb8942bd67c219c356f61506ec71 [0,1,0,0,0,0|3,0,0]=4 136 B10R1.4 CCNC1CCCCC1C 0a6a67710a04d0a4019e93d8f358beef [0,1,0,0,0,0|2,0,1]=4 137 B10R1.4 CCNC1CCCCC1O cab70b0d7048631dfdcbfe71841f0fdb [0,1,0,0,0,0|2,0,1]=4 138 B10R1.4 CCN[C@@H]1CCCC[C@@H]1C e1838a3dfce1be8774030cb38cadc8a8 [0,1,0,0,0,0|2,0,1]=4 139 B10R1.4 CCN[C@@H]1CCCC[C@H]1C 615764c975ae11d6bfe89a970bd051eb [0,1,0,0,0,0|2,0,1]=4 140 B10R1.4 CCN[C@@H]1CCCC[C@H]1O 3560f2039731995ef233caf22329f344 [0,1,0,0,0,0|2,0,1]=4 141 B10R1.4 CCN[C@H]1CCCC[C@@H]1C be0f57ee3e667adc7604c643c6c81280 [0,1,0,0,0,0|2,0,1]=4 142 B10R1.4 CCN[C@H]1CCCC[C@@H]1O f5999981aedc57da02406a7fea523d0c [0,1,0,0,0,0|2,0,1]=4 143 B10R1.4 CCN[C@H]1CCCC[C@H]1C fc338e738c022c0d4e1728f6dd42fc12 [0,1,0,0,0,0|2,0,1]=4 144 B10R1.4 CCN[C@H]1CCCC[C@H]1O 82496c56f17d72e49ca2b5b4b02bb9b0 [0,1,0,0,0,0|2,0,1]=4 145 B10R1.4 CCOC1CCCCC1=O 507ef4f19e89191dc15f42fb27f687ef [0,1,0,0,0,0|1,0,2]=4 146 B10R1.4 CCOC1CCCCC1C 98a98ba096ca8cc7e27c67a7da40ad7b [0,1,0,0,0,0|1,0,1]=3 147 B10R1.4 CCOC1CCCCC1F 079d4f9d37c5ce8da3be8df805e7ccac [0,1,0,0,0,0|1,0,1]=3 148 B10R1.4 CCOC1CCOCC1C 4465e9ba3cf6422ff58321c48dabda27 [0,1,0,0,0,0|2,0,1]=4 149 B10R1.4 CCOC1CCOCC1F 67769755b2a427354a2f86f3b75f1221 [0,1,0,0,0,0|2,0,1]=4 150 B10R1.4 CCO[C@@H]1CCCC[C@@H]1C 83d8c0bfbcf5371da8c218bad9c586f9 [0,1,0,0,0,0|1,0,1]=3 151 B10R1.4 CCO[C@@H]1CCCC[C@H]1F b305ec38a4fc4688a7a568327f40ca75 [0,1,0,0,0,0|1,0,1]=3 152 B10R1.4 CCO[C@@H]1CCOC[C@@H]1F ccd9c7909d0eeae93c06bc3d92f2d3a1 [0,1,0,0,0,0|2,0,1]=4 153 B10R1.4 CCO[C@H]1CCCC[C@@H]1C ec4e8495974299370fc90a30a76e8186 [0,1,0,0,0,0|1,0,1]=3 154 B10R1.4 CCO[C@H]1CCCC[C@H]1C 4418bd5b72dfb837aa581fefe48f6627 [0,1,0,0,0,0|1,0,1]=3 155 B10R1.4 CCO[C@H]1CCOC[C@@H]1F 500c7a21191ef6ae51d3245c909a0ba2 [0,1,0,0,0,0|2,0,1]=4 156 B10R1.4 CCO[C@H]1CCOC[C@H]1F d900847b430c19eee2d9940e18b30f8a [0,1,0,0,0,0|2,0,1]=4 157 B10R1.4 C[C@@H]1CCCCN1CC=O 814ac02c18c447f025bc8aee73a1045b [0,1,0,0,0,0|2,0,0]=3 158 B10R1.4 C[C@@H]1CCCC[C@@H]1NC#N 706e4f296e0b1f4d05ae47c7dadff869 [0,1,0,0,0,0|2,0,1]=4 159 B10R1.4 C[C@@H]1CCCC[C@@H]1NC=O cdefab676ed956f0f985e780591b60ff [0,1,0,0,0,0|1,0,0]=2 160 B10R1.4 C[C@@H]1CCCC[C@@H]1NCF 6832fb905fd4eedd8b65eba105fed913 [0,1,0,0,0,0|2,0,1]=4 161 B10R1.4 C[C@@H]1CCCC[C@@H]1NCO a4d87bc2ba663c2c22190ee043a4215e [0,1,0,0,0,0|1,0,2]=4 162 B10R1.4 C[C@@H]1CCCC[C@@H]1OCF e6622b115f3f5e4b50d4679b00ee05c9 [0,1,0,0,0,0|1,0,1]=3 163 B10R1.4 C[C@@H]1CCCC[C@H]1NC=O f829a42871a4ab0b9776c06cd36de92b [0,1,0,0,0,0|1,0,0]=2 164 B10R1.4 C[C@@H]1CCCC[C@H]1NCF c87f9c730f9d0b0e5088a02ac21728b6 [0,1,0,0,0,0|2,0,1]=4 165 B10R1.4 C[C@@H]1CCCC[C@H]1NCO 56b4e705fd3b60b2a3c805aa24d7fe72 [0,1,0,0,0,0|1,0,2]=4 166 B10R1.4 C[C@@H]1COCCN1CC=O 74fb3ad857d8c31265ce250caa1137a1 [0,1,0,0,0,0|3,0,0]=4 167 B10R1.4 C[C@@H]1COCC[C@@H]1NC=O f613fcb1f0d6a78255ce26c87f49227f [0,1,0,0,0,0|2,0,0]=3 168 B10R1.4 C[C@H]1CCCCN1CC=O 6f5ce6f7d96182cae349a65a68bdd503 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.4 C[C@H]1CCCC[C@@H]1NC=O 6df21a0e3e8e89c2bca8e0d82625af9a [0,1,0,0,0,0|1,0,0]=2 170 B10R1.4 C[C@H]1CCCC[C@@H]1NCF 6e9a6379be28e88d50fc87d2047af611 [0,1,0,0,0,0|2,0,1]=4 171 B10R1.4 C[C@H]1CCCC[C@@H]1NCO 9d6cffdfc5461680a7cea39bff264e8c [0,1,0,0,0,0|1,0,2]=4 172 B10R1.4 C[C@H]1CCCC[C@@H]1OCF b3be85fd90b5dac4d2f889f15d005f32 [0,1,0,0,0,0|1,0,1]=3 173 B10R1.4 C[C@H]1CCCC[C@H]1NC=O 19f2468f008fbcdafda27b73fe3a043b [0,1,0,0,0,0|1,0,0]=2 174 B10R1.4 C[C@H]1CCCC[C@H]1NCF c6a75ed3985b8d13901e64c1a3b1e927 [0,1,0,0,0,0|2,0,1]=4 175 B10R1.4 C[C@H]1CCCC[C@H]1NCO d35300c898e379f4d6863cf745c3f218 [0,1,0,0,0,0|1,0,2]=4 176 B10R1.4 C[C@H]1CCCC[C@H]1OCF 203bd5f17e23a87bab63c93749399803 [0,1,0,0,0,0|1,0,1]=3 177 B10R1.4 C[C@H]1COCCN1CC=O d46688eae822bc3347294045117cf2b9 [0,1,0,0,0,0|3,0,0]=4 178 B10R1.4 C[C@H]1COCC[C@H]1NC=O 3b7059746f26d4957fc75c154d87da13 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.4 FCOC1CCCCC1F 27ad66f283b44033373741514effc477 [0,1,0,0,0,0|1,0,1]=3 180 B10R1.4 FCOC1CCOCC1F ae019f3aabd6ac51f4476cfa1be51fe1 [0,1,0,0,0,0|2,0,1]=4 181 B10R1.4 FCO[C@@H]1CCCC[C@H]1F 7b32a8eb4786d082c22c7e9938197fbc [0,1,0,0,0,0|1,0,1]=3 182 B10R1.4 FCO[C@@H]1CCOC[C@@H]1F 46af6f110b96673b6e8e87a3e49e06c1 [0,1,0,0,0,0|2,0,1]=4 183 B10R1.4 FCO[C@H]1CCOC[C@@H]1F 761e2eb3d673ccc8e9d867b469c52446 [0,1,0,0,0,0|2,0,1]=4 184 B10R1.4 FCO[C@H]1CCOC[C@H]1F 6a8376aaf54a2d021ec79eafde956213 [0,1,0,0,0,0|2,0,1]=4 185 B10R1.4 N#CNC1CCCCC1F e341391be56dfb6a51d46f15056d4d94 [0,1,0,0,0,0|2,0,1]=4 186 B10R1.4 N#CNC1CCCCC1O 9dca53906ca1277fed23ec8e1c7b0d92 [0,1,0,0,0,0|2,0,1]=4 187 B10R1.4 N#CN[C@H]1CCCC[C@@H]1O 138b381def81641166e1a0f3dfd6e817 [0,1,0,0,0,0|2,0,1]=4 188 B10R1.4 O=C1CCCCC1OCF 935910af5320d7ec6c2da0e4043d7c6e [0,1,0,0,0,0|1,0,2]=4 189 B10R1.4 O=CNC1CCCCC1O 46bda5886d88e8065e368663d2c5be75 [0,1,0,0,0,0|1,0,0]=2 190 B10R1.4 O=CNC1CCCNC1=O f6da1c43bc5339f63cfaf3dde1207f77 [0,1,0,0,0,0|2,0,1]=4 191 B10R1.4 O=CNC1CCOCC1O 246d786b36731d7c51ccfadeb3a1c9af [0,1,0,0,0,0|2,0,0]=3 192 B10R1.4 O=CN[C@@H]1CCCC[C@H]1O 9d71346f39b74c0cfa11467ab3235ecb [0,1,0,0,0,0|1,0,0]=2 193 B10R1.4 O=CN[C@@H]1CCCNC1=O d36bb1e3b45a60044b3e2d218ef043dc [0,1,0,0,0,0|2,0,1]=4 194 B10R1.4 O=CN[C@@H]1CCOC[C@@H]1O cbf246cb1972690c8b54600ab89aeda9 [0,1,0,0,0,0|2,0,0]=3 195 B10R1.4 O=CN[C@@H]1CCOC[C@H]1F 9f7eac65772ad2f60f58d978542871cc [0,1,0,0,0,0|2,0,0]=3 196 B10R1.4 O=CN[C@@H]1CCOC[C@H]1O 910a06c9853ca83c178fb7af66b6041a [0,1,0,0,0,0|2,0,0]=3 197 B10R1.4 O=CN[C@@H]1COCC[C@@H]1O 9e6969a9f7c0dbe858af40b76d840a5c [0,1,0,0,0,0|2,0,0]=3 198 B10R1.4 O=CN[C@@H]1COCC[C@H]1O 13adbf2a194ca8b95e2bcd23a8474329 [0,1,0,0,0,0|2,0,0]=3 199 B10R1.4 O=CN[C@H]1CCCC[C@@H]1O ce7a4a88b8ea8da974f5fc6ab27eddb1 [0,1,0,0,0,0|1,0,0]=2 200 B10R1.4 O=CN[C@H]1CCCC[C@H]1O dc7e156f231681c664af73762de81a75 [0,1,0,0,0,0|1,0,0]=2 201 B10R1.4 O=CN[C@H]1CCCNC1=O 682fc0196eae394c213d9a64f5b4cf6e [0,1,0,0,0,0|2,0,1]=4 202 B10R1.4 O=CN[C@H]1CCOC[C@@H]1F ec042a9d7324c15237f31596caf874db [0,1,0,0,0,0|2,0,0]=3 203 B10R1.4 O=CN[C@H]1CCOC[C@@H]1O 58622511a1aa1fe4244dbb18789c04d7 [0,1,0,0,0,0|2,0,0]=3 204 B10R1.4 O=CN[C@H]1CCOC[C@H]1O 4b4ef1434ab78d2fe5f5dc0bd83b2d88 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.4 O=CN[C@H]1COCC[C@@H]1O 0f039aebf149a7a6422336bafc0a6e1e [0,1,0,0,0,0|2,0,0]=3 206 B10R1.4 O=CN[C@H]1COCC[C@H]1O 4d9e5bb3092df038627ab9a4d2705922 [0,1,0,0,0,0|2,0,0]=3 207 B10R1.4 OC1CCCCC1NCF 92a08a2ba7260b2aa796de00448fb00c [0,1,0,0,0,0|2,0,1]=4 208 B10R1.4 OCNC1CCCCC1O 595b745144ff32eb590c970e40514cda [0,1,0,0,0,0|1,0,2]=4 209 B10R1.4 OCN[C@@H]1CCCC[C@H]1O 6f8ac798d0a969431a848e04db98f6eb [0,1,0,0,0,0|1,0,2]=4 210 B10R1.4 OCN[C@H]1CCCC[C@@H]1O 28c1c80a9faf75b65a89e1aae68beb6c [0,1,0,0,0,0|1,0,2]=4 211 B10R1.4 OCN[C@H]1CCCC[C@H]1O 8feedab2a6b93345f6e579047afc214b [0,1,0,0,0,0|1,0,2]=4 212 B10R1.4 O[C@@H]1CCCC[C@@H]1NCF 1c93d3ea5e453430a5825eb1b465d604 [0,1,0,0,0,0|2,0,1]=4 213 B10R1.4 O[C@@H]1CCCC[C@H]1NCF c4bdacda855850fa04c675ba4822417d [0,1,0,0,0,0|2,0,1]=4 214 B10R1.4 O[C@H]1CCCC[C@@H]1NCF 8030dca2dfbd9539f39e785dcc2baee6 [0,1,0,0,0,0|2,0,1]=4 215 B10R1.10 C=CCN1CCCC(C1)C ec067262f3f4afde97dcd22b3b2f0ea0 [0,1,0,0,0,0|3,0,0]=4 216 B10R1.10 C=CCN1CCCC(C1)F a2059e386fb62701294c598446fd6288 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.10 C=CCN1CCCC(C1)O e7ba19e8b4b634b6e8b2ac154e605a8e [0,1,0,0,0,0|3,0,0]=4 218 B10R1.10 C=CCN1CCC[C@@H](C1)C ea65ec47e239ecd79f6d4c8b23f87f01 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.10 C=CCN1CCC[C@@H](C1)F 8ca33a2858263ae38e882e342881335c [0,1,0,0,0,0|3,0,0]=4 220 B10R1.10 C=CCN1CCC[C@@H](C1)O 6e9f39d83c24811743db0d05b8dc63e2 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.10 C=CCN1CCC[C@H](C1)C c777c0295f899c88258a9ce18d129edf [0,1,0,0,0,0|3,0,0]=4 222 B10R1.10 C=CCN1CCC[C@H](C1)F 1313f5d2c5cc380535e35d2335a595ea [0,1,0,0,0,0|3,0,0]=4 223 B10R1.10 C=CCN1CCC[C@H](C1)O bcb3c96d074c13c106ca9a25d8c4a6b4 [0,1,0,0,0,0|3,0,0]=4 224 B10R1.10 CC1CC(CCO1)NC=O c7bcfd7524476396c24b1f526ff5629c [0,1,0,0,0,0|2,0,0]=3 225 B10R1.10 CC1CC(CCO1)OCF 23db4e2e87cff1a153177f6d9328446a [0,1,0,0,0,0|2,0,1]=4 226 B10R1.10 CC1CCCC(C1)NC=O a17cbd4e3036778885ce3068174816a1 [0,1,0,0,0,0|1,0,0]=2 227 B10R1.10 CC1CCCC(C1)NCF 3a585411dc52b2db016103bbb5bbb45f [0,1,0,0,0,0|2,0,1]=4 228 B10R1.10 CC1CCCC(C1)NCO 5b990827fa9fea6446790d320ee857b3 [0,1,0,0,0,0|1,0,2]=4 229 B10R1.10 CC1CCCC(C1)OCF ee42c01f55e35e9a46ba40b0962955f9 [0,1,0,0,0,0|1,0,1]=3 230 B10R1.10 CC1CCCN(C1)CC=O d9fa3f7f2e4956f00565cdd1d0a6c0b8 [0,1,0,0,0,0|2,0,0]=3 231 B10R1.10 CC1CN(CCO1)CC=O 602ff319c6f01c1227f58f2744b59224 [0,1,0,0,0,0|3,0,0]=4 232 B10R1.10 CCNC1CCCC(C1)C 77f1f79b4adaf95ab4b9ef12620388b0 [0,1,0,0,0,0|2,0,1]=4 233 B10R1.10 CCNC1CCCC(C1)O 113e722fc1e449e3e54ccf67b4ce78a7 [0,1,0,0,0,0|2,0,1]=4 234 B10R1.10 CCN[C@@H]1CCC[C@@H](C1)O 7f9bb0b6d56b12bb66d83f760d316ab1 [0,1,0,0,0,0|2,0,1]=4 235 B10R1.10 CCN[C@@H]1CCC[C@H](C1)C b54432e71e2a2bf8bdf4246e5c24a915 [0,1,0,0,0,0|2,0,1]=4 236 B10R1.10 CCN[C@@H]1CCC[C@H](C1)O 396290b6b5db7e9cb63a3fcf9b0c183b [0,1,0,0,0,0|2,0,1]=4 237 B10R1.10 CCN[C@H]1CCC[C@@H](C1)O 79d8666b7770f893e752839182a97ad1 [0,1,0,0,0,0|2,0,1]=4 238 B10R1.10 CCN[C@H]1CCC[C@H](C1)O 5b66beda661cb9accdacd389931ec98f [0,1,0,0,0,0|2,0,1]=4 239 B10R1.10 CCOC1CCCC(=O)C1 7694e8ef5c808ba4dfd648fc2fdd5673 [0,1,0,0,0,0|1,0,2]=4 240 B10R1.10 CCOC1CCCC(C1)C 05d0af7621eacccee87006fe3e417b13 [0,1,0,0,0,0|1,0,1]=3 241 B10R1.10 CCOC1CCCN(C1)C 7fac3ee0c7265cd3dee0d6def2acf995 [0,1,0,0,0,0|2,0,1]=4 242 B10R1.10 CCOC1CCOC(C1)C 4995be4c683a8fc0b22c6d7c934af05f [0,1,0,0,0,0|2,0,1]=4 243 B10R1.10 CCO[C@@H]1CCCN(C1)C 8792e0ec2d00de10f4fb5369bf62dbd8 [0,1,0,0,0,0|2,0,1]=4 244 B10R1.10 CCO[C@@H]1CCC[C@@H](C1)C ce55d21559242a12587fb793cf17f8c8 [0,1,0,0,0,0|1,0,1]=3 245 B10R1.10 CCO[C@@H]1CCO[C@@H](C1)C 1f09d7291ca66f49d47f3c20ef5062e9 [0,1,0,0,0,0|2,0,1]=4 246 B10R1.10 CCO[C@@H]1CCO[C@H](C1)C 379686bf7b276e155f68e113ba0aedb8 [0,1,0,0,0,0|2,0,1]=4 247 B10R1.10 CCO[C@H]1CCCN(C1)C dc6a0d691a196305da622e2d54e468fe [0,1,0,0,0,0|2,0,1]=4 248 B10R1.10 CCO[C@H]1CCC[C@@H](C1)C 39c7f1f81843ee831419d80230008049 [0,1,0,0,0,0|1,0,1]=3 249 B10R1.10 CCO[C@H]1CCC[C@H](C1)C c3bbffbe08f75b723c5a87fe9bd00adc [0,1,0,0,0,0|1,0,1]=3 250 B10R1.10 CCO[C@H]1CCO[C@@H](C1)C fc3ea2ca42162b22b37fe3ace5558969 [0,1,0,0,0,0|2,0,1]=4 251 B10R1.10 CCO[C@H]1CCO[C@H](C1)C 5839222d06d24eb14355e03cc9a74f91 [0,1,0,0,0,0|2,0,1]=4 252 B10R1.10 CN1CCCC(C1)OCF a41355185de23693231d10dd3314a382 [0,1,0,0,0,0|2,0,1]=4 253 B10R1.10 CN1CCC[C@@H](C1)OCF 7d7b78691af2225b5d9adf493e3f3f2d [0,1,0,0,0,0|2,0,1]=4 254 B10R1.10 CN1CCC[C@H](C1)OCF 53fb15ceeed817b2752a59cc27f9f66b [0,1,0,0,0,0|2,0,1]=4 255 B10R1.10 C[C@@H]1CCCN(C1)CC=O b86b114d3af9a694a07458e5e4aa562b [0,1,0,0,0,0|2,0,0]=3 256 B10R1.10 C[C@@H]1CCC[C@@H](C1)OCF 81bb9715deaae3cbc92a9e1504fe0c1c [0,1,0,0,0,0|1,0,1]=3 257 B10R1.10 C[C@@H]1CCC[C@H](C1)NC=O 6f39176ec4d5e01852d746d6dbd970d4 [0,1,0,0,0,0|1,0,0]=2 258 B10R1.10 C[C@@H]1CCC[C@H](C1)NCF 40b2f07b0b83e2e23e28dfa98670612b [0,1,0,0,0,0|2,0,1]=4 259 B10R1.10 C[C@@H]1CCC[C@H](C1)NCO 0141010beb818bcf4396f3fc169829fc [0,1,0,0,0,0|1,0,2]=4 260 B10R1.10 C[C@@H]1CN(CCO1)CC=O dbfc8abfec2d8df0b3bb264d1bb4ed4b [0,1,0,0,0,0|3,0,0]=4 261 B10R1.10 C[C@@H]1C[C@@H](CCO1)NC=O e664930704097e37968ab84b33ff0ada [0,1,0,0,0,0|2,0,0]=3 262 B10R1.10 C[C@@H]1C[C@@H](CCO1)OCF 78f1ff9a6b9a5e63f6824c6e822f61e7 [0,1,0,0,0,0|2,0,1]=4 263 B10R1.10 C[C@@H]1C[C@H](CCO1)NC=O a06ca4084ced461924de5f48b6f078f6 [0,1,0,0,0,0|2,0,0]=3 264 B10R1.10 C[C@@H]1C[C@H](CCO1)OCF 9477be1db38586a4ccec1d645c0c8e6c [0,1,0,0,0,0|2,0,1]=4 265 B10R1.10 C[C@H]1CCCN(C1)CC=O 162c9ac6ba03ec25d91f62b0932e7148 [0,1,0,0,0,0|2,0,0]=3 266 B10R1.10 C[C@H]1CCC[C@@H](C1)OCF bbbcaf6195e1239bf9227a22fb623886 [0,1,0,0,0,0|1,0,1]=3 267 B10R1.10 C[C@H]1CCC[C@H](C1)OCF 36d2c58f8018d103e578ffcb512be0bc [0,1,0,0,0,0|1,0,1]=3 268 B10R1.10 C[C@H]1CN(CCO1)CC=O 3d530be17fda5edbf2fd89f82505a5a8 [0,1,0,0,0,0|3,0,0]=4 269 B10R1.10 C[C@H]1C[C@@H](CCO1)NC=O fa37c8a57a26750c8e7f06650d6f57c0 [0,1,0,0,0,0|2,0,0]=3 270 B10R1.10 C[C@H]1C[C@@H](CCO1)OCF 619142df144bc539735fce9ac5823e4f [0,1,0,0,0,0|2,0,1]=4 271 B10R1.10 C[C@H]1C[C@H](CCO1)NC=O 0f313ccbd6319e50063f96e2171144bf [0,1,0,0,0,0|2,0,0]=3 272 B10R1.10 C[C@H]1C[C@H](CCO1)OCF 636d22864e95592b64852bf51a6ef18e [0,1,0,0,0,0|2,0,1]=4 273 B10R1.10 O=C1CCCC(C1)OCF 3ef4074d9d8cde512776f61233cdd122 [0,1,0,0,0,0|1,0,2]=4 274 B10R1.10 O=CCN1CCCC(=O)C1 c4b9600e4614d8322ef72d868498cfe4 [0,1,0,0,0,0|2,0,1]=4 275 B10R1.10 O=CCN1CCCC(C1)F 5dc7e1b75d75755d41eac602ca32cceb [0,1,0,0,0,0|2,0,0]=3 276 B10R1.10 O=CCN1CCCC(C1)O 8254680454cd1053f35d938e118c657f [0,1,0,0,0,0|2,0,0]=3 277 B10R1.10 O=CCN1CCC[C@@H](C1)F 8d9fd0d39761ef0663af46cedcecde03 [0,1,0,0,0,0|2,0,0]=3 278 B10R1.10 O=CCN1CCC[C@@H](C1)O 573838c28f87425f300a1f5d52196fde [0,1,0,0,0,0|2,0,0]=3 279 B10R1.10 O=CCN1CCC[C@H](C1)F b4a4b47977f583ffdbfce59e9e25fbcd [0,1,0,0,0,0|2,0,0]=3 280 B10R1.10 O=CCN1CCC[C@H](C1)O 1471afae81ffc2f8a2808598eede4d50 [0,1,0,0,0,0|2,0,0]=3 281 B10R1.10 O=CNC1CCCC(C1)O be289b67b44feff11a16be8f83687208 [0,1,0,0,0,0|1,0,0]=2 282 B10R1.10 O=CNC1CCNC(=O)C1 d47a9ff12078ea45926ce99e6dc19669 [0,1,0,0,0,0|2,0,1]=4 283 B10R1.10 O=CNC1COCC(C1)O 8493356be03a7025816782c83ef32635 [0,1,0,0,0,0|2,0,0]=3 284 B10R1.10 O=CN[C@@H]1CCC[C@@H](C1)O 80de9e33010ceb3e9e383f0de5dd8037 [0,1,0,0,0,0|1,0,0]=2 285 B10R1.10 O=CN[C@@H]1CCC[C@H](C1)O 0a4e567a3dea037b8cbf40b1b45f85a9 [0,1,0,0,0,0|1,0,0]=2 286 B10R1.10 O=CN[C@@H]1CCNC(=O)C1 939e0de9e707ac9fd7ff5b73a3d70f40 [0,1,0,0,0,0|2,0,1]=4 287 B10R1.10 O=CN[C@@H]1COC[C@@H](C1)O 35880bd5bdabe5d36271592b2d6e556e [0,1,0,0,0,0|2,0,0]=3 288 B10R1.10 O=CN[C@H]1CCC[C@@H](C1)O 194e997088c52158a934d22d39f37a2a [0,1,0,0,0,0|1,0,0]=2 289 B10R1.10 O=CN[C@H]1CCC[C@H](C1)O 8faf5308afd82ed307b9535e7d0477e8 [0,1,0,0,0,0|1,0,0]=2 290 B10R1.10 O=CN[C@H]1CCNC(=O)C1 352532a44c9585014214a6f948f5ade2 [0,1,0,0,0,0|2,0,1]=4 291 B10R1.10 O=CN[C@H]1COC[C@H](C1)O d1365299c8dfb87e92059a4154ddf9ec [0,1,0,0,0,0|2,0,0]=3 292 B10R1.10 OC1CCCC(C1)NCF 8a745a6d70ab94cc540c9679db0a760c [0,1,0,0,0,0|2,0,1]=4 293 B10R1.10 OCNC1CCCC(C1)O c242f1fcf5b733230ae6c14c936017b4 [0,1,0,0,0,0|1,0,2]=4 294 B10R1.10 OCN[C@@H]1CCC[C@@H](C1)O 2715cc509d59e00e7158a0f3effd79e5 [0,1,0,0,0,0|1,0,2]=4 295 B10R1.10 OCN[C@@H]1CCC[C@H](C1)O 29b5d367f68c7c22f2925e4a466996a0 [0,1,0,0,0,0|1,0,2]=4 296 B10R1.10 OCN[C@H]1CCC[C@@H](C1)O 725152d27935eb8ad0a4918c5ba21ba4 [0,1,0,0,0,0|1,0,2]=4 297 B10R1.10 OCN[C@H]1CCC[C@H](C1)O c77145f28c5be1778489ce317c2759c7 [0,1,0,0,0,0|1,0,2]=4 298 B10R1.10 O[C@@H]1CCC[C@@H](C1)NCF 6a7c7b5690f770f5f6e1688d5c0c73d4 [0,1,0,0,0,0|2,0,1]=4 299 B10R1.10 O[C@@H]1CCC[C@H](C1)NCF 70fad0b4c77fcbd7d0261473720fb421 [0,1,0,0,0,0|2,0,1]=4 300 B10R1.10 O[C@H]1CCC[C@@H](C1)NCF 10ddf1c30cda850d1b9feb2799bb9d2f [0,1,0,0,0,0|2,0,1]=4 301 B10R1.10 O[C@H]1CCC[C@H](C1)NCF 5f97eb2e97a969091f1ed985f89dfa4c [0,1,0,0,0,0|2,0,1]=4 302 B10R1.15 CC(C=O)N1CCCOC1 fbf79b2a08c3bac87bb769747eb6cd8d [0,1,0,0,0,0|3,0,0]=4 303 B10R1.15 CC(C=O)N1CCCSC1 01b3370f89000c75fea3c499bd647204 [0,1,0,0,0,0|3,0,0]=4 304 B10R1.15 CC(C=O)N1CCOCC1 351b845173f6ca6677b12d5430488e8b [0,1,0,0,0,0|3,0,0]=4 305 B10R1.15 CC(C=O)N1CCSCC1 3dc4fbb9fff66787743a591a27cc9af6 [0,1,0,0,0,0|3,0,0]=4 306 B10R1.15 CCN(C)C1CCCCC1 0b02e5f627653026e48ece3dd417af37 [0,1,0,0,0,0|2,0,1]=4 307 B10R1.15 CN(C=O)C1CCCOC1 18e0d09f637d92745b07bf4892800333 [0,1,0,0,0,0|2,0,0]=3 308 B10R1.15 CN(CF)C1CCCCC1 9e533a33b076f85bde0aec74cbc5d68b [0,1,0,0,0,0|2,0,1]=4 309 B10R1.15 CN(CO)C1CCCCC1 24e331bb88e9b558829ad076fb21a36d [0,1,0,0,0,0|1,0,2]=4 310 B10R1.15 C[C@H](C=O)N1CCCOC1 16dae4db1482ae73f1d7e5b7edabe266 [0,1,0,0,0,0|3,0,0]=4 311 B10R1.15 C[C@H](C=O)N1CCCSC1 bcd6350f4addcd29debd1df7f27e0cad [0,1,0,0,0,0|3,0,0]=4 312 B10R1.15 C[C@H](C=O)N1CCOCC1 e22f5100998951f1a1fe7f128868fa98 [0,1,0,0,0,0|3,0,0]=4 313 B10R1.15 C[C@H](C=O)N1CCSCC1 e33691c1c1cf0e67f74d2761ef4e21d0 [0,1,0,0,0,0|3,0,0]=4 314 B10R1.15 O=CC(=O)N1CCCOC1 258c59b6767ba2f65e1091e1fdc143cc [0,1,0,0,0,0|3,0,0]=4 315 B10R1.15 O=CC(=O)N1CCCSC1 f358d5341e50f4b793bf275de51054ac [0,1,0,0,0,0|3,0,0]=4 316 B10R1.15 O=CC(=O)N1CCOCC1 f941c1c23a23c257dbdfb58a336e0a58 [0,1,0,0,0,0|3,0,0]=4 317 B10R1.15 O=CC(=O)N1CCSCC1 fdc9a2e57991d4e9f00aa80430cd1432 [0,1,0,0,0,0|3,0,0]=4 318 B10R1.17 BrCCNC1CCCCC1 8fdbf04547ed3edb0f6464bb861e6ead [0,1,0,0,0,0|2,0,1]=4 319 B10R1.17 C#CCNC1CCCCC1 d7c254352257bd4825f0f8911ad031a4 [0,1,0,0,0,0|2,0,1]=4 320 B10R1.17 C#CCOC1CCCCC1 678f6f90e3660d2aa8b3759e04bcb6a8 [0,1,0,0,0,0|1,0,1]=3 321 B10R1.17 C#CCOC1CCCCO1 30acdd7d7b02c33bfa2bde69942f7e99 [0,1,0,0,0,0|2,0,1]=4 322 B10R1.17 C#CCOC1CCCOC1 41afdaa18bb85fdbf48b7c3e9202a5e1 [0,1,0,0,0,0|2,0,1]=4 323 B10R1.17 C#CCOC1CCCSC1 a1a9d7b6965f9914889f0eebca3031a3 [0,1,0,0,0,0|2,0,1]=4 324 B10R1.17 C#CCOC1CCOCC1 7f5fd393736d9720b731d3b4eff5216e [0,1,0,0,0,0|2,0,1]=4 325 B10R1.17 C#CCOC1CCSCC1 148045389bfe24059a44cb31c371cf22 [0,1,0,0,0,0|2,0,1]=4 326 B10R1.17 C#CCO[C@@H]1CCCOC1 031ea39f64c7345473123319016024fc [0,1,0,0,0,0|2,0,1]=4 327 B10R1.17 C#CCO[C@H]1CCCOC1 bf3445faabec2ce288d46d6b072f180d [0,1,0,0,0,0|2,0,1]=4 328 B10R1.17 C=CCNC1CCCOC1 b2b4af0705e6633768dcd11599af5733 [0,1,0,0,0,0|3,0,0]=4 329 B10R1.17 C=CCNC1CCOCC1 dfa490e7023788124604c31ac26c4748 [0,1,0,0,0,0|3,0,0]=4 330 B10R1.17 C=CCNC1CCSCC1 c61924c9c667c54e864c98e1832f6723 [0,1,0,0,0,0|3,0,0]=4 331 B10R1.17 C=CCN[C@@H]1CCCOC1 598a5a75a3085ce330ca873f1cdad5a8 [0,1,0,0,0,0|3,0,0]=4 332 B10R1.17 C=CCN[C@H]1CCCOC1 163788733eabe0576d0f81ea9d5c26c3 [0,1,0,0,0,0|3,0,0]=4 333 B10R1.17 C=CCOC1C=CCCC1 bad57268d0b1789e9369d0ccf542d79e [0,1,0,0,0,0|1,0,2]=4 334 B10R1.17 C=CCOC1CC=CCC1 7b2d1fdb682762a0c94b6718be0e783b [0,1,0,0,0,0|1,0,2]=4 335 B10R1.17 C=CCOC1CCCCC1 60bb50b2a57d8626acce7d1b397f2204 [0,1,0,0,0,0|1,0,0]=2 336 B10R1.17 C=CCOC1CCCCO1 ff6f6124114c4fad2d3406c15e7cf0de [0,1,0,0,0,0|2,0,0]=3 337 B10R1.17 C=CCOC1CCCOC1 2857b0bec84a791877bb7df65af1ef56 [0,1,0,0,0,0|2,0,0]=3 338 B10R1.17 C=CCOC1CCCSC1 574e2fcc335aeed9af3f69d666fe064b [0,1,0,0,0,0|2,0,0]=3 339 B10R1.17 C=CCOC1CCOCC1 38f0fda1f75d1ffd76c6da7704ccd138 [0,1,0,0,0,0|2,0,0]=3 340 B10R1.17 C=CCOC1CCSCC1 da77c2e6fe243419ee0cc69004b35784 [0,1,0,0,0,0|2,0,0]=3 341 B10R1.17 C=CCO[C@@H]1CCCOC1 7420b7c2ca2092607de63f3c30db8b51 [0,1,0,0,0,0|2,0,0]=3 342 B10R1.17 C=CCO[C@H]1CCCOC1 91d91d3d80e065716120a1af7b7ac1d4 [0,1,0,0,0,0|2,0,0]=3 343 B10R1.17 CCCNC1CCCCC1 116c9b71b1a196b91e387ed3e22d47e2 [0,1,0,0,0,0|2,0,1]=4 344 B10R1.17 CCCOC1CCCCC1 a5977ebc84c522370a3bc5745fd0df69 [0,1,0,0,0,0|1,0,1]=3 345 B10R1.17 CCCOC1CCCCO1 e032b365203d5e61206393eed2791d41 [0,1,0,0,0,0|2,0,1]=4 346 B10R1.17 CCCOC1CCCOC1 28e12bcfd8e15b8340b0e298f13c2df4 [0,1,0,0,0,0|2,0,1]=4 347 B10R1.17 CCCOC1CCCSC1 ca37164237c2ca7855212eeba91ebe49 [0,1,0,0,0,0|2,0,1]=4 348 B10R1.17 CCCOC1CCOCC1 bb8bcf542005b3c5a0c4939cca6ce87a [0,1,0,0,0,0|2,0,1]=4 349 B10R1.17 CCCOC1CCSCC1 4081d7c400995ebde4b11bb2d95114df [0,1,0,0,0,0|2,0,1]=4 350 B10R1.17 CCCO[C@@H]1CCCOC1 a25161b5f353e59347a4869c9737c377 [0,1,0,0,0,0|2,0,1]=4 351 B10R1.17 CCCO[C@H]1CCCOC1 225b9f18238a9863ae2ba931a7c357d6 [0,1,0,0,0,0|2,0,1]=4 352 B10R1.17 CCNCC1CCCCC1 542a60293f152ecf14a309cd5653059e [0,1,0,0,0,0|2,0,1]=4 353 B10R1.17 CCOCC1CCCCC1 add8761bc60b25837d77d4bb73a33c8e [0,1,0,0,0,0|1,0,1]=3 354 B10R1.17 CCOCC1CCCCO1 70b872ce90931f873adb4dae986b77a3 [0,1,0,0,0,0|2,0,1]=4 355 B10R1.17 CCOCC1CCCOC1 540bf39e3fa305acb7a57a6c3c3cbf11 [0,1,0,0,0,0|2,0,1]=4 356 B10R1.17 CCOCC1CCOCC1 bc843b7d36526ade76de306c1a5c99bf [0,1,0,0,0,0|2,0,1]=4 357 B10R1.17 CCOCC1CCSCC1 b3ed29957cd906e1c476455adb2741a8 [0,1,0,0,0,0|2,0,1]=4 358 B10R1.17 CCOC[C@@H]1CCCCO1 82c130a20690fc6ae68b7469dbf8abb1 [0,1,0,0,0,0|2,0,1]=4 359 B10R1.17 CCOC[C@@H]1CCCOC1 948b0225f1ff7d3d4fd885631f934d01 [0,1,0,0,0,0|2,0,1]=4 360 B10R1.17 CCOC[C@H]1CCCCO1 737be79825146caaab66eb293128d258 [0,1,0,0,0,0|2,0,1]=4 361 B10R1.17 CCOC[C@H]1CCCOC1 51faa9aa4bfc0939a2177fe752fe9388 [0,1,0,0,0,0|2,0,1]=4 362 B10R1.17 COCOC1CCCCC1 aa4f42d6f5f36c6410d8a31d3ec6c1a1 [0,1,0,0,0,0|0,0,2]=3 363 B10R1.17 COCOC1CCCCO1 bfd1265fdda37d180d853435483f6dc4 [0,1,0,0,0,0|1,0,2]=4 364 B10R1.17 COCOC1CCCOC1 f0798db40057fa46ae5cf93ab8a270b6 [0,1,0,0,0,0|1,0,2]=4 365 B10R1.17 COCOC1CCCSC1 170f15a5674ad408aa4a1b14cbdef809 [0,1,0,0,0,0|1,0,2]=4 366 B10R1.17 COCOC1CCOCC1 03c67131ba63281c08d8fdbb636ad47c [0,1,0,0,0,0|1,0,2]=4 367 B10R1.17 COCOC1CCSCC1 76a44e7ae8581a362f1d64cca9cb8acd [0,1,0,0,0,0|1,0,2]=4 368 B10R1.17 COCO[C@@H]1CCCOC1 755d6978bdf567a4bb44c433a528ede3 [0,1,0,0,0,0|1,0,2]=4 369 B10R1.17 COCO[C@H]1CCCOC1 df31de056fc24228469ce6bb204dc397 [0,1,0,0,0,0|1,0,2]=4 370 B10R1.17 CSCOC1CCCCC1 78f5559130ba9dc39e0f4eb05b8b871b [0,1,0,0,0,0|0,1,1]=3 371 B10R1.17 CSCOC1CCCCO1 ece85fc6aa9195b286c5442b5992399e [0,1,0,0,0,0|1,1,1]=4 372 B10R1.17 CSCOC1CCCOC1 157d13dd8dcdd9784036ef1a630693e1 [0,1,0,0,0,0|1,1,1]=4 373 B10R1.17 CSCOC1CCCSC1 bf4303f778b9f09249a79d127961250d [0,1,0,0,0,0|1,1,1]=4 374 B10R1.17 CSCOC1CCOCC1 34b469ab14802d8e2af34c8e19268340 [0,1,0,0,0,0|1,1,1]=4 375 B10R1.17 CSCOC1CCSCC1 8222824de001decca933363b72c9d456 [0,1,0,0,0,0|1,1,1]=4 376 B10R1.17 CSCO[C@@H]1CCCOC1 b140173149e3e0bff1c5fefffcd46646 [0,1,0,0,0,0|1,1,1]=4 377 B10R1.17 CSCO[C@H]1CCCOC1 289aa059785d2fa8d8f16ef482c89f25 [0,1,0,0,0,0|1,1,1]=4 378 B10R1.17 FCCNC1CCCCC1 d09cb7c8791d8763606ab91eed16a2b4 [0,1,0,0,0,0|2,0,1]=4 379 B10R1.17 FCCOC1CCCCC1 df1bd689063f4e026df30e2e086ef822 [0,1,0,0,0,0|1,0,1]=3 380 B10R1.17 FCCOC1CCCCO1 a4c1ee307a6793b413ced1eb7200c131 [0,1,0,0,0,0|2,0,1]=4 381 B10R1.17 FCCOC1CCCOC1 5a5ea734d977001086dc90bb54b1a1b0 [0,1,0,0,0,0|2,0,1]=4 382 B10R1.17 FCCOC1CCCSC1 5c1dffd0f84c293007ee953d87cf77e2 [0,1,0,0,0,0|2,0,1]=4 383 B10R1.17 FCCOC1CCOCC1 73fa0a7e74c398ef417d8db8b17da99b [0,1,0,0,0,0|2,0,1]=4 384 B10R1.17 FCCOC1CCSCC1 a31aaf2bcf622fc49810d01746771240 [0,1,0,0,0,0|2,0,1]=4 385 B10R1.17 FCCO[C@@H]1CCCOC1 b2c757d45e661d7b6d22c279aa9a785e [0,1,0,0,0,0|2,0,1]=4 386 B10R1.17 FCCO[C@H]1CCCOC1 fa15894500fb095cb4894880c543c96e [0,1,0,0,0,0|2,0,1]=4 387 B10R1.17 FCNCC1CCCCC1 f7d98a6eed523a6f2bb56b607a9c2a21 [0,1,0,0,0,0|2,0,1]=4 388 B10R1.17 FCOCC1CCCCC1 3c5de1a231fe0982e32f3887259c2808 [0,1,0,0,0,0|1,0,1]=3 389 B10R1.17 FCOCC1CCCCO1 91ac82775f0bb38aa635369457ad089e [0,1,0,0,0,0|2,0,1]=4 390 B10R1.17 FCOCC1CCCOC1 28a4608583135a0aaea425889cb89875 [0,1,0,0,0,0|2,0,1]=4 391 B10R1.17 FCOCC1CCOCC1 8c3acfdf55f1c87f04f2b4e15e5f90f8 [0,1,0,0,0,0|2,0,1]=4 392 B10R1.17 FCOCC1CCSCC1 f3090dca65baf3360095d855e439d8e2 [0,1,0,0,0,0|2,0,1]=4 393 B10R1.17 FCOC[C@@H]1CCCCO1 ca1b2cb267bd690707fc848ca799b623 [0,1,0,0,0,0|2,0,1]=4 394 B10R1.17 FCOC[C@@H]1CCCOC1 49cd6390d42ac2c8b16ce799e1ff4f5f [0,1,0,0,0,0|2,0,1]=4 395 B10R1.17 FCOC[C@H]1CCCCO1 8ea64adf0799f6fa23f2275a2ca422eb [0,1,0,0,0,0|2,0,1]=4 396 B10R1.17 FCOC[C@H]1CCCOC1 7ad351b7ad45293aafe1272b36f683e6 [0,1,0,0,0,0|2,0,1]=4 397 B10R1.17 ICCNC1CCCCC1 0ea7912ac8efeac273e26921a720b10f [0,1,0,0,0,0|2,0,1]=4 398 B10R1.17 N#CCNC1CCCCC1 c14eccb21381cf33342da1f5aa926d1b [0,1,0,0,0,0|2,0,1]=4 399 B10R1.17 N#CCOC1CCCCC1 8ed0e508b710a4aa2002a8fee15b59c4 [0,1,0,0,0,0|1,0,1]=3 400 B10R1.17 N#CCOC1CCCCO1 58cae88d58449b7817e140b96f84c3da [0,1,0,0,0,0|2,0,1]=4 401 B10R1.17 N#CCOC1CCCOC1 01a37fddd707054edef1dff54b2ce06f [0,1,0,0,0,0|2,0,1]=4 402 B10R1.17 N#CCOC1CCCSC1 354241a8c6d58a22efd411eff2ba491c [0,1,0,0,0,0|2,0,1]=4 403 B10R1.17 N#CCOC1CCOCC1 1e072a5c49bcf4bdcbe619de87761166 [0,1,0,0,0,0|2,0,1]=4 404 B10R1.17 N#CCOC1CCSCC1 90d27ccd9939889d8edb25f47a52164f [0,1,0,0,0,0|2,0,1]=4 405 B10R1.17 N#CCO[C@@H]1CCCOC1 d9d7f28f2600c031983b976c717a9140 [0,1,0,0,0,0|2,0,1]=4 406 B10R1.17 N#CCO[C@H]1CCCOC1 cf0968cd28012a5c43d4a448abe0f4ee [0,1,0,0,0,0|2,0,1]=4 407 B10R1.17 N#CNCC1CCCCC1 1bc444afafda86d93a9c06bf4cef24c6 [0,1,0,0,0,0|2,0,1]=4 408 B10R1.17 O=CCCN1CCCOC1 9ad45fe46d09f63d6cc7598ad54fc25e [0,1,0,0,0,0|3,0,0]=4 409 B10R1.17 O=CCCN1CCCSC1 c5ef75c34d4a4b5027cd47ef20d11511 [0,1,0,0,0,0|3,0,0]=4 410 B10R1.17 O=CCCN1CCOCC1 8795cbfe6eab82661449750b81948d80 [0,1,0,0,0,0|3,0,0]=4 411 B10R1.17 O=CCCN1CCSCC1 fdbb42085fe17964460ec3907fca2a89 [0,1,0,0,0,0|3,0,0]=4 412 B10R1.17 O=CCNC1C=CCCC1 a5157ae5ff1004d6bbff6fd5b1f6a62e [0,1,0,0,0,0|1,0,2]=4 413 B10R1.17 O=CCNC1CCCOC1 6b730a17d614aafa1aa318a511651046 [0,1,0,0,0,0|2,0,0]=3 414 B10R1.17 O=CCNC1CCOCC1 50bf81f0270dd1d4294515ced70c064c [0,1,0,0,0,0|2,0,0]=3 415 B10R1.17 O=CCNC1CCSCC1 0024365efe323dc9ad8857b5b2a4cf77 [0,1,0,0,0,0|2,0,0]=3 416 B10R1.17 O=CCNC1CSCSC1 79384413de3a67e9ea45eea7ef880f83 [0,1,0,0,0,0|3,0,0]=4 417 B10R1.17 O=CCN[C@@H]1CCCOC1 a054c558ef790c97c3282d4cd91aeaf7 [0,1,0,0,0,0|2,0,0]=3 418 B10R1.17 O=CCN[C@H]1CCCOC1 81bdaac95724b93122faba5fab875208 [0,1,0,0,0,0|2,0,0]=3 419 B10R1.17 O=CCOC1C=CCCC1 859f3689b7089e03adfc3cce9cc38ebe [0,1,0,0,0,0|0,0,2]=3 420 B10R1.17 O=CCOC1CC=CCC1 3b89c2c36651de2f36a64bf73fcf75ce [0,1,0,0,0,0|0,0,2]=3 421 B10R1.17 O=CCOC1CCCCC1 2ac8d325a817eeba1e5b959a131d4d1f [0,1,0,0,0,0|0,0,0]=1 422 B10R1.17 O=CCOC1CCCCO1 32d8779509e070d5970150a4e2a2b467 [0,1,0,0,0,0|1,0,0]=2 423 B10R1.17 O=CCOC1CCCOC1 0acc287e80c367ba45db256a51a86ca8 [0,1,0,0,0,0|1,0,0]=2 424 B10R1.17 O=CCOC1CCCSC1 e0edb4cac81e1b62de1b4dd79d4b6b12 [0,1,0,0,0,0|1,0,0]=2 425 B10R1.17 O=CCOC1CCOCC1 3942062463ddd27c40f9dd244ed7fd0c [0,1,0,0,0,0|1,0,0]=2 426 B10R1.17 O=CCOC1CCSCC1 47bf0a366cae7124115b27b923321472 [0,1,0,0,0,0|1,0,0]=2 427 B10R1.17 O=CCO[C@@H]1CCCOC1 ef6af5491b3cb1f78f4d84cce6114b6f [0,1,0,0,0,0|1,0,0]=2 428 B10R1.17 O=CCO[C@H]1CCCOC1 1efae44d6f987c5e3b0b7d27475122aa [0,1,0,0,0,0|1,0,0]=2 429 B10R1.17 O=CNCC1=CCCCC1 584889090e9ec54011e3171791a4864a [0,1,0,0,0,0|1,0,2]=4 430 B10R1.17 O=CNCC1CC=CCC1 6cb3cb393b1f2e75ad5797ff7880ebfa [0,1,0,0,0,0|1,0,2]=4 431 B10R1.17 O=CNCC1CCCCC1 4e44cab3a60055af5bfabb127e62d3a7 [0,1,0,0,0,0|1,0,0]=2 432 B10R1.17 O=CNCC1CCCCO1 d9dd87ecc863fe06086920ca00dce84d [0,1,0,0,0,0|2,0,0]=3 433 B10R1.17 O=CNCC1CCCOC1 35ea698a015c8d5631b9e6ea95c71f52 [0,1,0,0,0,0|2,0,0]=3 434 B10R1.17 O=CNCC1CCOCC1 8d78e0091f7a806b9cf54f9fe19dd5ef [0,1,0,0,0,0|2,0,0]=3 435 B10R1.17 O=CNCC1CCSCC1 677d6b9fdb4d25bfb72f3ddaf19b329a [0,1,0,0,0,0|2,0,0]=3 436 B10R1.17 O=CNCC1COCCO1 c6a29942c43b6d12a75089fd1fdcfb11 [0,1,0,0,0,0|3,0,0]=4 437 B10R1.17 O=CNC[C@@H]1CCCOC1 06f4a32042159ed1445a60ce1a714339 [0,1,0,0,0,0|2,0,0]=3 438 B10R1.17 O=CNC[C@H]1CCCOC1 68341c1a910fe186088b2dbd54a23ea0 [0,1,0,0,0,0|2,0,0]=3 439 B10R1.17 O=CNC[C@H]1COCCO1 c71a7f58f5b0ea5ed441c38f893d3a4c [0,1,0,0,0,0|3,0,0]=4 440 B10R1.17 OCCNC1CCCCC1 cb4287e853e6a72233b428168d658cc4 [0,1,0,0,0,0|1,0,2]=4 441 B10R1.17 OCNCC1CCCCC1 a5b6a76774537dc00fb2137d722fa80d [0,1,0,0,0,0|1,0,2]=4 442 B10R1.17 SCCNC1CCCCC1 2b5507cafdb152e280f0c0037de00056 [0,1,0,0,0,0|1,1,1]=4 443 B10R1.17 SCCOC1CCCCC1 c87ab0dd8dcecaf86ae67499587b431b [0,1,0,0,0,0|0,1,1]=3 444 B10R1.17 SCCOC1CCCCO1 8d5c8c8f834110aae280dd94c2d99dc1 [0,1,0,0,0,0|1,1,1]=4 445 B10R1.17 SCCOC1CCCOC1 1c42dc2a59e66f5dd7f0373c1a020132 [0,1,0,0,0,0|1,1,1]=4 446 B10R1.17 SCCOC1CCCSC1 7fbcd8771b178a4518b86d199a906d98 [0,1,0,0,0,0|1,1,1]=4 447 B10R1.17 SCCOC1CCOCC1 7f1f2843f58f2c15152cd159cfd952b1 [0,1,0,0,0,0|1,1,1]=4 448 B10R1.17 SCCOC1CCSCC1 c26ac624f871e2c8d6f45c0940e29f63 [0,1,0,0,0,0|1,1,1]=4 449 B10R1.17 SCCO[C@@H]1CCCOC1 ba09b15e266244c27d79d9b23854d089 [0,1,0,0,0,0|1,1,1]=4 450 B10R1.17 SCCO[C@H]1CCCOC1 730b28034523def057ddad570764d5a8 [0,1,0,0,0,0|1,1,1]=4 451 B10R1.18 CC(=O)NC1C=CCCC1 1d5ddd958afbd2a3a6ae98a719be40e7 [0,1,0,0,0,0|1,0,2]=4 452 B10R1.18 CC(=O)NC1CCCOC1 4f95e852cc2bfb0219aae46495afcede [0,1,0,0,0,0|2,0,0]=3 453 B10R1.18 CC(=O)NC1CCOCC1 b8a9513c5c3615ab522c7c4bba9e7be0 [0,1,0,0,0,0|2,0,0]=3 454 B10R1.18 CC(=O)NC1CCSCC1 532c6db35a0b9f3a89303777aedbda02 [0,1,0,0,0,0|2,0,0]=3 455 B10R1.18 CC(=O)NC1CSCSC1 d0ae7147b50f1d3ca0ca8fa0e0f7a0be [0,1,0,0,0,0|3,0,0]=4 456 B10R1.18 CC(=O)N[C@@H]1CCCOC1 52485d58eafbf3c79fc267d807120eb6 [0,1,0,0,0,0|2,0,0]=3 457 B10R1.18 CC(=O)N[C@H]1CCCOC1 e380151c69e874f737c0bf1b7124947f [0,1,0,0,0,0|2,0,0]=3 458 B10R1.18 CC(C)OC1CCCCC1 901407d6daa772a248b53aa4b6ac8e30 [0,1,0,0,0,0|1,0,1]=3 459 B10R1.18 CC(C)OC1CCCCO1 cd0775eac08e04c38cddc5a061e10e3a [0,1,0,0,0,0|2,0,1]=4 460 B10R1.18 CC(C)OC1CCCOC1 5be5a80933617284aa64105ed9715aba [0,1,0,0,0,0|2,0,1]=4 461 B10R1.18 CC(C)OC1CCCSC1 66333ebe71b050cae9ef335e293ac7a6 [0,1,0,0,0,0|2,0,1]=4 462 B10R1.18 CC(C)OC1CCOCC1 d7f236c590864ba7852b08747928a7ec [0,1,0,0,0,0|2,0,1]=4 463 B10R1.18 CC(C)OC1CCSCC1 5bee124b630ead346ff384e539953ba4 [0,1,0,0,0,0|2,0,1]=4 464 B10R1.18 CC(C)O[C@@H]1CCCOC1 8d8ab022df163db6b8ed39810cc25da7 [0,1,0,0,0,0|2,0,1]=4 465 B10R1.18 CC(C)O[C@H]1CCCOC1 5749e494adb9caff7ffd9a16c12611f1 [0,1,0,0,0,0|2,0,1]=4 466 B10R1.18 NC(=O)CN1CCCOC1 94387a83bd4cae31e3f14782a40647e9 [0,1,0,0,0,0|3,0,0]=4 467 B10R1.18 NC(=O)CN1CCCSC1 b68231ec8070fb183d2e67e07bffdf5f [0,1,0,0,0,0|3,0,0]=4 468 B10R1.18 NC(=O)CN1CCOCC1 c410094cbb204aafa2a00a06ff1200a7 [0,1,0,0,0,0|3,0,0]=4 469 B10R1.18 NC(=O)CN1CCSCC1 e1433af854a61ebc2cf2a21d5e077032 [0,1,0,0,0,0|3,0,0]=4 470 B10R1.18 O=C(O)CN1CCCOC1 276c9e6db5c50efdf0013ee255981aea [0,1,0,0,0,0|3,0,0]=4 471 B10R1.18 O=C(O)CN1CCCSC1 969c23a84a85279fbc953810ec4f4635 [0,1,0,0,0,0|3,0,0]=4 472 B10R1.18 O=C(O)CN1CCOCC1 71b10415ca7d674c1df6add3bdabacae [0,1,0,0,0,0|3,0,0]=4 473 B10R1.18 O=C(O)CN1CCSCC1 71c83e558b9a1fa155bf6e87dce077b1 [0,1,0,0,0,0|3,0,0]=4 474 B10R1.377 CC1(CCCCC1)NC=O 6ae8a8b9f1f26131c7f30af4e9c95bc8 [0,1,0,0,0,0|1,0,0]=2 475 B10R1.377 CC1(CCCCC1)NCF 8572a67883f415f592d0fcf6b91e1df6 [0,1,0,0,0,0|2,0,1]=4 476 B10R1.377 CC1(CCCCC1)NCO f2c2c67aa89f96e757f2d9d4c78c9e25 [0,1,0,0,0,0|1,0,2]=4 477 B10R1.377 CC1(CCOCC1)NC=O 3fe473ec47ebb70e1ecc048a6f3391ca [0,1,0,0,0,0|2,0,0]=3 478 B10R1.377 CCNC1(CCCCC1)C 7bc1f4879cc7d7ffbc85efc0d1503c20 [0,1,0,0,0,0|2,0,1]=4 479 B8R0.1 C/C=C/C(C)OCCC 63733f028ee2622e94a5b800971df6ec [0,0,1,0,0,0|3,0,0]=4 480 B8R0.1 C=CCC(C)COCC 1270be54942bfc9267f93a523dae28a1 [0,0,1,0,0,0|3,0,0]=4 481 B8R0.1 C=CCC(C)OCCC a45dcff5acaff24e8a928ffef7da10dd [0,0,1,0,0,0|3,0,0]=4 482 B8R0.1 C=CCN(C)CCCC 7e690a78fa00c036d6b524400b1b2762 [0,0,1,0,0,0|3,0,0]=4 483 B8R0.1 C=CC[C@@H](C)OCCC d5c9cea8bbf114b9070cd8c5746c3116 [0,0,1,0,0,0|3,0,0]=4 484 B8R0.1 C=CC[C@H](C)OCCC 25f96375986637102dbe5a79fcef6427 [0,0,1,0,0,0|3,0,0]=4 485 B8R0.1 CC(CCCO)NC=O 15bbe5f218049b8debf6ff63d25de29f [0,0,1,0,0,0|2,0,0]=3 486 B8R0.1 CC=CC(C)OCCC d62e55aefb4912836b720106d29ce9c5 [0,0,1,0,0,0|3,0,0]=4 487 B8R0.1 CCCCC(C)NC#N 784eb56f230698d9aa3d1010255fd9a5 [0,0,1,0,0,0|2,0,1]=4 488 B8R0.1 CCCCC(C)NC=O 203907a44368850c8dee59ecad001a1f [0,0,1,0,0,0|1,0,0]=2 489 B8R0.1 CCCCC(C)NCC 4583005e506d2176e59cdaa84e6525c6 [0,0,1,0,0,0|2,0,1]=4 490 B8R0.1 CCCCC(C)NCF db34d3f788f978f6333b2ef84533bba3 [0,0,1,0,0,0|2,0,1]=4 491 B8R0.1 CCCCC(C)NCO 6228ac303b59f75d40554a9ce17c3ee3 [0,0,1,0,0,0|1,0,2]=4 492 B8R0.1 CCCCC(C)OCC e43df0ae121ab44cb6194c6546aa1e41 [0,0,1,0,0,0|1,0,1]=3 493 B8R0.1 CCCCC(C)OCF 8f64235a04b7426a52761157f7a2f136 [0,0,1,0,0,0|1,0,1]=3 494 B8R0.1 CCCCN(C)CC=O 0b9f4b899180868f46e162e3fdd5a057 [0,0,1,0,0,0|2,0,0]=3 495 B8R0.1 CCCC[C@@H](C)NC=O 85ae0f7eb97c9ecc6858b3133cc13253 [0,0,1,0,0,0|1,0,0]=2 496 B8R0.1 CCCC[C@@H](C)NCC c18bfbe49afa779f9ec8f1e0c1e03df7 [0,0,1,0,0,0|2,0,1]=4 497 B8R0.1 CCCC[C@@H](C)NCF 370b9a3d7cbc257e234752372becfe14 [0,0,1,0,0,0|2,0,1]=4 498 B8R0.1 CCCC[C@@H](C)NCO 4bc87525a9489fa57f5a33fe4ddc5813 [0,0,1,0,0,0|1,0,2]=4 499 B8R0.1 CCCC[C@@H](C)OCC d38acbfc54d47c4bbd565f1b434e5e73 [0,0,1,0,0,0|1,0,1]=3 500 B8R0.1 CCCC[C@@H](C)OCF ff66df83640c2dbad9e8ec8dcc4cafcc [0,0,1,0,0,0|1,0,1]=3 501 B8R0.1 CCCC[C@H](C)OCC f8165a8926a10ebcbdb8675cf31f0cb1 [0,0,1,0,0,0|1,0,1]=3 502 B8R0.1 CCCC[C@H](C)OCF e55dba0a966d7f5aa8a47328924d9297 [0,0,1,0,0,0|1,0,1]=3 503 B8R0.1 CCNCC(C)OCC eada9db090733897974960683afe5496 [0,0,1,0,0,0|2,0,1]=4 504 B8R0.1 CCOC(C)CCOC 196511f67d8eda011d6f33c8b16809a7 [0,0,1,0,0,0|2,0,1]=4 505 B8R0.1 CCOC(C)CCSC 324d3536b5929c293af9b175b80533e8 [0,0,1,0,0,0|2,0,1]=4 506 B8R0.1 CCOCC(C)OCC 20a9fb9f86ef4d51ef11c7f7a467151a [0,0,1,0,0,0|2,0,1]=4 507 B8R0.1 CCOCC(C)OCF bcb6d4f0696d0db17649578eada29ff8 [0,0,1,0,0,0|2,0,1]=4 508 B8R0.1 CN(CC=O)CCCO e829ef1e39177735d96baabedb183026 [0,0,1,0,0,0|3,0,0]=4 509 B8R0.1 COCCC(C)OCF 1c24462098656029d24876204a2cded4 [0,0,1,0,0,0|2,0,1]=4 510 B8R0.1 COCCN(C)CC=O c7dafc3b396de10656291e435de6410a [0,0,1,0,0,0|3,0,0]=4 511 B8R0.1 CSCCC(C)OCF ca44d8152c82433feb356f43eb2aa4aa [0,0,1,0,0,0|2,0,1]=4 512 B8R0.1 CSCCN(C)CC=O 89a7838ed9276e35ce7d12178b247609 [0,0,1,0,0,0|3,0,0]=4 513 B8R0.1 C[C@H](CCCO)NC=O 76787ce64f2b79059513d880ee57c0da [0,0,1,0,0,0|2,0,0]=3 514 B8R0.4 C#CCCCCNC=O fab4e18c7200300872a81b2f8c434fc9 [0,0,1,0,0,0|1,0,2]=4 515 B8R0.4 C#CCOCCOC=O 377001fa3c1ab01254e3078c71ef3ae2 [0,0,1,0,0,0|1,0,2]=4 516 B8R0.4 C/C=C/CCCOCC 29e30394c7c806aedb2c26dcf7eb5a9a [0,0,1,0,0,0|3,0,0]=4 517 B8R0.4 C/C=C/CCOCCC f366940c9b8e42845e1a3a54e7e58d66 [0,0,1,0,0,0|3,0,0]=4 518 B8R0.4 C/C=C/CNCCCC ce13f55ef8680a347af127fe05187ac2 [0,0,1,0,0,0|3,0,0]=4 519 B8R0.4 C/C=C/COCCCC 386b5fceec7ebb1bc8f3283962203eeb [0,0,1,0,0,0|3,0,0]=4 520 B8R0.4 C/C=C\CCCOCC 4d6755ca0163dc89f5ab91481d285f2d [0,0,1,0,0,0|3,0,0]=4 521 B8R0.4 C/C=C\CNCCCC b9e7ddbf697616b15bea928cc6394f2f [0,0,1,0,0,0|3,0,0]=4 522 B8R0.4 C/C=C\COCCCC c8285cb0cc053e0461398a5e6fb02665 [0,0,1,0,0,0|3,0,0]=4 523 B8R0.4 C=CCCCCNC=O d1a18970ef82160dc43ff2316b351101 [0,0,1,0,0,0|1,0,2]=4 524 B8R0.4 C=CCCCCNCC cad9e93d76afc8b0fa381258c4e7ac39 [0,0,1,0,0,0|3,0,0]=4 525 B8R0.4 C=CCCCCOCC 60183f731400a1b7f9d49b3e8c9e971a [0,0,1,0,0,0|3,0,0]=4 526 B8R0.4 C=CCCCNCCC ed9f94bd82f276e8a415d35039c9b633 [0,0,1,0,0,0|3,0,0]=4 527 B8R0.4 C=CCCCOCCC 5f646296a8d9f451f6f7524888b9f8ed [0,0,1,0,0,0|3,0,0]=4 528 B8R0.4 C=CCCNCCCC bba294da38688174bb39fbd588941b97 [0,0,1,0,0,0|3,0,0]=4 529 B8R0.4 C=CCCOCCCC 97ba8da216ed199156e3ec05890dcca1 [0,0,1,0,0,0|3,0,0]=4 530 B8R0.4 C=CCNCCCCC 011aacf19cd9f1faf70789f3f05aca79 [0,0,1,0,0,0|3,0,0]=4 531 B8R0.4 C=CCOCCCCC fcddc90e6084facec8d1d12eaaa08ee7 [0,0,1,0,0,0|3,0,0]=4 532 B8R0.4 C=CCOCCOC=O cc4c0fa320870fe6d6f693a921558628 [0,0,1,0,0,0|1,0,2]=4 533 B8R0.4 C=COCCCNCC d89071dcdb3acfadefaa437a059ee19e [0,0,1,0,0,0|2,0,0]=3 534 B8R0.4 C=COCCCNCF e07e5c3e606b8ffc18f594f94beea595 [0,0,1,0,0,0|3,0,0]=4 535 B8R0.4 C=COCCCNCO 7c4b3e65d98ea331ba11854946f4a847 [0,0,1,0,0,0|3,0,0]=4 536 B8R0.4 C=COCCNCCC 28cdbba6a7c35ff41b7005cb4f953384 [0,0,1,0,0,0|2,0,0]=3 537 B8R0.4 C=COCCNCCF c4db30a75b11ac3d125d39aaa0bafcf8 [0,0,1,0,0,0|3,0,0]=4 538 B8R0.4 C=COCCNCCO c962ee181883a9d05479745cb560753b [0,0,1,0,0,0|3,0,0]=4 539 B8R0.4 C=COCCNCCS 99e314c6d18b5e25ff66e5c7d4cb0d17 [0,0,1,0,0,0|3,0,0]=4 540 B8R0.4 C=COCCNCOC f224848c336840864306e8775fa9be91 [0,0,1,0,0,0|3,0,0]=4 541 B8R0.4 C=COCCNCSC c600bc4155cdfab00718c182a1d908ce [0,0,1,0,0,0|3,0,0]=4 542 B8R0.4 C=COCCOCCC d3d0232a519269e090de053aa19caca6 [0,0,1,0,0,0|2,0,0]=3 543 B8R0.4 C=COCCOCCF 2bb3cc79cd54325a3b4a658a60f2531e [0,0,1,0,0,0|3,0,0]=4 544 B8R0.4 C=COCCOCCS 1dc3bcdc2ff447de0c7aec1863e71212 [0,0,1,0,0,0|3,0,0]=4 545 B8R0.4 C=COCCOCOC 28985632a82f745364d35b6f4482f6c2 [0,0,1,0,0,0|3,0,0]=4 546 B8R0.4 C=COCCOCSC 1542023f7ad8f1a42415fe567facda9d [0,0,1,0,0,0|3,0,0]=4 547 B8R0.4 CC=CCCCOCC 5c3740efae5691bcaf9a76740bada28e [0,0,1,0,0,0|3,0,0]=4 548 B8R0.4 CC=CCNCCCC 6c09d356389ec0afd4d9be0c8efbc370 [0,0,1,0,0,0|3,0,0]=4 549 B8R0.4 CC=CCOCCCC 071b2f24d4974b0b4fcd0a0845303916 [0,0,1,0,0,0|3,0,0]=4 550 B8R0.4 CCCCCCNC#N bb02e52ec524ebcb56f04e4bf9b34243 [0,0,1,0,0,0|2,0,1]=4 551 B8R0.4 CCCCCCNC=O e5c1cbb738d0eb89b1d21f4508106baa [0,0,1,0,0,0|1,0,0]=2 552 B8R0.4 CCCCCCNCC 007e02c518c21b960782cd7d67a6f9d7 [0,0,1,0,0,0|2,0,1]=4 553 B8R0.4 CCCCCCNCF fcc33172a41ee2d3e601afc70a912863 [0,0,1,0,0,0|2,0,1]=4 554 B8R0.4 CCCCCCNCO fee4d07ce0e7c74e0c9bf65bf9405250 [0,0,1,0,0,0|1,0,2]=4 555 B8R0.4 CCCCCCOCC 9345e14939c0037a8cd7124fa95af69b [0,0,1,0,0,0|1,0,1]=3 556 B8R0.4 CCCCCCOCF 5545a0a4abb65fe9a326f72bb8454219 [0,0,1,0,0,0|1,0,1]=3 557 B8R0.4 CCCCCNCC=O 8ada82f0f40b5a52493af2d9d7bdb07d [0,0,1,0,0,0|2,0,0]=3 558 B8R0.4 CCCCCOCC=O 95ddace22ad0ae385e1b30e1a33c697f [0,0,1,0,0,0|2,0,0]=3 559 B8R0.4 CCCCNC/C=C/Cl aefc90227738a0a04d85ff4e3fb94a96 [0,0,1,0,0,0|3,0,0]=4 560 B8R0.4 CCCCNC/C=C\Cl 95b879f76fb0ff759a3b6bfdbdb337b9 [0,0,1,0,0,0|3,0,0]=4 561 B8R0.4 CCCCNC/C=C\O 030dd5950e83ae29a206c0c1dbd703ac [0,0,1,0,0,0|2,0,1]=4 562 B8R0.4 CCCCNCCC=O cc5d699181445c3bad4f64b752b1821b [0,0,1,0,0,0|2,0,0]=3 563 B8R0.4 CCCCNCOCC 6270590fe71f8e7cfb7887c503e7cb19 [0,0,1,0,0,0|2,0,1]=4 564 B8R0.4 CCCCOC/C=C/Cl 568b090b21b75e4cb48d2918836f8eba [0,0,1,0,0,0|3,0,0]=4 565 B8R0.4 CCCCOC/C=C\Cl 9d90a4fa764ef1d03091eed959904ce8 [0,0,1,0,0,0|3,0,0]=4 566 B8R0.4 CCCCOCC=CCl 0f3a0d8674fc69f02691e3930c83fca6 [0,0,1,0,0,0|3,0,0]=4 567 B8R0.4 CCCCOCCC=O 72658ceb532935f03c9214743d27894e [0,0,1,0,0,0|2,0,0]=3 568 B8R0.4 CCCCOCOCC cfd273cfcd393094625c8ef6899069be [0,0,1,0,0,0|2,0,1]=4 569 B8R0.4 CCCNCCCC=O 7ef3dd3b1a5b87258ceb3eef303de84a [0,0,1,0,0,0|2,0,0]=3 570 B8R0.4 CCCNCCOCC 788b5a303fd5463369b362f7c1e82c05 [0,0,1,0,0,0|2,0,1]=4 571 B8R0.4 CCCOC/C=C/C=O 88e4ab35b9a1c04df8f17a2331d70828 [0,0,1,0,0,0|2,0,1]=4 572 B8R0.4 CCCOCCCC=O 36a3d4a82e0ed496435ff747ce5facc5 [0,0,1,0,0,0|2,0,0]=3 573 B8R0.4 CCCOCCNC=O 698de65c018187ef4a1695deaa4ff61b [0,0,1,0,0,0|2,0,0]=3 574 B8R0.4 CCCOCCOC=O 55073fa6df391382112376726b3f158f [0,0,1,0,0,0|1,0,0]=2 575 B8R0.4 CCCOCCOCC 329b2bcd6f865f8651c78dbc452ecac4 [0,0,1,0,0,0|2,0,1]=4 576 B8R0.4 CCCOCCOCF 6893c8c2de2661d9cf2e52b0c6eaabcf [0,0,1,0,0,0|2,0,1]=4 577 B8R0.4 CCCSCCOCC c76e8fe318a52d32927def1b7ebdffa7 [0,0,1,0,0,0|2,0,1]=4 578 B8R0.4 CCCSCCOCF 720d0236377e6144f736cd0f4037f880 [0,0,1,0,0,0|2,0,1]=4 579 B8R0.4 CCNCCCOCC f2ffbe155d0d4a2462785a082836f9b5 [0,0,1,0,0,0|2,0,1]=4 580 B8R0.4 CCOCCCCC=O d263cb2a99b9780b9b3058ad6e318449 [0,0,1,0,0,0|2,0,0]=3 581 B8R0.4 CCOCCCCOC 884278e30d78a09f4fe2f7feb30d0d3f [0,0,1,0,0,0|2,0,1]=4 582 B8R0.4 CCOCCCCSC c32f6fe4365f04c7fe23f7790fb72a1b [0,0,1,0,0,0|2,0,1]=4 583 B8R0.4 CCOCCCNC=O 0935cc0e22c341f4c068e5af7412e4dc [0,0,1,0,0,0|2,0,0]=3 584 B8R0.4 CCOCCCOCC 1ce53fcb477dcf09005ceecf2916bb17 [0,0,1,0,0,0|2,0,1]=4 585 B8R0.4 CCOCCCOCF 2c2cf6b3b3dd51f869cf61ba85e465ae [0,0,1,0,0,0|2,0,1]=4 586 B8R0.4 CCOCCCSCC 93ac6b931fc33d114d8490d7cf350c9c [0,0,1,0,0,0|2,0,1]=4 587 B8R0.4 CCOCCNCC=O 9b6362b955c81d6a818d07f93060ce81 [0,0,1,0,0,0|3,0,0]=4 588 B8R0.4 CCOCCOCC=O 0f0b31cfd13d5d1ef62013c36758792f [0,0,1,0,0,0|3,0,0]=4 589 B8R0.4 CCOCOCCC=O 00ff08f097e74805397d4946d664ecfe [0,0,1,0,0,0|3,0,0]=4 590 B8R0.4 CCSCCCOCF d72522531acf839532bc264a9c459c9f [0,0,1,0,0,0|2,0,1]=4 591 B8R0.4 CCSCCNCC=O 8c2eb03b3d86184cc927f5d4b3c77ac6 [0,0,1,0,0,0|3,0,0]=4 592 B8R0.4 CCSCCOCC=O 6eeca61611fda4d213ea1a5d8f547156 [0,0,1,0,0,0|3,0,0]=4 593 B8R0.4 COCCCCNC=O 6e2b3dcc61de1f0bdb65d861415360be [0,0,1,0,0,0|2,0,0]=3 594 B8R0.4 COCCCCOCF e815a6c287695e1a636002d6644f305e [0,0,1,0,0,0|2,0,1]=4 595 B8R0.4 COCCCNCC=O 79f3770a5332c7aa2006f56f8caadfb2 [0,0,1,0,0,0|3,0,0]=4 596 B8R0.4 COCCCOCC=O 0c2e972178898bc6d1628b2f4858b03c [0,0,1,0,0,0|3,0,0]=4 597 B8R0.4 COCCNCCC=O 231f83e2145cee673a577fcbc59607dc [0,0,1,0,0,0|3,0,0]=4 598 B8R0.4 COCCOCCC=O 2cddfa1660d37f7f1ab97a7bd88a1df8 [0,0,1,0,0,0|3,0,0]=4 599 B8R0.4 COCOCCCC=O 684e0671f7887e8ada626a3c87e02a67 [0,0,1,0,0,0|3,0,0]=4 600 B8R0.4 COCOCCNC=O d2f3dc716da407412ea36aea7489896a [0,0,1,0,0,0|3,0,0]=4 601 B8R0.4 COCOCCOC=O 773d5ab92f0785e20c35a5ecfa8aef71 [0,0,1,0,0,0|2,0,0]=3 602 B8R0.4 CSCCCCNC=O c239594501a90b4a128618f0c7081c5b [0,0,1,0,0,0|2,0,0]=3 603 B8R0.4 CSCCCCOCF d0c2f220ea9615e6564739bdaf4f26d6 [0,0,1,0,0,0|2,0,1]=4 604 B8R0.4 CSCCCNCC=O 639a0134481756177dfb6e8b26f25146 [0,0,1,0,0,0|3,0,0]=4 605 B8R0.4 CSCCCOCC=O 9aff7a336ececb72c4fe588f28037e70 [0,0,1,0,0,0|3,0,0]=4 606 B8R0.4 CSCCNCCC=O 6a9c051f85f5257fb975b52def5686c5 [0,0,1,0,0,0|3,0,0]=4 607 B8R0.4 CSCCOCCC=O b536dffbb68d78cf6840eddbe6be827c [0,0,1,0,0,0|3,0,0]=4 608 B8R0.4 CSCOCCCC=O 02e58623d80bf7d5cca843eacdf2cd45 [0,0,1,0,0,0|3,0,0]=4 609 B8R0.4 CSCOCCNC=O 06cab0f55d10d488e369b65237bc7019 [0,0,1,0,0,0|3,0,0]=4 610 B8R0.4 CSCOCCOC=O 6b8870cbaaae325b360a7cd8be5fab08 [0,0,1,0,0,0|2,0,0]=3 611 B8R0.4 N#CCCCCNC=O 3cd3800040138849f83fc8af50952e52 [0,0,1,0,0,0|2,0,1]=4 612 B8R0.4 N#CCOCCOC=O 9d6003c9923a25956c14b6575f90e53d [0,0,1,0,0,0|2,0,1]=4 613 B8R0.4 O=CCCCCOCF 85b3ca7ddc0c3fb867d0185bbf0921f7 [0,0,1,0,0,0|3,0,0]=4 614 B8R0.4 O=CCCCNCCBr 5e09bfc9621932d4fb0368b0d04a42bb [0,0,1,0,0,0|3,0,0]=4 615 B8R0.4 O=CCCCNCCF 9ef00e7f50632796f91c39cf64b27b1e [0,0,1,0,0,0|3,0,0]=4 616 B8R0.4 O=CCCCNCCI abb8da695e5124ac987c7d8731b9762b [0,0,1,0,0,0|3,0,0]=4 617 B8R0.4 O=CCCCNCCO 1bdd2d1ee3e05ff4d3000e48e13914eb [0,0,1,0,0,0|3,0,0]=4 618 B8R0.4 O=CCCCNCCS 303aeb6b773578a67453b1630ba18dc2 [0,0,1,0,0,0|3,0,0]=4 619 B8R0.4 O=CCCCOCCF e7532aaece8a67865517c3b01b67c5ec [0,0,1,0,0,0|3,0,0]=4 620 B8R0.4 O=CCCCOCCS 991b115ad7b60aa47bc8f80580adc02b [0,0,1,0,0,0|3,0,0]=4 621 B8R0.4 O=CCCNCCCCl f16c75c276bf2599e9ae201a54b0ee63 [0,0,1,0,0,0|3,0,0]=4 622 B8R0.4 O=CCCNCCCO 20d68d5fd2c369dcd2205fd4753202b2 [0,0,1,0,0,0|3,0,0]=4 623 B8R0.4 O=CCCOCCCF 12bf2bf84237f34effc6d41e7d4e1236 [0,0,1,0,0,0|3,0,0]=4 624 B8R0.4 O=CCCOCCCS fa8d8cbc8a3558586641843cfd71f1ec [0,0,1,0,0,0|3,0,0]=4 625 B8R0.4 O=CCNCCCCCl 4eb32c99e72aaf8f46243cc4018004a5 [0,0,1,0,0,0|3,0,0]=4 626 B8R0.4 O=CCNCCCCO 7540d6cb2ce4253a8b70f8723f610795 [0,0,1,0,0,0|3,0,0]=4 627 B8R0.4 O=CCNCCCCS 87cb67d97c5146189dcb0b12c7de3eeb [0,0,1,0,0,0|3,0,0]=4 628 B8R0.4 O=CCOCCCCF 1f1ad11e7509bf0f0a0f4a0a60b01a6b [0,0,1,0,0,0|3,0,0]=4 629 B8R0.4 O=CCOCCCCS 65f9d64787faff90f142a6384e5b9a2f [0,0,1,0,0,0|3,0,0]=4 630 B8R0.4 O=CCOCCOC=O f05f0d0e8934b517680eca7957de44e9 [0,0,1,0,0,0|2,0,1]=4 631 B8R0.4 O=CNCCCCCCl 66cea552e3781af1cb79b403cbf86bb3 [0,0,1,0,0,0|2,0,0]=3 632 B8R0.4 O=CNCCCCCO d786d8c3b7589bade0484b0d1e3b2e3b [0,0,1,0,0,0|2,0,0]=3 633 B8R0.4 O=CNCCOCCF c8a5c0eacdcd1d316a424c4005d58ef9 [0,0,1,0,0,0|3,0,0]=4 634 B8R0.4 O=CNCCOCCO 2965d694fa10a828f84ff41ee0bcab8c [0,0,1,0,0,0|3,0,0]=4 635 B8R0.4 O=CNCCOCCS fd3b3090b4eefe81cd9992494316f59f [0,0,1,0,0,0|3,0,0]=4 636 B8R0.4 O=CNCCSCCO 6350af265f31b9f5de0271d49057ec24 [0,0,1,0,0,0|3,0,0]=4 637 B8R0.4 O=COCCOCCF 3ac9afe53341268fdfe07221ba11eb92 [0,0,1,0,0,0|2,0,0]=3 638 B8R0.4 O=COCCOCCS e57473f45057007c5c8548c766fce976 [0,0,1,0,0,0|2,0,0]=3 639 B8R0.22 C=CCN(CC)CCC 7aebbfb3f75baa8bbab14ad7e2fc6fe2 [0,0,1,0,0,0|3,0,0]=4 640 B8R0.22 CCC(CC#N)NC=O ba773f485fe917b32fd2162e6d6e2c97 [0,0,1,0,0,0|2,0,1]=4 641 B8R0.22 CCC(COC)NC=O 53905710bc62d6f533f443331f56e2bc [0,0,1,0,0,0|2,0,0]=3 642 B8R0.22 CCC(COC)OCF e4a3f6d1c69a2354f3937d8ddd14d68d [0,0,1,0,0,0|2,0,1]=4 643 B8R0.22 CCC(CSC)OCF 2ad6205708c499d48b4ee5a13ffd89a9 [0,0,1,0,0,0|2,0,1]=4 644 B8R0.22 CCCC(CC)NC#N 02d99bdf5a76ac9c852f51329e019127 [0,0,1,0,0,0|2,0,1]=4 645 B8R0.22 CCCC(CC)OCC 2f33f90cfe6f34bcef6403a269e3e2c2 [0,0,1,0,0,0|1,0,1]=3 646 B8R0.22 CCCC(CC)OCF ce7c200aebd362fbdb26e3cffa550e7b [0,0,1,0,0,0|1,0,1]=3 647 B8R0.22 CCCC(CO)NC=O 41f5afc0296d6847bc820d8afc2b5787 [0,0,1,0,0,0|2,0,0]=3 648 B8R0.22 CCCN(CC)CC=O 10f91472c4600bbc31b6ae1008baca40 [0,0,1,0,0,0|2,0,0]=3 649 B8R0.22 CCC[C@@H](CC)OCC b58a52b0075a76b2b518807461776ed4 [0,0,1,0,0,0|1,0,1]=3 650 B8R0.22 CCC[C@@H](CC)OCF 7aa5f0ec7ab4c268dbb1cc54d34ff94b [0,0,1,0,0,0|1,0,1]=3 651 B8R0.22 CCC[C@@H](CO)NC=O 3c94a70b3970ecaf12f548b2138bdede [0,0,1,0,0,0|2,0,0]=3 652 B8R0.22 CCC[C@H](CO)NC=O 930af0e5fd8674584b8a8514e2d4657f [0,0,1,0,0,0|2,0,0]=3 653 B8R0.22 CCN(CC=O)CCCl 4ed90969909b022e2ac83da8060f9efc [0,0,1,0,0,0|3,0,0]=4 654 B8R0.22 CCN(CC=O)CCO 97dbc0347b45240747141aa67b4d0675 [0,0,1,0,0,0|3,0,0]=4 655 B8R0.22 CCOC(CC)COC 5abfd343e0b4d1c299a8c6b54e73b27d [0,0,1,0,0,0|2,0,1]=4 656 B8R0.22 CCOC(CC)CSC 8ed7b9fab73898e63015d64833b57a87 [0,0,1,0,0,0|2,0,1]=4 657 B8R0.22 CC[C@@H](CC#N)NC=O d1d8f2fe5eae06eb9750607c79e07f98 [0,0,1,0,0,0|2,0,1]=4 658 B8R0.22 CC[C@H](CC#N)NC=O fabf20f5d4e21823e8aa2b7704696426 [0,0,1,0,0,0|2,0,1]=4 659 B8R0.22 COCC(CO)NC=O 7cb927b980bd90d760ca02f17ab63be0 [0,0,1,0,0,0|3,0,0]=4 660 B8R0.22 CSCC(CO)NC=O dbcc07b4bda20d44a07ec89880e75884 [0,0,1,0,0,0|3,0,0]=4 661 B8R0.22 O=CNC(CO)CCO 1c386d33bbd7c581f75e6c17d6cd6e2e [0,0,1,0,0,0|3,0,0]=4 662 B8R0.22 O=CN[C@@H](CO)CCO eb8f36be4729f323a89920f2afd3da27 [0,0,1,0,0,0|3,0,0]=4 663 B10R2.58 C=CCN1CC2CC2C1 dc27d1096f581790eb4eb9cb6efe5698 [0,0,0,1,0,0|3,0,0]=4 664 B10R2.58 CCOC1CC2CC2C1 6a8a083a393f1e58f8a2ac9d11c95da3 [0,0,0,1,0,0|1,0,1]=3 665 B10R2.58 CCOC1C[C@@H]2C[C@@H]2C1 fa009518c41528c51bd4b0d216fd21c1 [0,0,0,1,0,0|1,0,1]=3 666 B10R2.58 CCO[C@@H]1C[C@@H]2C[C@@H]2C1 546181f45e7372b1e7d03a25ba055345 [0,0,0,1,0,0|1,0,1]=3 667 B10R2.58 CCO[C@H]1C[C@@H]2C[C@@H]2C1 a92ada4d08b0809e312e91d8c684c32d [0,0,0,1,0,0|1,0,1]=3 668 B10R2.58 FCOC1CC2CC2C1 214213eedfb6b503849ee8eb43d4b5a4 [0,0,0,1,0,0|1,0,1]=3 669 B10R2.58 FCOC1C[C@@H]2C[C@@H]2C1 fd3f97a3fd0daded0c3089105bd1a9db [0,0,0,1,0,0|1,0,1]=3 670 B10R2.58 FCO[C@@H]1C[C@@H]2C[C@@H]2C1 ea973069d44dfd74faf9f7b3f3bfbdf6 [0,0,0,1,0,0|1,0,1]=3 671 B10R2.58 FCO[C@H]1C[C@@H]2C[C@@H]2C1 d924e40659fac57708968a5937d27918 [0,0,0,1,0,0|1,0,1]=3 672 B10R2.58 O=CCN1CC2CC2C1 4c9996e344d47e4af83e3e9b3386a973 [0,0,0,1,0,0|2,0,0]=3 673 B10R2.160 O=CN1C2COCC1C2 a9cae76a1e0d12b072332d73ece71a73 [0,0,0,1,0,0|2,0,0]=3 674 B10R2.161 CCN1C2CCC1CC2 f84f7185249790b2c036181a673a7e64 [0,0,0,1,0,0|2,0,1]=4 675 B10R2.161 CCN1[C@H]2CC[C@@H]1CC2 1bb39b377edf98fd683d63cd5c6d5284 [0,0,0,1,0,0|2,0,1]=4 676 B10R2.161 FCN1C2CCC1CC2 ec63fca497b01a4ffee789ed234578dd [0,0,0,1,0,0|2,0,1]=4 677 B10R2.161 FCN1[C@H]2CC[C@@H]1CC2 bba7cb6f2a13532d3ed0bee530b5104d [0,0,0,1,0,0|2,0,1]=4 678 B10R2.161 O=CN1C2CCC1CC2 60bc77443d963e6f90b1cc919253da95 [0,0,0,1,0,0|1,0,0]=2 679 B10R2.161 O=CN1[C@H]2CC[C@@H]1CC2 a7bf0e73d35ccd15fcf332150a93e8c7 [0,0,0,1,0,0|1,0,0]=2 680 B10R2.161 OCN1C2CCC1CC2 4f8041f5ac2db91636c66649bd7596bc [0,0,0,1,0,0|1,0,2]=4 681 B10R2.161 OCN1[C@H]2CC[C@@H]1CC2 ff809dc4c43cef5c969456bf938e11ae [0,0,0,1,0,0|1,0,2]=4 682 B10R2.172 C=CCN1C2C1CCC2 0a7c8da66ea2abcd87e7a442d5e6133c [0,0,0,1,0,0|3,0,0]=4 683 B10R2.172 O=CCN1C2C1CCC2 ab55566c7a5a788e7a0752de32778f3c [0,0,0,1,0,0|2,0,0]=3 684 B10R2.368 C=CCN1CCC2C1C2 5200f76b90637003a544f2e5d6570fbf [0,0,0,1,0,0|3,0,0]=4 685 B10R2.368 CCOC1CCC2C1C2 d4e9987cb63a9ccb0eead7207c99b478 [0,0,0,1,0,0|1,0,1]=3 686 B10R2.368 CCO[C@@H]1CC[C@@H]2[C@H]1C2 781092ba12891af7e92e6ca046e78c5d [0,0,0,1,0,0|1,0,1]=3 687 B10R2.368 FCOC1CCC2C1C2 1af3907914ca61a44a665cf26399697d [0,0,0,1,0,0|1,0,1]=3 688 B10R2.368 FCO[C@@H]1CC[C@@H]2[C@H]1C2 54ab85d6b6ba339d3d54adf50d80c34c [0,0,0,1,0,0|1,0,1]=3 689 B10R2.368 O=CCN1CCC2C1C2 91f8affa59aea7dd47016dfad8e00d76 [0,0,0,1,0,0|2,0,0]=3 690 B10R2.513 CCN1C2C1CCCC2 bd43fed2867ffc04153365e744c2e524 [0,0,0,1,0,0|2,0,1]=4 691 B10R2.513 FCN1C2C1CCCC2 2511af52074b4ae58c5c72fa4fa08706 [0,0,0,1,0,0|2,0,1]=4 692 B10R2.513 O=CN1C2C1CCCC2 0c0fd4316eddea7e8beb4111dd8a3203 [0,0,0,1,0,0|1,0,0]=2 693 B10R2.513 OCN1C2C1CCCC2 d6916074fac40088857af6efa37abed1 [0,0,0,1,0,0|1,0,2]=4 694 B8R1.8 CCNC1CCCC1 abbec96cb7bed76391f8cd34a2b780b6 [0,0,0,0,1,0|2,0,1]=4 695 B8R1.8 CCOC1CCCC1 ce4ece9e93729f2dc32c7121b6646f41 [0,0,0,0,1,0|1,0,1]=3 696 B8R1.8 CCOC1CCCO1 ace7c24bdcea053e870832c56c8928c4 [0,0,0,0,1,0|2,0,1]=4 697 B8R1.8 CCOC1CCOC1 84e689fe0b2aea2f8383349931affd9e [0,0,0,0,1,0|2,0,1]=4 698 B8R1.8 CCOC1CCSC1 04aaf8fedcad347e8e4be0984e30209b [0,0,0,0,1,0|2,0,1]=4 699 B8R1.8 CCO[C@@H]1CCOC1 dbd17ccad3cb41f9c7226e5aa5839784 [0,0,0,0,1,0|2,0,1]=4 700 B8R1.8 CCO[C@@H]1CCSC1 6024b564e26ca7e04d7b02930d2316cc [0,0,0,0,1,0|2,0,1]=4 701 B8R1.8 CCO[C@H]1CCOC1 086f16e0470dc00d3e8d35a058f10144 [0,0,0,0,1,0|2,0,1]=4 702 B8R1.8 CCO[C@H]1CCSC1 2e0bfb0e7ce3291350197a8c174a6264 [0,0,0,0,1,0|2,0,1]=4 703 B8R1.8 FCNC1CCCC1 aa1dda43fcc2c9304287b028aaf95907 [0,0,0,0,1,0|2,0,1]=4 704 B8R1.8 FCOC1CCCC1 3a18d808c8ea803a7e2173107aa8436c [0,0,0,0,1,0|1,0,1]=3 705 B8R1.8 FCOC1CCCO1 341775c5b3881699fcb9a13a61611ec4 [0,0,0,0,1,0|2,0,1]=4 706 B8R1.8 FCOC1CCOC1 dd266c2430124fff3fce691c18e28234 [0,0,0,0,1,0|2,0,1]=4 707 B8R1.8 FCOC1CCSC1 f8f6f296ad6ade850e96ba039dea79ec [0,0,0,0,1,0|2,0,1]=4 708 B8R1.8 FCO[C@@H]1CCOC1 2f0a74cb641694e38feb66e5e3e7011f [0,0,0,0,1,0|2,0,1]=4 709 B8R1.8 FCO[C@@H]1CCSC1 167bc92bd5239abe1a03b8937d910bee [0,0,0,0,1,0|2,0,1]=4 710 B8R1.8 FCO[C@H]1CCOC1 60d51a47377d177f8c280d0a99b59886 [0,0,0,0,1,0|2,0,1]=4 711 B8R1.8 FCO[C@H]1CCSC1 2d17ed5a52b01d81f24848fd9cde0e5b [0,0,0,0,1,0|2,0,1]=4 712 B8R1.8 N#CNC1CCCC1 1455c5fdc3e5fbc19f5d3501e1b484ad [0,0,0,0,1,0|2,0,1]=4 713 B8R1.8 O=CCN1CCSC1 14861ad96d7cd5c90441f6d38859a442 [0,0,0,0,1,0|3,0,0]=4 714 B8R1.8 O=CNC1CC=CC1 19ecdde8cbf64eb0bd156ac46c4fa7d5 [0,0,0,0,1,0|1,0,2]=4 715 B8R1.8 O=CNC1CCCC1 9941fb95f5bfd095412442670e9f2499 [0,0,0,0,1,0|1,0,0]=2 716 B8R1.8 O=CNC1CCOC1 e7b13204a0b810870373335ae06b13c2 [0,0,0,0,1,0|2,0,0]=3 717 B8R1.8 O=CNC1CCSC1 82c5edb5966e6ade7f67bb51f82f09ea [0,0,0,0,1,0|2,0,0]=3 718 B8R1.8 O=CN[C@@H]1CCOC1 8b6fe9f11693342d0eb8e36d1ad51ff3 [0,0,0,0,1,0|2,0,0]=3 719 B8R1.8 O=CN[C@H]1CCOC1 f295aedd4a6355b7f9c423148debde31 [0,0,0,0,1,0|2,0,0]=3 720 B8R1.8 OCNC1CCCC1 bd97d9ff634af16a4e2cdcc6aa11ca03 [0,0,0,0,1,0|1,0,2]=4 721 B10R1.85 C=CCN1CCCCCC1 dedbea71de50dce4778efb471019b0b0 [0,0,0,0,0,1|3,0,0]=4 722 B10R1.85 C=CCN1CCCOCC1 706b67ffd10afa347d6b3d6a3eaaa538 [0,0,0,0,0,1|3,0,0]=4 723 B10R1.85 CCNC1CCCCCC1 0c95c29b93e32e146162fd72980d84b0 [0,0,0,0,0,1|2,0,1]=4 724 B10R1.85 CCNC1CCCOCC1 f7f3109a402ca4c4a83cfb0bb4504d7a [0,0,0,0,0,1|2,0,1]=4 725 B10R1.85 CCOC1CCCCCC1 3ceaf49955c2e83c7e4ec278fd2e50f6 [0,0,0,0,0,1|1,0,1]=3 726 B10R1.85 CCOC1CCCOCC1 eb88bd3389c520df3554ee47bbccb2fe [0,0,0,0,0,1|1,0,1]=3 727 B10R1.85 CCOC1COCCOC1 3205a3a5e212b917d7141e01b43dd9d7 [0,0,0,0,0,1|2,0,1]=4 728 B10R1.85 FCNC1CCCCCC1 d9941b22490be54ccbbbbf89c73fad6a [0,0,0,0,0,1|2,0,1]=4 729 B10R1.85 FCNC1CCCOCC1 2a4d03554d3a542b5f6f36554a5b6cae [0,0,0,0,0,1|2,0,1]=4 730 B10R1.85 FCOC1CCCCCC1 5716769f937d10c4581f0ddcaefc884e [0,0,0,0,0,1|1,0,1]=3 731 B10R1.85 FCOC1CCCOCC1 060456a2aa48bad55bfafa6777d75ca0 [0,0,0,0,0,1|1,0,1]=3 732 B10R1.85 FCOC1COCCOC1 9dec9caef71250527d4267ee299d6805 [0,0,0,0,0,1|2,0,1]=4 733 B10R1.85 N#CNC1CCCCCC1 e208d8f66371b1148941f69fc311516e [0,0,0,0,0,1|2,0,1]=4 734 B10R1.85 N#CNC1CCCOCC1 a2e72ed5e4219f95f7e814ef46694711 [0,0,0,0,0,1|2,0,1]=4 735 B10R1.85 O=CCN1CCCCCC1 f724e4ec53ccca226b2bc57eaef06e6e [0,0,0,0,0,1|2,0,0]=3 736 B10R1.85 O=CCN1CCCOCC1 21765a29448f0dc0ea8ed5f1c15a3e96 [0,0,0,0,0,1|2,0,0]=3 737 B10R1.85 O=CNC1CCC=CCC1 9151088df81cf55918953c83bf98d6ba [0,0,0,0,0,1|1,0,1]=3 738 B10R1.85 O=CNC1CCCCCC1 113187389de6916fbb9a078d48160950 [0,0,0,0,0,1|1,0,0]=2 739 B10R1.85 OCNC1CCCCCC1 94921a425b816c358f5fadb4a2c976db [0,0,0,0,0,1|1,0,2]=4 740 B10R1.85 OCNC1CCCOCC1 35e0984f80ff727954f6eeffb213ed53 [0,0,0,0,0,1|1,0,2]=4 741 B7R0.1 C=CCCCNCC d6a027a0701e414181b831a715c54cb6 [1,0,1,0,0,0|2,0,0]=4 742 B7R0.1 C=CCCCOCC 44cf1a7a597e160be341d31404acdfaa [1,0,1,0,0,0|2,0,0]=4 743 B7R0.1 C=CCCNCCC c633813bb9d3717e891210de7cc1e8d5 [1,0,1,0,0,0|2,0,0]=4 744 B7R0.1 C=CCCOCCC b938a9e5fd3f24fa3adf9ccf635a9e5b [1,0,1,0,0,0|2,0,0]=4 745 B7R0.1 C=CCNCCCC 3d8f05f7ed31cff346091b529993046e [1,0,1,0,0,0|2,0,0]=4 746 B7R0.1 C=CCOCCCC 01358a2b7449cb631c1f1da5323f5dd1 [1,0,1,0,0,0|2,0,0]=4 747 B7R0.1 C=COCCNCC e376510fa630867a53db8435ac1e7531 [1,0,1,0,0,0|2,0,0]=4 748 B7R0.1 C=COCCOCC d9229c17186e0b503ee0d758327ee4d9 [1,0,1,0,0,0|2,0,0]=4 749 B7R0.1 CCCCCNC=O a8a22095c4bcd5b43c5b29c77fc7eedb [1,0,1,0,0,0|1,0,0]=3 750 B7R0.1 CCCCCOCC bc8c76b482c8637477570a20a92424f9 [1,0,1,0,0,0|1,0,1]=4 751 B7R0.1 CCCCCOCF 12202160b083613b3fc9b1e5cca026a2 [1,0,1,0,0,0|1,0,1]=4 752 B7R0.1 CCCCNCC=O 2e37d7006381e9687c17149af03971de [1,0,1,0,0,0|1,0,0]=3 753 B7R0.1 CCCCNCOC fca288cb8dbe01759ae101c18bfa412c [1,0,1,0,0,0|1,0,1]=4 754 B7R0.1 CCCCOCC=O 059f1387d1800516c5888740482db589 [1,0,1,0,0,0|1,0,0]=3 755 B7R0.1 CCCCOCOC 9cbd5d2e1afa2f28354b07c6bb86bcff [1,0,1,0,0,0|1,0,1]=4 756 B7R0.1 CCCNCCC=O 6175371dd27625c7d44a4a376a810e9d [1,0,1,0,0,0|1,0,0]=3 757 B7R0.1 CCCNCCOC f29ce84f8c4a36f99b7727e369f1b3a2 [1,0,1,0,0,0|1,0,1]=4 758 B7R0.1 CCCNCCON bf9627abd7d34e77302e8e1bfd5dbfaa [1,0,1,0,0,0|2,0,0]=4 759 B7R0.1 CCCOCCC=O 066ce9d71bb9cb79ed95a965d8418289 [1,0,1,0,0,0|1,0,0]=3 760 B7R0.1 CCCOCCOC 587c6353ef70a105adefc48caf2dd9ab [1,0,1,0,0,0|1,0,1]=4 761 B7R0.1 CCNCCCOC 38e4872da65a7f4c607195bb3a42a7d3 [1,0,1,0,0,0|1,0,1]=4 762 B7R0.1 CCOCCCC=O 8252684f63a0fadbbbc733c07d72d862 [1,0,1,0,0,0|1,0,0]=3 763 B7R0.1 CCOCCCOC a7162a0b2ffcde779cbd4b369203415c [1,0,1,0,0,0|1,0,1]=4 764 B7R0.1 CCOCCNC=O 5ff8b0f631a008d336c5b5d059941e52 [1,0,1,0,0,0|2,0,0]=4 765 B7R0.1 CCOCCOC=O 13c874dc60dfb3d1f6f6a29b0d060101 [1,0,1,0,0,0|1,0,0]=3 766 B7R0.1 CCSCCNC=O 385ec0536f2dafb781a8f3aea079d78c [1,0,1,0,0,0|2,0,0]=4 767 B7R0.1 COCCCNC=O 8b809f06a028927c1bb77d4ce795b6c6 [1,0,1,0,0,0|2,0,0]=4 768 B7R0.1 COCCNCC=O 30a27f931dd328052d03310080bbede9 [1,0,1,0,0,0|2,0,0]=4 769 B7R0.1 COCCOCC=O 7bf0866abc6521aca0a006639887e6db [1,0,1,0,0,0|2,0,0]=4 770 B7R0.1 COCOCCC=O 867162fff7db4dfba86a4f93622307d6 [1,0,1,0,0,0|2,0,0]=4 771 B7R0.1 CSCCCNC=O 7314f13ceee46dd5e864578ae6458630 [1,0,1,0,0,0|2,0,0]=4 772 B7R0.1 CSCCNCC=O 8de69eeee638d27e11ca8a7f5e17ae95 [1,0,1,0,0,0|2,0,0]=4 773 B7R0.1 CSCCOCC=O 7ceb38e7eb56bc23c985da3b919bcd85 [1,0,1,0,0,0|2,0,0]=4 774 B7R0.1 CSCOCCC=O eca7e28d98d26bea86d16bbabb7f8fbd [1,0,1,0,0,0|2,0,0]=4 775 B7R0.1 O=CCCCOCF 78f6a2560292de5460d17953e3976f02 [1,0,1,0,0,0|2,0,0]=4 776 B7R0.1 O=CCCNCCBr 291f019ce3bf899c9d2e33793b2b93f1 [1,0,1,0,0,0|2,0,0]=4 777 B7R0.1 O=CCCNCCF 03b16d128f405ac3e0d050695aad18fa [1,0,1,0,0,0|2,0,0]=4 778 B7R0.1 O=CCCNCCI 98b4f0ed1ee425ed4236063d3f41c320 [1,0,1,0,0,0|2,0,0]=4 779 B7R0.1 O=CCCNCCO 624a8e88bd3627d1f4811c83acb74cb8 [1,0,1,0,0,0|2,0,0]=4 780 B7R0.1 O=CCCNCCS 2c7d16d16b489acd0898d35ca2ec1288 [1,0,1,0,0,0|2,0,0]=4 781 B7R0.1 O=CCCOCCF 799d4b07b5e7a35b60f3a0c45dcb8147 [1,0,1,0,0,0|2,0,0]=4 782 B7R0.1 O=CCCOCCS 5ca5a4b308c3272ba99d0c42e8ac625b [1,0,1,0,0,0|2,0,0]=4 783 B7R0.1 O=CCNCCCCl b1d3b8faf2fb5ab605f4c9413bd0ce31 [1,0,1,0,0,0|2,0,0]=4 784 B7R0.1 O=CCNCCCO 68540a99f30371e028542cb2d30d539a [1,0,1,0,0,0|2,0,0]=4 785 B7R0.1 O=CCOCCCF 30c212e5e5e6bba647ac0be6ae41e232 [1,0,1,0,0,0|2,0,0]=4 786 B7R0.1 O=CCOCCCS cee0da51fe633a0479c401372ce33e5f [1,0,1,0,0,0|2,0,0]=4 787 B7R0.1 O=CNCCCCCl f92f31577db7c76752d74048c9613e26 [1,0,1,0,0,0|2,0,0]=4 788 B7R0.1 O=CNCCCCO 2b728fba12236cded175996b460e95da [1,0,1,0,0,0|2,0,0]=4 789 B7R0.1 O=CNCCCCS 8f7648f8a23508fcd6d57892fa9ccef7 [1,0,1,0,0,0|2,0,0]=4 790 B7R0.1 O=COCCOCF 26ea822921d5df0874b513814a734854 [1,0,1,0,0,0|2,0,0]=4 791 B7R0.3 C=CC(C)COCC de472e64667dabd8a37119adef312e1a [1,0,1,0,0,0|2,0,0]=4 792 B7R0.3 C=CC(C)NCCC ce56ff835d97c72d3c77b342679142d9 [1,0,1,0,0,0|2,0,0]=4 793 B7R0.3 C=CC(C)OCCC 8464afc7aadbd92a9fa5abdf7f0413c4 [1,0,1,0,0,0|2,0,0]=4 794 B7R0.3 C=C[C@H](C)OCCC a65433c10fca3bf1d0678a7bf1f757da [1,0,1,0,0,0|2,0,0]=4 795 B7R0.3 CC(C=O)NCCBr e62dcd68debd83fbc562e7642602b43a [1,0,1,0,0,0|2,0,0]=4 796 B7R0.3 CC(C=O)NCCF 3f043d9316d202555af83ac46b0372cc [1,0,1,0,0,0|2,0,0]=4 797 B7R0.3 CC(C=O)NCCI 0d60b9f4140097c5e41c90179bcb853b [1,0,1,0,0,0|2,0,0]=4 798 B7R0.3 CC(C=O)NCCO 96981c8499c542f7fb2722dd0795dded [1,0,1,0,0,0|2,0,0]=4 799 B7R0.3 CC(C=O)NCCS 2cf826365eb6ff97374090530c3ccaf5 [1,0,1,0,0,0|2,0,0]=4 800 B7R0.3 CC(C=O)OCCF 9676f45a56098fb26857cb4b8fa0bcb0 [1,0,1,0,0,0|2,0,0]=4 801 B7R0.3 CC(C=O)OCCS 707059ad8fea5768d8b6a96e20ccb88c [1,0,1,0,0,0|2,0,0]=4 802 B7R0.3 CCCCN(C)C=O 9e1fd6b74517af7f400dd8faea413d3e [1,0,1,0,0,0|1,0,0]=3 803 B7R0.3 CCCNC(C)C=O 7e933d948c2e669e598ddc3c695365b5 [1,0,1,0,0,0|1,0,0]=3 804 B7R0.3 CCCN[C@H](C)C=O 7a63958ebc59429c5dcc5f06d2683ced [1,0,1,0,0,0|1,0,0]=3 805 B7R0.3 CCCOC(C)C=O 64f7abc1e62101b123e23f4c74164a7e [1,0,1,0,0,0|1,0,0]=3 806 B7R0.3 CCCO[C@H](C)C=O 08508c09bba0136bf81083f7b07956d8 [1,0,1,0,0,0|1,0,0]=3 807 B7R0.3 CCNC[C@@H](C)OC 6e88fe4f7175c837d5238f2168d0e9a3 [1,0,1,0,0,0|1,0,1]=4 808 B7R0.3 CCNC[C@H](C)OC 0584eeded494335d50fae9461e407d42 [1,0,1,0,0,0|1,0,1]=4 809 B7R0.3 CCOCC(C)OC 00214de46f1604d32f121bd91c115789 [1,0,1,0,0,0|1,0,1]=4 810 B7R0.3 CCOC[C@@H](C)OC ecceb3df9b78b58b5b76fdc0f6911e92 [1,0,1,0,0,0|1,0,1]=4 811 B7R0.3 CCOC[C@H](C)OC fd13d8de7d92a89af8eab0e711a6bd02 [1,0,1,0,0,0|1,0,1]=4 812 B7R0.3 CN(C=O)CCCO d9d91dbce26e2eec91c5287e49989c6b [1,0,1,0,0,0|2,0,0]=4 813 B7R0.3 COCCN(C)C=O 31e1cd7ac14afa72fee2870fbd09d003 [1,0,1,0,0,0|2,0,0]=4 814 B7R0.3 COCOC(C)C=O 3707afff98f056c5534ccbc658911b1f [1,0,1,0,0,0|2,0,0]=4 815 B7R0.3 COCO[C@H](C)C=O 34de2462dae77151365395b9e28ef026 [1,0,1,0,0,0|2,0,0]=4 816 B7R0.3 CSCCN(C)C=O a6a4e8ea5b94212ce62d31147e5f4a78 [1,0,1,0,0,0|2,0,0]=4 817 B7R0.3 CSCOC(C)C=O f3e4026b3b027885c21fad548f08eb1c [1,0,1,0,0,0|2,0,0]=4 818 B7R0.3 C[C@H](C=O)NCCBr 1c88aafc7cf0e6ecf5a695c971d96c26 [1,0,1,0,0,0|2,0,0]=4 819 B7R0.3 C[C@H](C=O)NCCF 312336c63755d0cb499e935eb3842567 [1,0,1,0,0,0|2,0,0]=4 820 B7R0.3 C[C@H](C=O)NCCI 365ac184287fbb3cff12bb64cb86f31d [1,0,1,0,0,0|2,0,0]=4 821 B7R0.3 C[C@H](C=O)NCCO c2af2d81a42c507f9635465d1a70fd23 [1,0,1,0,0,0|2,0,0]=4 822 B7R0.3 C[C@H](C=O)NCCS e667bec1b7d47f2ddf6d0ff1e8c85311 [1,0,1,0,0,0|2,0,0]=4 823 B7R0.3 C[C@H](C=O)OCCF a0a5cbe08a1078c6900a6f0acbda2a8d [1,0,1,0,0,0|2,0,0]=4 824 B7R0.3 C[C@H](C=O)OCCS 15879fc18488d12b970460b0830cdd69 [1,0,1,0,0,0|2,0,0]=4 825 B7R0.7 CC(CCO)NC=O 892cc7a0d08c79535b8216399ec9a52d [1,0,1,0,0,0|2,0,0]=4 826 B7R0.7 CCCC(C)NC=O 3b3fdc3aff176c80def2c27de1055661 [1,0,1,0,0,0|1,0,0]=3 827 B7R0.7 CCCC(C)OCC f8a13dff786165aad9d4cfd77470c868 [1,0,1,0,0,0|1,0,1]=4 828 B7R0.7 CCCC(C)OCF e53aa9a0be571d844376e05ef43b0243 [1,0,1,0,0,0|1,0,1]=4 829 B7R0.7 CCCN(C)CC=O 1c62a002dac50aaed88f0fc6ab9f5e8c [1,0,1,0,0,0|2,0,0]=4 830 B7R0.7 CCC[C@@H](C)OCC ad566fabe40b68a5eff8830d607c6d5f [1,0,1,0,0,0|1,0,1]=4 831 B7R0.7 CCC[C@@H](C)OCF 7663802c803efdb5ffdb71e415c741b7 [1,0,1,0,0,0|1,0,1]=4 832 B7R0.7 CCC[C@H](C)NC=O d7593154c1a9fc5db070af269735e419 [1,0,1,0,0,0|1,0,0]=3 833 B7R0.7 CCC[C@H](C)OCC 1fee3bcf808f20e21cce64abf5182523 [1,0,1,0,0,0|1,0,1]=4 834 B7R0.7 CCC[C@H](C)OCF aaf4041a99f006e154459098e0beb231 [1,0,1,0,0,0|1,0,1]=4 835 B7R0.7 COCC(C)NC=O 45a0b649e4600219d555cc1f9498bdc8 [1,0,1,0,0,0|2,0,0]=4 836 B7R0.7 COC[C@@H](C)NC=O d1500602ed7da53624fa7ed4337a50c3 [1,0,1,0,0,0|2,0,0]=4 837 B7R0.7 COC[C@H](C)NC=O 9ace0af38b8cac4dc5e5d6d9564d36a8 [1,0,1,0,0,0|2,0,0]=4 838 B7R0.7 C[C@@H](CCO)NC=O eb95ec52954fcdf5dbae515a1b580040 [1,0,1,0,0,0|2,0,0]=4 839 B7R0.7 C[C@H](CCO)NC=O b74e456417922c93cc7901b1f7160ec1 [1,0,1,0,0,0|2,0,0]=4 840 B7R0.12 C=CC(CC)OCC 3384f4e6ac585bde2972dae19026fd2c [1,0,1,0,0,0|2,0,0]=4 841 B7R0.12 CCC(CC)NC=O 4175bd0bc40e9e83245363507b336b46 [1,0,1,0,0,0|1,0,0]=3 842 B7R0.12 CCC(CC)OCF 636355b0b109acffc3ac81270024a401 [1,0,1,0,0,0|1,0,1]=4 843 B7R0.12 CCC(CO)NC=O 742cd9cb7df8523077fcd6bd9de1d480 [1,0,1,0,0,0|2,0,0]=4 844 B7R0.12 CCCN(C=O)CC c9c4d92e42201b75307332d9c7692aa9 [1,0,1,0,0,0|1,0,0]=3 845 B7R0.12 CCN(C=O)CCCl 03512ce3018e8845973ab6d439faef81 [1,0,1,0,0,0|2,0,0]=4 846 B7R0.12 CCN(C=O)CCO f06d113e63228ddd0fbad99b8e842127 [1,0,1,0,0,0|2,0,0]=4 847 B7R0.12 CCOC(CC)CC 60351d1ac9a51febe159ba00076742a6 [1,0,1,0,0,0|1,0,1]=4 848 B7R0.12 CC[C@@H](CO)NC=O 637c953e48cb45b4be088640a9f26fb2 [1,0,1,0,0,0|2,0,0]=4 849 B7R0.12 CC[C@H](CO)NC=O c5c2fc5e70a5e94955887b0f6db6a1a2 [1,0,1,0,0,0|2,0,0]=4 850 B9R0.4 CC(=O)NC(C)CCCO a409476001ef0aff88161eb86bbe5db4 [0,1,1,0,0,0|2,0,0]=4 851 B9R0.4 CC(=O)N[C@H](C)CCCO 9a046063324b070dedfa3d3739745edc [0,1,1,0,0,0|2,0,0]=4 852 B9R0.4 CC(=O)OC(C)NCCBr 3f1c204a59be950e15bd4feaa3675001 [0,1,1,0,0,0|2,0,0]=4 853 B9R0.4 CC(=O)OC(C)NCCF 228736a205797ea15b61fd8e68b87e67 [0,1,1,0,0,0|2,0,0]=4 854 B9R0.4 CC(=O)OC(C)NCCI c286c8d763aee4f3868d0f17a0d94c3b [0,1,1,0,0,0|2,0,0]=4 855 B9R0.4 CC(=O)OC(C)NCCO ac5b0ecf8a083e3beb0c0204a7207851 [0,1,1,0,0,0|2,0,0]=4 856 B9R0.4 CC(=O)OC(C)NCCS 7d5c0fa70919a52ddfecf5135d6ca3d7 [0,1,1,0,0,0|2,0,0]=4 857 B9R0.4 CC(=O)OC(C)OCCF da7affa6b14ff4a99be2b6049cc00c20 [0,1,1,0,0,0|2,0,0]=4 858 B9R0.4 CC(=O)OC(C)OCCS 4f606964d17daf8060dfd0795b3ba543 [0,1,1,0,0,0|2,0,0]=4 859 B9R0.4 CCCCC(C)NC(=O)C 8c6d1ed0c215b53ce5178d84ca54f179 [0,1,1,0,0,0|1,0,0]=3 860 B9R0.4 CCCCC(C)OC(C)C 7d0041807bb32d7526544e4be63436cc [0,1,1,0,0,0|1,0,1]=4 861 B9R0.4 CCCCN(C)CC(=O)N 11a1371995cbb23558bde2849897cd1f [0,1,1,0,0,0|2,0,0]=4 862 B9R0.4 CCCCN(C)CC(=O)O 2ab0d2e55fe8aec010bf103a963bc69a [0,1,1,0,0,0|2,0,0]=4 863 B9R0.4 CCCC[C@@H](C)NC(=O)C 438042d33778c53023e503021e96ec24 [0,1,1,0,0,0|1,0,0]=3 864 B9R0.4 CCCC[C@@H](C)OC(C)C f2902ac7b36ddb0c2d5e60097d1384f3 [0,1,1,0,0,0|1,0,1]=4 865 B9R0.4 CCCC[C@H](C)OC(C)C 8664abbc4990f641117154ef08ccd4ca [0,1,1,0,0,0|1,0,1]=4 866 B9R0.4 CCCNC(C)CC(=O)O 2d5bf9ae8b9d33e8e5f89637131f543d [0,1,1,0,0,0|2,0,0]=4 867 B9R0.4 CCCNC(C)OC(=O)C 284b4f4f851898134a79c6bd0e68afcb [0,1,1,0,0,0|1,0,0]=3 868 B9R0.4 CCCN[C@@H](C)CC(=O)O 7dd12827a70b6d0f3eb1d105dd87e0f1 [0,1,1,0,0,0|2,0,0]=4 869 B9R0.4 CCCN[C@H](C)CC(=O)O 49558fe427823d5af7fc8494312831dd [0,1,1,0,0,0|2,0,0]=4 870 B9R0.4 CCCOC(C)CC(=O)N 7cf4be07e7dc937d6ecb8463967854c0 [0,1,1,0,0,0|2,0,0]=4 871 B9R0.4 CCCOC(C)CC(=O)O 464f5b57c4d27de1c96f770591eff582 [0,1,1,0,0,0|2,0,0]=4 872 B9R0.4 CCCOC(C)OC(=O)C 6c8b7c881ac77e2983b8764698a63829 [0,1,1,0,0,0|1,0,0]=3 873 B9R0.4 CCCO[C@@H](C)CC(=O)O 672c62b3f5b285724de30ca7be3b4175 [0,1,1,0,0,0|2,0,0]=4 874 B9R0.4 CCCO[C@H](C)CC(=O)O 78d34951f815792f2a0561852a75d7ea [0,1,1,0,0,0|2,0,0]=4 875 B9R0.4 CCOCC(C)NC(=O)C 891e676bd6e096c9e78b579a4d42a446 [0,1,1,0,0,0|2,0,0]=4 876 B9R0.4 CCOC[C@@H](C)NC(=O)C 82a9a914977322c59ad71ebab295e094 [0,1,1,0,0,0|2,0,0]=4 877 B9R0.4 COCOC(C)OC(=O)C c73ebf630a8c2a58943bc42724d4d8d9 [0,1,1,0,0,0|2,0,0]=4 878 B9R0.5 C/C=C/C(C)OCCCC fe4021be7eb9ddab5576a9db273dea52 [0,1,1,0,0,0|2,0,0]=4 879 B9R0.5 C=CCC(C)CNCCC 57145e6cde5992e28644e2005aca4a52 [0,1,1,0,0,0|2,0,0]=4 880 B9R0.5 C=CCC(C)COCCC 7e85aeea39477af9cfd8878a56719121 [0,1,1,0,0,0|2,0,0]=4 881 B9R0.5 C=CCC(C)OCCCC f19d39a50fdfd6ad2267d2fbf05a2b41 [0,1,1,0,0,0|2,0,0]=4 882 B9R0.5 C=CC[C@@H](C)OCCCC b20fd45ea1dd5c3cccb6f7a22cc0e480 [0,1,1,0,0,0|2,0,0]=4 883 B9R0.5 C=CC[C@H](C)OCCCC 591b4bbc39f98a534a3a9dc1d5e7fa51 [0,1,1,0,0,0|2,0,0]=4 884 B9R0.5 CC=CC(C)OCCCC ac5240649470c3f452111f552f4c343a [0,1,1,0,0,0|2,0,0]=4 885 B9R0.5 CCCCCC(C)NC=O 8ebcf0f9aaad2891aad2d805d5730b90 [0,1,1,0,0,0|1,0,0]=3 886 B9R0.5 CCCCCC(C)OCC 730550df732f69eef1e6a549de510b2c [0,1,1,0,0,0|1,0,1]=4 887 B9R0.5 CCCCCC(C)OCF 91cb6ddeef5e8a675eb7cdefedcad036 [0,1,1,0,0,0|1,0,1]=4 888 B9R0.5 CCCCCN(C)CC=O 78bb5a09a7732691e4b2ef4ef4683cdd [0,1,1,0,0,0|2,0,0]=4 889 B9R0.5 CCCCC[C@@H](C)OCC 8f2bb2e64349b01f8c7137850e01df92 [0,1,1,0,0,0|1,0,1]=4 890 B9R0.5 CCCCC[C@@H](C)OCF dddbd16c736b0cf2a41037d9959ad3e8 [0,1,1,0,0,0|1,0,1]=4 891 B9R0.5 CCCCC[C@H](C)NC=O e9ec5cd528aff38be097392db8efa5ac [0,1,1,0,0,0|1,0,0]=3 892 B9R0.5 CCCCC[C@H](C)OCC 2cf9a829d5eb89110544892bd459dee4 [0,1,1,0,0,0|1,0,1]=4 893 B9R0.5 CCCCC[C@H](C)OCF 127043f0fb9c13be21bff612ac563c1b [0,1,1,0,0,0|1,0,1]=4 894 B9R0.5 CCCNCC(C)OCC 67b61dd333dbaac4f86976019539379e [0,1,1,0,0,0|1,0,1]=4 895 B9R0.5 CCCOCC(C)OCC a9309e87d325b6f2b1644b3d0636499f [0,1,1,0,0,0|1,0,1]=4 896 B9R0.5 CCCOCC(C)OCF 3c217a0a0555b3f9e34d23a6269a5c80 [0,1,1,0,0,0|1,0,1]=4 897 B9R0.5 CCOCCN(C)CC=O 7acec88657f57cb021d93d1cfad83ba5 [0,1,1,0,0,0|2,0,0]=4 898 B9R0.5 CN(CC=O)CCCCO 837ff6a1ec2106692e579c582051f56a [0,1,1,0,0,0|2,0,0]=4 899 B9R0.5 COCCCN(C)CC=O 635fdf23af030f1cf489d4fee368aafe [0,1,1,0,0,0|2,0,0]=4 900 B9R0.8 CCCCN(C)C(=O)C=O ed88baf3777d406fb62edc639f2ad7fc [0,1,1,0,0,0|2,0,0]=4 901 B9R0.8 CCCCN(C)C(C)C=O 3e234b787b915a4fa23d538586656631 [0,1,1,0,0,0|2,0,0]=4 902 B9R0.8 CCCCN(C)[C@H](C)C=O 5a3e8452b96b13acaa984c292628b701 [0,1,1,0,0,0|2,0,0]=4 903 B9R0.18 C#CCOC(C)CCCC a6bf8a2fbde7f7937d084a3ce3f21abb [0,1,1,0,0,0|1,0,1]=4 904 B9R0.18 C#CCO[C@@H](C)CCCC d36d8187ba9fe99db945c7ac19c589a4 [0,1,1,0,0,0|1,0,1]=4 905 B9R0.18 C#CCO[C@H](C)CCCC 4f5dddefc5ccbd74a979c1cd0f8b39d1 [0,1,1,0,0,0|1,0,1]=4 906 B9R0.18 C=CCCC(C)OCC=O 245abb6264f9567ca70639c760a12645 [0,1,1,0,0,0|0,0,2]=4 907 B9R0.18 C=CCC[C@@H](C)OCC=O e49696fb124602a3eb80822ba9f553f3 [0,1,1,0,0,0|0,0,2]=4 908 B9R0.18 C=CCNC(C)CCCC b7e84b71e08b90f5001bff3ed3e79daa [0,1,1,0,0,0|2,0,0]=4 909 B9R0.18 C=CCN[C@H](C)CCCC 717efbfcef1985e4262e18519df5cea0 [0,1,1,0,0,0|2,0,0]=4 910 B9R0.18 C=CCOC(C)CCCC e05948ecaeff8c28551c390203faa54a [0,1,1,0,0,0|1,0,0]=3 911 B9R0.18 C=CCOC(C)CCOC f3c795786c7022d726115bd3f9ed9fd7 [0,1,1,0,0,0|2,0,0]=4 912 B9R0.18 C=CCOC(C)CCSC c718e5cdece70b71b1fcdd31f660a068 [0,1,1,0,0,0|2,0,0]=4 913 B9R0.18 C=CCOC(C)COCC 764c32529709baf48be8cb2233a09513 [0,1,1,0,0,0|2,0,0]=4 914 B9R0.18 C=CCO[C@@H](C)CCCC 785b4fd0e7d2a1185c3f37e0ca8f48b9 [0,1,1,0,0,0|1,0,0]=3 915 B9R0.18 C=CCO[C@H](C)CCCC 8279474ab6fe084178c62f137ffa8b53 [0,1,1,0,0,0|1,0,0]=3 916 B9R0.18 CC(CCCO)NCC=O c7f19c3ade85d6e05312f1a58a72a0b0 [0,1,1,0,0,0|2,0,0]=4 917 B9R0.18 CCC#CC(C)OCC=O 2b1abd7d5586aaa42e43353c0b47708a [0,1,1,0,0,0|0,0,2]=4 918 B9R0.18 CCCCC(C)COCC 58365c9c9e662717f1bbd5e7f384f400 [0,1,1,0,0,0|1,0,1]=4 919 B9R0.18 CCCCC(C)COCF 09ffbdc6b473e3828f87d6ed9dd457d6 [0,1,1,0,0,0|1,0,1]=4 920 B9R0.18 CCCCC(C)NCC=O 17b13b22e791a7a0520f1bfd34f0e857 [0,1,1,0,0,0|1,0,0]=3 921 B9R0.18 CCCCC(C)OCC#N a49c2f2b2ea1e149d9135336e3cfab81 [0,1,1,0,0,0|1,0,1]=4 922 B9R0.18 CCCCC(C)OCC=O eda04f1a17d81cf08f2f32366dad6c90 [0,1,1,0,0,0|0,0,0]=2 923 B9R0.18 CCCCC(C)OCCC 03a9a54da7ce8074115dc5963e2487d3 [0,1,1,0,0,0|1,0,1]=4 924 B9R0.18 CCCCC(C)OCCF 3f799a7d24890a960e30edb9bb965fe5 [0,1,1,0,0,0|1,0,1]=4 925 B9R0.18 CCCCC(C)OCCS 498240fa81efc48a364f781ba80a2136 [0,1,1,0,0,0|0,1,1]=4 926 B9R0.18 CCCCC(C)OCOC 2647a8351841aefd7767410eec944f14 [0,1,1,0,0,0|0,0,2]=4 927 B9R0.18 CCCCC(C)OCSC 675cf4242578276faef054101752fff5 [0,1,1,0,0,0|0,1,1]=4 928 B9R0.18 CCCCC(O)CNC=O eec15ce6abd05c06c56bfdaadbde9a0b [0,1,1,0,0,0|2,0,0]=4 929 B9R0.18 CCCCN(C)CCC=O bf49116c9af507ce2cb2ede0349f47b2 [0,1,1,0,0,0|2,0,0]=4 930 B9R0.18 CCCC[C@@H](C)NCC=O 04b56f2fdbafe2353e082e13229eedf1 [0,1,1,0,0,0|1,0,0]=3 931 B9R0.18 CCCC[C@@H](C)OCC#N 3768ccd6166470de9b4699e30d70c1fa [0,1,1,0,0,0|1,0,1]=4 932 B9R0.18 CCCC[C@@H](C)OCC=O 993915524a0a10ada5c5e7e66a19b57f [0,1,1,0,0,0|0,0,0]=2 933 B9R0.18 CCCC[C@@H](C)OCCC 3919e2b8d370ec3c53a10b41264f7777 [0,1,1,0,0,0|1,0,1]=4 934 B9R0.18 CCCC[C@@H](C)OCCF 9e6e7d202edc7f99d8130b72feff99d7 [0,1,1,0,0,0|1,0,1]=4 935 B9R0.18 CCCC[C@@H](C)OCCS da0dc6ff36920e5da60fbd4660080dd8 [0,1,1,0,0,0|0,1,1]=4 936 B9R0.18 CCCC[C@@H](C)OCSC 5f93169fe26264ec85ba889f3f1492c7 [0,1,1,0,0,0|0,1,1]=4 937 B9R0.18 CCCC[C@H](C)OCC#N 8fb280eb0fa37a708edcd7a81ea14614 [0,1,1,0,0,0|1,0,1]=4 938 B9R0.18 CCCC[C@H](C)OCC=O 64aea713a6e78b2a7c1dcccee369110a [0,1,1,0,0,0|0,0,0]=2 939 B9R0.18 CCCC[C@H](C)OCCC 66356f9f032d16fe1fbfbbab77eafd41 [0,1,1,0,0,0|1,0,1]=4 940 B9R0.18 CCCC[C@H](C)OCCF 452211e2967f01206ae8ab89031a98ce [0,1,1,0,0,0|1,0,1]=4 941 B9R0.18 CCCC[C@H](C)OCCS e7099a214ea1736c512624854b8788ff [0,1,1,0,0,0|0,1,1]=4 942 B9R0.18 CCCC[C@H](C)OCSC 6f25ee6b4cd5695fd2c5f7349596b758 [0,1,1,0,0,0|0,1,1]=4 943 B9R0.18 CCOCC(C)OCC=O 87171cd27869753cf4db9a5f37f279d2 [0,1,1,0,0,0|1,0,0]=3 944 B9R0.18 COCCC(C)OCC=O d178477da94c6d9f9961f612dbf593df [0,1,1,0,0,0|1,0,0]=3 945 B9R0.18 CSCCC(C)OCC=O 1beb2ad0681904a21447ab254d6c6257 [0,1,1,0,0,0|1,0,0]=3 946 B9R0.18 C[C@H](CCCO)CNC=O 55135246a811de86327512e6eb7c8cd9 [0,1,1,0,0,0|2,0,0]=4 947 B9R0.18 C[C@H](CCCO)NCC=O 60c5b1603c2bcf27c36775727a810895 [0,1,1,0,0,0|2,0,0]=4 948 B9R0.34 CCC(C)CC(C)NC=O da1680796a95364ea1511cef23b93312 [0,1,1,0,0,0|1,0,0]=3 949 B9R0.34 CCC(O)CN(C)CC=O e70ac0c48a159bedf4512721fbb9849c [0,1,1,0,0,0|2,0,0]=4 950 B9R0.40 CCCCC(CC)OCC f8505015964e9c49dca586a5dee77bc8 [0,1,1,0,0,0|1,0,1]=4 951 B9R0.40 CCCCC(CC)OCF 0e987e381d58de15ad70b5901cf1f3fd [0,1,1,0,0,0|1,0,1]=4 952 B9R0.40 CCCCC(CO)NC=O f57b27fd178a9c21476ed36190092a88 [0,1,1,0,0,0|1,0,0]=3 953 B9R0.40 CCCCN(CC)CC=O d871d9f188cada87ccdeb3afe3a7e109 [0,1,1,0,0,0|2,0,0]=4 954 B9R0.40 CCCC[C@@H](CO)NC=O 42c575253100261406d9404d8f784f62 [0,1,1,0,0,0|1,0,0]=3 955 B9R0.40 CCCC[C@H](CO)NC=O 8e288fee5f34d414b25597e2bfe4aa89 [0,1,1,0,0,0|1,0,0]=3 956 B9R0.40 CSCCC(CO)NC=O 68aaa4eb282b8a236b75d241474debc4 [0,1,1,0,0,0|2,0,0]=4 957 B9R0.40 CSCC[C@@H](CO)NC=O d2f210ede537b3bb2a60357b8814a073 [0,1,1,0,0,0|2,0,0]=4 958 B9R0.40 CSCC[C@H](CO)NC=O cc7aef84e49c6f0818ca22825b094c35 [0,1,1,0,0,0|2,0,0]=4 959 B9R0.40 O=CNC(CO)CCCO 0ab348ed17e29f13f068b776021b3b41 [0,1,1,0,0,0|2,0,0]=4 960 B9R0.48 CC(C)CCC(C)NC=O 0e29263a1badab455d9e9ecb6f4fc6bd [0,1,1,0,0,0|1,0,0]=3 961 B9R0.48 CC(C)CCC(C)OCF 60f38c3752acae577ed864cc86a1a5a9 [0,1,1,0,0,0|1,0,1]=4 962 B9R0.48 CC(C)CCN(C)CC=O 63e9028e1872ca734b43a3e2f79564b8 [0,1,1,0,0,0|2,0,0]=4 963 B9R0.48 CC(CCN(C)C)NC=O 85ac04c2bfc3fcba95d660dd80bebe67 [0,1,1,0,0,0|2,0,0]=4 964 B9R0.48 CC(O)CCN(C)CC=O 68d5890db2cadede87ecf10404f7c147 [0,1,1,0,0,0|2,0,0]=4 965 B9R0.48 CCOC(C)CCC(C)C 238b79e992f85c5e82c5f29d7dc01557 [0,1,1,0,0,0|1,0,1]=4 966 B9R0.48 C[C@@H](CCN(C)C)NC=O 5b57fd99dc1bb12d18329d62ec4f7e81 [0,1,1,0,0,0|2,0,0]=4 967 B9R0.48 C[C@H](CCN(C)C)NC=O 4e8c3bebb153fd5965552aebb697c744 [0,1,1,0,0,0|2,0,0]=4 968 B9R0.66 CC(C)(CCCO)NC=O bdfb5bba7f97be6a6c65d2922a696b78 [0,1,1,0,0,0|2,0,0]=4 969 B9R0.66 CCOCC(C)(C)NC=O c926b383b4d777b650d576cc6eae3720 [0,1,1,0,0,0|2,0,0]=4 970 B9R0.66 CCSCC(C)(C)NC=O 6470f94310c98505d2f9f8924079652a [0,1,1,0,0,0|2,0,0]=4 971 B9R0.66 CSCCC(C)(C)NC=O 453ee6b95425e18f1cf872ad5712f4da [0,1,1,0,0,0|2,0,0]=4 972 B9R0.2 C=C(C)COCCOC=O e8ff5eee3d0b7bf35567e690a7866878 [0,1,1,0,0,0|1,0,1]=4 973 B9R0.2 C=COCCCNC(C)C 777c7d2dfc8abf56f3a7c2b52ce50716 [0,1,1,0,0,0|2,0,0]=4 974 B9R0.2 C=COCCNCC(C)C a06e4680115927d5360f337be7af0873 [0,1,1,0,0,0|2,0,0]=4 975 B9R0.2 C=COCCNCC(C)O 789be98f12e5b0a06a59a99695d75afb [0,1,1,0,0,0|2,0,0]=4 976 B9R0.2 C=COCCNC[C@@H](C)O 987571217d13fe5ab112e0581a2d3587 [0,1,1,0,0,0|2,0,0]=4 977 B9R0.2 C=COCCNC[C@H](C)O 645d83b788089bb4ef88c7b87cc7e56a [0,1,1,0,0,0|2,0,0]=4 978 B9R0.2 C=COCCOCC(C)C 037c83e0afa78f2fb0f987f38801cc5b [0,1,1,0,0,0|2,0,0]=4 979 B9R0.2 CC(=O)NCCCCCCl 9810fdb3b44bef22ae3578265fbb7e47 [0,1,1,0,0,0|2,0,0]=4 980 B9R0.2 CC(=O)NCCCCCO 6528e540cd36869e25e869b54ef6b7c3 [0,1,1,0,0,0|2,0,0]=4 981 B9R0.2 CC(=O)OCCCOCF 839300b4a23ae7f13d770824ad5ba603 [0,1,1,0,0,0|2,0,0]=4 982 B9R0.2 CC(=O)OCCNCCBr 86e70651e2ef68f3f2552b68c9fd9535 [0,1,1,0,0,0|2,0,0]=4 983 B9R0.2 CC(=O)OCCNCCF bec963d44f70641aefa68f79b9e9f243 [0,1,1,0,0,0|2,0,0]=4 984 B9R0.2 CC(=O)OCCNCCI 512fc7b78f65a98aaa9b5a24a55dd29e [0,1,1,0,0,0|2,0,0]=4 985 B9R0.2 CC(=O)OCCNCCO fbc6a9b22162aa146956efcd3fed83de [0,1,1,0,0,0|2,0,0]=4 986 B9R0.2 CC(=O)OCCNCCS 0d342b6bb6a97266d2b38620542a908c [0,1,1,0,0,0|2,0,0]=4 987 B9R0.2 CC(=O)OCCOCCF 5233cd269967a92f3e4bf92bf7bbcb9d [0,1,1,0,0,0|2,0,0]=4 988 B9R0.2 CC(=O)OCCOCCS 63ea2c4adc5d14c13c2d8bc53161cf6c [0,1,1,0,0,0|2,0,0]=4 989 B9R0.2 CC(=O)OCNCCCCl 4c34a9d20da691b9859482fc9219ac0e [0,1,1,0,0,0|2,0,0]=4 990 B9R0.2 CC(=O)OCNCCCO 89aaf0a95b5cea62d4321235936deeff [0,1,1,0,0,0|2,0,0]=4 991 B9R0.2 CC(=O)OCOCCCF 2bfb3b9762b06c6017d0cd676ab47db2 [0,1,1,0,0,0|2,0,0]=4 992 B9R0.2 CC(=O)OCOCCCS 3586e68ace2929307ff5b4a00f63eae7 [0,1,1,0,0,0|2,0,0]=4 993 B9R0.2 CC(C)CCCCOCF f3b722f8d58182c1fd9af9438362dbc9 [0,1,1,0,0,0|1,0,1]=4 994 B9R0.2 CC(C)CCCNCC=O a9635929cb5f6673003ac83cb324a189 [0,1,1,0,0,0|2,0,0]=4 995 B9R0.2 CC(C)CCCOCC=O bdd24f9b5eb3e927a3ba2032fbfb17f1 [0,1,1,0,0,0|2,0,0]=4 996 B9R0.2 CC(C)CCNCCC=O 3b8ed8b8e431e36419922df1c8d0950c [0,1,1,0,0,0|2,0,0]=4 997 B9R0.2 CC(C)CCOCCC=O 35e5fe09d7f172e01a3fc9fb57f41a74 [0,1,1,0,0,0|2,0,0]=4 998 B9R0.2 CC(C)CNCCCC=O 872fc89896121b754faaba603a4d1689 [0,1,1,0,0,0|2,0,0]=4 999 B9R0.2 CC(C)COCCCC=O 9c821c872d407f7f9bdf7808cd327ff2 [0,1,1,0,0,0|2,0,0]=4 1000 B9R0.2 CC(C)COCCNC=O a0952173bb62da1f84f22c4def655b76 [0,1,1,0,0,0|2,0,0]=4 1001 B9R0.2 CC(C)COCCOC=O 93375745bf75f1308b2bac5c5e314bd3 [0,1,1,0,0,0|1,0,0]=3 1002 B9R0.2 CC(C)OCCCCC=O 2da322abd65c1cb61d17df904562e2b4 [0,1,1,0,0,0|2,0,0]=4 1003 B9R0.2 CC(C)OCCCNC=O e96409307329684ed58a23e721f30ca6 [0,1,1,0,0,0|2,0,0]=4 1004 B9R0.2 CC(C)SCCCNC=O df15df0d049edf2c640ed4bbc56cdc64 [0,1,1,0,0,0|2,0,0]=4 1005 B9R0.2 CC(F)COCCCC=O 45096cdcd588570c1ee49532928d3413 [0,1,1,0,0,0|2,0,0]=4 1006 B9R0.2 CC(O)CCNCCC=O dad92ac32d5c5e0bc77e419c63b4a071 [0,1,1,0,0,0|2,0,0]=4 1007 B9R0.2 CC(O)CNCCCC=O daeba85824bf9b8a7fe9f07668cb65d2 [0,1,1,0,0,0|2,0,0]=4 1008 B9R0.2 CC(S)COCCCC=O 2376ada453809bf361ec74ea138f968f [0,1,1,0,0,0|2,0,0]=4 1009 B9R0.2 CCCCCCNC(=O)C 39216d9115deaeddca0efb3bbde5d8cb [0,1,1,0,0,0|1,0,0]=3 1010 B9R0.2 CCCCCCOC(C)C 7177762ff96f664d7658fbf17ddec082 [0,1,1,0,0,0|1,0,1]=4 1011 B9R0.2 CCCCCNCC(=O)C 08234591298ac478e9a5e187e3c7cd4f [0,1,1,0,0,0|2,0,0]=4 1012 B9R0.2 CCCCCNCC(=O)N df1b9e1446c7d44676f292e2874ccd31 [0,1,1,0,0,0|2,0,0]=4 1013 B9R0.2 CCCCCNCC(=O)O 50016d51731d942cf0c89f16645029e7 [0,1,1,0,0,0|2,0,0]=4 1014 B9R0.2 CCCCCOCC(=O)C 499380b88b419c17c81350fa0478ac8c [0,1,1,0,0,0|2,0,0]=4 1015 B9R0.2 CCCCCOCC(=O)N ac3a2c078e0201ad0c0dae7872f135fb [0,1,1,0,0,0|2,0,0]=4 1016 B9R0.2 CCCCCOCC(=O)O 880094d6a378029586dbdb044c20be8e [0,1,1,0,0,0|2,0,0]=4 1017 B9R0.2 CCCCNCCC(=O)C 23aeaf3a105e0d1d74c9a684b3a6ae92 [0,1,1,0,0,0|2,0,0]=4 1018 B9R0.2 CCCCNCCC(=O)N 2d98b6dd492f5bb47b303e933495165d [0,1,1,0,0,0|2,0,0]=4 1019 B9R0.2 CCCCNCCC(=O)O 2d9ff059f34708cc77b9165028ecaefa [0,1,1,0,0,0|2,0,0]=4 1020 B9R0.2 CCCCNCOC(=O)C f747ae8d75ae5077cb457c21af32c3d4 [0,1,1,0,0,0|1,0,0]=3 1021 B9R0.2 CCCCNCSC(=O)N c68e80692e27dc4bcd1af702e7ea36a7 [0,1,1,0,0,0|1,1,0]=4 1022 B9R0.2 CCCCOCCC(=O)C 6113a5294b2f420804d815edd80f0f40 [0,1,1,0,0,0|2,0,0]=4 1023 B9R0.2 CCCCOCCC(=O)N 5eb5a710abf4db2a2dded5d930468391 [0,1,1,0,0,0|2,0,0]=4 1024 B9R0.2 CCCCOCCC(=O)O f7b98599c570a58f82c0818a4675303f [0,1,1,0,0,0|2,0,0]=4 1025 B9R0.2 CCCCOCNC(=O)C c90275af9c3de9eb05be63b1efa3b4d9 [0,1,1,0,0,0|2,0,0]=4 1026 B9R0.2 CCCCOCNC(=O)N c8570fe5b0fca07c49ea855c2c714e28 [0,1,1,0,0,0|2,0,0]=4 1027 B9R0.2 CCCCOCOC(=O)C 52b453d7294c4b6acb8f00c70315374a [0,1,1,0,0,0|1,0,0]=3 1028 B9R0.2 CCCCOCSC(=O)N d1d81793d91d56bfe6b40ff2fdeafcee [0,1,1,0,0,0|1,1,0]=4 1029 B9R0.2 CCCNCCCC(=O)C 59b56db2c5ba6f2408c45d91cf5d07cf [0,1,1,0,0,0|2,0,0]=4 1030 B9R0.2 CCCNCCCC(=O)N ad3cbfcffc5634ad25d1d1d605d0c75d [0,1,1,0,0,0|2,0,0]=4 1031 B9R0.2 CCCNCCCC(=O)O 2c6599e2a5de3ceb0ce4fd582834477f [0,1,1,0,0,0|2,0,0]=4 1032 B9R0.2 CCCNCCNC(=O)C 8ec9c538248c1278a7a78c753f9b558d [0,1,1,0,0,0|2,0,0]=4 1033 B9R0.2 CCCNCCNC(=O)N eba9cf87c3d4b4412b3b52d629da0618 [0,1,1,0,0,0|2,0,0]=4 1034 B9R0.2 CCCNCCOC(=O)C 1f7e1f87180a6b7613488d41ed0bd627 [0,1,1,0,0,0|1,0,0]=3 1035 B9R0.2 CCCNCCSC(=O)C 9a734654dda6d6cb5b5c8675b98c7ffb [0,1,1,0,0,0|1,1,0]=4 1036 B9R0.2 CCCOCCCC(=O)C 3197867314079ee7d28a75ba48b024e1 [0,1,1,0,0,0|2,0,0]=4 1037 B9R0.2 CCCOCCCC(=O)N 070095bcac514fc69d894401c1bbf694 [0,1,1,0,0,0|2,0,0]=4 1038 B9R0.2 CCCOCCCC(=O)O 0bf29d754b3e882141bfdc8089deee25 [0,1,1,0,0,0|2,0,0]=4 1039 B9R0.2 CCCOCCNC(=O)C 2d108407d153229ed52501407a328bfe [0,1,1,0,0,0|2,0,0]=4 1040 B9R0.2 CCCOCCNC(=O)N de0f07e5faa70e06a173f52c30b9f0f6 [0,1,1,0,0,0|2,0,0]=4 1041 B9R0.2 CCCOCCOC(=O)C f41b865aa303cc7ca2bd22086d82154a [0,1,1,0,0,0|1,0,0]=3 1042 B9R0.2 CCCOCCSC(=O)C e5fbc3852cf2e5bc0f0d48122e1eb071 [0,1,1,0,0,0|1,1,0]=4 1043 B9R0.2 CCNCCCCC(=O)N e58565c8abd8e5ef4e9f04f253e40e9c [0,1,1,0,0,0|2,0,0]=4 1044 B9R0.2 CCNCCCCC(=O)O c85642c501ae78ad2dab942f5836991c [0,1,1,0,0,0|2,0,0]=4 1045 B9R0.2 CCNCCCNC(=O)C 81f3181e8e4443de7d578da2748320f4 [0,1,1,0,0,0|2,0,0]=4 1046 B9R0.2 CCOCCCCC(=O)C ecee09a6206772fa3d500ecaf82261c4 [0,1,1,0,0,0|2,0,0]=4 1047 B9R0.2 CCOCCCCC(=O)N 6c8808518c393835c53b3e5d4f87702a [0,1,1,0,0,0|2,0,0]=4 1048 B9R0.2 CCOCCCCC(=O)O dd3c266ef7ca2d55081985bcebc78969 [0,1,1,0,0,0|2,0,0]=4 1049 B9R0.2 CCOCCCCC(C)C 342635d8f7fe78b6b1c62374e4a1ad34 [0,1,1,0,0,0|1,0,1]=4 1050 B9R0.2 CCOCCCNC(=O)C c5dadd69f1df46bcde7d3d147d2b830b [0,1,1,0,0,0|2,0,0]=4 1051 B9R0.2 CCOCCCOC(=O)C 521ac746c4773e46268f3042c9c9e91c [0,1,1,0,0,0|1,0,0]=3 1052 B9R0.2 CCOCCCO[N+](=O)[O-] 671da1fb10fc3d567c6bf28af17e030a [0,1,1,0,0,0|2,0,0]=4 1053 B9R0.2 CCOCCCSC(=O)C c7c25084ef75859ffb4a847bdfcca873 [0,1,1,0,0,0|1,1,0]=4 1054 B9R0.2 CN(C)CCCCNC=O 2e9bad4ba89324f58cb42b7773bcd69a [0,1,1,0,0,0|2,0,0]=4 1055 B9R0.2 CN(C)COCCOC=O 42383fbf9ac9af51652831d0be7b6dd0 [0,1,1,0,0,0|2,0,0]=4 1056 B9R0.2 COCCCCNC(=O)C 4f652cda1775947bb169784843d0beab [0,1,1,0,0,0|2,0,0]=4 1057 B9R0.2 COCCNCOC(=O)C 7c792011f968ec1a1d9667b50dc4d640 [0,1,1,0,0,0|2,0,0]=4 1058 B9R0.2 COCCOCOC(=O)C 3c0c9969f08b445ef676eb92f534751f [0,1,1,0,0,0|2,0,0]=4 1059 B9R0.2 COCOCCOC(=O)C c1d21b4657b103686de2e70024d8053c [0,1,1,0,0,0|2,0,0]=4 1060 B9R0.2 CSCCCCNC(=O)C fe724d5efdffb6641eb31ec001ed77cf [0,1,1,0,0,0|2,0,0]=4 1061 B9R0.2 CSCCNCOC(=O)C 4a9417d660a2b8f603a487e0613a69d1 [0,1,1,0,0,0|2,0,0]=4 1062 B9R0.2 CSCCOCOC(=O)C 4ce161e7666f6d339ad656d877b5738e [0,1,1,0,0,0|2,0,0]=4 1063 B9R0.2 CSCOCCOC(=O)C 85f658ca31404ad6a9d937e79a707f17 [0,1,1,0,0,0|2,0,0]=4 1064 B9R0.2 C[C@@H](F)COCCCC=O 15ec93434fa37469dace6cc0d307b1c7 [0,1,1,0,0,0|2,0,0]=4 1065 B9R0.2 C[C@@H](O)CCNCCC=O 6661f70d05883b3717e63de7ccf03505 [0,1,1,0,0,0|2,0,0]=4 1066 B9R0.2 C[C@@H](O)CNCCCC=O 6e8902a63b22adf010822e70d20b9de4 [0,1,1,0,0,0|2,0,0]=4 1067 B9R0.2 C[C@H](F)COCCCC=O cd3cf6e1ccde2460618b3cd07e9f0c33 [0,1,1,0,0,0|2,0,0]=4 1068 B9R0.2 C[C@H](O)CCNCCC=O 3db470150683485e06f6af186a125748 [0,1,1,0,0,0|2,0,0]=4 1069 B9R0.2 C[C@H](O)CNCCCC=O 97a2309139eba09278aa90c3d2821b80 [0,1,1,0,0,0|2,0,0]=4 1070 B9R0.2 O=CNCCCCC(F)F a4b2e7fcaed3b86f361e3ba8965c8b25 [0,1,1,0,0,0|2,0,0]=4 1071 B9R0.2 O=COCCOCC(F)F 381d7bd9c83ca8a439f79ab3fced2463 [0,1,1,0,0,0|2,0,0]=4 1072 B9R0.45 C#CCCCCCNC=O 353c9727650993b322d351830acdf93c [0,1,1,0,0,0|1,0,1]=4 1073 B9R0.45 C#CCCCCOCC=O 7374e2bc75ec57e5871816f717aa486e [0,1,1,0,0,0|0,0,2]=4 1074 B9R0.45 C#CCCOCCOC=O 83211b3a9a2875ee4d94d6c4e4081a42 [0,1,1,0,0,0|0,0,2]=4 1075 B9R0.45 C#CCOCCCCCC f5db1c348f2482ec2d74aff14ea6fbb8 [0,1,1,0,0,0|1,0,1]=4 1076 B9R0.45 C/C=C/CCCOCC=O 1133dd39557966bbfc717550ad829422 [0,1,1,0,0,0|0,0,2]=4 1077 B9R0.45 C/C=C/CCCOCCC 6078f7ffc27dfa8185f6236738ef681e [0,1,1,0,0,0|2,0,0]=4 1078 B9R0.45 C/C=C/CCOCCCC 34807d765a53dafaafda84290da499b4 [0,1,1,0,0,0|2,0,0]=4 1079 B9R0.45 C/C=C/CNCCCCC 173af57cfda70fbf416f0d5599bfa036 [0,1,1,0,0,0|2,0,0]=4 1080 B9R0.45 C/C=C/COCCCCC 802c5cbc78037013e3e1230ad72e88ef [0,1,1,0,0,0|2,0,0]=4 1081 B9R0.45 C/C=C/COCCOC=O e819ad25deb5d2df2d81c446421a10a2 [0,1,1,0,0,0|0,0,2]=4 1082 B9R0.45 C/C=C\CCCNCCC bd38004b14a3ffe818d001cefe29aee7 [0,1,1,0,0,0|2,0,0]=4 1083 B9R0.45 C/C=C\CCCOCC=O d18705bb046350f1567ecd8aed8ca6a7 [0,1,1,0,0,0|0,0,2]=4 1084 B9R0.45 C/C=C\CCCOCCC 083c73f409535e210af3eb7849dd56ad [0,1,1,0,0,0|2,0,0]=4 1085 B9R0.45 C/C=C\CNCCCCC 2ee64f407eb13d42c64dbdca505fc819 [0,1,1,0,0,0|2,0,0]=4 1086 B9R0.45 C/C=C\COCCCCC 49d9ba2c76d4226b734a25af963b3a40 [0,1,1,0,0,0|2,0,0]=4 1087 B9R0.45 C/C=C\COCCOC=O 17d1af70c1d9a0bec32f4992817ff790 [0,1,1,0,0,0|0,0,2]=4 1088 B9R0.45 C=CCCCCCNC=O 37acb8face8da4e33847766c3e966de6 [0,1,1,0,0,0|1,0,1]=4 1089 B9R0.45 C=CCCCCCNCC 890f1c6c1d85667d7cffa859ba2c1d3e [0,1,1,0,0,0|2,0,0]=4 1090 B9R0.45 C=CCCCCCOCC 23f590b48ebd5146440db0699ec4bb83 [0,1,1,0,0,0|2,0,0]=4 1091 B9R0.45 C=CCCCCNCCC 1c3124d4bfead54322e8b6cd10acbe7e [0,1,1,0,0,0|2,0,0]=4 1092 B9R0.45 C=CCCCCOCC=O 4cdebe78f89dc273e9c86e4da9bd53c6 [0,1,1,0,0,0|0,0,2]=4 1093 B9R0.45 C=CCCCCOCCC f624e5cfeefd7c8f70f95b431a05113e [0,1,1,0,0,0|2,0,0]=4 1094 B9R0.45 C=CCCCNCCCC fa1d0b4e193451fb553c9cd2afd75cca [0,1,1,0,0,0|2,0,0]=4 1095 B9R0.45 C=CCCCOCCCC e8806365586991cd800b2ef6da7fc881 [0,1,1,0,0,0|2,0,0]=4 1096 B9R0.45 C=CCCNCCCCC a855019ae48c9b8cf6923444d001ccd3 [0,1,1,0,0,0|2,0,0]=4 1097 B9R0.45 C=CCCOCCCCC 6e7cf8472e35f7c7bd7858bc8c7bfd04 [0,1,1,0,0,0|2,0,0]=4 1098 B9R0.45 C=CCCOCCOC=O 669d6dddab0aec33a8de73c11c6d8591 [0,1,1,0,0,0|0,0,2]=4 1099 B9R0.45 C=CCNCCCCCC 6384eba9acd253c5ddf82f9491922adb [0,1,1,0,0,0|2,0,0]=4 1100 B9R0.45 C=CCOCCCCCC 87e2c78ad35addafbe1ba3af3a2416ee [0,1,1,0,0,0|1,0,0]=3 1101 B9R0.45 C=CCOCCCCOC 128cb8201d6a9addfa90ce2aa3d56855 [0,1,1,0,0,0|2,0,0]=4 1102 B9R0.45 C=CCOCCCCSC d6f879632d2f8647ad8df3191aa8d592 [0,1,1,0,0,0|2,0,0]=4 1103 B9R0.45 C=CCOCCCOCC 07f39b6bf8d420b1e0d79a059a1cabfd [0,1,1,0,0,0|2,0,0]=4 1104 B9R0.45 C=CCOCCCSCC 010127de1abeb4b03bb349c6ddd307c9 [0,1,1,0,0,0|2,0,0]=4 1105 B9R0.45 C=CCOCCNCCC 9694c4d9a9f18cb3ea4ec1572bfb4ddb [0,1,1,0,0,0|2,0,0]=4 1106 B9R0.45 C=CCOCCOCCC efb69812f28efe0f9f62374b7669e490 [0,1,1,0,0,0|2,0,0]=4 1107 B9R0.45 C=CCOCCSCCC 06be4be84f87fa36d14a267f98502073 [0,1,1,0,0,0|2,0,0]=4 1108 B9R0.45 C=COCCCCOCC af306989d4deb93a89f269ce19f884c9 [0,1,1,0,0,0|1,0,0]=3 1109 B9R0.45 C=COCCCCOCF 50c0607f55a8209e7fc37c96dd312573 [0,1,1,0,0,0|2,0,0]=4 1110 B9R0.45 C=COCCCNCCC 48f364dfd76ffa0b91930c0b5e61593d [0,1,1,0,0,0|1,0,0]=3 1111 B9R0.45 C=COCCCNCCF 8a4377b1293c4c3a356c117bc22f1276 [0,1,1,0,0,0|2,0,0]=4 1112 B9R0.45 C=COCCCNCCO 06c96074c4860e09f343f58912e6352b [0,1,1,0,0,0|2,0,0]=4 1113 B9R0.45 C=COCCCNCCS 82042d396eed08d179f973d36b8680d2 [0,1,1,0,0,0|2,0,0]=4 1114 B9R0.45 C=COCCCNCOC 7165fb7dc1db9d60dd04e6f58d60b83f [0,1,1,0,0,0|2,0,0]=4 1115 B9R0.45 C=COCCCNCSC 1218193fde8f5b9da4d83a81f4ceeacd [0,1,1,0,0,0|2,0,0]=4 1116 B9R0.45 C=COCCNCCCC a4714520314ca7cd019c104ad0112ac9 [0,1,1,0,0,0|1,0,0]=3 1117 B9R0.45 C=COCCNCCCF f3e2b4fd1de0dc9bbf62d1b344a7bac4 [0,1,1,0,0,0|2,0,0]=4 1118 B9R0.45 C=COCCNCCCO d27f80adf1430ea08deaa2cefb519d7b [0,1,1,0,0,0|2,0,0]=4 1119 B9R0.45 C=COCCNCCCS 3141383726fb60b6effd0dcc6457a22f [0,1,1,0,0,0|2,0,0]=4 1120 B9R0.45 C=COCCNCCOC 8998d3f2852cb060cf80f9e513ded42d [0,1,1,0,0,0|2,0,0]=4 1121 B9R0.45 C=COCCNCCSC 0eb4df1ced90f3cd2e7965b4838f2c42 [0,1,1,0,0,0|2,0,0]=4 1122 B9R0.45 C=COCCNCOCC 1307fb188bd023c0a1e33682053c534b [0,1,1,0,0,0|2,0,0]=4 1123 B9R0.45 C=COCCOCCCC c861b9e6afb5156062cdccf5beab2100 [0,1,1,0,0,0|1,0,0]=3 1124 B9R0.45 C=COCCOCCCF 325dbbe62a7d23e9a09f0f079dac21f6 [0,1,1,0,0,0|2,0,0]=4 1125 B9R0.45 C=COCCOCCCS 84870c3b7ba54bfa81156e923badff1a [0,1,1,0,0,0|2,0,0]=4 1126 B9R0.45 C=COCCOCCOC d5c7454fb8eeee486998f67fc36cc9ef [0,1,1,0,0,0|2,0,0]=4 1127 B9R0.45 C=COCCOCCSC 711c9866788c25cca93044aa576a1794 [0,1,1,0,0,0|2,0,0]=4 1128 B9R0.45 C=COCCOCOCC 126e9a328f128a52a96dcf4759bdbcbd [0,1,1,0,0,0|2,0,0]=4 1129 B9R0.45 CC#CCCCOCC=O 663ad91ba809ad42bac7437ef74a39d4 [0,1,1,0,0,0|0,0,2]=4 1130 B9R0.45 CC#CCOCCOC=O 99367d885087b4d5132fdf1004ef0c19 [0,1,1,0,0,0|0,0,2]=4 1131 B9R0.45 CC/C=C/CCOCC=O ad17a670e163a34530891c854a5f696c [0,1,1,0,0,0|0,0,2]=4 1132 B9R0.45 CC/C=C\CCOCC=O 43305c6de6e2aa8f989b2fa311880427 [0,1,1,0,0,0|0,0,2]=4 1133 B9R0.45 CC=CCCCOCC=O a48ec6b46a57870327d7e3aa293527bd [0,1,1,0,0,0|0,0,2]=4 1134 B9R0.45 CC=CCCCOCCC 544004ad9efa2af2fea80f1c7a474136 [0,1,1,0,0,0|2,0,0]=4 1135 B9R0.45 CC=CCNCCCCC 4ef4adafa1d8c573d6eb296bc442117e [0,1,1,0,0,0|2,0,0]=4 1136 B9R0.45 CC=CCOCCCCC 805449d8867d5a337059530a7812a078 [0,1,1,0,0,0|2,0,0]=4 1137 B9R0.45 CCC#CCCOCC=O f3592ea51856d33dfc0b4bb86b6a1514 [0,1,1,0,0,0|0,0,2]=4 1138 B9R0.45 CCC/C=C/COCC=O 4b38aa72153068d33113c423eeaba184 [0,1,1,0,0,0|0,0,2]=4 1139 B9R0.45 CCC/C=C\COCC=O bf01e182e8daf457f7933faee15ce932 [0,1,1,0,0,0|0,0,2]=4 1140 B9R0.45 CCCC#CCOCC=O a97331af7fccddc94ac63e85e9270e0b [0,1,1,0,0,0|0,0,2]=4 1141 B9R0.45 CCCCCCCNC=O 9b073fb330d599f3dde0b2db41b840f2 [0,1,1,0,0,0|1,0,0]=3 1142 B9R0.45 CCCCCCCOCC afc5a86de4d9d2aada96fa893fe06937 [0,1,1,0,0,0|1,0,1]=4 1143 B9R0.45 CCCCCCCOCF 34dddba0abdfe53e071e6123614e32ad [0,1,1,0,0,0|1,0,1]=4 1144 B9R0.45 CCCCCCNCC=O 7bf21a30ec03a5d95442fb7cb6f190b9 [0,1,1,0,0,0|1,0,0]=3 1145 B9R0.45 CCCCCCOCC#N 41f322377cad05989d164a4262163638 [0,1,1,0,0,0|1,0,1]=4 1146 B9R0.45 CCCCCCOCC=O bd855bb441849ecb00a1d491cea228b2 [0,1,1,0,0,0|0,0,0]=2 1147 B9R0.45 CCCCCCOCCC e53b5b4f9e861a4f0969c775813c954e [0,1,1,0,0,0|1,0,1]=4 1148 B9R0.45 CCCCCCOCCF 5c07b9abefb4c7383b2510ed2f25aa7d [0,1,1,0,0,0|1,0,1]=4 1149 B9R0.45 CCCCCCOCCS dfca5cb8f17cf53fc21013be4aea075a [0,1,1,0,0,0|0,1,1]=4 1150 B9R0.45 CCCCCCOCOC 6663dbbf181def3e6cf6b976451eb0e9 [0,1,1,0,0,0|0,0,2]=4 1151 B9R0.45 CCCCCCOCSC ea8aeb7aec2e44107948b184f1a2484b [0,1,1,0,0,0|0,1,1]=4 1152 B9R0.45 CCCCCNC/C=C/Cl dd2b4d6593db8690c89984276577f51f [0,1,1,0,0,0|2,0,0]=4 1153 B9R0.45 CCCCCNC/C=C\Cl fb74b9636967ca4beacb07a8f7ddd469 [0,1,1,0,0,0|2,0,0]=4 1154 B9R0.45 CCCCCNC/C=C\O a03bd9f596fd925d470752532a1e67bf [0,1,1,0,0,0|1,0,1]=4 1155 B9R0.45 CCCCCNCCC=O eb975a62ee073d19d198cbf0dd0dbc33 [0,1,1,0,0,0|1,0,0]=3 1156 B9R0.45 CCCCCNCOCC 106dd0a5d7506881af71fe2f076cb844 [0,1,1,0,0,0|1,0,1]=4 1157 B9R0.45 CCCCCOC/C=C/Cl 902b3675920ce425dd913260445c6a1b [0,1,1,0,0,0|2,0,0]=4 1158 B9R0.45 CCCCCOC/C=C\Cl 3081f394d252ec216de633eb3f90aefe [0,1,1,0,0,0|2,0,0]=4 1159 B9R0.45 CCCCCOCC=CCl 1caf48ce8f7b269d545bfce57c62ccdf [0,1,1,0,0,0|2,0,0]=4 1160 B9R0.45 CCCCCOCCC=O ed64f81c6eb909127bbb96fe2d29088b [0,1,1,0,0,0|1,0,0]=3 1161 B9R0.45 CCCCCOCOCC 61d6517ecd367dc788621782453f190f [0,1,1,0,0,0|1,0,1]=4 1162 B9R0.45 CCCCNCCCC=O be1900420fface744e26218846840016 [0,1,1,0,0,0|1,0,0]=3 1163 B9R0.45 CCCCNCCOCC 39271ffac0a4948f82700c61c9eec153 [0,1,1,0,0,0|1,0,1]=4 1164 B9R0.45 CCCCOC/C=C/C=O 2da2f2ec693713191f08b0d2f08d4dd9 [0,1,1,0,0,0|1,0,1]=4 1165 B9R0.45 CCCCOCCCC=O e3a2ccc9f19eff655a1e3387aa118b3a [0,1,1,0,0,0|1,0,0]=3 1166 B9R0.45 CCCCOCCNC=O 4226cf4337dc176d54852a303582fe15 [0,1,1,0,0,0|1,0,0]=3 1167 B9R0.45 CCCCOCCOC=O 731530ac43d06b0807181f538b37c31d [0,1,1,0,0,0|0,0,0]=2 1168 B9R0.45 CCCCOCCOCC bc40d3f7a271e2ee8715a56f03d564ef [0,1,1,0,0,0|1,0,1]=4 1169 B9R0.45 CCCCOCCOCF 07adb0bf6498af630a31d7ca7d57b829 [0,1,1,0,0,0|1,0,1]=4 1170 B9R0.45 CCCCSCCOCC 696d57545195b0a32e7d1cb44c602929 [0,1,1,0,0,0|1,0,1]=4 1171 B9R0.45 CCCCSCCOCF 2ebbef8cba35a7b011868c08f9cbced9 [0,1,1,0,0,0|1,0,1]=4 1172 B9R0.45 CCCNCCCCC=O f2022f14c7209eed0862d6ecf6b84706 [0,1,1,0,0,0|1,0,0]=3 1173 B9R0.45 CCCNCCCOCC a836c1341cedce3cb982b7dda3393120 [0,1,1,0,0,0|1,0,1]=4 1174 B9R0.45 CCCNCCOCC=O 1acace12342365729be0b4a1c8839b77 [0,1,1,0,0,0|1,0,0]=3 1175 B9R0.45 CCCOCCCCC=O 8b78d2c4a466c2768be601b9198fb016 [0,1,1,0,0,0|1,0,0]=3 1176 B9R0.45 CCCOCCCNC=O 3f83c74e540093398b86151d188b589d [0,1,1,0,0,0|1,0,0]=3 1177 B9R0.45 CCCOCCCOCC 7ae5cc2cef81f72870de148e55495f6e [0,1,1,0,0,0|1,0,1]=4 1178 B9R0.45 CCCOCCNCC=O cdec424df104fd1655eaaf340942285e [0,1,1,0,0,0|2,0,0]=4 1179 B9R0.45 CCCOCCOCC=O 486de8dd4e53e5f78a86ffc7c128bf3d [0,1,1,0,0,0|1,0,0]=3 1180 B9R0.45 CCCSCCOCC=O e8465b63891a9e011620a8eb43746fcd [0,1,1,0,0,0|1,0,0]=3 1181 B9R0.45 CCOCCCCCCF 1581be03b145221792da0e70f0dc7ced [0,1,1,0,0,0|1,0,1]=4 1182 B9R0.45 CCOCCCCCCS 890481a3122baa8d804b207afa67ebc3 [0,1,1,0,0,0|1,0,1]=4 1183 B9R0.45 CCOCCCNCC=O 1df50ec465f64bbc25635b22e5db7849 [0,1,1,0,0,0|2,0,0]=4 1184 B9R0.45 CCOCCCOCC=O cf6a32481fe179a2dab7e02bde302388 [0,1,1,0,0,0|1,0,0]=3 1185 B9R0.45 CCOCCNCCC=O 1589f5d637413f41c0bad2d8a4cd3b81 [0,1,1,0,0,0|2,0,0]=4 1186 B9R0.45 CCOCCOCCC=O fba0b09a493de7243832a69755d5a406 [0,1,1,0,0,0|2,0,0]=4 1187 B9R0.45 CCOCOCCCC=O 8ebce82bd916a55c6d87bc905a09f51f [0,1,1,0,0,0|2,0,0]=4 1188 B9R0.45 CCOCOCCNC=O 1f04069abdc79a13f2b31dcce221deef [0,1,1,0,0,0|2,0,0]=4 1189 B9R0.45 CCOCOCCOC=O 3f9d016c5825b4d3c13708d373f1904b [0,1,1,0,0,0|1,0,0]=3 1190 B9R0.45 CCSCCCCNC=O e3da595d950c9d5eba0c543529449821 [0,1,1,0,0,0|1,0,0]=3 1191 B9R0.45 CCSCCCOCC=O ff794a905fa0fbec7cf974222d58c65f [0,1,1,0,0,0|1,0,0]=3 1192 B9R0.45 CCSCCNCCC=O a73cdd3c5e667bfa86a2f130b2447f60 [0,1,1,0,0,0|2,0,0]=4 1193 B9R0.45 CCSCCOCCC=O 4abc77696f56ecc9cbf6b43c5ce07dd7 [0,1,1,0,0,0|2,0,0]=4 1194 B9R0.45 COCCCCCNC=O e93060d28d3ca03cb27bbc266d47205c [0,1,1,0,0,0|1,0,0]=3 1195 B9R0.45 COCCCCNCC=O bc0f621bc614bad8c542e04b6f8c00d4 [0,1,1,0,0,0|2,0,0]=4 1196 B9R0.45 COCCCCOCC=O 5bf6bdc536c03e33ef79afe0bce39d17 [0,1,1,0,0,0|1,0,0]=3 1197 B9R0.45 COCCCNCCC=O b57190bb20fa468cbc8789f244d6b619 [0,1,1,0,0,0|2,0,0]=4 1198 B9R0.45 COCCCOCCC=O b6a7a464a93f4512a62aaafac7d2c3bf [0,1,1,0,0,0|2,0,0]=4 1199 B9R0.45 COCCNCCCC=O 8de8c440c27ce646b454682cc54ec04c [0,1,1,0,0,0|2,0,0]=4 1200 B9R0.45 COCCOCCCC=O 4eced31e0a91724ea66865665efb8a73 [0,1,1,0,0,0|2,0,0]=4 1201 B9R0.45 COCCOCCNC=O 5e7b5dc6a2bdf3c54f930b381d1b5f5a [0,1,1,0,0,0|2,0,0]=4 1202 B9R0.45 COCCOCCOC=O e4b02c69ad76bfd6e69932198cedf7cf [0,1,1,0,0,0|1,0,0]=3 1203 B9R0.45 COCOCCCCC=O 1e9f4f95dc82f1192a72acc421b3ceb4 [0,1,1,0,0,0|2,0,0]=4 1204 B9R0.45 COCOCCOCC=O 56cd8f5e42e3aae0878d43f728c9efb2 [0,1,1,0,0,0|2,0,0]=4 1205 B9R0.45 CSCCCCNCC=O ceb16b1926dbac74a0dccfe6e9c90c38 [0,1,1,0,0,0|2,0,0]=4 1206 B9R0.45 CSCCCCOCC=O c382918f846eeb37fed2c51c97422532 [0,1,1,0,0,0|1,0,0]=3 1207 B9R0.45 CSCCCNCCC=O d38fed5441cd6c2e041c6d8986238557 [0,1,1,0,0,0|2,0,0]=4 1208 B9R0.45 CSCCCOCCC=O 8295bf8657dc69649b9faab665f00482 [0,1,1,0,0,0|2,0,0]=4 1209 B9R0.45 CSCCNCCCC=O 8d7d5642d85386280bfc36051d0df084 [0,1,1,0,0,0|2,0,0]=4 1210 B9R0.45 CSCCOCCCC=O 52e7ca7dbd7d70965091faf706831a8b [0,1,1,0,0,0|2,0,0]=4 1211 B9R0.45 CSCCOCCNC=O 45e773006217e1f2d795f168e07555a6 [0,1,1,0,0,0|2,0,0]=4 1212 B9R0.45 CSCCOCCOC=O 40e891e92003ea888885a83977e0fbb7 [0,1,1,0,0,0|1,0,0]=3 1213 B9R0.45 CSCOCCCCC=O e279a2cb99bc97e67b45db8cbfac7c12 [0,1,1,0,0,0|2,0,0]=4 1214 B9R0.45 CSCOCCOCC=O bffa0b86bda7eab4537345618cfe61ad [0,1,1,0,0,0|2,0,0]=4 1215 B9R0.45 FCCCCCCOCF 7fc0be4fea9d788b90d0660a719e3795 [0,1,1,0,0,0|1,0,1]=4 1216 B9R0.45 FCOCCCCCCS bc16a0c993f73bdeec29888445293583 [0,1,1,0,0,0|1,0,1]=4 1217 B9R0.45 N#CCCCCCNC=O a3dece92023954edd0841cbe0f7c23ab [0,1,1,0,0,0|1,0,1]=4 1218 B9R0.45 N#CCCCCOCC=O a86c5ccc5668a8da4e1062f9b8cd25d8 [0,1,1,0,0,0|1,0,1]=4 1219 B9R0.45 N#CCCOCCOC=O 3ba0cd1e8f3895f4b647eab387820cdb [0,1,1,0,0,0|1,0,1]=4 1220 B9R0.45 O=CCCCCNCCBr 5abec0ed0917442c8c232cdb425a9841 [0,1,1,0,0,0|2,0,0]=4 1221 B9R0.45 O=CCCCCNCCF eb9f24cce8e482daf38d14d9d549bbb1 [0,1,1,0,0,0|2,0,0]=4 1222 B9R0.45 O=CCCCCNCCI 70b4665906e4318f4c49372e2844c374 [0,1,1,0,0,0|2,0,0]=4 1223 B9R0.45 O=CCCCCNCCO 85ae23fbf5ae9276f3b511278a68fed1 [0,1,1,0,0,0|2,0,0]=4 1224 B9R0.45 O=CCCCCNCCS deffd1d2c176beb2f0f71b26a9711ee2 [0,1,1,0,0,0|2,0,0]=4 1225 B9R0.45 O=CCCCCOCC=O 7ef8386ecbb49019770effbfa4132a27 [0,1,1,0,0,0|1,0,1]=4 1226 B9R0.45 O=CCCCCOCCF 9b2c7b33aa8c8f306ca8eb570fcf7b58 [0,1,1,0,0,0|2,0,0]=4 1227 B9R0.45 O=CCCCCOCCS bc4f0fef628b9966ab9f3b44089a7d10 [0,1,1,0,0,0|2,0,0]=4 1228 B9R0.45 O=CCCCNCCCCl 3dae4dda634271ae27163fd45f5d3163 [0,1,1,0,0,0|2,0,0]=4 1229 B9R0.45 O=CCCCNCCCO 58ef7b77b7be690608fd65ce9c6abe71 [0,1,1,0,0,0|2,0,0]=4 1230 B9R0.45 O=CCCCOCCCF e1070872c292eb7b879ef21318c9c15c [0,1,1,0,0,0|2,0,0]=4 1231 B9R0.45 O=CCCCOCCCS 138cbbec11bd45b1a4d85bf9b5287b7a [0,1,1,0,0,0|2,0,0]=4 1232 B9R0.45 O=CCCNCCCCCl f851f5adb29aefdb303aca6a0afddb51 [0,1,1,0,0,0|2,0,0]=4 1233 B9R0.45 O=CCCNCCCCO e756673586d39ac10639a8b5db39bc11 [0,1,1,0,0,0|2,0,0]=4 1234 B9R0.45 O=CCCNCCCCS a16cbec588d57d2616e56c10fc4cf764 [0,1,1,0,0,0|2,0,0]=4 1235 B9R0.45 O=CCCOCCCCF b28a94840b1fc0f0b86ff0a09810e8f8 [0,1,1,0,0,0|2,0,0]=4 1236 B9R0.45 O=CCCOCCCCS 1e02f2461dcb63ee34b6c10ad7ae6e80 [0,1,1,0,0,0|2,0,0]=4 1237 B9R0.45 O=CCCOCCOC=O 481f74f4a74e340c595a87b689454483 [0,1,1,0,0,0|1,0,1]=4 1238 B9R0.45 O=CCNCCCCCCl a090314f6f7fb6541d79b47c4505cb08 [0,1,1,0,0,0|2,0,0]=4 1239 B9R0.45 O=CCNCCCCCO e20d30c887448f62cb966ff66604b03d [0,1,1,0,0,0|2,0,0]=4 1240 B9R0.45 O=CCOCCNCCBr 9819b5c51421182fcdb248da2578a61b [0,1,1,0,0,0|2,0,0]=4 1241 B9R0.45 O=CCOCCNCCF e9530f27022516b2df446fd4acb3c2b4 [0,1,1,0,0,0|2,0,0]=4 1242 B9R0.45 O=CCOCCNCCI 982e6a53b402275ae463ac8e959e2533 [0,1,1,0,0,0|2,0,0]=4 1243 B9R0.45 O=CCOCCNCCO a2db44e87b2fb5f984ed853f6da8166f [0,1,1,0,0,0|2,0,0]=4 1244 B9R0.45 O=CCOCCNCCS 30555c8d14175bdff7d9852359d5da46 [0,1,1,0,0,0|2,0,0]=4 1245 B9R0.45 O=CCOCCOCCF 8034a51f97cd228bd06c22d3c7378cb2 [0,1,1,0,0,0|2,0,0]=4 1246 B9R0.45 O=CCOCCOCCS 78becc0461eb1993db100c499f5982b4 [0,1,1,0,0,0|2,0,0]=4 1247 B9R0.45 O=CNCCCCCCCl a8d8b40eb8e24dc175f39e3613e37fe1 [0,1,1,0,0,0|1,0,0]=3 1248 B9R0.45 O=CNCCCCCCO da506faeac8e24bf810b2dadaf20a2f0 [0,1,1,0,0,0|1,0,0]=3 1249 B9R0.45 O=CNCCCOCCO c13219eb813f52a6a7b71943199239d8 [0,1,1,0,0,0|2,0,0]=4 1250 B9R0.45 O=CNCCOCCCF aecb41e1dec5d5cfb70b44dddd0a16bd [0,1,1,0,0,0|2,0,0]=4 1251 B9R0.45 O=CNCCOCCCO 2927b39b5e49691c6067a00f092b2e7d [0,1,1,0,0,0|2,0,0]=4 1252 B9R0.45 O=CNCCOCCCS 2f83dfa3851bd131879a6c8d5ea708d2 [0,1,1,0,0,0|2,0,0]=4 1253 B9R0.45 O=COCCOCCCF c6307ebf3fb8c4d9a04e9e143e22f0f0 [0,1,1,0,0,0|1,0,0]=3 1254 B9R0.45 O=COCCOCCCS d7818eb647bba146b010bb20a5b86538 [0,1,1,0,0,0|1,0,0]=3 1255 B9R0.46 C=C(C=O)OCCCCC 73f23f9026875d2248a24c18d18361c4 [0,1,1,0,0,0|2,0,0]=4 1256 B9R0.46 C=COCCNC(C)CC 96268375baa943486c5bcb44f6e7b72c [0,1,1,0,0,0|2,0,0]=4 1257 B9R0.46 C=COCCOC(C)CC 2985a6aa5e711a9babef791b93b4a616 [0,1,1,0,0,0|2,0,0]=4 1258 B9R0.46 CC(CO)CCCNC=O 2da4c407608a3357ec193b0031a8c7cf [0,1,1,0,0,0|2,0,0]=4 1259 B9R0.46 CCC(C)CCCOCF 25eeed0d978fad0afbb1541ecdc0db9d [0,1,1,0,0,0|1,0,1]=4 1260 B9R0.46 CCC(C)CCNCC=O a6e7e31b7174e33afbb2e49091f71799 [0,1,1,0,0,0|2,0,0]=4 1261 B9R0.46 CCC(C)CCOCC=O ffa804ef82eba2baed5b236b8174cc5b [0,1,1,0,0,0|2,0,0]=4 1262 B9R0.46 CCC(C)CNCCC=O d1c23829c335ff019dcbfacafd5d0460 [0,1,1,0,0,0|2,0,0]=4 1263 B9R0.46 CCC(C)COCCC=O 2d73e4df98095e84f26e8630b8c1ab90 [0,1,1,0,0,0|2,0,0]=4 1264 B9R0.46 CCC(C)NCCCC=O ed3b198797f9907d63520eb2a7b47340 [0,1,1,0,0,0|2,0,0]=4 1265 B9R0.46 CCC(C)OCCCC=O 490e4bd62c6c0bc054893d7857d462c9 [0,1,1,0,0,0|2,0,0]=4 1266 B9R0.46 CCC(C)OCCNC=O a01a9adcadc461327c7aab245a262d96 [0,1,1,0,0,0|2,0,0]=4 1267 B9R0.46 CCC(C)OCCOC=O 186c75d581c36984caa7089474780127 [0,1,1,0,0,0|1,0,0]=3 1268 B9R0.46 CCC(O)CNCCC=O cd5859b03f179b813ebaa6940985c168 [0,1,1,0,0,0|2,0,0]=4 1269 B9R0.46 CCC(S)CCOCC=O ec52efc3fa4920f55eb496eb0701f7dc [0,1,1,0,0,0|2,0,0]=4 1270 B9R0.46 CCCCCCN(C)C=O bb80d4044c0f59026002adf38475cf21 [0,1,1,0,0,0|1,0,0]=3 1271 B9R0.46 CCCCCNC(=O)C=O f4e49d97916bc3a259206e9c19346054 [0,1,1,0,0,0|2,0,0]=4 1272 B9R0.46 CCCCCNC(C)C=O a1e76f644541968a2425e9e5ecba0c50 [0,1,1,0,0,0|2,0,0]=4 1273 B9R0.46 CCCCCN[C@H](C)C=O f165fdff1e1cb70bd9666da848ba80ab [0,1,1,0,0,0|2,0,0]=4 1274 B9R0.46 CCCCCOC(C)C=O e16af054a8530937c558322756befd3b [0,1,1,0,0,0|2,0,0]=4 1275 B9R0.46 CCCCCO[C@H](C)C=O a119465539c723056c69d3cef66a5d39 [0,1,1,0,0,0|2,0,0]=4 1276 B9R0.46 CCCOCCN(C)C=O 1992e4eb6f9e42487b54ea3b9d8f7b64 [0,1,1,0,0,0|2,0,0]=4 1277 B9R0.46 CCN(C)CCCCC=O 74bce0e309052ddf19f81d22decddd11 [0,1,1,0,0,0|2,0,0]=4 1278 B9R0.46 CCN(C)CCCNC=O a00a4d07cd80f4382708c0945aa2c234 [0,1,1,0,0,0|2,0,0]=4 1279 B9R0.46 CCOCCCC(C)CC 0ea2c075acda26928eb230e2cbdf0ebc [0,1,1,0,0,0|1,0,1]=4 1280 B9R0.46 CCOCCC[C@@H](C)CC d4ed2edda0b29eae54d6246c567e945f [0,1,1,0,0,0|1,0,1]=4 1281 B9R0.46 CC[C@@H](C)COCCC=O 73ea6284a99d686bca8912bc4d397db8 [0,1,1,0,0,0|2,0,0]=4 1282 B9R0.46 CC[C@@H](C)NCCCC=O e1be8b6d98f789c65613c869a985540c [0,1,1,0,0,0|2,0,0]=4 1283 B9R0.46 CC[C@@H](C)OCCCC=O affc126d70813ac032232a3d21f0923c [0,1,1,0,0,0|2,0,0]=4 1284 B9R0.46 CC[C@@H](O)CNCCC=O 7c53ec8f7aba46128b14d414a03d6336 [0,1,1,0,0,0|2,0,0]=4 1285 B9R0.46 CC[C@H](C)CCCOCF 194911e0348f65d440f6b1ae1cabf828 [0,1,1,0,0,0|1,0,1]=4 1286 B9R0.46 CC[C@H](C)CCOCC=O 80dda8846c63ca08a849cc59acf34bed [0,1,1,0,0,0|2,0,0]=4 1287 B9R0.46 CC[C@H](C)CNCCC=O e358f485d099c641cfa1fcd506941f98 [0,1,1,0,0,0|2,0,0]=4 1288 B9R0.46 CC[C@H](C)COCCC=O 02998a6cb7d56226c823a7da35ede65f [0,1,1,0,0,0|2,0,0]=4 1289 B9R0.46 CC[C@H](C)NCCCC=O 27877691633ef91afbfdce76ea02c29f [0,1,1,0,0,0|2,0,0]=4 1290 B9R0.46 CC[C@H](C)OCCCC=O 0bd2ba4d0329602504b9b03e6e85ee4b [0,1,1,0,0,0|2,0,0]=4 1291 B9R0.46 CN(C=O)CCCCCO c53771f4b7aac7f2d7cf4ff756dc1493 [0,1,1,0,0,0|2,0,0]=4 1292 B9R0.46 COCCCCN(C)C=O c4af9136179b3511052f27a49eec2e11 [0,1,1,0,0,0|2,0,0]=4 1293 B9R0.12 CCC(C)C(CO)NC=O 5c179e5dbf30713710d115bdaf54bfc5 [0,1,1,0,0,0|2,0,0]=4 1294 B9R0.12 CCC(O)C(CC)NC=O 46201a24567777837b8f03c0021cc041 [0,1,1,0,0,0|1,0,0]=3 1295 B9R0.12 CCCN(CC)C(=O)C=O a19f97e09aa2fe0ef98428a0a9f1811e [0,1,1,0,0,0|2,0,0]=4 1296 B9R0.12 CCCN(CC)C(C)C=O 8a6514457cf8a83910db4ecc29f223cb [0,1,1,0,0,0|2,0,0]=4 1297 B9R0.12 CCCN(CC)[C@H](C)C=O ceb9a99ce36145d5dafaf734e00c59aa [0,1,1,0,0,0|2,0,0]=4 1298 B9R0.12 CC[C@@H](C)[C@H](CO)NC=O c73220cc765c315148b2e8b86c603524 [0,1,1,0,0,0|2,0,0]=4 1299 B9R0.12 CC[C@H](C)[C@@H](CO)NC=O 9a4c2431f2dee04525d5ce74b8c56c00 [0,1,1,0,0,0|2,0,0]=4 1300 B9R0.14 CC(C)CC(CO)NC=O 2401a4af5f90f2ad600b0ec39355d7f1 [0,1,1,0,0,0|2,0,0]=4 1301 B9R0.14 CC(C)C[C@@H](CO)NC=O 18f9ed63fde76e1cc00bd712daefc11f [0,1,1,0,0,0|2,0,0]=4 1302 B9R0.14 CC(C)C[C@H](CO)NC=O ff770270429d63a77a333a5d1c96a15e [0,1,1,0,0,0|2,0,0]=4 1303 B9R0.14 CCC(CN(C)C)NC=O 1235696c89992e36494b92eb971536e9 [0,1,1,0,0,0|2,0,0]=4 1304 B9R0.14 CCC(COC)NC(=O)C 33391342a5047426c06babf996f3c088 [0,1,1,0,0,0|2,0,0]=4 1305 B9R0.14 CCCC(CC)OC(C)C c50b63b5afd43bc9dd207a7943b338ed [0,1,1,0,0,0|1,0,1]=4 1306 B9R0.14 CCCC(CO)NC(=O)C f3bf17abc83f73293b80dc3dfcb282f9 [0,1,1,0,0,0|2,0,0]=4 1307 B9R0.14 CCCN(CC)CC(=O)N 9bf9e40bad95314a8a84e74e0471e384 [0,1,1,0,0,0|2,0,0]=4 1308 B9R0.14 CCCN(CC)CC(=O)O 3343166bff6a93f1a85ce8253803b19e [0,1,1,0,0,0|2,0,0]=4 1309 B9R0.14 CCC[C@@H](CC)OC(C)C a39a86427e11d72d6f7273e04c6ecbea [0,1,1,0,0,0|1,0,1]=4 1310 B9R0.14 CCC[C@@H](CO)NC(=O)C 1f7828ff873e7c1f12c0daf2d17463c6 [0,1,1,0,0,0|2,0,0]=4 1311 B9R0.14 CCC[C@H](CO)NC(=O)C da4d526e59be455b3e6f6ae6f972462b [0,1,1,0,0,0|2,0,0]=4 1312 B9R0.14 CCN(CC=O)CC(C)C 297e969ab1e837d2bbd0539198015021 [0,1,1,0,0,0|2,0,0]=4 1313 B9R0.14 CCN(CC=O)CC(C)O ed1b313135103c68d3a3fd7202af2a6d [0,1,1,0,0,0|2,0,0]=4 1314 B9R0.14 CCN(CC=O)C[C@H](C)O c51b4b749ce3f8308a5e40010dd9e954 [0,1,1,0,0,0|2,0,0]=4 1315 B9R0.14 CCNC(CC)CC(=O)O 46b3094fad7cebceb8943df84913f37e [0,1,1,0,0,0|2,0,0]=4 1316 B9R0.14 CCN[C@@H](CC)CC(=O)O 21df25326eabd4481a004736f4916afa [0,1,1,0,0,0|2,0,0]=4 1317 B9R0.14 CCN[C@H](CC)CC(=O)O a15a38745d4cdc3a3747943041323451 [0,1,1,0,0,0|2,0,0]=4 1318 B9R0.14 CCOC(CC)CC(=O)O 067fe73a7b822a47a7ba0f3d160fbef0 [0,1,1,0,0,0|2,0,0]=4 1319 B9R0.14 CCO[C@@H](CC)CC(=O)O 33e42c57d3d148d94f92e79e109828f9 [0,1,1,0,0,0|2,0,0]=4 1320 B9R0.14 CCO[C@H](CC)CC(=O)O 455a3fd4e9034df148e3bfd48e87cfe6 [0,1,1,0,0,0|2,0,0]=4 1321 B9R0.15 CC(C)C(CCO)NC=O e12943deb791d78016913eb4bab64cb3 [0,1,1,0,0,0|2,0,0]=4 1322 B9R0.15 CCCC(OCC)C(C)C e92d999be069504d5fc7f6e2735d7a96 [0,1,1,0,0,0|1,0,1]=4 1323 B9R0.15 CCCC(OCF)C(C)C 0ef7c4f36b8fd0d0fc148d8413dbc8c9 [0,1,1,0,0,0|1,0,1]=4 1324 B9R0.15 CCCN(CC=O)C(C)C 35466d46e78549c3f1ea3d38e32be947 [0,1,1,0,0,0|2,0,0]=4 1325 B9R0.15 COCC(NC=O)C(C)C 6d4a9693309f79b18084e24108b1069b [0,1,1,0,0,0|2,0,0]=4 1326 B9R0.15 COC[C@@H](NC=O)C(C)C 4ceceae0168b803b0270694120f14c1d [0,1,1,0,0,0|2,0,0]=4 1327 B9R0.15 COC[C@H](NC=O)C(C)C b6e0e4558c7d7711b8543fe6166439ec [0,1,1,0,0,0|2,0,0]=4 1328 B9R0.17 CCCC(CCC)NC=O 807aff51f1fe24d356c6711fc8370f90 [0,1,1,0,0,0|1,0,0]=3 1329 B9R0.17 CCCC(CCC)OCC eaefef31a773bb3c066a25cae0992714 [0,1,1,0,0,0|1,0,1]=4 1330 B9R0.17 CCCC(CCC)OCF ba5ef35becd613f75720a15441855b31 [0,1,1,0,0,0|1,0,1]=4 1331 B9R0.17 CCCC(CCO)NC=O f887f8e048c82ec42b3b224f31c660de [0,1,1,0,0,0|1,0,0]=3 1332 B9R0.17 CCCN(CC=O)CCC 3f7ee899d33e18ef7369adb9b220d9b3 [0,1,1,0,0,0|2,0,0]=4 1333 B9R0.17 CCCN(CC=O)CCO 138004b89d5c4657e701909e51217872 [0,1,1,0,0,0|2,0,0]=4 1334 B9R0.17 COCC(CCO)NC=O 041b3216dea15bf357ed6b311d97fceb [0,1,1,0,0,0|2,0,0]=4 1335 B9R0.17 COCC(COC)NC=O a4ba2755183f02d9e0eab56c89d31eb0 [0,1,1,0,0,0|2,0,0]=4 1336 B9R0.59 CCCC(C)(CO)NC=O 552042b121c4cca548e7f645f7563aba [0,1,1,0,0,0|2,0,0]=4 1337 B9R1.1 CC1CCN(CC1)C=O cd1885c4b5a60655a81f4f7aac11f926 [1,1,0,0,0,0|1,0,0]=3 1338 B9R1.1 CN1CCN(CC1)C=O 425b0a0854116b4d34ccf791328ead5e [1,1,0,0,0,0|2,0,0]=4 1339 B9R1.1 O=CN1CCC(CC1)Cl 0f8885b1cbec326e72007210720ce685 [1,1,0,0,0,0|1,0,0]=3 1340 B9R1.1 O=CN1CCC(CC1)F a8375fcd63170cc85e942f6f795820d2 [1,1,0,0,0,0|1,0,0]=3 1341 B9R1.1 O=CN1CCC(CC1)I 09840532f9aae62595854240e3123351 [1,1,0,0,0,0|1,0,0]=3 1342 B9R1.1 O=CN1CCC(CC1)O 9119fcb5a9f758b718576c8b3456fe09 [1,1,0,0,0,0|1,0,0]=3 1343 B9R1.2 CC1CCCN(C1)C=O 5a06aa6b42e18f18aee9823269dae409 [1,1,0,0,0,0|1,0,0]=3 1344 B9R1.2 CC1CN(CCO1)C=O 419911434d41e805d16780cbe76cce9d [1,1,0,0,0,0|2,0,0]=4 1345 B9R1.2 C[C@@H]1CCCN(C1)C=O b5e680c9235a8f69b3718f41b577e428 [1,1,0,0,0,0|1,0,0]=3 1346 B9R1.2 C[C@@H]1CN(CCO1)C=O b5db532eab9a99bf3ba15375dd3b6f02 [1,1,0,0,0,0|2,0,0]=4 1347 B9R1.2 C[C@H]1CCCN(C1)C=O 4dab749a75683c45748ebdcac3ae2c8b [1,1,0,0,0,0|1,0,0]=3 1348 B9R1.2 C[C@H]1CN(CCO1)C=O df29ae4feffabe0da5bd47bb2c69d059 [1,1,0,0,0,0|2,0,0]=4 1349 B9R1.2 O=CN1CCCC(=O)C1 853ed8a7ea6d407efd205be254a69349 [1,1,0,0,0,0|1,0,1]=4 1350 B9R1.2 O=CN1CCCC(C1)F 04917882399611fcb80fb86df59a89e2 [1,1,0,0,0,0|1,0,0]=3 1351 B9R1.2 O=CN1CCCC(C1)O 0df930667a84d8d3d91a613bfd57f133 [1,1,0,0,0,0|1,0,0]=3 1352 B9R1.2 O=CN1CCC[C@@H](C1)F 8bf0e6ef9ed8e1b7cb36e4499af92a58 [1,1,0,0,0,0|1,0,0]=3 1353 B9R1.2 O=CN1CCC[C@@H](C1)O 50e0b44fd1f0b47772960747a9d4dc2e [1,1,0,0,0,0|1,0,0]=3 1354 B9R1.2 O=CN1CCC[C@H](C1)F ec017dd9294189577b258dfb95fb493e [1,1,0,0,0,0|1,0,0]=3 1355 B9R1.2 O=CN1CCC[C@H](C1)O 1099b25f2d4ea20dc0b6d23f3ff3e4f6 [1,1,0,0,0,0|1,0,0]=3 1356 B9R1.6 CC(=O)N1CCCOC1 736ab4cc5910e1cdbf1f270a5cd9760a [1,1,0,0,0,0|2,0,0]=4 1357 B9R1.6 CC(=O)N1CCCSC1 1ff1106b7e69aa264320301adcb4387e [1,1,0,0,0,0|2,0,0]=4 1358 B9R1.6 CC(=O)N1CCOCC1 b274306c5ecbdaabc7e8d85c11df9df8 [1,1,0,0,0,0|2,0,0]=4 1359 B9R1.6 CC(=O)N1CCSCC1 a2a73cc62f318cd0138a717f4c94c193 [1,1,0,0,0,0|2,0,0]=4 1360 B9R1.15 CC1CCCCN1C=O 5edffbe7b981e62d376cf463cc81b5a0 [1,1,0,0,0,0|1,0,0]=3 1361 B9R1.15 CC1COCCN1C=O 04bb76f81435fa2bb54099b84251b430 [1,1,0,0,0,0|2,0,0]=4 1362 B9R1.15 C[C@@H]1CCCCN1C=O a3eec1c9235da9d654fdc4f1cd619716 [1,1,0,0,0,0|1,0,0]=3 1363 B9R1.15 C[C@@H]1COCCN1C=O 0c7d5e9730004733a4641e1221ef05f8 [1,1,0,0,0,0|2,0,0]=4 1364 B9R1.15 C[C@H]1CCCCN1C=O ca092eb4253ff1332fa8641d72ce7d5e [1,1,0,0,0,0|1,0,0]=3 1365 B9R1.15 C[C@H]1COCCN1C=O 768699be3648dab4c6a8b1f24cf31cd1 [1,1,0,0,0,0|2,0,0]=4 1366 B9R1.7 CC1CCC(C1)NC=O 86b9d16d14b01af118f6eff98f26bcb3 [0,1,0,0,1,0|1,0,0]=3 1367 B9R1.7 CC1CCC(C1)OCF 9089501ad242f89319fa28aecc141070 [0,1,0,0,1,0|1,0,1]=4 1368 B9R1.7 CC1CCN(C1)CC=O 60f84b0ab71f7f996705ad5037a1aec2 [0,1,0,0,1,0|2,0,0]=4 1369 B9R1.7 CCOC1CCC(C1)C 2e79cb3e7d53d70b7a3a49594f9b7572 [0,1,0,0,1,0|1,0,1]=4 1370 B9R1.7 CCOC1CCC(C1)F cb7366f0f3c88496c0dd299220151677 [0,1,0,0,1,0|1,0,1]=4 1371 B9R1.7 FCOC1CCC(C1)F cb731a7dd7f85be41196b1e7732d848e [0,1,0,0,1,0|1,0,1]=4 1372 B9R1.7 O=CCN1CCC(C1)F f060a91610fd1c160462b8451592274c [0,1,0,0,1,0|2,0,0]=4 1373 B9R1.7 O=CCN1CCC(C1)O 99e2f8a92ac31be412a249812f35919e [0,1,0,0,1,0|2,0,0]=4 1374 B9R1.7 O=CCN1CC[C@@H](C1)F 3f3302fb44a2f6535f8baf3daa5909e7 [0,1,0,0,1,0|2,0,0]=4 1375 B9R1.7 O=CCN1CC[C@@H](C1)O 24c35e433dba4bd0d149bd5947289fc2 [0,1,0,0,1,0|2,0,0]=4 1376 B9R1.7 O=CCN1CC[C@H](C1)F 19a6e702b7550830275cbcf7f340a515 [0,1,0,0,1,0|2,0,0]=4 1377 B9R1.7 O=CCN1CC[C@H](C1)O ed1c58142b5d5eed74956f954dbf3a4e [0,1,0,0,1,0|2,0,0]=4 1378 B9R1.7 O=CNC1CCC(C1)O 9cc0bb9735d2014b640fab8dcfdfefc4 [0,1,0,0,1,0|1,0,0]=3 1379 B9R1.7 O=CN[C@@H]1CC[C@@H](C1)O 6b6f95f63e2bfc66d50e9dc0e05ccf52 [0,1,0,0,1,0|1,0,0]=3 1380 B9R1.7 O=CN[C@@H]1CC[C@H](C1)O 05e9ad2eeb1cb0070327160fd3027c54 [0,1,0,0,1,0|1,0,0]=3 1381 B9R1.7 O=CN[C@H]1CC[C@@H](C1)O 2acd9ee67829d57d2e126fa249833c6a [0,1,0,0,1,0|1,0,0]=3 1382 B9R1.7 O=CN[C@H]1CC[C@H](C1)O 94a849c4445c8edddaa5dbfc86e7851c [0,1,0,0,1,0|1,0,0]=3 1383 B9R1.11 CN(C=O)C1CCOC1 25ca4f16a91f3107ff9e87d5adde4584 [0,1,0,0,1,0|2,0,0]=4 1384 B9R1.11 CN(C=O)[C@@H]1CCOC1 f85136c46c3b0a309253c227707c27ca [0,1,0,0,1,0|2,0,0]=4 1385 B9R1.11 CN(C=O)[C@H]1CCOC1 0259ec1bf703c36ed28ab9e80f8e89f6 [0,1,0,0,1,0|2,0,0]=4 1386 B9R1.12 C#CCOC1CCCC1 8722ca3512977b1a522adee489822a80 [0,1,0,0,1,0|1,0,1]=4 1387 B9R1.12 C=CCNC1CCCC1 a44dfccd7811107fa017bf97428af755 [0,1,0,0,1,0|2,0,0]=4 1388 B9R1.12 C=CCOC1CCCC1 22f7677a5a2db535f14966e96785d78f [0,1,0,0,1,0|1,0,0]=3 1389 B9R1.12 C=CCOC1CCCO1 07dc06b14814543ad8fc1e6830b8ad31 [0,1,0,0,1,0|2,0,0]=4 1390 B9R1.12 C=CCOC1CCOC1 f7dcb259ebd712ed1d20050b5ae42528 [0,1,0,0,1,0|2,0,0]=4 1391 B9R1.12 C=CCOC1CCSC1 91499e92622fab1e7f2c5e46ab4d9b5c [0,1,0,0,1,0|2,0,0]=4 1392 B9R1.12 C=CCO[C@@H]1CCOC1 1c87c5212babdae70db54e2b4f5cebba [0,1,0,0,1,0|2,0,0]=4 1393 B9R1.12 C=CCO[C@@H]1CCSC1 c475f04d972d75c445b64dea1f91dbe8 [0,1,0,0,1,0|2,0,0]=4 1394 B9R1.12 C=CCO[C@H]1CCOC1 6ac41eef9f664c640abe61f0570c0c4d [0,1,0,0,1,0|2,0,0]=4 1395 B9R1.12 C=CCO[C@H]1CCSC1 3a48bba6ccea0d1c14e655596734cc66 [0,1,0,0,1,0|2,0,0]=4 1396 B9R1.12 CCCOC1CCCC1 8b31bdd2ae6636509668964f17d3af12 [0,1,0,0,1,0|1,0,1]=4 1397 B9R1.12 CCOCC1CCCC1 78dfb99153363e6ae71186392081c4c4 [0,1,0,0,1,0|1,0,1]=4 1398 B9R1.12 COCOC1CCCC1 2943e1e93dd873c7391396ec9633419e [0,1,0,0,1,0|0,0,2]=4 1399 B9R1.12 CSCOC1CCCC1 4d4f03fa523a880c781e82e000450363 [0,1,0,0,1,0|0,1,1]=4 1400 B9R1.12 FCCOC1CCCC1 b4ff08bedab1a43d91a75b49048b20b0 [0,1,0,0,1,0|1,0,1]=4 1401 B9R1.12 FCOCC1CCCC1 adc3b963cccb9f54cfa066ef371e1987 [0,1,0,0,1,0|1,0,1]=4 1402 B9R1.12 N#CCOC1CCCC1 597d114ba6fc77410ee8043a322c52e4 [0,1,0,0,1,0|1,0,1]=4 1403 B9R1.12 O=CCNC1CCCC1 5c29f4b53ebb87f60f2e590cae79d70e [0,1,0,0,1,0|1,0,0]=3 1404 B9R1.12 O=CCNC1CCOC1 5ebd18c32723aecf0a10ba0b1026f623 [0,1,0,0,1,0|2,0,0]=4 1405 B9R1.12 O=CCNC1CCSC1 94dd37d0be671d43fdf2361d32027eb7 [0,1,0,0,1,0|2,0,0]=4 1406 B9R1.12 O=CCN[C@@H]1CCOC1 c004fef25816fba950d6dc5d24530df6 [0,1,0,0,1,0|2,0,0]=4 1407 B9R1.12 O=CCN[C@H]1CCOC1 9ca8efb181f33f329c38592f6f8b2f1d [0,1,0,0,1,0|2,0,0]=4 1408 B9R1.12 O=CCOC1C=CCC1 41dbe9bc4abbc85f5c193c497af03476 [0,1,0,0,1,0|0,0,2]=4 1409 B9R1.12 O=CCOC1CC=CC1 aada3e65c14b3e8caa11088140cc3e4a [0,1,0,0,1,0|0,0,2]=4 1410 B9R1.12 O=CCOC1CCCC1 a6adf3d3a9898d822d20d244584a5d22 [0,1,0,0,1,0|0,0,0]=2 1411 B9R1.12 O=CCOC1CCCO1 b12387ccaf578e9136cfdda5442c6ed5 [0,1,0,0,1,0|1,0,0]=3 1412 B9R1.12 O=CCOC1CCOC1 dc39bcd71af6fa4a51e765dc1c7cc22b [0,1,0,0,1,0|1,0,0]=3 1413 B9R1.12 O=CCOC1CCSC1 d2117f08ca242a7df7aed3c889c7183d [0,1,0,0,1,0|1,0,0]=3 1414 B9R1.12 O=CCO[C@@H]1CCOC1 ba6a023905b97fe4c3886891f0169109 [0,1,0,0,1,0|1,0,0]=3 1415 B9R1.12 O=CCO[C@@H]1CCSC1 c32996f1fdfc0ecf3541c8ebef4f1bfc [0,1,0,0,1,0|1,0,0]=3 1416 B9R1.12 O=CCO[C@H]1CCOC1 ba4a88d81a344c083f0092fd5cbc39ac [0,1,0,0,1,0|1,0,0]=3 1417 B9R1.12 O=CCO[C@H]1CCSC1 1a840422c6e1aec7b7491b309995c9af [0,1,0,0,1,0|1,0,0]=3 1418 B9R1.12 O=CNCC1CCCC1 07bc0016cbba20adfd4b5def8fc2be28 [0,1,0,0,1,0|1,0,0]=3 1419 B9R1.12 O=CNCC1CCCO1 119dc507c9398e42b1f4ed984596ee10 [0,1,0,0,1,0|2,0,0]=4 1420 B9R1.12 O=CNCC1CCOC1 d0a8b11bfe41f1a2881d21d4b8d8fda7 [0,1,0,0,1,0|2,0,0]=4 1421 B9R1.12 O=CNC[C@@H]1CCCO1 1db6e6cf4b42f513cad73704b19cd2ea [0,1,0,0,1,0|2,0,0]=4 1422 B9R1.12 O=CNC[C@@H]1CCOC1 0cdeaf208e802b3ac6af755e7b6ce1c7 [0,1,0,0,1,0|2,0,0]=4 1423 B9R1.12 O=CNC[C@H]1CCCO1 d67473c99765cbcf463c4cc54c44cf84 [0,1,0,0,1,0|2,0,0]=4 1424 B9R1.12 O=CNC[C@H]1CCOC1 3972f408d9cc05ccac06471e1022cfb3 [0,1,0,0,1,0|2,0,0]=4 1425 B9R1.12 SCCOC1CCCC1 ce0001e3012cc122d56bcdd753ee7ed0 [0,1,0,0,1,0|0,1,1]=4 1426 B9R1.13 CC(=O)NC1CCCC1 a2d6bc9cfdeb39e26a278a42ee1d6324 [0,1,0,0,1,0|1,0,0]=3 1427 B9R1.13 CC(=O)NC1CCOC1 c5177dfe9e6c084a2da585e140eb24a0 [0,1,0,0,1,0|2,0,0]=4 1428 B9R1.13 CC(=O)NC1CCSC1 730ac5b1a87c9b477c5040aed194c284 [0,1,0,0,1,0|2,0,0]=4 1429 B9R1.13 CC(=O)N[C@@H]1CCOC1 a0946b6158cd267ecce33909819f831a [0,1,0,0,1,0|2,0,0]=4 1430 B9R1.13 CC(=O)N[C@H]1CCOC1 1f47913b87a63d932081a27afac44166 [0,1,0,0,1,0|2,0,0]=4 1431 B9R1.13 CC(C)OC1CCCC1 215fe9a68b5f8765bce60b7c8e66fcb4 [0,1,0,0,1,0|1,0,1]=4 1432 B9R1.33 CC1CCCC1OCF 32f68f74d298f1c114dbc7dd09935821 [0,1,0,0,1,0|1,0,1]=4 1433 B9R1.33 CC1CCCN1CC=O 27928a5411863f8bf406ba8c60b72aa7 [0,1,0,0,1,0|2,0,0]=4 1434 B9R1.33 CCOC1CCCC1C e450d37d5269371ee21c4d9099cf78f8 [0,1,0,0,1,0|1,0,1]=4 1435 B9R1.33 CCO[C@@H]1CCC[C@@H]1C 48c6c8a377684215533cce2f3b7a040e [0,1,0,0,1,0|1,0,1]=4 1436 B9R1.33 CCO[C@@H]1CCC[C@H]1C 8546dfd57bc5bf5d07eccd29f6ea3a23 [0,1,0,0,1,0|1,0,1]=4 1437 B9R1.33 CCO[C@@H]1CCC[C@H]1F 72550d5d818c2295f7ce45f538a74c92 [0,1,0,0,1,0|1,0,1]=4 1438 B9R1.33 CCO[C@H]1CCC[C@@H]1C 572fc68e8a7c8a7220d19d5da78e401e [0,1,0,0,1,0|1,0,1]=4 1439 B9R1.33 CCO[C@H]1CCC[C@H]1C 292472170f80aa7cd37f5df4f5f5c571 [0,1,0,0,1,0|1,0,1]=4 1440 B9R1.33 C[C@@H]1CCCN1CC=O 628393964742a01eee790b1703c7f48c [0,1,0,0,1,0|2,0,0]=4 1441 B9R1.33 C[C@@H]1CCC[C@@H]1OCF 22b3e84f2ed8c44061bfce0789720234 [0,1,0,0,1,0|1,0,1]=4 1442 B9R1.33 C[C@@H]1CCC[C@H]1OCF 055ee3d509f14e26b1cd85bd2abbeffb [0,1,0,0,1,0|1,0,1]=4 1443 B9R1.33 C[C@H]1CCCN1CC=O 7489760bd07ab3dac73fc24ef598634e [0,1,0,0,1,0|2,0,0]=4 1444 B9R1.33 C[C@H]1CCC[C@@H]1OCF 23b83a359e8c77c1ff60bdac1439e1a3 [0,1,0,0,1,0|1,0,1]=4 1445 B9R1.33 C[C@H]1CCC[C@H]1OCF 59a7f5726623d931b860afe2ddbbde2f [0,1,0,0,1,0|1,0,1]=4 1446 B9R1.33 FCO[C@@H]1CCC[C@H]1F 813555c6d841e20a730e4a6773476ea6 [0,1,0,0,1,0|1,0,1]=4 1447 B9R1.33 O=CCN1CCCC1O 01cd7a46a4aeeeea309967ac9e52751a [0,1,0,0,1,0|2,0,0]=4 1448 B9R1.33 O=CNC1COCC1O 8a660c587cad8c269ab00fb0df7cd154 [0,1,0,0,1,0|2,0,0]=4 1449 B9R1.33 O=CN[C@@H]1COC[C@@H]1O f898993a9f81f150abef41790ac487ca [0,1,0,0,1,0|2,0,0]=4 1450 B9R1.33 O=CN[C@@H]1COC[C@H]1O 187db9f1fc45bae154da94c5f849a158 [0,1,0,0,1,0|2,0,0]=4 1451 B9R1.33 O=CN[C@H]1COC[C@@H]1O 0425afcebb9b96f41287e87d190f87e0 [0,1,0,0,1,0|2,0,0]=4 1452 B9R1.33 O=CN[C@H]1COC[C@H]1F 2dc9a367173d6cca836677b4188f937d [0,1,0,0,1,0|2,0,0]=4 1453 B9R1.33 O=CN[C@H]1COC[C@H]1O 3325eb2ca0b5aa721b924b5069f801c5 [0,1,0,0,1,0|2,0,0]=4 1454 B9R1.134 CC1(CCCC1)NC=O 9f346bb798ddf4840d6f5ddf15261dc2 [0,1,0,0,1,0|1,0,0]=3 1455 B9R1.134 CC1(CCOC1)NC=O ad65daccf261b60746a7096eb8cd15d3 [0,1,0,0,1,0|2,0,0]=4 1456 B11R1.5 CC1CCCCCN1CC=O 9c42281793eac0f9ff4e09cff95b5799 [0,1,0,0,0,1|2,0,0]=4 1457 B11R1.5 CC1CCOCCN1CC=O eb6d9a133a77613d7cb3a1afb4104676 [0,1,0,0,0,1|2,0,0]=4 1458 B11R1.5 CC1CCSCCN1CC=O 8e4b8682c33102c9f6b7770d2242a28f [0,1,0,0,0,1|2,0,0]=4 1459 B11R1.5 CC1COCCCN1CC=O 63b1e8fbfc246805ea050f12187de6ea [0,1,0,0,0,1|2,0,0]=4 1460 B11R1.5 CCOC1CCCCCC1=O 6f512a9e711095b873eeb84a2a48b1a3 [0,1,0,0,0,1|1,0,1]=4 1461 B11R1.5 O=C1CCCCCC1OCF 1d4dd4103e923ca865993bfbc40b6a96 [0,1,0,0,0,1|1,0,1]=4 1462 B11R1.5 O=CNC1CCCCNC1=O c98b2e9ccd89d7d68384775f02247b47 [0,1,0,0,0,1|1,0,1]=4 1463 B11R1.5 O=CN[C@@H]1CCCCC[C@@H]1O d3325b3c25e63a999df9307534d541f3 [0,1,0,0,0,1|1,0,0]=3 1464 B11R1.5 O=CN[C@@H]1CCCCC[C@H]1O bb0838c3eaaaf658bdb3698df6bc84a4 [0,1,0,0,0,1|1,0,0]=3 1465 B11R1.5 O=CN[C@@H]1CCCCNC1=O 815160869e8acbfa55d5fda13c34e2e7 [0,1,0,0,0,1|1,0,1]=4 1466 B11R1.5 O=CN[C@H]1CCCCC[C@@H]1O 8bcc6d7bd9d3b8b0fb58de5506b252e9 [0,1,0,0,0,1|1,0,0]=3 1467 B11R1.5 O=CN[C@H]1CCCCNC1=O 251309dfd679bd353b3fc26d7c34eab1 [0,1,0,0,0,1|1,0,1]=4 1468 B11R1.110 CC1CN(CCCO1)CC=O bc0f21e2be69804bc5806e5d41532031 [0,1,0,0,0,1|2,0,0]=4 1469 B11R1.110 CN1CCOCC(C1)NC=O 1de93b59b1665f98764868681edab4f0 [0,1,0,0,0,1|2,0,0]=4 1470 B11R1.110 CN1CCOC[C@@H](C1)NC=O d979d410d29f269f1d667ae986917dc6 [0,1,0,0,0,1|2,0,0]=4 1471 B11R1.110 CN1CCOC[C@H](C1)NC=O 14dc3d3c3786a5fc4cff5d4c8f7a0f16 [0,1,0,0,0,1|2,0,0]=4 1472 B11R1.110 O=CCN1CCCCC(C1)O 9360f8b91aee36cb59bb59f2079dcd54 [0,1,0,0,0,1|2,0,0]=4 1473 B11R1.110 O=CCN1CCCC[C@H](C1)O 8ace5ce89956147304ed2db10d2ebfc6 [0,1,0,0,0,1|2,0,0]=4 1474 B11R1.110 O=CCN1CCOCC(C1)F 33285ab5dfc1087bb38ba246847288e1 [0,1,0,0,0,1|2,0,0]=4 1475 B11R1.110 O=CCN1CCOCC(C1)O ac42247a676c562e393d5c8988c9f93a [0,1,0,0,0,1|2,0,0]=4 1476 B11R1.110 O=CCN1CCOC[C@@H](C1)F ca9df59105b2a4afbea4512f2266b316 [0,1,0,0,0,1|2,0,0]=4 1477 B11R1.110 O=CCN1CCOC[C@@H](C1)O 08d882d2ead6799bf49b67e1ce2c2337 [0,1,0,0,0,1|2,0,0]=4 1478 B11R1.110 O=CCN1CCOC[C@H](C1)F 500d4f3a9843612b3e7a3984fdcab9d7 [0,1,0,0,0,1|2,0,0]=4 1479 B11R1.110 O=CCN1CCOC[C@H](C1)O e66c36287fb085fdfcf36c6f18dfd1ed [0,1,0,0,0,1|2,0,0]=4 1480 B11R1.135 CC1CCCN(CC1)CC=O ebce8a13090c033b9df5a070e4187478 [0,1,0,0,0,1|2,0,0]=4 1481 B11R1.135 CCOC1CCCN(CC1)C ac95087d926748d1aff63190292c8b15 [0,1,0,0,0,1|1,0,1]=4 1482 B11R1.135 CCO[C@@H]1CCCN(CC1)C 30a69bb501e36beecb61605cf15f997c [0,1,0,0,0,1|1,0,1]=4 1483 B11R1.135 CCO[C@H]1CCCN(CC1)C 2406ec2aec6a1585f056eb822d3b017d [0,1,0,0,0,1|1,0,1]=4 1484 B11R1.135 CN1CCCC(CC1)NC=O 214f66884c4b417d9efdce8f5a7742cd [0,1,0,0,0,1|1,0,0]=3 1485 B11R1.135 CN1CCCC(CC1)OCF 90d792e1a8b338493b8056bb03bae557 [0,1,0,0,0,1|1,0,1]=4 1486 B11R1.135 CN1CCCN(CC1)CC=O 33e391cd28ee1857e7a3831a22410f42 [0,1,0,0,0,1|2,0,0]=4 1487 B11R1.135 CN1CCC[C@@H](CC1)OCF 368384b3355a64173e936e8861150957 [0,1,0,0,0,1|1,0,1]=4 1488 B11R1.135 CN1CCC[C@H](CC1)OCF 77aedbf8bcd0b62547460c797d6e7032 [0,1,0,0,0,1|1,0,1]=4 1489 B11R1.135 O=CCN1CCCC(=O)CC1 b88f1537876174ee7b1be316ca12b0a5 [0,1,0,0,0,1|2,0,0]=4 1490 B11R1.135 O=CCN1CCCC(CC1)F fb2e283cfaa6163b9f9c5ac0034805bd [0,1,0,0,0,1|2,0,0]=4 1491 B11R1.135 O=CCN1CCCC(CC1)O 31ccacb7e0c42634bd1710f6e935ebb8 [0,1,0,0,0,1|2,0,0]=4 1492 B11R1.135 O=CCN1CCC[C@@H](CC1)O d98f2882749bc79dd566e6c6038c22b9 [0,1,0,0,0,1|2,0,0]=4 1493 B11R1.135 O=CCN1CCC[C@H](CC1)O f3d14be1772a2a93d79d41a0c1073718 [0,1,0,0,0,1|2,0,0]=4 1494 B11R1.203 C#CCOC1CCCCCC1 4efed4173334472998a496f83c88b14b [0,1,0,0,0,1|1,0,1]=4 1495 B11R1.203 C#CCOC1CCCOCC1 ab550971303cc4117d42c7d05f0af1a7 [0,1,0,0,0,1|1,0,1]=4 1496 B11R1.203 C=CCNC1CCCCCC1 835b77ea2f05d1db508b48e058218dd9 [0,1,0,0,0,1|2,0,0]=4 1497 B11R1.203 C=CCNC1CCCOCC1 1be08262a435c741d84bac4f9254ef20 [0,1,0,0,0,1|2,0,0]=4 1498 B11R1.203 C=CCOC1CCCCCC1 ca0d4f6ae71f9bd82e371d166ad276fd [0,1,0,0,0,1|1,0,0]=3 1499 B11R1.203 C=CCOC1CCCOCC1 9a61617b39c478d5d16ad9dcc6077816 [0,1,0,0,0,1|1,0,0]=3 1500 B11R1.203 C=CCOC1COCCOC1 f1075a814478d7d34331499bd1032f78 [0,1,0,0,0,1|2,0,0]=4 1501 B11R1.203 CCCOC1CCCCCC1 a0d3b974b653d57eb78c12eb297baa1e [0,1,0,0,0,1|1,0,1]=4 1502 B11R1.203 CCCOC1CCCOCC1 e6ba70a1eee68a270651209b5c88918d [0,1,0,0,0,1|1,0,1]=4 1503 B11R1.203 CCOCC1CCCCCC1 01b51887c2e87b16f92024e3ab52aa12 [0,1,0,0,0,1|1,0,1]=4 1504 B11R1.203 COCOC1CCCCCC1 c669f7add16d44cc1d0541c9bd6617f7 [0,1,0,0,0,1|0,0,2]=4 1505 B11R1.203 COCOC1CCCOCC1 6b97d0bcd0cd87e23fc9406aa043f7c9 [0,1,0,0,0,1|0,0,2]=4 1506 B11R1.203 CSCOC1CCCCCC1 90eec6a2a8287bbaa85dcf4e8ba247e3 [0,1,0,0,0,1|0,1,1]=4 1507 B11R1.203 CSCOC1CCCOCC1 4b210e54c282e5a0f79fbbd7031b9748 [0,1,0,0,0,1|0,1,1]=4 1508 B11R1.203 FCCOC1CCCCCC1 7a234923a4de254fa31b1ac546f7c56f [0,1,0,0,0,1|1,0,1]=4 1509 B11R1.203 FCCOC1CCCOCC1 26daca4980a1c3f8e55c2dfe4e11924a [0,1,0,0,0,1|1,0,1]=4 1510 B11R1.203 FCOCC1CCCCCC1 180d24b69547b24cf74154898667164f [0,1,0,0,0,1|1,0,1]=4 1511 B11R1.203 N#CCOC1CCCCCC1 bfda39c26c4faec30b442b7e564adea4 [0,1,0,0,0,1|1,0,1]=4 1512 B11R1.203 N#CCOC1CCCOCC1 28d30ba798c67fa9df85903458ee8c9f [0,1,0,0,0,1|1,0,1]=4 1513 B11R1.203 O=CCCN1CCCCCC1 17784adde57d54451972fe0abbcf77b2 [0,1,0,0,0,1|2,0,0]=4 1514 B11R1.203 O=CCCN1CCCOCC1 16d14934f47760e6972ab602b1b06649 [0,1,0,0,0,1|2,0,0]=4 1515 B11R1.203 O=CCNC1CCC=CCC1 d838ba6153db90d1bef80bd862d73bcf [0,1,0,0,0,1|1,0,1]=4 1516 B11R1.203 O=CCNC1CCCCCC1 24eb6ac1a8dc2aac972722589a5f9050 [0,1,0,0,0,1|1,0,0]=3 1517 B11R1.203 O=CCNC1CCCOCC1 03ce52f15f32e381f6e463780268eddc [0,1,0,0,0,1|1,0,0]=3 1518 B11R1.203 O=CCOC1CCCCCC1 90420dad8ba0ca85278761550a74b58d [0,1,0,0,0,1|0,0,0]=2 1519 B11R1.203 O=CCOC1CCCOCC1 8e3db2c046c240e38c6f08efcab52a47 [0,1,0,0,0,1|0,0,0]=2 1520 B11R1.203 O=CCOC1COCCOC1 af843a8f61ca6bfb178bacae39190fcd [0,1,0,0,0,1|1,0,0]=3 1521 B11R1.203 O=CNCC1CCCCCC1 d98c7cfb82f8e40dc854108c9b87d8cb [0,1,0,0,0,1|1,0,0]=3 1522 B11R1.203 SCCOC1CCCCCC1 75478865fa94ff788ac8d34e86861fcf [0,1,0,0,0,1|0,1,1]=4 1523 B11R1.203 SCCOC1CCCOCC1 14d85e84a340706dfc045b3f87cc068c [0,1,0,0,0,1|0,1,1]=4 1524 B11R1.742 CC(=O)NC1CCC=CCC1 5e70f5c316af8cefbc5fffa0e646db51 [0,1,0,0,0,1|1,0,1]=4 1525 B11R1.742 CC(=O)NC1CCCCCC1 980c21986259e09356273dbf1a23f9df [0,1,0,0,0,1|1,0,0]=3 1526 B11R1.742 CC(=O)NC1CCCOCC1 faa609e7c510cdc55c5bbc154131a5e7 [0,1,0,0,0,1|1,0,0]=3 1527 B11R1.742 CC(C)OC1CCCCCC1 49cd74212008956419b032828c1aeb5a [0,1,0,0,0,1|1,0,1]=4 1528 B11R1.742 CC(C)OC1CCCOCC1 8e934b4df966fa14609d3072f87f8236 [0,1,0,0,0,1|1,0,1]=4 1529 B11R1.742 NC(=O)CN1CCCCCC1 3c6bdaed56195046700c5f9a02a73e34 [0,1,0,0,0,1|2,0,0]=4 1530 B11R1.742 NC(=O)CN1CCCOCC1 916ad609f21f064a7486c06fea619804 [0,1,0,0,0,1|2,0,0]=4 1531 B11R1.742 O=C(O)CN1CCCCCC1 d9f9edaddb25360088e69733dfba1666 [0,1,0,0,0,1|2,0,0]=4 1532 B11R1.742 O=C(O)CN1CCCOCC1 621646c1635481e8abe6c4a7848bde48 [0,1,0,0,0,1|2,0,0]=4 1533 B11R1.779 CC1(CCCCCC1)NC=O 088ad1793f04ee1af40695a37216d5f7 [0,1,0,0,0,1|1,0,0]=3 1534 B11R1.852 CC(C=O)N1CCCCCC1 6a41cd07a6de1affb08a5c24d4098a82 [0,1,0,0,0,1|2,0,0]=4 1535 B11R1.852 CC(C=O)N1CCCOCC1 8cbc278e6ffab750d40f828fe5e9e17a [0,1,0,0,0,1|2,0,0]=4 1536 B11R1.852 C[C@H](C=O)N1CCCCCC1 ab5737e77eafb94585a750688b4876ae [0,1,0,0,0,1|2,0,0]=4 1537 B11R1.852 C[C@H](C=O)N1CCCOCC1 83e86143632a36f6cabfd69fd7595a4e [0,1,0,0,0,1|2,0,0]=4 1538 B11R1.852 O=CC(=O)N1CCCCCC1 7431d7858aca3be4e39cb356c3397529 [0,1,0,0,0,1|2,0,0]=4 1539 B11R1.852 O=CC(=O)N1CCCOCC1 abbe14e14f3d94fac7a30f4f09f44cd4 [0,1,0,0,0,1|2,0,0]=4 1540 B11R1.1 C#CCOC1CCC(CC1)C 01bb9a460464dd43989414b7132b65e3 [0,2,0,0,0,0|1,0,1]=4 1541 B11R1.1 C#CCOC1CCC(CC1)F 3cbb808f8daa96f55efd0326cec7efa0 [0,2,0,0,0,0|1,0,1]=4 1542 B11R1.1 C#CCO[C@H]1CC[C@@H](CC1)C 4ab1296a22f19a5bd3a739d9dcf95729 [0,2,0,0,0,0|1,0,1]=4 1543 B11R1.1 C#CCO[C@H]1CC[C@H](CC1)C 5f08a3bd80296cb477d30dadf5c24657 [0,2,0,0,0,0|1,0,1]=4 1544 B11R1.1 C=CCNC1CCC(CC1)C 5ccc9cd77b86908b19eb61208954f840 [0,2,0,0,0,0|2,0,0]=4 1545 B11R1.1 C=CCNC1CCC(CC1)Cl 4ca8473443ae46441f0951e1d9efc8d5 [0,2,0,0,0,0|2,0,0]=4 1546 B11R1.1 C=CCNC1CCC(CC1)O 22b4797cf4a46cf4bf515761bbf63b10 [0,2,0,0,0,0|2,0,0]=4 1547 B11R1.1 C=CCN[C@H]1CC[C@@H](CC1)C bdedd3ed61b7a922a0f4239d04dc5509 [0,2,0,0,0,0|2,0,0]=4 1548 B11R1.1 C=CCN[C@H]1CC[C@@H](CC1)Cl 0174e33026c654c795c2f695fb3fe4da [0,2,0,0,0,0|2,0,0]=4 1549 B11R1.1 C=CCN[C@H]1CC[C@@H](CC1)O 6e8b39882c208f64ca82ee6f7fdc378c [0,2,0,0,0,0|2,0,0]=4 1550 B11R1.1 C=CCN[C@H]1CC[C@H](CC1)C 32f2e547e259777a312e2813fc5f9615 [0,2,0,0,0,0|2,0,0]=4 1551 B11R1.1 C=CCN[C@H]1CC[C@H](CC1)Cl 07bfee1058f3c8d209a3d2d976223a77 [0,2,0,0,0,0|2,0,0]=4 1552 B11R1.1 C=CCN[C@H]1CC[C@H](CC1)O 18339fd99f2480c7aa567d7912c85bad [0,2,0,0,0,0|2,0,0]=4 1553 B11R1.1 C=CCOC1CCC(=O)CC1 e1d18ba6081760cd96dc30f677edbdf2 [0,2,0,0,0,0|1,0,1]=4 1554 B11R1.1 C=CCOC1CCC(CC1)C e10acc49d9ce8691b91f3b245d9299a3 [0,2,0,0,0,0|1,0,0]=3 1555 B11R1.1 C=CCOC1CCC(CC1)F cbdf0fc8b5f11511043ede4bf69b6d1b [0,2,0,0,0,0|1,0,0]=3 1556 B11R1.1 C=CCOC1CCN(CC1)C c0475d88e87fd1721dd18cce40d2993e [0,2,0,0,0,0|2,0,0]=4 1557 B11R1.1 C=CCO[C@H]1CC[C@@H](CC1)C 1d94e25dfadb8b36500a011d724360e6 [0,2,0,0,0,0|1,0,0]=3 1558 B11R1.1 C=CCO[C@H]1CC[C@H](CC1)C 30dd112a7b9d5760f17a63dc741ed0fa [0,2,0,0,0,0|1,0,0]=3 1559 B11R1.1 CC1CCC(CC1)CNC=O 503909cbd8c013b6a46a0f6c42bea9ee [0,2,0,0,0,0|1,0,0]=3 1560 B11R1.1 CC1CCC(CC1)COCF af51a2e75cf06678cf86a00ac53db214 [0,2,0,0,0,0|1,0,1]=4 1561 B11R1.1 CC1CCC(CC1)NCC=O 563781267b1c5876db8c186cc1166349 [0,2,0,0,0,0|1,0,0]=3 1562 B11R1.1 CC1CCC(CC1)OCC#N 9f2756e3cfc9779b57ead8c476c7a31b [0,2,0,0,0,0|1,0,1]=4 1563 B11R1.1 CC1CCC(CC1)OCC=O e44873f4c1043ecb3c6f132001b29734 [0,2,0,0,0,0|0,0,0]=2 1564 B11R1.1 CC1CCC(CC1)OCCF ce456cdbd327590758e4e44044d5c53c [0,2,0,0,0,0|1,0,1]=4 1565 B11R1.1 CC1CCC(CC1)OCCS 9efb3f6957e3abcb443685317ffa0329 [0,2,0,0,0,0|0,1,1]=4 1566 B11R1.1 CC1CCN(CC1)CCC=O 74178a1ee1490f0ff0130d95dfdd79c3 [0,2,0,0,0,0|2,0,0]=4 1567 B11R1.1 CCCOC1CCC(CC1)C 7a9689dd98aa4f92d8f5043f1b15a983 [0,2,0,0,0,0|1,0,1]=4 1568 B11R1.1 CCCOC1CCC(CC1)F 5492765cb272ae15f43940e3f2e983f3 [0,2,0,0,0,0|1,0,1]=4 1569 B11R1.1 CCCO[C@H]1CC[C@@H](CC1)C 63f78b25b14708866f991f61dafeaa8d [0,2,0,0,0,0|1,0,1]=4 1570 B11R1.1 CCCO[C@H]1CC[C@H](CC1)C effb30eda82162f702b9f3fc5c106b18 [0,2,0,0,0,0|1,0,1]=4 1571 B11R1.1 CCOCC1CCC(CC1)C c51abc060b6548b39618627130923e28 [0,2,0,0,0,0|1,0,1]=4 1572 B11R1.1 CCOC[C@H]1CC[C@@H](CC1)C 447d65990e933e27973675b6f4d63d93 [0,2,0,0,0,0|1,0,1]=4 1573 B11R1.1 CCOC[C@H]1CC[C@H](CC1)C dca432ad3524dc848cfaf2383ff946e5 [0,2,0,0,0,0|1,0,1]=4 1574 B11R1.1 CN1CCC(CC1)CNC=O d58822b8b4567d61ba6a3c86fb1587ad [0,2,0,0,0,0|2,0,0]=4 1575 B11R1.1 CN1CCC(CC1)NCC=O 68bcd86875bcd6589d1c68c2fec77b73 [0,2,0,0,0,0|2,0,0]=4 1576 B11R1.1 CN1CCC(CC1)OCC=O 3ec0c0f5feaf51ae955f7da46b4e5866 [0,2,0,0,0,0|1,0,0]=3 1577 B11R1.1 COCOC1CCC(CC1)C b533e79cb752dbf004705603517f68e3 [0,2,0,0,0,0|0,0,2]=4 1578 B11R1.1 COCOC1CCC(CC1)F 40042d71ede654fe0b57fb5f311b6c78 [0,2,0,0,0,0|0,0,2]=4 1579 B11R1.1 COCO[C@H]1CC[C@@H](CC1)C 46f04969d505a344d47828591d5afbba [0,2,0,0,0,0|0,0,2]=4 1580 B11R1.1 COCO[C@H]1CC[C@H](CC1)C ead0cf63d354fae1455120fb75d88bd2 [0,2,0,0,0,0|0,0,2]=4 1581 B11R1.1 CSCOC1CCC(CC1)C 2ed1809682919ae968d68dcdfab70946 [0,2,0,0,0,0|0,1,1]=4 1582 B11R1.1 CSCOC1CCC(CC1)F 6910e82d33b718c312bcc96456df4bd6 [0,2,0,0,0,0|0,1,1]=4 1583 B11R1.1 CSCO[C@H]1CC[C@@H](CC1)C 378fff2f5110dd0e2b9a433891936a76 [0,2,0,0,0,0|0,1,1]=4 1584 B11R1.1 CSCO[C@H]1CC[C@H](CC1)C b0830592b39456e901a9c670ac0ecd46 [0,2,0,0,0,0|0,1,1]=4 1585 B11R1.1 C[C@H]1CC[C@@H](CC1)COCF 1156b04e4643bcc353f9b60940a0a0a8 [0,2,0,0,0,0|1,0,1]=4 1586 B11R1.1 C[C@H]1CC[C@@H](CC1)NCC=O 695b49a444409c7d2538a45b3dd58134 [0,2,0,0,0,0|1,0,0]=3 1587 B11R1.1 C[C@H]1CC[C@@H](CC1)OCC#N 4e7ebf9ac3f95ab6b8d3c5df5bb533cb [0,2,0,0,0,0|1,0,1]=4 1588 B11R1.1 C[C@H]1CC[C@@H](CC1)OCC=O da57f1f46be41e0505bd071f94010653 [0,2,0,0,0,0|0,0,0]=2 1589 B11R1.1 C[C@H]1CC[C@@H](CC1)OCCF 4c346f75017703b58e8a34fba1ea021d [0,2,0,0,0,0|1,0,1]=4 1590 B11R1.1 C[C@H]1CC[C@@H](CC1)OCCS c380f3a1b0a22c05ca2cf57fc6ed20af [0,2,0,0,0,0|0,1,1]=4 1591 B11R1.1 C[C@H]1CC[C@H](CC1)COCF 17c17b2e444aa81eff9a33b7bedf3390 [0,2,0,0,0,0|1,0,1]=4 1592 B11R1.1 C[C@H]1CC[C@H](CC1)NCC=O a22b3d8233fa52031c106d19282beb22 [0,2,0,0,0,0|1,0,0]=3 1593 B11R1.1 C[C@H]1CC[C@H](CC1)OCC#N 9d42d5eb18e98535a8929bdfbadaec3e [0,2,0,0,0,0|1,0,1]=4 1594 B11R1.1 C[C@H]1CC[C@H](CC1)OCC=O 75c958c0a563ac84ed12efbb91fb7007 [0,2,0,0,0,0|0,0,0]=2 1595 B11R1.1 C[C@H]1CC[C@H](CC1)OCCF 8ec150b84a2ea614892a7f20ea825f28 [0,2,0,0,0,0|1,0,1]=4 1596 B11R1.1 C[C@H]1CC[C@H](CC1)OCCS ad1e68d829a3ee2a7146e5047919419f [0,2,0,0,0,0|0,1,1]=4 1597 B11R1.1 FC1CCC(CC1)OCCS 57f6260afed6fab3f9c4af1800b7ec5b [0,2,0,0,0,0|0,1,1]=4 1598 B11R1.1 FCCOC1CCC(CC1)F 2f9e3d58f23dc5277988daefa2d314da [0,2,0,0,0,0|1,0,1]=4 1599 B11R1.1 N#CCOC1CCC(CC1)F b7d1e6ced8db629496eb630551b35db8 [0,2,0,0,0,0|1,0,1]=4 1600 B11R1.1 O=CCCN1CCC(CC1)Cl 726831b4483e548d01180b3044e5bf0e [0,2,0,0,0,0|2,0,0]=4 1601 B11R1.1 O=CCCN1CCC(CC1)F b2a11cb371e3ffb7fe45fada7c46f28a [0,2,0,0,0,0|2,0,0]=4 1602 B11R1.1 O=CCCN1CCC(CC1)I a4970402566e9e3fe5a7cfb26fb7378c [0,2,0,0,0,0|2,0,0]=4 1603 B11R1.1 O=CCCN1CCC(CC1)O 9203fb3fb04969798a37449bea16c30e [0,2,0,0,0,0|2,0,0]=4 1604 B11R1.1 O=CCNC1CCC(CC1)Cl aea6b7bbc5e364e2758efc331efc4172 [0,2,0,0,0,0|1,0,0]=3 1605 B11R1.1 O=CCNC1CCC(CC1)O 52451bb2db840ca9893a28591d28b0d9 [0,2,0,0,0,0|1,0,0]=3 1606 B11R1.1 O=CCN[C@H]1CC[C@@H](CC1)Cl 0ffe4c61b919a6a0ef3ebc2487cea13d [0,2,0,0,0,0|1,0,0]=3 1607 B11R1.1 O=CCN[C@H]1CC[C@@H](CC1)O 7fa00c144a66949160d6b0dafe345087 [0,2,0,0,0,0|1,0,0]=3 1608 B11R1.1 O=CCN[C@H]1CC[C@H](CC1)Cl 1be5375c996de6cbce5a657c29fd26a9 [0,2,0,0,0,0|1,0,0]=3 1609 B11R1.1 O=CCN[C@H]1CC[C@H](CC1)O 5650465dd6dcd1a4733fcbe2fa5d2541 [0,2,0,0,0,0|1,0,0]=3 1610 B11R1.1 O=CCOC1CC=C(CC1)Br f1e5abb794855c18d05f2362cbe6a50d [0,2,0,0,0,0|0,0,2]=4 1611 B11R1.1 O=CCOC1CCC(=O)CC1 5ba1739ce2aa5e2f1e9dd16e6746cf64 [0,2,0,0,0,0|0,0,1]=3 1612 B11R1.1 O=CCOC1CCC(=O)NC1 6b8461d580bde98c45a7f9d64b9fab79 [0,2,0,0,0,0|1,0,1]=4 1613 B11R1.1 O=CCOC1CCC(=O)OC1 9f2163389721640fc416d26b80ed80b1 [0,2,0,0,0,0|1,0,1]=4 1614 B11R1.1 O=CCOC1CCC(CC1)F 8a290cc2d3861b6f090d98ff22636375 [0,2,0,0,0,0|0,0,0]=2 1615 B11R1.1 O=CCO[C@@H]1CCC(=O)NC1 3581528fe167f8d6b737878e143e203d [0,2,0,0,0,0|1,0,1]=4 1616 B11R1.1 O=CCO[C@H]1CCC(=O)NC1 8b47b94ed4a8565282eb10f063f0978a [0,2,0,0,0,0|1,0,1]=4 1617 B11R1.1 O=CNCC1CCC(CC1)Cl 57bd5bf5f90e6edd7c947402853a288f [0,2,0,0,0,0|1,0,0]=3 1618 B11R1.1 O=CNCC1CCC(CC1)O 9263642340770910b55fcf12f680e979 [0,2,0,0,0,0|1,0,0]=3 1619 B11R1.1 O=CNC[C@H]1CC[C@@H](CC1)F 1dfd1a094dea6c756949fe033879c98b [0,2,0,0,0,0|1,0,0]=3 1620 B11R1.1 O=CNC[C@H]1CC[C@@H](CC1)O 8cbda474beefcee12cd39711c505a15f [0,2,0,0,0,0|1,0,0]=3 1621 B11R1.1 O=CNC[C@H]1CC[C@H](CC1)F 6bd7f287e6553b4f72dca8fb991714f0 [0,2,0,0,0,0|1,0,0]=3 1622 B11R1.20 CC(=O)NC1CCC(CC1)C d5b9c289f55164a8ef9fd28f678cff26 [0,2,0,0,0,0|1,0,0]=3 1623 B11R1.20 CC(=O)NC1CCC(CC1)Cl 76e885a44d6ff7276ddb2cec71b9bb91 [0,2,0,0,0,0|1,0,0]=3 1624 B11R1.20 CC(=O)NC1CCC(CC1)O 32ccc720dacb2d1a60bef0ac05af6e03 [0,2,0,0,0,0|1,0,0]=3 1625 B11R1.20 CC(=O)NC1CCN(CC1)C 365f1d8bab7411b36bf113908c710eba [0,2,0,0,0,0|2,0,0]=4 1626 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C 59946d0e4761e996c325795030cfdc0f [0,2,0,0,0,0|1,0,0]=3 1627 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)Cl d9ee28abd65cc9504067bebafb158071 [0,2,0,0,0,0|1,0,0]=3 1628 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)O de0f4c835ebb4ab00269ab1d23370b55 [0,2,0,0,0,0|1,0,0]=3 1629 B11R1.20 CC(=O)N[C@H]1CC[C@H](CC1)C d5b4032d8a2c96d43aa13ec6b6d114f1 [0,2,0,0,0,0|1,0,0]=3 1630 B11R1.20 CC(=O)N[C@H]1CC[C@H](CC1)Cl 38f4de32edba01e8633a04da61695570 [0,2,0,0,0,0|1,0,0]=3 1631 B11R1.20 CC(=O)N[C@H]1CC[C@H](CC1)O c1dc106a33ee46042df9bb05d205ab58 [0,2,0,0,0,0|1,0,0]=3 1632 B11R1.20 CC(C)OC1CCC(CC1)F f8ac96671e1d8cebb8d0d381455bb00f [0,2,0,0,0,0|1,0,1]=4 1633 B11R1.20 CC(C)O[C@H]1CC[C@@H](CC1)C 946b7f948ca67338ace34d326f9240a7 [0,2,0,0,0,0|1,0,1]=4 1634 B11R1.20 CC(C)O[C@H]1CC[C@H](CC1)C d27dc5a2956277c5f4d7b56b3150ccb9 [0,2,0,0,0,0|1,0,1]=4 1635 B11R1.20 CC1CCC(CC1)OC(C)C ac4eff980fe42f1bc06c0529e2b5a636 [0,2,0,0,0,0|1,0,1]=4 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CC(C=O)N1CCC(CC1)F 6b35501ca81c15bbe096af108a0b2420 [0,2,0,0,0,0|2,0,0]=4 1648 B11R1.22 CC(C=O)N1CCC(CC1)I 44da54046ce8745d369d2ec2704ca7be [0,2,0,0,0,0|2,0,0]=4 1649 B11R1.22 CC(C=O)N1CCC(CC1)O 89198967e9769a6e3f2c7c29f86d511a [0,2,0,0,0,0|2,0,0]=4 1650 B11R1.22 CC1CCC(CC1)N(C)C=O d9c207cb2d222888c85cc78ba33477cd [0,2,0,0,0,0|1,0,0]=3 1651 B11R1.22 CC1CCN(CC1)C(=O)C=O f9871bca41412a78c66e6352ee165e64 [0,2,0,0,0,0|2,0,0]=4 1652 B11R1.22 CC1CCN(CC1)C(C)C=O 388b625bfb3c8913f51b920a17e13af3 [0,2,0,0,0,0|2,0,0]=4 1653 B11R1.22 CC1CCN(CC1)[C@H](C)C=O f4a207dc455af6f0abebdc393be97736 [0,2,0,0,0,0|2,0,0]=4 1654 B11R1.22 CN(C=O)C1CCC(CC1)O b091e142e145a4715dfc88542ecfb983 [0,2,0,0,0,0|1,0,0]=3 1655 B11R1.22 CN(C=O)[C@H]1CC[C@@H](CC1)C ffa741d4e11710edc04dba3db77b5f54 [0,2,0,0,0,0|1,0,0]=3 1656 B11R1.22 CN(C=O)[C@H]1CC[C@@H](CC1)O 0f51908af19db360dd6deee9338f9c8f [0,2,0,0,0,0|1,0,0]=3 1657 B11R1.22 CN(C=O)[C@H]1CC[C@H](CC1)O 2b1e8a67ecd4adf61b3e5a8180a4f9c2 [0,2,0,0,0,0|1,0,0]=3 1658 B11R1.22 C[C@H](C=O)N1CCC(CC1)Cl c17dd00aee89a4a4b715e55a7d039d13 [0,2,0,0,0,0|2,0,0]=4 1659 B11R1.22 C[C@H](C=O)N1CCC(CC1)F 803e20ba60ff16e0a7448f78385fd897 [0,2,0,0,0,0|2,0,0]=4 1660 B11R1.22 C[C@H](C=O)N1CCC(CC1)I 2cf1468875690c0217c1558e4413f650 [0,2,0,0,0,0|2,0,0]=4 1661 B11R1.22 C[C@H](C=O)N1CCC(CC1)O 00dc57064c987a802becefee43e3f43c [0,2,0,0,0,0|2,0,0]=4 1662 B11R1.22 O=CC(=O)N1CCC(CC1)Cl 923133ba8edb877410310e2b3e78fe06 [0,2,0,0,0,0|2,0,0]=4 1663 B11R1.22 O=CC(=O)N1CCC(CC1)F 4248e391794d619de19275ccb16d5780 [0,2,0,0,0,0|2,0,0]=4 1664 B11R1.22 O=CC(=O)N1CCC(CC1)I d4f536cce4d3da195c70b13719d5804a [0,2,0,0,0,0|2,0,0]=4 1665 B11R1.22 O=CC(=O)N1CCC(CC1)O 7703308564cfdd271b7ff5b649bd5171 [0,2,0,0,0,0|2,0,0]=4 1666 B11R1.81 CC1CC(CCN1CC=O)O 2062774d57aa5d1807a4064ded8e874d [0,2,0,0,0,0|2,0,0]=4 1667 B11R1.81 CC1CCC(C(C1)C)OCF b5d1eaf27e4ebd5eefc0964a27cdd04f [0,2,0,0,0,0|1,0,1]=4 1668 B11R1.81 CC1CCN(C(C1)C)CC=O e5fef56ae870894cd540f192363486a4 [0,2,0,0,0,0|2,0,0]=4 1669 B11R1.81 CCOC1CCC(CC1C)C 5246aeca18c911a03ccd65c74b371681 [0,2,0,0,0,0|1,0,1]=4 1670 B11R1.81 CN1CC[C@H]([C@@H](C1)F)NC=O 4d2b49494e788e6fe22eb0dc301965ab [0,2,0,0,0,0|2,0,0]=4 1671 B11R1.81 CN1CC[C@H]([C@H](C1)F)NC=O 9dbd5f9f904e98728a53da363ca1c417 [0,2,0,0,0,0|2,0,0]=4 1672 B11R1.81 C[C@@H]1CCN([C@@H](C1)C)CC=O 74e68e224b1d83e07fdfe60ad5aef97f [0,2,0,0,0,0|2,0,0]=4 1673 B11R1.81 C[C@@H]1CN(CC[C@H]1NC=O)C 0a5b685af50fee89f649fb7525b76c74 [0,2,0,0,0,0|2,0,0]=4 1674 B11R1.81 C[C@@H]1C[C@@H](CCN1CC=O)O 39127eab0974fd7e52607e36035119ea [0,2,0,0,0,0|2,0,0]=4 1675 B11R1.81 C[C@@H]1C[C@H](CCN1CC=O)O f18312f76be4ec47dd1a96e9e680161e [0,2,0,0,0,0|2,0,0]=4 1676 B11R1.81 C[C@H]1CCN([C@H](C1)C)CC=O 0a0a0b72c1014612b541bb7f6998d463 [0,2,0,0,0,0|2,0,0]=4 1677 B11R1.81 C[C@H]1CN(CC[C@H]1NC=O)C d20f428327292b05bec039be423329a1 [0,2,0,0,0,0|2,0,0]=4 1678 B11R1.82 CC1(CCC(CC1)NC=O)C 0dfdb9530d26622dd09e8bc3c927ba9d [0,2,0,0,0,0|1,0,0]=3 1679 B11R1.82 CC1(CCC(CC1)NC=O)O a6de811cb61b1381d0ff4359d8b17461 [0,2,0,0,0,0|1,0,0]=3 1680 B11R1.82 CC1(CCC(CC1)OCF)C 783a96ed22d0fd1f4c24d317e362545e [0,2,0,0,0,0|1,0,1]=4 1681 B11R1.82 CC1(CCC(CO1)NC=O)C 3fbf83ef08a46f9f14617b26045c52ea [0,2,0,0,0,0|2,0,0]=4 1682 B11R1.82 CC1(CCN(CC1)CC=O)C 5b4b99744366486dc4f0c5499c635ac4 [0,2,0,0,0,0|2,0,0]=4 1683 B11R1.82 CC1(CCN(CC1)CC=O)O 0e9e75b6e496b3702e2f55c26988dea8 [0,2,0,0,0,0|2,0,0]=4 1684 B11R1.82 CCOC1CCC(CC1)(C)C 1b6ccac4b12dfa4f4ce2f585b5732bac [0,2,0,0,0,0|1,0,1]=4 1685 B11R1.82 CCOC1CCC(CC1)(F)F 17a61f6b3d06014e84a11c2b7cc024c8 [0,2,0,0,0,0|1,0,1]=4 1686 B11R1.82 C[C@@]1(CC[C@@H](CC1)NC=O)O 9e116c89ac45c4ee0ee1ba6b14ee3b01 [0,2,0,0,0,0|1,0,0]=3 1687 B11R1.82 C[C@@]1(CC[C@H](CC1)NC=O)O 45d61310f663646eeec112a8fe6f1e83 [0,2,0,0,0,0|1,0,0]=3 1688 B11R1.82 FCOC1CCC(CC1)(F)F 682395646e7d2ac8eb3067b68881de40 [0,2,0,0,0,0|1,0,1]=4 1689 B11R1.82 O=CCN1CCC(CC1)(F)F 8a56d6b6b12ae79e209c73830f722d2f [0,2,0,0,0,0|2,0,0]=4 1690 B11R1.82 O=CNC1CCC(CC1)(F)F dd1ba221f5dfd4beb3603217f3467695 [0,2,0,0,0,0|1,0,0]=3 1691 B11R1.82 O=CNC1CCS(=O)(=O)CC1 2506a5abac9c0e30786034eb6818a60f [0,2,0,0,0,0|2,0,0]=4 1692 B11R1.83 C#CC1CCC(CC1)NC=O b2a2b072b3cc5ae2301435b2fa24c397 [0,2,0,0,0,0|1,0,0]=3 1693 B11R1.83 C#C[C@H]1CC[C@@H](CC1)OCC c3a8d5c938d2c3c06ab460fb06f5a25b [0,2,0,0,0,0|1,0,1]=4 1694 B11R1.83 C#C[C@H]1CC[C@@H](CC1)OCF 91e64e3bfb3bee8fcf70767e1c8f7e2d [0,2,0,0,0,0|1,0,1]=4 1695 B11R1.83 CCC1CCC(CC1)NC=O bef17f52eefd0fd2d7b23840d2fa7eae [0,2,0,0,0,0|1,0,0]=3 1696 B11R1.83 CCC1CCC(CC1)OCF a6d18ba1211d04ecf3491844a41cb5c1 [0,2,0,0,0,0|1,0,1]=4 1697 B11R1.83 CCC1CCN(CC1)CC=O a16bb01f6242cfd969bd0c7c67262f60 [0,2,0,0,0,0|2,0,0]=4 1698 B11R1.83 CCN1CCC(CC1)NC=O b215703abfe8d47e34bc938fcce7bf6b [0,2,0,0,0,0|2,0,0]=4 1699 B11R1.83 CCOC1CCC(CC1)C#N 5205eebcfa815785963f3561e7f23685 [0,2,0,0,0,0|1,0,1]=4 1700 B11R1.83 CCOC1CCC(CC1)C=O 128bd101c56d5d7ac071030c8b8b7f58 [0,2,0,0,0,0|1,0,1]=4 1701 B11R1.83 CCOC1CCC(CC1)CC 02797840577dca733a061ea69f341836 [0,2,0,0,0,0|1,0,1]=4 1702 B11R1.83 CCOC1CCC(CC1)OC c0425e8c2adb7ee2e2432fab83363c98 [0,2,0,0,0,0|1,0,1]=4 1703 B11R1.83 CCO[C@H]1CC[C@@H](CC1)C#N c24fc84f9e07e050805e60b190a2673f [0,2,0,0,0,0|1,0,1]=4 1704 B11R1.83 CCO[C@H]1CC[C@@H](CC1)C=O f96fb5ffebd4410affc315505d0bceb9 [0,2,0,0,0,0|1,0,1]=4 1705 B11R1.83 CCO[C@H]1CC[C@@H](CC1)CC c57f8121828892c0bd063a684a07ef71 [0,2,0,0,0,0|1,0,1]=4 1706 B11R1.83 CCO[C@H]1CC[C@@H](CC1)OC d5f5223b75e830d9b8a0e527c7b36c67 [0,2,0,0,0,0|1,0,1]=4 1707 B11R1.83 CCO[C@H]1CC[C@H](CC1)C=O 8a05f9f205da63d96d70c9c8076b1599 [0,2,0,0,0,0|1,0,1]=4 1708 B11R1.83 CCO[C@H]1CC[C@H](CC1)CC fdd0354268bfd20b80436ddee0e4b628 [0,2,0,0,0,0|1,0,1]=4 1709 B11R1.83 CCO[C@H]1CC[C@H](CC1)OC 583108b04ffe64777fa99ee5183678dc [0,2,0,0,0,0|1,0,1]=4 1710 B11R1.83 CC[C@H]1CC[C@@H](CC1)OCF 195d3bee012f52f15c383d5624ab17c8 [0,2,0,0,0,0|1,0,1]=4 1711 B11R1.83 CC[C@H]1CC[C@H](CC1)OCF dbd61384f451ef6840fa92660c9f8873 [0,2,0,0,0,0|1,0,1]=4 1712 B11R1.83 COC1CCC(CC1)NC=O 1e519784d7c7b4cc2e349e002237fb8e [0,2,0,0,0,0|1,0,0]=3 1713 B11R1.83 COC1CCC(CC1)OCF daa1bafcff1f551e62e14d32ed23ffa5 [0,2,0,0,0,0|1,0,1]=4 1714 B11R1.83 COC1CCN(CC1)CC=O e245bbd97ade3df5ac2b1ff3aceae383 [0,2,0,0,0,0|2,0,0]=4 1715 B11R1.83 CON1CCC(CC1)NC=O 72923b5dbbf73eee218fa35c8398510c [0,2,0,0,0,0|2,0,0]=4 1716 B11R1.83 CO[C@H]1CC[C@@H](CC1)NC=O a44dc2799f9155ba92492a11ce465960 [0,2,0,0,0,0|1,0,0]=3 1717 B11R1.83 CO[C@H]1CC[C@@H](CC1)OCF 71ecdcd92228a13192c29ab491cc59ee [0,2,0,0,0,0|1,0,1]=4 1718 B11R1.83 CO[C@H]1CC[C@H](CC1)NC=O 44b2ce294eac12187a868776e4b50e7d [0,2,0,0,0,0|1,0,0]=3 1719 B11R1.83 CO[C@H]1CC[C@H](CC1)OCF bb6492bfc97384d0848492d452508ee7 [0,2,0,0,0,0|1,0,1]=4 1720 B11R1.83 CSC1CCN(CC1)CC=O 6f5bcd11179e589c4d334269eea6f4e0 [0,2,0,0,0,0|2,0,0]=4 1721 B11R1.83 N#CC1CCC(CC1)NC=O 6ed7ae0b62a0d65eb124b841122f77d0 [0,2,0,0,0,0|1,0,0]=3 1722 B11R1.83 N#CC1CCC(CC1)OCF 9b04daf38c2315036db77bb50611af44 [0,2,0,0,0,0|1,0,1]=4 1723 B11R1.83 N#CC1CCN(CC1)CC=O 52db4b9f40b34f4f89291053a813f76f [0,2,0,0,0,0|2,0,0]=4 1724 B11R1.83 N#C[C@H]1CC[C@@H](CC1)NC=O 1ebcab12dede094736a95073a4d18351 [0,2,0,0,0,0|1,0,0]=3 1725 B11R1.83 N#C[C@H]1CC[C@@H](CC1)OCF d7facb414a105e2c9a965951a87f7b0c [0,2,0,0,0,0|1,0,1]=4 1726 B11R1.83 O=CC1CCC(CC1)OCF 6d8c7e6d8618b519bb9493e8e6c910fd [0,2,0,0,0,0|1,0,1]=4 1727 B11R1.83 O=CCN1CCC(CC1)C=O 61105f1560e6c4f6887c9c04bf6ea038 [0,2,0,0,0,0|2,0,0]=4 1728 B11R1.83 O=CCN1CCC(CC1)CF e8da660ae9cf28a399afbe977e184f97 [0,2,0,0,0,0|2,0,0]=4 1729 B11R1.83 O=CCN1CCC(CC1)CO a03d76533be38a0fce47870972e87e4d [0,2,0,0,0,0|2,0,0]=4 1730 B11R1.83 O=CNC1CCC(CC1)CO 9746ec8f5e4f85d965cc790188dc8afd [0,2,0,0,0,0|1,0,0]=3 1731 B11R1.83 O=CN[C@H]1CC[C@@H](CC1)CO d002a83574d9a8fad5a8779eeb33abfb [0,2,0,0,0,0|1,0,0]=3 1732 B11R1.83 O=CN[C@H]1CC[C@H](CC1)CO 6bf8c884a72a92184263b3724138f2f9 [0,2,0,0,0,0|1,0,0]=3 1733 B11R1.83 O=C[C@H]1CC[C@@H](CC1)OCF 58eafd04aa0e534b42c7218ae5cd8797 [0,2,0,0,0,0|1,0,1]=4 1734 B11R1.83 O=C[C@H]1CC[C@H](CC1)OCF bd1b5e07de1aab59a0cd93e3f095d132 [0,2,0,0,0,0|1,0,1]=4 1735 B11R1.192 CC1CC(CCN1C)NC=O bebb54a662db231671a587b05f482c77 [0,2,0,0,0,0|2,0,0]=4 1736 B11R1.192 CC1CCC(CC1C)OCF 0bf5dff7bcdf809fc1634e4369f5b8cc [0,2,0,0,0,0|1,0,1]=4 1737 B11R1.192 CC1CCN(CC1O)CC=O 374deadc81e57175156206222cf6ab79 [0,2,0,0,0,0|2,0,0]=4 1738 B11R1.192 CC1CN(CCC1O)CC=O 43ec5bae4fbb0e4f723ff6edc4309666 [0,2,0,0,0,0|2,0,0]=4 1739 B11R1.192 CCOC1CCC(C(C1)C)C d24b6e7faefbe3bf1f15394631ab65e5 [0,2,0,0,0,0|1,0,1]=4 1740 B11R1.192 C[C@@H]1CCN(C[C@@H]1O)CC=O 9e7d73cf9bbe4801ec5c46957410d5e9 [0,2,0,0,0,0|2,0,0]=4 1741 B11R1.192 C[C@@H]1CCN(C[C@H]1O)CC=O 7461524b908c71b71e7a66362336f371 [0,2,0,0,0,0|2,0,0]=4 1742 B11R1.192 C[C@@H]1CN(CC[C@H]1O)CC=O 43203da87baa814e24d42fe223f8de05 [0,2,0,0,0,0|2,0,0]=4 1743 B11R1.192 C[C@H]1CCN(C[C@@H]1O)CC=O ed2b432490592b75c4731533799876f2 [0,2,0,0,0,0|2,0,0]=4 1744 B11R1.192 C[C@H]1CCN(C[C@H]1O)CC=O ea195029283e6cdb0e4d9c628a9c880c [0,2,0,0,0,0|2,0,0]=4 1745 B11R1.192 C[C@H]1CN(CC[C@H]1O)CC=O b206113d2aa9657b6d2a210fc02c8d6a [0,2,0,0,0,0|2,0,0]=4 1746 B11R1.192 C[C@H]1C[C@H](CCN1C)NC=O eb071eeda918f424025777b41c35cb4e [0,2,0,0,0,0|2,0,0]=4 1747 B11R1.192 O=CCN1CC[C@@H]([C@H](C1)O)O 4680ac4db1e6f479aa91129ccaec4a65 [0,2,0,0,0,0|2,0,0]=4 1748 B11R1.192 O=CCN1CC[C@H]([C@@H](C1)F)O fcc0f1f3e78f1f8ed03013bfd25aaaee [0,2,0,0,0,0|2,0,0]=4 1749 B11R1.192 O=CCN1CC[C@H]([C@@H](C1)O)F cacaaaae443a7d58fe3c6aa8f10c4d2a [0,2,0,0,0,0|2,0,0]=4 1750 B11R1.192 O=CCN1CC[C@H]([C@H](C1)F)O 55bae39db5246d1af31169c84b4e6ce5 [0,2,0,0,0,0|2,0,0]=4 1751 B11R1.192 O=CCN1CC[C@H]([C@H](C1)O)F 86db2b48333ea368fcaa0c2a922cad95 [0,2,0,0,0,0|2,0,0]=4 1752 B11R1.13 CC1C(CCCN1CC=O)O c9126d7079ce888f05648347afe97ce5 [0,2,0,0,0,0|2,0,0]=4 1753 B11R1.13 CC1CCCC(C1C)NC=O 5bf82a1b4f29264a3432bd7286f5b05d [0,2,0,0,0,0|1,0,0]=3 1754 B11R1.13 CC1CCCC(C1C)OCF 9f6c8e1e2d6f4c150a4696e06f3ece04 [0,2,0,0,0,0|1,0,1]=4 1755 B11R1.13 CCOC1CCCC(C1C)C 4098a7a3821b84edaba6a0d52db91b33 [0,2,0,0,0,0|1,0,1]=4 1756 B11R1.13 C[C@@H]1[C@H](CCCN1CC=O)O 46de7b3029d38337a1ff3bafd28e20ad [0,2,0,0,0,0|2,0,0]=4 1757 B11R1.13 C[C@H]1[C@@H](CCCN1CC=O)O 63be8c17db630c30eb671e890592fabb [0,2,0,0,0,0|2,0,0]=4 1758 B11R1.17 C#CCOC1CCCCC1C de6c309116e3fd7e608abcd5a99821f4 [0,2,0,0,0,0|1,0,1]=4 1759 B11R1.17 C#CCOC1CCCCC1F e62f26c8c942528f99703ba400085bf4 [0,2,0,0,0,0|1,0,1]=4 1760 B11R1.17 C#CCO[C@@H]1CCCC[C@@H]1C cef42b4bbbf2cf3de09407ca45002729 [0,2,0,0,0,0|1,0,1]=4 1761 B11R1.17 C#CCO[C@@H]1CCCC[C@H]1F 6aa41fd82eaa25394f9590d3a82b5c3c [0,2,0,0,0,0|1,0,1]=4 1762 B11R1.17 C#CCO[C@H]1CCCC[C@@H]1C 59932442031a5312dd7713bd79e943c5 [0,2,0,0,0,0|1,0,1]=4 1763 B11R1.17 C#CCO[C@H]1CCCC[C@H]1C 7059b29e56a61d35282285af437ddea8 [0,2,0,0,0,0|1,0,1]=4 1764 B11R1.17 C=CCNC1CCCCC1C 0f8e1cb32627df43b10feebc2d437183 [0,2,0,0,0,0|2,0,0]=4 1765 B11R1.17 C=CCNC1CCCCC1O 207fdcaae57bb9b73b7515f183c0fb56 [0,2,0,0,0,0|2,0,0]=4 1766 B11R1.17 C=CCN[C@@H]1CCCC[C@@H]1C 5a2a4402da25c0ab68bba3cde500961d [0,2,0,0,0,0|2,0,0]=4 1767 B11R1.17 C=CCN[C@@H]1CCCC[C@H]1C 4a6db63969f1730e35d7ac55b1690c81 [0,2,0,0,0,0|2,0,0]=4 1768 B11R1.17 C=CCN[C@@H]1CCCC[C@H]1O ee2cbd0ab8a8e1101abf442442a0b0db [0,2,0,0,0,0|2,0,0]=4 1769 B11R1.17 C=CCN[C@H]1CCCC[C@@H]1C 1c5801197116ba8d45b5c1241369d490 [0,2,0,0,0,0|2,0,0]=4 1770 B11R1.17 C=CCN[C@H]1CCCC[C@@H]1O 28a9d4b13ce4e53ed2761ad834fbcadc [0,2,0,0,0,0|2,0,0]=4 1771 B11R1.17 C=CCN[C@H]1CCCC[C@H]1C 01ef9d6efd289cbc744aeea855c543e1 [0,2,0,0,0,0|2,0,0]=4 1772 B11R1.17 C=CCN[C@H]1CCCC[C@H]1O 5c55d0cef06da69dcf6b28bf1d12fabc [0,2,0,0,0,0|2,0,0]=4 1773 B11R1.17 C=CCOC1CCCCC1=O 7c0d6399ba4bb1218efd714532f64dc7 [0,2,0,0,0,0|1,0,1]=4 1774 B11R1.17 C=CCOC1CCCCC1C 499585986b8d70f4b8d53e77c99298e1 [0,2,0,0,0,0|1,0,0]=3 1775 B11R1.17 C=CCOC1CCCCC1F e0ab31dd3c88aa1a52be31ac2b55ba03 [0,2,0,0,0,0|1,0,0]=3 1776 B11R1.17 C=CCOC1CCOCC1C c0ad1801fa89f6f1c1b2b88d0caa3ca1 [0,2,0,0,0,0|2,0,0]=4 1777 B11R1.17 C=CCOC1CCOCC1F 105cb3a64f9f0a4b60c4bcd7327b3807 [0,2,0,0,0,0|2,0,0]=4 1778 B11R1.17 C=CCO[C@@H]1CCCC[C@@H]1C 4264fb512d1b0adf711f3964d5f98030 [0,2,0,0,0,0|1,0,0]=3 1779 B11R1.17 C=CCO[C@@H]1CCCC[C@H]1F 0b352b4ec41bd728a061c0f1a26337e6 [0,2,0,0,0,0|1,0,0]=3 1780 B11R1.17 C=CCO[C@@H]1CCOC[C@@H]1F 7ab0816b00314d31aff3ff6781361bc4 [0,2,0,0,0,0|2,0,0]=4 1781 B11R1.17 C=CCO[C@H]1CCCC[C@@H]1C 66511d4755f17c1150b367e93f6ee423 [0,2,0,0,0,0|1,0,0]=3 1782 B11R1.17 C=CCO[C@H]1CCCC[C@H]1C 97b8607e579c0b86bed86d48c1d4973a [0,2,0,0,0,0|1,0,0]=3 1783 B11R1.17 C=CCO[C@H]1CCOC[C@@H]1F 51422109901d0ff40bd2e7e5782cc45f [0,2,0,0,0,0|2,0,0]=4 1784 B11R1.17 C=CCO[C@H]1CCOC[C@H]1F fff0f967fd084c57e4501712946b58dc [0,2,0,0,0,0|2,0,0]=4 1785 B11R1.17 CC1CCCCC1CNC=O 258dd7a96deba7febdb8348ed4089e86 [0,2,0,0,0,0|1,0,0]=3 1786 B11R1.17 CC1CCCCC1NCC=O 822891e5e136c9289f9711cfadb5d66b [0,2,0,0,0,0|1,0,0]=3 1787 B11R1.17 CC1CCCCC1OCC#N a4afb4ff4279a3633c12b8e0f2588ed8 [0,2,0,0,0,0|1,0,1]=4 1788 B11R1.17 CC1CCCCC1OCC=O 7bd3b929eded7b7b89c9febdee55a5c2 [0,2,0,0,0,0|0,0,0]=2 1789 B11R1.17 CC1CCCCC1OCCF dbad73d99254e4ee3296ed6293b7e54b [0,2,0,0,0,0|1,0,1]=4 1790 B11R1.17 CC1CCCCC1OCCS 2590ec6e7649626e0ce7c7117fe9347e [0,2,0,0,0,0|0,1,1]=4 1791 B11R1.17 CC1CCCCN1CCC=O a9b3f62835c65e514d20883a1d79e3a5 [0,2,0,0,0,0|2,0,0]=4 1792 B11R1.17 CC1COCCC1NCC=O ed24d9af1ff56d599184a63cb4e59b59 [0,2,0,0,0,0|2,0,0]=4 1793 B11R1.17 CC1COCCC1OCC=O f6081e9b63143383237f6488ee0d71a0 [0,2,0,0,0,0|1,0,0]=3 1794 B11R1.17 CCCOC1CCCCC1C 4d0cd2cc86879eaea764a5e506032648 [0,2,0,0,0,0|1,0,1]=4 1795 B11R1.17 CCCOC1CCCCC1F 5b119750afb6113f1e64ad8ff5224643 [0,2,0,0,0,0|1,0,1]=4 1796 B11R1.17 CCCO[C@@H]1CCCC[C@@H]1C e7057264cfbad8629f9a4688e6a83d4f [0,2,0,0,0,0|1,0,1]=4 1797 B11R1.17 CCCO[C@@H]1CCCC[C@H]1F b046b599956a03824b30c58925a0f1ac [0,2,0,0,0,0|1,0,1]=4 1798 B11R1.17 CCCO[C@H]1CCCC[C@@H]1C 6243eb875afc5a9f4ff394ac6f43dee3 [0,2,0,0,0,0|1,0,1]=4 1799 B11R1.17 CCCO[C@H]1CCCC[C@H]1C 81c2b2c6a4f88908629c095bb85377dd [0,2,0,0,0,0|1,0,1]=4 1800 B11R1.17 CN1CCCCC1CNC=O 1ff54f003791a6b6f4cbc5e12734fa24 [0,2,0,0,0,0|2,0,0]=4 1801 B11R1.17 COCOC1CCCCC1C 04612028f51e6cada192150c12627c72 [0,2,0,0,0,0|0,0,2]=4 1802 B11R1.17 COCOC1CCCCC1F 076f7211c19815684905b29cc9b90905 [0,2,0,0,0,0|0,0,2]=4 1803 B11R1.17 COCO[C@@H]1CCCC[C@@H]1C 13b925b59bd3c505248c6e004437cf1c [0,2,0,0,0,0|0,0,2]=4 1804 B11R1.17 COCO[C@@H]1CCCC[C@H]1F 56d7a3125a81f950136332e73ec2440e [0,2,0,0,0,0|0,0,2]=4 1805 B11R1.17 COCO[C@H]1CCCC[C@@H]1C c1630b0bfee2f4e9e26e6e47add49623 [0,2,0,0,0,0|0,0,2]=4 1806 B11R1.17 COCO[C@H]1CCCC[C@H]1C 40896b335cde93f2f6d498ccca277374 [0,2,0,0,0,0|0,0,2]=4 1807 B11R1.17 CSCOC1CCCCC1C 7ad203cec64717c90481576c7786bb07 [0,2,0,0,0,0|0,1,1]=4 1808 B11R1.17 CSCOC1CCCCC1F 827ec9abf8b18f0c70620ef304fb89ec [0,2,0,0,0,0|0,1,1]=4 1809 B11R1.17 CSCO[C@@H]1CCCC[C@@H]1C 1fa088698c8224331021de5c87e94d80 [0,2,0,0,0,0|0,1,1]=4 1810 B11R1.17 CSCO[C@@H]1CCCC[C@H]1F 4dd2383af96199ae32e5b1a082bded92 [0,2,0,0,0,0|0,1,1]=4 1811 B11R1.17 CSCO[C@H]1CCCC[C@@H]1C 2781b7cfa1a51dc80f8e0408b9fa3d68 [0,2,0,0,0,0|0,1,1]=4 1812 B11R1.17 CSCO[C@H]1CCCC[C@H]1C d966848fd97cf8f4c939348557cc6d17 [0,2,0,0,0,0|0,1,1]=4 1813 B11R1.17 C[C@@H]1CCCCN1CCC=O 15385e821b5f4feb5b8d61f6bf0c2a42 [0,2,0,0,0,0|2,0,0]=4 1814 B11R1.17 C[C@@H]1CCCC[C@@H]1NCC=O 5ccf3c74006165bda80577a764d074e4 [0,2,0,0,0,0|1,0,0]=3 1815 B11R1.17 C[C@@H]1CCCC[C@@H]1OCC#N c8ab6acc8d3f8f867ac85e66ba75ff5d [0,2,0,0,0,0|1,0,1]=4 1816 B11R1.17 C[C@@H]1CCCC[C@@H]1OCC=O d1ac85bc7593435da4239136c56deef0 [0,2,0,0,0,0|0,0,0]=2 1817 B11R1.17 C[C@@H]1CCCC[C@@H]1OCCF 2eefa151e6e59f054bbaee32ba283c98 [0,2,0,0,0,0|1,0,1]=4 1818 B11R1.17 C[C@@H]1CCCC[C@@H]1OCCS f63be3378242d696b498bcbf6b6b9ab8 [0,2,0,0,0,0|0,1,1]=4 1819 B11R1.17 C[C@@H]1CCCC[C@H]1NCC=O f70fafce3f9483650deb6f77db1dcfdc [0,2,0,0,0,0|1,0,0]=3 1820 B11R1.17 C[C@@H]1COCC[C@@H]1NCC=O 1865100cbf3991f0eddc1c91085f1048 [0,2,0,0,0,0|2,0,0]=4 1821 B11R1.17 C[C@H]1CCCCN1CCC=O d1b1585713c65dadb2c8cfd5d7289b26 [0,2,0,0,0,0|2,0,0]=4 1822 B11R1.17 C[C@H]1CCCC[C@@H]1NCC=O 2297d6775451edf05514321d3fbe377c [0,2,0,0,0,0|1,0,0]=3 1823 B11R1.17 C[C@H]1CCCC[C@@H]1OCC#N c6e248f3f3c3dc7122db82f41caad172 [0,2,0,0,0,0|1,0,1]=4 1824 B11R1.17 C[C@H]1CCCC[C@@H]1OCC=O 302cd3a8de23eda591da0b5f068e9827 [0,2,0,0,0,0|0,0,0]=2 1825 B11R1.17 C[C@H]1CCCC[C@@H]1OCCF 5ccb609b65c8c6d0dc7a9e72cf4f2317 [0,2,0,0,0,0|1,0,1]=4 1826 B11R1.17 C[C@H]1CCCC[C@@H]1OCCS 11d3d12f0afaac2d5b26f85f6cc2f69e [0,2,0,0,0,0|0,1,1]=4 1827 B11R1.17 C[C@H]1CCCC[C@H]1NCC=O 9cc410cce0514e4359d7296e58cd83d6 [0,2,0,0,0,0|1,0,0]=3 1828 B11R1.17 C[C@H]1CCCC[C@H]1OCC#N cbebc22ba5befa17acab299276faac24 [0,2,0,0,0,0|1,0,1]=4 1829 B11R1.17 C[C@H]1CCCC[C@H]1OCC=O 618550352360bab8ec27f338b1353a30 [0,2,0,0,0,0|0,0,0]=2 1830 B11R1.17 C[C@H]1CCCC[C@H]1OCCF 2abb0a28c254dd3dbe118b235d42bc1f [0,2,0,0,0,0|1,0,1]=4 1831 B11R1.17 C[C@H]1CCCC[C@H]1OCCS ffd9997f4f199afa9828e6a571afc26b [0,2,0,0,0,0|0,1,1]=4 1832 B11R1.17 C[C@H]1COCC[C@H]1NCC=O 7ed140f571a1a877852089ee6642b244 [0,2,0,0,0,0|2,0,0]=4 1833 B11R1.17 FC1CCCCC1OCCS 2896b7fcf1674c2c59835dd53468f9e8 [0,2,0,0,0,0|0,1,1]=4 1834 B11R1.17 FCCOC1CCCCC1F 638126321e6a9cc61c44ffc74666b02d [0,2,0,0,0,0|1,0,1]=4 1835 B11R1.17 FCCO[C@@H]1CCCC[C@H]1F 8c76ae2b495403cf589b86b0f7c8fd8f [0,2,0,0,0,0|1,0,1]=4 1836 B11R1.17 F[C@@H]1CCCC[C@H]1OCCS 4b72a244d84539c4ccb4357903a2d83b [0,2,0,0,0,0|0,1,1]=4 1837 B11R1.17 N#CCOC1CCCCC1F 8e60f31031596ae7ae2fb6f21e2a42ab [0,2,0,0,0,0|1,0,1]=4 1838 B11R1.17 N#CCO[C@@H]1CCCC[C@H]1F 12bb14af302d02c26400e7f42d68c9b4 [0,2,0,0,0,0|1,0,1]=4 1839 B11R1.17 O=CCNC1CCCCC1O ccf03e475b42dc4fe89b7584e87e45b7 [0,2,0,0,0,0|1,0,0]=3 1840 B11R1.17 O=CCNC1CCOCC1O 6d080c1a27fca9a279a54a6f43a98696 [0,2,0,0,0,0|2,0,0]=4 1841 B11R1.17 O=CCN[C@@H]1CCCC[C@H]1O 1b31fa31ebde8fc8b834456456cc27f4 [0,2,0,0,0,0|1,0,0]=3 1842 B11R1.17 O=CCN[C@@H]1CCOC[C@@H]1O 42efed33c8aed331199f8da60baa3a76 [0,2,0,0,0,0|2,0,0]=4 1843 B11R1.17 O=CCN[C@@H]1CCOC[C@H]1F 57346fd4b572b29a455b7a66b7102f7e [0,2,0,0,0,0|2,0,0]=4 1844 B11R1.17 O=CCN[C@@H]1CCOC[C@H]1O 464ddccadcf21b9c3ce755ae70c4fee7 [0,2,0,0,0,0|2,0,0]=4 1845 B11R1.17 O=CCN[C@@H]1COCC[C@@H]1O a9fda6e46d9d5f6ed1deeedf71fc73d0 [0,2,0,0,0,0|2,0,0]=4 1846 B11R1.17 O=CCN[C@@H]1COCC[C@H]1O be90919a1191d5019fb5affd322295f0 [0,2,0,0,0,0|2,0,0]=4 1847 B11R1.17 O=CCN[C@H]1CCCC[C@@H]1O f7e1b7228d7aa13c14e004e83b31b729 [0,2,0,0,0,0|1,0,0]=3 1848 B11R1.17 O=CCN[C@H]1CCCC[C@H]1O b185ae73559d2735ee8f823fd465ae06 [0,2,0,0,0,0|1,0,0]=3 1849 B11R1.17 O=CCN[C@H]1CCOC[C@@H]1F d70c3f6d58dbd290043ff96ea6d4e46e [0,2,0,0,0,0|2,0,0]=4 1850 B11R1.17 O=CCN[C@H]1CCOC[C@@H]1O 5510045d025134af2e3166a0a12e9237 [0,2,0,0,0,0|2,0,0]=4 1851 B11R1.17 O=CCN[C@H]1CCOC[C@H]1O c6663322ab09d6852b35174750732646 [0,2,0,0,0,0|2,0,0]=4 1852 B11R1.17 O=CCN[C@H]1COCC[C@@H]1O c170160501f494b74082b341d9ab8886 [0,2,0,0,0,0|2,0,0]=4 1853 B11R1.17 O=CCN[C@H]1COCC[C@H]1O 467c37b3c66914080f80710bcbcb46ad [0,2,0,0,0,0|2,0,0]=4 1854 B11R1.17 O=CCOC1CCCC=C1Br eeae24bf818c50fb8b08ef7e99d3161c [0,2,0,0,0,0|0,0,2]=4 1855 B11R1.17 O=CCOC1CCCCC1=O 6f0428b216be6f3298c638f28c946743 [0,2,0,0,0,0|0,0,1]=3 1856 B11R1.17 O=CCOC1CCCCC1F 43f570b02cbac0a2c7872aaa8027cf7e [0,2,0,0,0,0|0,0,0]=2 1857 B11R1.17 O=CCOC1CCCNC1=O b52abebcd87cd604988de686a4cb5fe5 [0,2,0,0,0,0|1,0,1]=4 1858 B11R1.17 O=CCOC1CCCOC1=O 81d31c362e0a7c70e40b0ea10c4c7da2 [0,2,0,0,0,0|1,0,1]=4 1859 B11R1.17 O=CCOC1CCOCC1F d32f6f62225893c70a363c7e231c7c76 [0,2,0,0,0,0|1,0,0]=3 1860 B11R1.17 O=CCO[C@@H]1CCCC[C@H]1F 387cb05df7314dd3c1a9efe9af5937e4 [0,2,0,0,0,0|0,0,0]=2 1861 B11R1.17 O=CCO[C@@H]1CCCNC1=O 0374419bb3c73c5dec482d8517889ec1 [0,2,0,0,0,0|1,0,1]=4 1862 B11R1.17 O=CCO[C@@H]1CCOC[C@@H]1F ec0b67eebf0d3981530045d5de20bbc8 [0,2,0,0,0,0|1,0,0]=3 1863 B11R1.17 O=CCO[C@H]1CCCNC1=O d67dc95a37a3d046a6886ef4211628ce [0,2,0,0,0,0|1,0,1]=4 1864 B11R1.17 O=CCO[C@H]1CCOC[C@@H]1F f7a147e6b343bd6cbaa8d15648a0d0c4 [0,2,0,0,0,0|1,0,0]=3 1865 B11R1.17 O=CCO[C@H]1CCOC[C@H]1F 5025e784d21038c3022af31587bc267b [0,2,0,0,0,0|1,0,0]=3 1866 B11R1.17 O=CNCC1CCCCC1O 438da8e64898a3094d65ec7aa4e7597b [0,2,0,0,0,0|1,0,0]=3 1867 B11R1.17 O=CNCC1CSCCC1O 9b4253baa60895d340049d19e6d32a57 [0,2,0,0,0,0|2,0,0]=4 1868 B11R1.41 C#CC1CCCCC1OCC 11d03ec38e105c1077a77b10c0f43e52 [0,2,0,0,0,0|1,0,1]=4 1869 B11R1.41 C#CC1CCCCC1OCF 84a418d0e8fe62efa0cff9be6250e0c0 [0,2,0,0,0,0|1,0,1]=4 1870 B11R1.41 C#CC1CCCCN1CC=O b436fbdfe06f3ff757a2efe778fa11bc [0,2,0,0,0,0|2,0,0]=4 1871 B11R1.41 C#C[C@@H]1CCCC[C@@H]1OCC 3f9387ae5f19f01dc9bd2ab37ef91438 [0,2,0,0,0,0|1,0,1]=4 1872 B11R1.41 C#C[C@@H]1CCCC[C@@H]1OCF becd7312133518af8ecea3a64a58206d [0,2,0,0,0,0|1,0,1]=4 1873 B11R1.41 C#C[C@@H]1CCCC[C@H]1OCC cd8a4dd470d1785f1ad7760e915998b8 [0,2,0,0,0,0|1,0,1]=4 1874 B11R1.41 C#C[C@@H]1CCCC[C@H]1OCF b0be058e6572472838b79395215b7562 [0,2,0,0,0,0|1,0,1]=4 1875 B11R1.41 CCC1CCCCC1OCF 1cd08105dd638695cc6af1465a6af2c4 [0,2,0,0,0,0|1,0,1]=4 1876 B11R1.41 CCC1CCCCN1CC=O 748aabe74482115f55e00322a7b46875 [0,2,0,0,0,0|2,0,0]=4 1877 B11R1.41 CCC1COCCC1NC=O 9765dbe94cce8d7e77e2060d0e49c2f2 [0,2,0,0,0,0|2,0,0]=4 1878 B11R1.41 CCOC1CCCCC1CC 810042b55fdd81b47fd5fb695851c34e [0,2,0,0,0,0|1,0,1]=4 1879 B11R1.41 CCOC1CCCCC1OC b532451a5bdbf718fe078517509cf76d [0,2,0,0,0,0|1,0,1]=4 1880 B11R1.41 CCO[C@@H]1CCCC[C@H]1SC 2993473c789d05460b7803f356cbcc00 [0,2,0,0,0,0|1,0,1]=4 1881 B11R1.41 CC[C@@H]1CCCCN1CC=O 4159365175d2ec814c24df618d6c0669 [0,2,0,0,0,0|2,0,0]=4 1882 B11R1.41 CC[C@H]1CCCCN1CC=O 91e74095fda1ba31ae667e551915a7e2 [0,2,0,0,0,0|2,0,0]=4 1883 B11R1.41 COC1CCCCC1NC=O cc5e2a74ace5b96f1afb859e3def4284 [0,2,0,0,0,0|1,0,0]=3 1884 B11R1.41 COC1CCCCC1OCF 18391e98e9d5d7752fd1211205dddc51 [0,2,0,0,0,0|1,0,1]=4 1885 B11R1.41 CO[C@@H]1COCC[C@@H]1NC=O 0c0c9c16178e0de9a098d1ae8ae1172d [0,2,0,0,0,0|2,0,0]=4 1886 B11R1.41 CO[C@@H]1COCC[C@H]1NC=O 91881cc1c7545a3ab1c6dbe65524ad46 [0,2,0,0,0,0|2,0,0]=4 1887 B11R1.41 CO[C@H]1CCCC[C@@H]1NC=O f68560348deb1cf0ef006703908d203d [0,2,0,0,0,0|1,0,0]=3 1888 B11R1.41 CO[C@H]1COCC[C@@H]1NC=O fb47511d465864a5aa00d803f468841f [0,2,0,0,0,0|2,0,0]=4 1889 B11R1.41 CO[C@H]1COCC[C@H]1NC=O 60aae49333f2908c7c88a0cbdb032c04 [0,2,0,0,0,0|2,0,0]=4 1890 B11R1.41 CS[C@@H]1CCCC[C@H]1OCF 32b730335c5e08e68e3bf3b6aee6b345 [0,2,0,0,0,0|1,0,1]=4 1891 B11R1.41 N#CC1CCCCN1CC=O 1b5e8540272274103a23cb5019d97465 [0,2,0,0,0,0|2,0,0]=4 1892 B11R1.41 N#C[C@@H]1CCCCN1CC=O c8abbc51f41909e420728173b6d98462 [0,2,0,0,0,0|2,0,0]=4 1893 B11R1.41 N#C[C@H]1CCCCN1CC=O 06c073e081f07c1fca855fce8dd2b872 [0,2,0,0,0,0|2,0,0]=4 1894 B11R1.41 O=CCN1CCCCC1C=O d127896abc999bf0da76a8bdf35d1e61 [0,2,0,0,0,0|2,0,0]=4 1895 B11R1.41 O=CCN1CCCCC1CO 48cda386568df1883dff822fa7f6127f [0,2,0,0,0,0|2,0,0]=4 1896 B11R1.41 O=CCN1CCCC[C@@H]1CO d70841756a3e93b7ed5cb250d3fabcfd [0,2,0,0,0,0|2,0,0]=4 1897 B11R1.41 O=CCN1CCCC[C@H]1CO 73f1dc92f2db511a8dc812ca4bfbaac4 [0,2,0,0,0,0|2,0,0]=4 1898 B11R1.41 O=CNC1CCOCC1CO 04b66acc30d7e7d236fa652735ba4a92 [0,2,0,0,0,0|2,0,0]=4 1899 B11R1.41 O=CN[C@@H]1CCCC[C@@H]1CO 9d20d8d62d25011a622962147aa3b6d2 [0,2,0,0,0,0|1,0,0]=3 1900 B11R1.41 O=CN[C@@H]1CCCC[C@H]1CO f353a135c51fbe92959326a57efea182 [0,2,0,0,0,0|1,0,0]=3 1901 B11R1.41 O=CN[C@@H]1CCOC[C@@H]1CO 23406e48be36da508ab477e666b3e8cf [0,2,0,0,0,0|2,0,0]=4 1902 B11R1.41 O=CN[C@H]1CCCC[C@H]1CO 77e3fca0ffe3271fe24eb97865c93f43 [0,2,0,0,0,0|1,0,0]=3 1903 B11R1.86 CC(=O)NC1CCCCC1C 670701ef37830c881dfd98f284b6eaef [0,2,0,0,0,0|1,0,0]=3 1904 B11R1.86 CC(=O)NC1CCCCC1O bc79a4a57827afa3a4fa640017043055 [0,2,0,0,0,0|1,0,0]=3 1905 B11R1.86 CC(=O)NC1CCOCC1C edce8fbaf211b854c7f2ed742fd852ac [0,2,0,0,0,0|2,0,0]=4 1906 B11R1.86 CC(=O)NC1CCOCC1O cb746fa02122a1c8e989262a386091b1 [0,2,0,0,0,0|2,0,0]=4 1907 B11R1.86 CC(=O)N[C@@H]1CCCC[C@@H]1C 2bac565059009b92e61af1d1f0ba1ffd [0,2,0,0,0,0|1,0,0]=3 1908 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1C 479fb6aae9438e2010ab8b66de7f20cf [0,2,0,0,0,0|1,0,0]=3 1909 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1O db67c1bdd3ca05ff8229e30fa13e50d9 [0,2,0,0,0,0|1,0,0]=3 1910 B11R1.86 CC(=O)N[C@@H]1CCOC[C@@H]1C 248ac71d47aadfd8f2eeffdc90582804 [0,2,0,0,0,0|2,0,0]=4 1911 B11R1.86 CC(=O)N[C@@H]1CCOC[C@@H]1O 5251c2796e93ed258960602eafe4f324 [0,2,0,0,0,0|2,0,0]=4 1912 B11R1.86 CC(=O)N[C@@H]1CCOC[C@H]1F 4f420ebee40698c307e49ee9c6af0122 [0,2,0,0,0,0|2,0,0]=4 1913 B11R1.86 CC(=O)N[C@@H]1CCOC[C@H]1O 817b64886b10369169918ea81c6ac193 [0,2,0,0,0,0|2,0,0]=4 1914 B11R1.86 CC(=O)N[C@@H]1COCC[C@@H]1O 5f343067535cbb6efe6f9ac8f2cfc299 [0,2,0,0,0,0|2,0,0]=4 1915 B11R1.86 CC(=O)N[C@@H]1COCC[C@H]1O 869f7a7742874e07df4c6c076fc79d56 [0,2,0,0,0,0|2,0,0]=4 1916 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1C 18a83c7bce0c6708eeacbe02f36aa7ad [0,2,0,0,0,0|1,0,0]=3 1917 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1O cd06a0c7fdec32c28b7b1670c804df5a [0,2,0,0,0,0|1,0,0]=3 1918 B11R1.86 CC(=O)N[C@H]1CCCC[C@H]1C c4b6727756a1c9df9d0de80b9b0690de [0,2,0,0,0,0|1,0,0]=3 1919 B11R1.86 CC(=O)N[C@H]1CCCC[C@H]1O 3d7a6b45c93e0f7c67e70ae3e747c43c [0,2,0,0,0,0|1,0,0]=3 1920 B11R1.86 CC(=O)N[C@H]1CCOC[C@@H]1F eee6e1972846d96f5b0db9b205ce6ccc [0,2,0,0,0,0|2,0,0]=4 1921 B11R1.86 CC(=O)N[C@H]1CCOC[C@@H]1O 766dd2f31551893d0f625a222f7f4efe [0,2,0,0,0,0|2,0,0]=4 1922 B11R1.86 CC(=O)N[C@H]1CCOC[C@H]1C 32b6893bb7f4f962fa7d51cc42867b19 [0,2,0,0,0,0|2,0,0]=4 1923 B11R1.86 CC(=O)N[C@H]1CCOC[C@H]1O fe90578a9a63664c28a2dedd612c7a5d [0,2,0,0,0,0|2,0,0]=4 1924 B11R1.86 CC(=O)N[C@H]1COCC[C@@H]1O 05299134e04c83f554aa1112864b71ab [0,2,0,0,0,0|2,0,0]=4 1925 B11R1.86 CC(=O)N[C@H]1COCC[C@H]1O 70b05ac012a26d313e29548ce8507da1 [0,2,0,0,0,0|2,0,0]=4 1926 B11R1.86 CC(C)OC1CCCCC1C b4c267bb3b9407b9284b4f055ae2de60 [0,2,0,0,0,0|1,0,1]=4 1927 B11R1.86 CC(C)OC1CCCCC1F 175e2060d6b5b69445f61e890d59ebc4 [0,2,0,0,0,0|1,0,1]=4 1928 B11R1.86 CC(C)O[C@@H]1CCCC[C@@H]1C f3f862e5cd7c7e64b484aab9f56b2096 [0,2,0,0,0,0|1,0,1]=4 1929 B11R1.86 CC(C)O[C@@H]1CCCC[C@H]1F 7269fb47453e7ef3d70e17da1c9f95d6 [0,2,0,0,0,0|1,0,1]=4 1930 B11R1.86 CC(C)O[C@H]1CCCC[C@@H]1C 64cafc3979af74337ea251fe8ffa8fbe [0,2,0,0,0,0|1,0,1]=4 1931 B11R1.86 CC(C)O[C@H]1CCCC[C@H]1C 39bbc4065e1eb39991f25781ceb406de [0,2,0,0,0,0|1,0,1]=4 1932 B11R1.86 CC1CCCCN1CC(=O)N 95d8db6234d5d946df75a0454d896ca4 [0,2,0,0,0,0|2,0,0]=4 1933 B11R1.86 CC1CCCCN1CC(=O)O ae84160ac6931f8f66d20194a2549691 [0,2,0,0,0,0|2,0,0]=4 1934 B11R1.86 C[C@@H]1CCCCN1CC(=O)N 224870232655bdf8beec7ae59fbf7936 [0,2,0,0,0,0|2,0,0]=4 1935 B11R1.86 C[C@@H]1CCCCN1CC(=O)O e977167422de3a18af9f7c21c4b88fdb [0,2,0,0,0,0|2,0,0]=4 1936 B11R1.86 C[C@H]1CCCCN1CC(=O)N eeecbfc2e69926c3df9a2ea739e8e528 [0,2,0,0,0,0|2,0,0]=4 1937 B11R1.86 C[C@H]1CCCCN1CC(=O)O b00078cb16b191d42880e0e45b0eac26 [0,2,0,0,0,0|2,0,0]=4 1938 B11R1.182 CC1CCC(C(C1)OCF)C 2d9e9530690521416f4055d2b89b2a2d [0,2,0,0,0,0|1,0,1]=4 1939 B11R1.182 CC1CCC(CN1CC=O)O ff9a716b31490cc4cccc362f257506a6 [0,2,0,0,0,0|2,0,0]=4 1940 B11R1.182 CCOC1CC(CCC1C)C 33ca5bb47c81f1fcde925eecbfed1877 [0,2,0,0,0,0|1,0,1]=4 1941 B11R1.182 C[C@@H]1CC[C@H](CN1CC=O)O 590d15a639d91a5a6281b3931e34bbd3 [0,2,0,0,0,0|2,0,0]=4 1942 B11R1.191 CC1(CCCCC1NC=O)C 399d48ef2d9749724b23989a3ed85538 [0,2,0,0,0,0|1,0,0]=3 1943 B11R1.191 CC1(CCCCC1NC=O)O bff8372e18ab19a6ae21ae7925983638 [0,2,0,0,0,0|1,0,0]=3 1944 B11R1.191 CC1(CCCCC1OCF)C a37c21803b3101bde4b43f5ae35d8fca [0,2,0,0,0,0|1,0,1]=4 1945 B11R1.191 CC1(CCCCN1CC=O)C 68b6f85de9bc391cf2741feb23e8a659 [0,2,0,0,0,0|2,0,0]=4 1946 B11R1.191 CC1(COCCC1NC=O)C 8b86279361c8a32e7e6525aa41132c5d [0,2,0,0,0,0|2,0,0]=4 1947 B11R1.191 CCOC1CCCCC1(C)C ffb41d0422e8151677e995843e539298 [0,2,0,0,0,0|1,0,1]=4 1948 B11R1.191 CCOC1CCCCC1(F)F 27a6c9f2987cf691be5ef7d45536520f [0,2,0,0,0,0|1,0,1]=4 1949 B11R1.191 FCOC1CCCCC1(F)F d43ee6653ad3144e949e4d6830995416 [0,2,0,0,0,0|1,0,1]=4 1950 B11R1.191 O=CNC1CCCCC1(F)F 51185d53bffc0de124042ab9fec18e98 [0,2,0,0,0,0|1,0,0]=3 1951 B11R1.191 O=CNC1COCCC1(F)F 11f8fdbf53c8a0ed2aa5a9a5abb9d3a2 [0,2,0,0,0,0|2,0,0]=4 1952 B11R1.222 CC(C=O)N1CCCCC1C e6729ab0dfb9e07ef37f9e01ca438481 [0,2,0,0,0,0|2,0,0]=4 1953 B11R1.222 CC(C=O)N1CCCC[C@@H]1C 0a9d70f37a64ebcd1bfb08bd07fbdfaa [0,2,0,0,0,0|2,0,0]=4 1954 B11R1.222 CC(C=O)N1CCCC[C@H]1C c9975310cc492ffa5d52198516c31590 [0,2,0,0,0,0|2,0,0]=4 1955 B11R1.222 CC1CCCCN1C(=O)C=O 2892a74f4a16871a90474e06d74388f9 [0,2,0,0,0,0|2,0,0]=4 1956 B11R1.222 CC1CCCCN1[C@H](C)C=O 1da49ebee89836f0d53762b8d8f18fff [0,2,0,0,0,0|2,0,0]=4 1957 B11R1.222 CN(C=O)[C@@H]1CCCC[C@H]1O 69efb889ad400dbefb4291280ad267a7 [0,2,0,0,0,0|1,0,0]=3 1958 B11R1.222 CN(C=O)[C@H]1CCCC[C@@H]1O c9906e7af070457acc44032f40b3515a [0,2,0,0,0,0|1,0,0]=3 1959 B11R1.222 CN(C=O)[C@H]1CCCC[C@H]1O 207e7043a180a082fab0328f5777a393 [0,2,0,0,0,0|1,0,0]=3 1960 B11R1.222 C[C@@H]1CCCCN1C(=O)C=O 12cad2dbfc5561d4317760834fa5dd7a [0,2,0,0,0,0|2,0,0]=4 1961 B11R1.222 C[C@H](C=O)N1CCCC[C@@H]1C 22b368bbb3c0d4d6a87b371bc5c701a7 [0,2,0,0,0,0|2,0,0]=4 1962 B11R1.222 C[C@H](C=O)N1CCCC[C@H]1C 10485b522302a4d3fd0fc40d19754ecc [0,2,0,0,0,0|2,0,0]=4 1963 B11R1.222 C[C@H]1CCCCN1C(=O)C=O 27bb5acce87176d3c595dde750caf102 [0,2,0,0,0,0|2,0,0]=4 1964 B11R1.605 CC1CCCC(C1OCF)C 4cf95f9b7208f4468fcad7c4a94714da [0,2,0,0,0,0|1,0,1]=4 1965 B11R1.605 CC1CCCC(N1CC=O)C 77588300ee2271b5dfd32fc781987991 [0,2,0,0,0,0|2,0,0]=4 1966 B11R1.605 CCOC1C(CCCC1C)C 30abb37be90a01722ca4faa64380cfec [0,2,0,0,0,0|1,0,1]=4 1967 B11R1.605 C[C@@H]1CCC[C@@H](N1CC=O)C f8741cacb83a2c7e07dd5c7a9647a20b [0,2,0,0,0,0|2,0,0]=4 1968 B11R1.605 C[C@@H]1CCC[C@H](N1CC=O)C cc7d7b2314fbc20f3da68985a17cb621 [0,2,0,0,0,0|2,0,0]=4 1969 B11R1.605 C[C@H]1CCC[C@@H](N1CC=O)C 434f83b4eae1841552b8fb03d863fa00 [0,2,0,0,0,0|2,0,0]=4 1970 B11R1.605 O=CN[C@H]1[C@@H](CCC[C@@H]1O)O 96dcd4c18eca8165eae213b752b38678 [0,2,0,0,0,0|1,0,0]=3 1971 B11R1.23 CC(C=O)N1CCCC(C1)F eed13e50018ba46ec2997dc16a253162 [0,2,0,0,0,0|2,0,0]=4 1972 B11R1.23 CC(C=O)N1CCCC(C1)O d128478599bc3834ce1bf0f3d453809f [0,2,0,0,0,0|2,0,0]=4 1973 B11R1.23 CC(C=O)N1CCC[C@@H](C1)C 115f57877190fc7395f99d67f03b64b5 [0,2,0,0,0,0|2,0,0]=4 1974 B11R1.23 CC(C=O)N1CCC[C@@H](C1)F 00d62aca4bcdd86e111e9f55ccce116b [0,2,0,0,0,0|2,0,0]=4 1975 B11R1.23 CC(C=O)N1CCC[C@@H](C1)O 2408ce19d2565149122fbaa936f61ac8 [0,2,0,0,0,0|2,0,0]=4 1976 B11R1.23 CC(C=O)N1CCC[C@H](C1)C 0a0d97e208c5c7009f99599169961e0a [0,2,0,0,0,0|2,0,0]=4 1977 B11R1.23 CC(C=O)N1CCC[C@H](C1)F bb3ecea41a0f8cf7d18cb43e731f4be8 [0,2,0,0,0,0|2,0,0]=4 1978 B11R1.23 CC(C=O)N1CCC[C@H](C1)O dc2ee7752b1084efd47dedb18399fb06 [0,2,0,0,0,0|2,0,0]=4 1979 B11R1.23 CC1CCCN(C1)C(=O)C=O fc16aa0c34ca78f8a62d27cad7a7bdeb [0,2,0,0,0,0|2,0,0]=4 1980 B11R1.23 CC1CCCN(C1)C(C)C=O 8fbd8b4ad0bdd14532c0024d738b4101 [0,2,0,0,0,0|2,0,0]=4 1981 B11R1.23 CC1CCCN(C1)[C@H](C)C=O c2e79fdd5936632467b8fd064e3d7ee4 [0,2,0,0,0,0|2,0,0]=4 1982 B11R1.23 CN(C=O)C1CCCC(C1)O 9b767bbb2dcb2e2d08a4fbe9fd1c7701 [0,2,0,0,0,0|1,0,0]=3 1983 B11R1.23 CN(C=O)[C@@H]1CCC[C@H](C1)O c7618bdfcf3c382d22b12defb64c9d16 [0,2,0,0,0,0|1,0,0]=3 1984 B11R1.23 CN(C=O)[C@H]1CCC[C@@H](C1)O d5ee9d7190ffa0c91396ba7df0ba5380 [0,2,0,0,0,0|1,0,0]=3 1985 B11R1.23 CN1CCC[C@@H](C1)N(C)C=O dc0575cef58d8ebe47d89e5da997d54d [0,2,0,0,0,0|2,0,0]=4 1986 B11R1.23 CN1CCC[C@H](C1)N(C)C=O 0c7e2d1ea84dde5d3f0f3cc0b5fb7805 [0,2,0,0,0,0|2,0,0]=4 1987 B11R1.23 C[C@@H]1CCCN(C1)C(=O)C=O d7b75cf711e4001c7d4df82df242904c [0,2,0,0,0,0|2,0,0]=4 1988 B11R1.23 C[C@@H]1CCCN(C1)[C@H](C)C=O 2c7143a4bd428aa9ef73af0844d1b63d [0,2,0,0,0,0|2,0,0]=4 1989 B11R1.23 C[C@H](C=O)N1CCCC(C1)F ef9dafc474bed9a27083dd6154765864 [0,2,0,0,0,0|2,0,0]=4 1990 B11R1.23 C[C@H](C=O)N1CCCC(C1)O 73dab1c5b9ef8580eee52e9a31c6d6f2 [0,2,0,0,0,0|2,0,0]=4 1991 B11R1.23 C[C@H](C=O)N1CCC[C@@H](C1)F 02ccce7fbcbfb82e09d7e67b09c3e468 [0,2,0,0,0,0|2,0,0]=4 1992 B11R1.23 C[C@H](C=O)N1CCC[C@@H](C1)O 364105ff2bcbaa4eb79049b9dc306931 [0,2,0,0,0,0|2,0,0]=4 1993 B11R1.23 C[C@H](C=O)N1CCC[C@H](C1)F a069f691dadc8b4768acc67f96036840 [0,2,0,0,0,0|2,0,0]=4 1994 B11R1.23 C[C@H](C=O)N1CCC[C@H](C1)O 3b8f2ac32a6222d1c3abc551d7001215 [0,2,0,0,0,0|2,0,0]=4 1995 B11R1.23 C[C@H]1CCCN(C1)C(=O)C=O 6093b15ace88bc127962456c3021fc2a [0,2,0,0,0,0|2,0,0]=4 1996 B11R1.23 C[C@H]1CCCN(C1)[C@H](C)C=O eb6a8a4f245e3490af5ec3c4d83c0f34 [0,2,0,0,0,0|2,0,0]=4 1997 B11R1.23 O=CC(=O)N1CCCC(C1)F 9e5453ad586ad3d60f271147b2dfe0a4 [0,2,0,0,0,0|2,0,0]=4 1998 B11R1.23 O=CC(=O)N1CCCC(C1)O 7b1acf1b78649e3696de1f56450c8aa0 [0,2,0,0,0,0|2,0,0]=4 1999 B11R1.23 O=CC(=O)N1CCC[C@@H](C1)F 60f22e91e07c5d41510c33f7899eb060 [0,2,0,0,0,0|2,0,0]=4 2000 B11R1.23 O=CC(=O)N1CCC[C@@H](C1)O b79eca0fc43a3b2a758c7e13bb437581 [0,2,0,0,0,0|2,0,0]=4 2001 B11R1.23 O=CC(=O)N1CCC[C@H](C1)F ee1298ee7a247e67043576149c553271 [0,2,0,0,0,0|2,0,0]=4 2002 B11R1.23 O=CC(=O)N1CCC[C@H](C1)O d6305abdfd093035b56fb10eb037aa60 [0,2,0,0,0,0|2,0,0]=4 2003 B11R1.24 C#CCOC1CCCC(C1)C b5bcc1d5859396fd4246e19e2c79c5d9 [0,2,0,0,0,0|1,0,1]=4 2004 B11R1.24 C#CCO[C@@H]1CCC[C@@H](C1)C 08ea033e3ee659796da7843c26fac795 [0,2,0,0,0,0|1,0,1]=4 2005 B11R1.24 C#CCO[C@H]1CCC[C@@H](C1)C c793af54fc3283067e81d6c49d4d53cd [0,2,0,0,0,0|1,0,1]=4 2006 B11R1.24 C#CCO[C@H]1CCC[C@H](C1)C e95e034cffb5fdafec2e82b6223b7c33 [0,2,0,0,0,0|1,0,1]=4 2007 B11R1.24 C=CCNC1CCCC(C1)C 35587d0a5f6b4d27dc9421a54b3c5646 [0,2,0,0,0,0|2,0,0]=4 2008 B11R1.24 C=CCNC1CCCC(C1)O 8eb0ef24456e7e80580652623a13a40d [0,2,0,0,0,0|2,0,0]=4 2009 B11R1.24 C=CCN[C@@H]1CCC[C@@H](C1)O 65d5de3d2677c580c7c20b52771b6f38 [0,2,0,0,0,0|2,0,0]=4 2010 B11R1.24 C=CCN[C@@H]1CCC[C@H](C1)C d36e31c01ba47090a6901d7b34cd04e1 [0,2,0,0,0,0|2,0,0]=4 2011 B11R1.24 C=CCN[C@@H]1CCC[C@H](C1)O 73e0e089a45131fa94e58d3f0e9a0410 [0,2,0,0,0,0|2,0,0]=4 2012 B11R1.24 C=CCN[C@H]1CCC[C@@H](C1)O 0bd5cc838709c0a6941a303b926f9aa9 [0,2,0,0,0,0|2,0,0]=4 2013 B11R1.24 C=CCN[C@H]1CCC[C@H](C1)O b136319756265f960e15361346d2564b [0,2,0,0,0,0|2,0,0]=4 2014 B11R1.24 C=CCOC1CCCC(=O)C1 00c799e2473105c732a7980796ffed52 [0,2,0,0,0,0|1,0,1]=4 2015 B11R1.24 C=CCOC1CCCC(C1)C 0c07a2612b7fbc66bc17a62aed21856c [0,2,0,0,0,0|1,0,0]=3 2016 B11R1.24 C=CCOC1CCCN(C1)C 864ca621d0a2324e19816f2f940e28d5 [0,2,0,0,0,0|2,0,0]=4 2017 B11R1.24 C=CCOC1CCOC(C1)C 9c1c144169a591f81c2639afd6f4e316 [0,2,0,0,0,0|2,0,0]=4 2018 B11R1.24 C=CCO[C@@H]1CCCN(C1)C 4364d3c7ccdb0f3544200aa50cdade1d [0,2,0,0,0,0|2,0,0]=4 2019 B11R1.24 C=CCO[C@@H]1CCC[C@@H](C1)C b4e006868d015eb24c781e024135c509 [0,2,0,0,0,0|1,0,0]=3 2020 B11R1.24 C=CCO[C@@H]1CCO[C@@H](C1)C eb8c9638e38ed7f0e3fcb76edd5e89b7 [0,2,0,0,0,0|2,0,0]=4 2021 B11R1.24 C=CCO[C@@H]1CCO[C@H](C1)C db96b7ba39fc0375e41363c230dcabb5 [0,2,0,0,0,0|2,0,0]=4 2022 B11R1.24 C=CCO[C@H]1CCCN(C1)C d930f19e3b1bfdb1258e1b0c23662fda [0,2,0,0,0,0|2,0,0]=4 2023 B11R1.24 C=CCO[C@H]1CCC[C@@H](C1)C dd453784b69f1a694ff59a8769dbdd02 [0,2,0,0,0,0|1,0,0]=3 2024 B11R1.24 C=CCO[C@H]1CCC[C@H](C1)C 8b9dc0e52aec8fc2f1ea300810835c36 [0,2,0,0,0,0|1,0,0]=3 2025 B11R1.24 C=CCO[C@H]1CCO[C@@H](C1)C 38d8914c7b86b1f406f95ba3ec24f493 [0,2,0,0,0,0|2,0,0]=4 2026 B11R1.24 C=CCO[C@H]1CCO[C@H](C1)C 64312da6dbd53c40b9ef5823a0ab2817 [0,2,0,0,0,0|2,0,0]=4 2027 B11R1.24 CC1=CC(CCC1)OCC=O b429916537614646cba93649313085ca [0,2,0,0,0,0|0,0,2]=4 2028 B11R1.24 CC1CC(CCO1)NCC=O ec358d2be752de3043fab61c4fc4621a [0,2,0,0,0,0|2,0,0]=4 2029 B11R1.24 CC1CC(CCO1)OCC=O 32c60a488bb00fa7f466d18e35e0074e [0,2,0,0,0,0|1,0,0]=3 2030 B11R1.24 CC1CCCC(C1)CNC=O 3d3ee1d2d9fabea1bce8ec4b77578c2d [0,2,0,0,0,0|1,0,0]=3 2031 B11R1.24 CC1CCCC(C1)COCF a44fa7942d633efbb1ace4e242bd0f68 [0,2,0,0,0,0|1,0,1]=4 2032 B11R1.24 CC1CCCC(C1)NCC=O fc93fe072129d573be6da01b94884ce0 [0,2,0,0,0,0|1,0,0]=3 2033 B11R1.24 CC1CCCC(C1)OCC#N 286afe6aef0342a0b8cbe4c1c0bf168c [0,2,0,0,0,0|1,0,1]=4 2034 B11R1.24 CC1CCCC(C1)OCC=O 2a96116c70bb59516d29ac6eeada7462 [0,2,0,0,0,0|0,0,0]=2 2035 B11R1.24 CC1CCCC(C1)OCCF 34dc8ec9e7b5680e6c337d9cecabba36 [0,2,0,0,0,0|1,0,1]=4 2036 B11R1.24 CC1CCCC(C1)OCCS b73b708ea9daec77ee15353be5a399f5 [0,2,0,0,0,0|0,1,1]=4 2037 B11R1.24 CC1CCCN(C1)CCC=O 8afb16a6271d90dc204c932be8231b4d [0,2,0,0,0,0|2,0,0]=4 2038 B11R1.24 CCCOC1CCCC(C1)C 51405fdb3ff3cc2adf7c96653b9e85c4 [0,2,0,0,0,0|1,0,1]=4 2039 B11R1.24 CCCO[C@@H]1CCC[C@@H](C1)C 6ab0223803e6a8aacec5c5bacc8264c3 [0,2,0,0,0,0|1,0,1]=4 2040 B11R1.24 CCCO[C@H]1CCC[C@@H](C1)C 6ac94074d08177dad0794af8039ca22e [0,2,0,0,0,0|1,0,1]=4 2041 B11R1.24 CCCO[C@H]1CCC[C@H](C1)C a9a57dcfebcc6debd037c1cce2e8fd54 [0,2,0,0,0,0|1,0,1]=4 2042 B11R1.24 CCOCC1CCCC(C1)C 1b1d1f21e9bb615a91aa888f67e7d832 [0,2,0,0,0,0|1,0,1]=4 2043 B11R1.24 CN1CCCC(C1)CNC=O a26385d9af6118361fc1b86d86ef7246 [0,2,0,0,0,0|2,0,0]=4 2044 B11R1.24 CN1CCCC(C1)NCC=O e078626c289224ed7dc2da054a5eafc5 [0,2,0,0,0,0|2,0,0]=4 2045 B11R1.24 CN1CCCC(C1)OCC=O d830f4650a8d7c520c3669c5bb8798dd [0,2,0,0,0,0|1,0,0]=3 2046 B11R1.24 CN1CCC[C@@H](C1)CNC=O 0f4caff431f34409dc898a8399366b9d [0,2,0,0,0,0|2,0,0]=4 2047 B11R1.24 CN1CCC[C@@H](C1)NCC=O 8e56e48f01269c113b2195efff72a78c [0,2,0,0,0,0|2,0,0]=4 2048 B11R1.24 CN1CCC[C@@H](C1)OCC=O 92717a6528a118e9ccf35d58fdf0bd48 [0,2,0,0,0,0|1,0,0]=3 2049 B11R1.24 CN1CCC[C@H](C1)CNC=O 2a40d52fd9eb775e38516a5876d8567b [0,2,0,0,0,0|2,0,0]=4 2050 B11R1.24 CN1CCC[C@H](C1)NCC=O 5d196959c2e73270b6d417350dc1c8cd [0,2,0,0,0,0|2,0,0]=4 2051 B11R1.24 CN1CCC[C@H](C1)OCC=O 5606aaebc1a363a02230a7be50e67793 [0,2,0,0,0,0|1,0,0]=3 2052 B11R1.24 COCOC1CCCC(C1)C e99ecad30ef89f93b298fb272e3d29af [0,2,0,0,0,0|0,0,2]=4 2053 B11R1.24 COCO[C@@H]1CCC[C@@H](C1)C 23117f2ee0fd41bc40b5f1d8ca4da895 [0,2,0,0,0,0|0,0,2]=4 2054 B11R1.24 COCO[C@H]1CCC[C@@H](C1)C b798f9eec577e4b7e9c9be7771c96892 [0,2,0,0,0,0|0,0,2]=4 2055 B11R1.24 COCO[C@H]1CCC[C@H](C1)C 2a1195e71d7ff1409a4a6fce008b83cb [0,2,0,0,0,0|0,0,2]=4 2056 B11R1.24 CSCOC1CCCC(C1)C 95e224fa882ebc32a4d8230616995fb4 [0,2,0,0,0,0|0,1,1]=4 2057 B11R1.24 CSCO[C@@H]1CCC[C@@H](C1)C 8664cf1d84dfe36ae785090fe122a220 [0,2,0,0,0,0|0,1,1]=4 2058 B11R1.24 CSCO[C@H]1CCC[C@@H](C1)C f75fa12fded282e9c870eb751eed1e50 [0,2,0,0,0,0|0,1,1]=4 2059 B11R1.24 CSCO[C@H]1CCC[C@H](C1)C 120ab20889f1a1ad3945a510297d7354 [0,2,0,0,0,0|0,1,1]=4 2060 B11R1.24 C[C@@H]1CCCN(C1)CCC=O a2f96e519ae8866a3db79e62dc9e94f7 [0,2,0,0,0,0|2,0,0]=4 2061 B11R1.24 C[C@@H]1CCC[C@@H](C1)OCC#N 4565de61b331add1db7d9203b938935d [0,2,0,0,0,0|1,0,1]=4 2062 B11R1.24 C[C@@H]1CCC[C@@H](C1)OCC=O ed8cb49c316c812a2eff11953a9c60ff [0,2,0,0,0,0|0,0,0]=2 2063 B11R1.24 C[C@@H]1CCC[C@@H](C1)OCCF f6cbd4c084efb91702d18b89fe430660 [0,2,0,0,0,0|1,0,1]=4 2064 B11R1.24 C[C@@H]1CCC[C@@H](C1)OCCS 5177be2b454c47f1b61f4b12470943dd [0,2,0,0,0,0|0,1,1]=4 2065 B11R1.24 C[C@@H]1CCC[C@H](C1)NCC=O 4c7d8482f7e069b225618d623d932add [0,2,0,0,0,0|1,0,0]=3 2066 B11R1.24 C[C@@H]1C[C@@H](CCO1)NCC=O 7529596d0683cb380642becb1bd08f09 [0,2,0,0,0,0|2,0,0]=4 2067 B11R1.24 C[C@@H]1C[C@@H](CCO1)OCC=O adac3d9b78077206344447bb9fc70d83 [0,2,0,0,0,0|1,0,0]=3 2068 B11R1.24 C[C@@H]1C[C@H](CCO1)NCC=O 7d5b44e3485532d6aac2782fd0114b19 [0,2,0,0,0,0|2,0,0]=4 2069 B11R1.24 C[C@@H]1C[C@H](CCO1)OCC=O d9e10a889e3c2e360babccd0f41d880a [0,2,0,0,0,0|1,0,0]=3 2070 B11R1.24 C[C@H]1CCCN(C1)CCC=O 0a642c8a343784f6953dd14469f48add [0,2,0,0,0,0|2,0,0]=4 2071 B11R1.24 C[C@H]1CCC[C@@H](C1)OCC#N 96c4ba6edbf4fac43428e9954102ac2a [0,2,0,0,0,0|1,0,1]=4 2072 B11R1.24 C[C@H]1CCC[C@@H](C1)OCC=O f016619862a2675c02c40c712bcdf92a [0,2,0,0,0,0|0,0,0]=2 2073 B11R1.24 C[C@H]1CCC[C@@H](C1)OCCF 7cb2f11d7a8c495f3414341611661be3 [0,2,0,0,0,0|1,0,1]=4 2074 B11R1.24 C[C@H]1CCC[C@@H](C1)OCCS a384c2206a18515c37b01ac8ef0c9a0d [0,2,0,0,0,0|0,1,1]=4 2075 B11R1.24 C[C@H]1CCC[C@H](C1)OCC#N 50fdc497ad96ea02e95ee0b075e8242c [0,2,0,0,0,0|1,0,1]=4 2076 B11R1.24 C[C@H]1CCC[C@H](C1)OCC=O ae1b29bcce36512aa6d08ccc0482bd2a [0,2,0,0,0,0|0,0,0]=2 2077 B11R1.24 C[C@H]1CCC[C@H](C1)OCCF 61a02d11d288aa3dd2f2a493e65d9567 [0,2,0,0,0,0|1,0,1]=4 2078 B11R1.24 C[C@H]1CCC[C@H](C1)OCCS 3f7648b2ed5dadea24b4de53bd369844 [0,2,0,0,0,0|0,1,1]=4 2079 B11R1.24 C[C@H]1C[C@@H](CCO1)NCC=O 01feac3f3f5476e6e00c5c3d449d24f7 [0,2,0,0,0,0|2,0,0]=4 2080 B11R1.24 C[C@H]1C[C@@H](CCO1)OCC=O 146eb2140e6056b65a13d4d5d5e978f6 [0,2,0,0,0,0|1,0,0]=3 2081 B11R1.24 C[C@H]1C[C@H](CCO1)NCC=O 17bb340a9824326bf1b95982abf81cd3 [0,2,0,0,0,0|2,0,0]=4 2082 B11R1.24 C[C@H]1C[C@H](CCO1)OCC=O a5695743ca936634706c28eb040956f8 [0,2,0,0,0,0|1,0,0]=3 2083 B11R1.24 O=CCCN1CCCC(C1)F ba66a7eaf317f5d2c6e732931080d606 [0,2,0,0,0,0|2,0,0]=4 2084 B11R1.24 O=CCCN1CCCC(C1)O f06f99371b9ff90247273bd590fc063a [0,2,0,0,0,0|2,0,0]=4 2085 B11R1.24 O=CCCN1CCC[C@@H](C1)F c5c5f6f99b2c6968665ab899b800927f [0,2,0,0,0,0|2,0,0]=4 2086 B11R1.24 O=CCCN1CCC[C@@H](C1)O e2f59738b056e52c86350d48a0464a8f [0,2,0,0,0,0|2,0,0]=4 2087 B11R1.24 O=CCCN1CCC[C@H](C1)F 8361c0884152754ef5718ce3b8a7f18f [0,2,0,0,0,0|2,0,0]=4 2088 B11R1.24 O=CCCN1CCC[C@H](C1)O ca1de2fee8200e3038708c6bd642d889 [0,2,0,0,0,0|2,0,0]=4 2089 B11R1.24 O=CCNC1CCCC(C1)O c464fc05ec1d755054851c32bfe65f6c [0,2,0,0,0,0|1,0,0]=3 2090 B11R1.24 O=CCNC1COCC(C1)O bf3458e0cd609ac5d8481a3840d065b5 [0,2,0,0,0,0|2,0,0]=4 2091 B11R1.24 O=CCN[C@@H]1CCC[C@@H](C1)O e9fd0ae6c899060dcc3b1df490133d38 [0,2,0,0,0,0|1,0,0]=3 2092 B11R1.24 O=CCN[C@@H]1CCC[C@H](C1)O fe85bc555e6ca25ea1a1e30026910f60 [0,2,0,0,0,0|1,0,0]=3 2093 B11R1.24 O=CCN[C@@H]1COC[C@@H](C1)O 74d1d543e3d3c8b7c3f36b77fabbca56 [0,2,0,0,0,0|2,0,0]=4 2094 B11R1.24 O=CCN[C@H]1CCC[C@@H](C1)O c2e4330acbf51edb41a0288c21f1b951 [0,2,0,0,0,0|1,0,0]=3 2095 B11R1.24 O=CCN[C@H]1CCC[C@H](C1)O fa5a72fb9440b3c5a8e5ea2fc2a415cb [0,2,0,0,0,0|1,0,0]=3 2096 B11R1.24 O=CCN[C@H]1COC[C@H](C1)O 5c9765e3bc77f74879831397f488b2fd [0,2,0,0,0,0|2,0,0]=4 2097 B11R1.24 O=CCOC1CCCC(=O)C1 f1d2042f864d3157e7f9da5b8939dab3 [0,2,0,0,0,0|0,0,1]=3 2098 B11R1.24 O=CCOC1CCNC(=O)C1 89a459e838ae001d49dda01a9b469ca8 [0,2,0,0,0,0|1,0,1]=4 2099 B11R1.24 O=CCO[C@@H]1CCNC(=O)C1 ec7fc5a019dec1d2f144027a5854b71c [0,2,0,0,0,0|1,0,1]=4 2100 B11R1.24 O=CCO[C@H]1CCNC(=O)C1 4906956fa8a688351563428434aebdd1 [0,2,0,0,0,0|1,0,1]=4 2101 B11R1.24 O=CNCC1CCCC(C1)O 5f5554bfd63bf0d29e59d215b7c1d0a0 [0,2,0,0,0,0|1,0,0]=3 2102 B11R1.24 O=CNC[C@H]1CCC[C@H](C1)O 6a92cf133d427f7f5406aa4d6bf0b406 [0,2,0,0,0,0|1,0,0]=3 2103 B11R1.34 CC1CC(CC(C1)OCF)C dac18d5501689caa146bd913ee92f677 [0,2,0,0,0,0|1,0,1]=4 2104 B11R1.34 CC1CC(CN(C1)CC=O)C bf0fcaf7109c745066f344f532fed2bf [0,2,0,0,0,0|2,0,0]=4 2105 B11R1.34 CCOC1CC(CC(C1)C)C bbf851b4ec944197fe00764cb00b56fb [0,2,0,0,0,0|1,0,1]=4 2106 B11R1.34 CCO[C@@H]1C[C@@H](C[C@@H](C1)C)C 34269a398ccc6c4113d11e785891e7b2 [0,2,0,0,0,0|1,0,1]=4 2107 B11R1.34 C[C@@H]1CC(C[C@@H](O1)C)NC=O c1fdb29b423d26adc4edc67e3f3bf082 [0,2,0,0,0,0|2,0,0]=4 2108 B11R1.34 C[C@@H]1C[C@@H](CN(C1)CC=O)C 69ca85759cd3908ffc1256af1f4102fd [0,2,0,0,0,0|2,0,0]=4 2109 B11R1.34 C[C@@H]1C[C@@H](C[C@@H](C1)OCF)C e1bb215a038a753b4327d2d0a514afe6 [0,2,0,0,0,0|1,0,1]=4 2110 B11R1.34 C[C@@H]1C[C@@H](C[C@@H](O1)C)NC=O 008281ae445443ad042b6346f466b7ae [0,2,0,0,0,0|2,0,0]=4 2111 B11R1.34 C[C@@H]1C[C@H](C[C@@H](O1)C)NC=O 3b629f6ded500657e5341ced954f80dd [0,2,0,0,0,0|2,0,0]=4 2112 B11R1.34 O=CCN1CC(CC(C1)O)O 7c0c6a79b36ce3e55db2ccacc116e669 [0,2,0,0,0,0|2,0,0]=4 2113 B11R1.34 O=CCN1C[C@@H](C[C@@H](C1)O)O b8be2d2fe290284eeaa302ed03992e86 [0,2,0,0,0,0|2,0,0]=4 2114 B11R1.34 O=CCN1C[C@@H](C[C@H](C1)O)O 60dd22e3d90a1d933de1884a289ada10 [0,2,0,0,0,0|2,0,0]=4 2115 B11R1.34 O=CCN1C[C@H](C[C@@H](C1)O)O c82817035f9ec7cd505540e02cd64c6d [0,2,0,0,0,0|2,0,0]=4 2116 B11R1.157 CC(=O)NC1CCCC(C1)C 2210d24c85aacb9ca5ad7d0be5468509 [0,2,0,0,0,0|1,0,0]=3 2117 B11R1.157 CC(=O)NC1CCCC(C1)O 967c8e42f6277b130f66885e6b186eb9 [0,2,0,0,0,0|1,0,0]=3 2118 B11R1.157 CC(=O)NC1CCCN(C1)C 34d6a502a6adfde883aef908a2ef9edd [0,2,0,0,0,0|2,0,0]=4 2119 B11R1.157 CC(=O)NC1CCOC(C1)C 0099ccc8c17d071fd81ba5664844dee7 [0,2,0,0,0,0|2,0,0]=4 2120 B11R1.157 CC(=O)NC1COCC(C1)O 450e97f086c76d616b7a0471a6126f5c [0,2,0,0,0,0|2,0,0]=4 2121 B11R1.157 CC(=O)N[C@@H]1CCCN(C1)C c757489c05f54677c333d5d1a5094257 [0,2,0,0,0,0|2,0,0]=4 2122 B11R1.157 CC(=O)N[C@@H]1CCC[C@@H](C1)O 036cedc2973fe4851309407026c34750 [0,2,0,0,0,0|1,0,0]=3 2123 B11R1.157 CC(=O)N[C@@H]1CCC[C@H](C1)C 71f4655f46cf4d4862a6cce1470e6ac9 [0,2,0,0,0,0|1,0,0]=3 2124 B11R1.157 CC(=O)N[C@@H]1CCC[C@H](C1)O 133d6afedfa5f62b0664ee93a2cd1962 [0,2,0,0,0,0|1,0,0]=3 2125 B11R1.157 CC(=O)N[C@@H]1CCO[C@@H](C1)C 522cc936fcd44ff7fe6fb47e9d0d3554 [0,2,0,0,0,0|2,0,0]=4 2126 B11R1.157 CC(=O)N[C@@H]1CCO[C@H](C1)C d0134359fa0892a6ae31761566406572 [0,2,0,0,0,0|2,0,0]=4 2127 B11R1.157 CC(=O)N[C@@H]1COC[C@@H](C1)O 9576af4f68e1052c36d3fccdc069b7a7 [0,2,0,0,0,0|2,0,0]=4 2128 B11R1.157 CC(=O)N[C@H]1CCCN(C1)C 7e2c23441263993d81fce59ecbac3164 [0,2,0,0,0,0|2,0,0]=4 2129 B11R1.157 CC(=O)N[C@H]1CCC[C@@H](C1)O 292207cd518c12ebcc52dfe886a419f2 [0,2,0,0,0,0|1,0,0]=3 2130 B11R1.157 CC(=O)N[C@H]1CCC[C@H](C1)O 39171aab208d3c96c4e74e0e531fdbfd [0,2,0,0,0,0|1,0,0]=3 2131 B11R1.157 CC(=O)N[C@H]1CCO[C@@H](C1)C 1282e3b2a5bbe38d539f7f9cb6e56cf1 [0,2,0,0,0,0|2,0,0]=4 2132 B11R1.157 CC(=O)N[C@H]1CCO[C@H](C1)C 86b839821b0a6c40bd50bead6fe2f529 [0,2,0,0,0,0|2,0,0]=4 2133 B11R1.157 CC(=O)N[C@H]1COC[C@H](C1)O 811ce9d28471271aa4f23efe35a4c507 [0,2,0,0,0,0|2,0,0]=4 2134 B11R1.157 CC(C)O[C@@H]1CCC[C@@H](C1)C 0a9915751c340c2589fb43def7e5038d [0,2,0,0,0,0|1,0,1]=4 2135 B11R1.157 CC(C)O[C@H]1CCC[C@@H](C1)C 60681334e4b6c5cf81b6d113046ef928 [0,2,0,0,0,0|1,0,1]=4 2136 B11R1.157 CC(C)O[C@H]1CCC[C@H](C1)C a2cf43a3be52c908712819425810f9c4 [0,2,0,0,0,0|1,0,1]=4 2137 B11R1.157 CC1CCCC(C1)OC(C)C c568b195209cb452caeb1f4cd28f5d68 [0,2,0,0,0,0|1,0,1]=4 2138 B11R1.157 CC1CCCN(C1)CC(=O)N e447a44f6aaeb356f7e500f1b96df590 [0,2,0,0,0,0|2,0,0]=4 2139 B11R1.157 CC1CCCN(C1)CC(=O)O d4ebd15284a303f50f85ba6b4d90a793 [0,2,0,0,0,0|2,0,0]=4 2140 B11R1.157 C[C@@H]1CCCN(C1)CC(=O)N 4a45d3fffe869f1cabc2186339f1e6d2 [0,2,0,0,0,0|2,0,0]=4 2141 B11R1.157 C[C@@H]1CCCN(C1)CC(=O)O 870d6379068dbf78f34bb30d36be26d2 [0,2,0,0,0,0|2,0,0]=4 2142 B11R1.157 C[C@H]1CCCN(C1)CC(=O)N de0fec5a29957430feafb98f70a91f3e [0,2,0,0,0,0|2,0,0]=4 2143 B11R1.157 C[C@H]1CCCN(C1)CC(=O)O 4c02b5b686cf18ffb51df551db136b7c [0,2,0,0,0,0|2,0,0]=4 2144 B11R1.157 NC(=O)CN1CCCC(C1)F a64e2093ad33b20ea743ef75c6268a3d [0,2,0,0,0,0|2,0,0]=4 2145 B11R1.157 NC(=O)CN1CCCC(C1)O acc855203aefeda057ab4a47394a6bf3 [0,2,0,0,0,0|2,0,0]=4 2146 B11R1.157 NC(=O)CN1CCC[C@@H](C1)F 2fe487edf025d77170015478a1a75de6 [0,2,0,0,0,0|2,0,0]=4 2147 B11R1.157 NC(=O)CN1CCC[C@@H](C1)O 513ee4c8af75b8631e89a459ac0a3825 [0,2,0,0,0,0|2,0,0]=4 2148 B11R1.157 NC(=O)CN1CCC[C@H](C1)F e80930800a50f0c397adab879df68a21 [0,2,0,0,0,0|2,0,0]=4 2149 B11R1.157 NC(=O)CN1CCC[C@H](C1)O b36c5a0be2a8d61533a7487e4ecd806c [0,2,0,0,0,0|2,0,0]=4 2150 B11R1.157 O=C(O)CN1CCCC(C1)F df26d481d723ae859133b1dd45263f8b [0,2,0,0,0,0|2,0,0]=4 2151 B11R1.157 O=C(O)CN1CCCC(C1)O 8a9081ae81f569ea0a4f01bce3eedfa1 [0,2,0,0,0,0|2,0,0]=4 2152 B11R1.157 O=C(O)CN1CCC[C@@H](C1)F 3877c0bc29adfde3b5f9efc3b6d550a4 [0,2,0,0,0,0|2,0,0]=4 2153 B11R1.157 O=C(O)CN1CCC[C@@H](C1)O ff18856f3d9fccfbb76f3f7e4a4cf5e0 [0,2,0,0,0,0|2,0,0]=4 2154 B11R1.157 O=C(O)CN1CCC[C@H](C1)F af0bc4e19c0db595d39589bdbc4a3cc0 [0,2,0,0,0,0|2,0,0]=4 2155 B11R1.157 O=C(O)CN1CCC[C@H](C1)O 50428b9f90feb50aec1d3ab69a75f460 [0,2,0,0,0,0|2,0,0]=4 2156 B11R1.189 C#CC1CCCN(C1)CC=O f70e037ae04cdf95a6ceeb756a1c1a9b [0,2,0,0,0,0|2,0,0]=4 2157 B11R1.189 CCC1CCCC(C1)OCF 9951a665f139e4cb095359c47cc7fc0b [0,2,0,0,0,0|1,0,1]=4 2158 B11R1.189 CCC1CCCN(C1)CC=O 4a965df2327709444c922546c0f26d17 [0,2,0,0,0,0|2,0,0]=4 2159 B11R1.189 CCN1CCCC(C1)NC=O 0eec3e05325c461ff75bf1406b512c71 [0,2,0,0,0,0|2,0,0]=4 2160 B11R1.189 CCN1CCC[C@@H](C1)NC=O d4ac8f8850b881c02b0df0e30023a06e [0,2,0,0,0,0|2,0,0]=4 2161 B11R1.189 CCN1CCC[C@H](C1)NC=O 14430991bcfcd353db672b1f2561c9c0 [0,2,0,0,0,0|2,0,0]=4 2162 B11R1.189 CCOC1CCCC(C1)CC 55257b44f758d6bf148c225672dde9b1 [0,2,0,0,0,0|1,0,1]=4 2163 B11R1.189 CCOC1CCCC(C1)OC adb714c0ecde599868a8e191ade0ab93 [0,2,0,0,0,0|1,0,1]=4 2164 B11R1.189 CCO[C@H]1CCC[C@@H](C1)OC 5032c38ff172859a7c32023bb3bc9ecd [0,2,0,0,0,0|1,0,1]=4 2165 B11R1.189 CCO[C@H]1CCC[C@H](C1)OC 30fdb955643fecc5fc952797b799aa80 [0,2,0,0,0,0|1,0,1]=4 2166 B11R1.189 COC1CCCC(C1)NC=O 47c748bad02e83d5d9b104c446ff5600 [0,2,0,0,0,0|1,0,0]=3 2167 B11R1.189 COC1CCCC(C1)OCF 4193df7d5d99359dccc3295242d8d2cb [0,2,0,0,0,0|1,0,1]=4 2168 B11R1.189 COC1CCCN(C1)CC=O 07994b5cf09562c768567f66a370f5af [0,2,0,0,0,0|2,0,0]=4 2169 B11R1.189 CO[C@@H]1CCCN(C1)CC=O a5876aa6a3515addb373ea7aff471a67 [0,2,0,0,0,0|2,0,0]=4 2170 B11R1.189 CO[C@@H]1CCC[C@@H](C1)NC=O 2a5d0bcb1187db194d5da84445e452bb [0,2,0,0,0,0|1,0,0]=3 2171 B11R1.189 CO[C@@H]1CCC[C@@H](C1)OCF b3790a69c647ee7f174feec50d422d78 [0,2,0,0,0,0|1,0,1]=4 2172 B11R1.189 CO[C@@H]1CCC[C@H](C1)NC=O cb570de7cc0fcfc3aeb86731d3e6bdbe [0,2,0,0,0,0|1,0,0]=3 2173 B11R1.189 CO[C@@H]1COC[C@@H](C1)NC=O e9355c56d776aad2cac5d3535544396e [0,2,0,0,0,0|2,0,0]=4 2174 B11R1.189 CO[C@H]1CCCN(C1)CC=O 5ab42f62c2e7ef75e2df7ca2230416b7 [0,2,0,0,0,0|2,0,0]=4 2175 B11R1.189 CO[C@H]1CCC[C@@H](C1)NC=O a4065a4fcdb5dbcb33ac3bef4f85121e [0,2,0,0,0,0|1,0,0]=3 2176 B11R1.189 CO[C@H]1CCC[C@@H](C1)OCF 8ebb225851758c5601d86b5f69d13c3a [0,2,0,0,0,0|1,0,1]=4 2177 B11R1.189 CO[C@H]1CCC[C@H](C1)NC=O 188f6c8c67f17fb9e104cf3b7b8a8631 [0,2,0,0,0,0|1,0,0]=3 2178 B11R1.189 CO[C@H]1COC[C@H](C1)NC=O b6d88a487dfe16162fbde1ac046b36b4 [0,2,0,0,0,0|2,0,0]=4 2179 B11R1.189 N#CC1CCCN(C1)CC=O bffd23d0f3aec71dcf3de34441abc6e1 [0,2,0,0,0,0|2,0,0]=4 2180 B11R1.189 N#C[C@@H]1CCCN(C1)CC=O b1161c149f2f07a485595c9f514a07da [0,2,0,0,0,0|2,0,0]=4 2181 B11R1.189 O=CCN1CCCC(C1)CO b172b3d80cc784108b6f9e531cc232dd [0,2,0,0,0,0|2,0,0]=4 2182 B11R1.189 O=CCN1CCC[C@@H](C1)CO efb017b80983b11fdd50e45be1748109 [0,2,0,0,0,0|2,0,0]=4 2183 B11R1.189 O=CCN1CCC[C@H](C1)CO 5eac611cfd5e7712cb2eae996a965fbf [0,2,0,0,0,0|2,0,0]=4 2184 B11R1.189 O=CNC1CCCC(C1)CO 30e909293bfa9aedb727b30a428870a7 [0,2,0,0,0,0|1,0,0]=3 2185 B11R1.189 O=CN[C@@H]1CCC[C@@H](C1)CO f707c2ef16fe66b4c404e986095f226a [0,2,0,0,0,0|1,0,0]=3 2186 B11R1.189 O=CN[C@@H]1CCC[C@H](C1)CO 85e7a59de23306fcec63c97ccfc73d74 [0,2,0,0,0,0|1,0,0]=3 2187 B11R1.189 O=CN[C@H]1CCC[C@@H](C1)CO a3c1bbd73ce7bd064b70f7e3827479f7 [0,2,0,0,0,0|1,0,0]=3 2188 B11R1.189 O=CN[C@H]1CCC[C@H](C1)CO 723326bfdc789206e284106d5fe07dd8 [0,2,0,0,0,0|1,0,0]=3 2189 B11R1.342 CC1(CC(CCO1)NC=O)C ca79ce91362e676195b61552401d53ca [0,2,0,0,0,0|2,0,0]=4 2190 B11R1.342 CC1(CCCC(C1)NC=O)C f62fb684d3acfa7384dd15d1d4ab4eae [0,2,0,0,0,0|1,0,0]=3 2191 B11R1.342 CC1(CCCC(C1)NC=O)O 44d3db4bc179bc7fb92b782ab3a1c6d2 [0,2,0,0,0,0|1,0,0]=3 2192 B11R1.342 CC1(CCCC(C1)OCF)C 11289b807a5d8f31d93a28264070a651 [0,2,0,0,0,0|1,0,1]=4 2193 B11R1.342 CC1(CCCN(C1)CC=O)C db0096f3a5c58d6161d968dcbc0017ef [0,2,0,0,0,0|2,0,0]=4 2194 B11R1.342 CC1(CCCN(C1)CC=O)O d322962a42f34d99c0458165e31dd31f [0,2,0,0,0,0|2,0,0]=4 2195 B11R1.342 CC1(CCC[C@@H](C1)NC=O)C 8d065fd35d5048328ad496addcb8a9fe [0,2,0,0,0,0|1,0,0]=3 2196 B11R1.342 CC1(CCC[C@H](C1)NC=O)C 762cac641c58fa5f04864151c0c1c95b [0,2,0,0,0,0|1,0,0]=3 2197 B11R1.342 CC1(C[C@@H](CCO1)NC=O)C cbf3639e71ba06b88aa5e866f97d9ccf [0,2,0,0,0,0|2,0,0]=4 2198 B11R1.342 CC1(C[C@H](CCO1)NC=O)C b36d86f506830db9085d3eb73f54d21b [0,2,0,0,0,0|2,0,0]=4 2199 B11R1.342 C[C@@]1(CCCN(C1)CC=O)O 80f5a590b5829bc7901f4607fca0ca87 [0,2,0,0,0,0|2,0,0]=4 2200 B11R1.342 C[C@@]1(CCC[C@H](C1)NC=O)O c8f25c4ab4fcacaf236114f5f16613a7 [0,2,0,0,0,0|1,0,0]=3 2201 B11R1.342 C[C@]1(CCCN(C1)CC=O)O 763a3ed06de200c65f84a3c8981e889e [0,2,0,0,0,0|2,0,0]=4 2202 B11R1.342 C[C@]1(CCC[C@H](C1)NC=O)O a8faee2ac19fc260b1c658750e2cfa44 [0,2,0,0,0,0|1,0,0]=3 2203 B11R1.342 O=CCN1CCCC(C1)(F)F 59bb7b5c04f6f406aeae3ef335811a64 [0,2,0,0,0,0|2,0,0]=4 2204 B11R1.342 O=CNC1CCCC(C1)(F)F e397673c05719f1ce3da085159d86e00 [0,2,0,0,0,0|1,0,0]=3 2205 B11R1.342 O=CNC1CCCS(=O)(=O)C1 f9bef1729c924e3778519c266e88ee72 [0,2,0,0,0,0|2,0,0]=4 2206 B11R1.342 O=CN[C@@H]1CCCS(=O)(=O)C1 fceb728e82d9fff9f2c17930ff94a93d [0,2,0,0,0,0|2,0,0]=4 2207 B11R1.342 O=CN[C@H]1CCCS(=O)(=O)C1 9b43a4046ceeccd78bf8982a5e77ef47 [0,2,0,0,0,0|2,0,0]=4 2208 B11R1.1251 CN1CCCC(C1)(C)NC=O 43dd87d7f299aac80c0cd366902eb7ab [0,2,0,0,0,0|2,0,0]=4 2209 B11R1.12 CCN(C=O)C1CCCCC1 1ee5de847883d8933ae03870009cfa65 [0,2,0,0,0,0|1,0,0]=3 2210 B11R1.12 CCN(C=O)C1CCOCC1 ac2af89c711e6e453a66021f4bb428df [0,2,0,0,0,0|2,0,0]=4 2211 B11R1.16 C=CCN(C)C1CCCCC1 bb4edfc500f944468a5d19c901ffb288 [0,2,0,0,0,0|2,0,0]=4 2212 B11R1.16 CC(NC=O)C1CCCCC1 5b0bed71e7b40559a80568632a082bd7 [0,2,0,0,0,0|1,0,0]=3 2213 B11R1.16 CC(NC=O)C1CCOCC1 c4bc390703a9b3c0fb1ba8532025a237 [0,2,0,0,0,0|2,0,0]=4 2214 B11R1.16 CC(OCF)C1CCCCC1 47957089bcc44d4f79f7d3a1b4076ad4 [0,2,0,0,0,0|1,0,1]=4 2215 B11R1.16 CCOC(C)C1CCCCC1 37be17fa0db3d275abb0f9a6c52c9161 [0,2,0,0,0,0|1,0,1]=4 2216 B11R1.16 CCO[C@@H](C)C1CCCCC1 df439a6e4e17aa6ad53b1ef6ed12fa04 [0,2,0,0,0,0|1,0,1]=4 2217 B11R1.16 CCO[C@H](C)C1CCCCC1 cf6c9a4c5bb690790b693154b5b07a7d [0,2,0,0,0,0|1,0,1]=4 2218 B11R1.16 CN(CC=O)C1CCCCC1 ca17f137ff3c935349c764fa597cdad5 [0,2,0,0,0,0|1,0,0]=3 2219 B11R1.16 CN(CC=O)C1CCCOC1 d2ba8fb97b16bdcd1135c25e760eb575 [0,2,0,0,0,0|2,0,0]=4 2220 B11R1.16 CN(CC=O)C1CCOCC1 25e70df20baedd41f03f2ac19f82e037 [0,2,0,0,0,0|2,0,0]=4 2221 B11R1.16 CN(CC=O)C1CCSCC1 59a3fb091fb06e34f29a1b410fe3099d [0,2,0,0,0,0|2,0,0]=4 2222 B11R1.16 C[C@@H](NC=O)C1CCCCC1 482674891e147b5cd22611a9cd5e80fa [0,2,0,0,0,0|1,0,0]=3 2223 B11R1.16 C[C@@H](NC=O)C1CCOCC1 ce29ede7cb53b1b85d455400698e9f47 [0,2,0,0,0,0|2,0,0]=4 2224 B11R1.16 C[C@@H](OCF)C1CCCCC1 059cf7d23dd4dac3c616f1a6be76f2d6 [0,2,0,0,0,0|1,0,1]=4 2225 B11R1.16 C[C@H](NC=O)C1CCCCC1 27b06f20cea81f01d1c9c49883358bf2 [0,2,0,0,0,0|1,0,0]=3 2226 B11R1.16 C[C@H](NC=O)C1CCOCC1 2f0d28a64fa3bfa0a511cb6d38ea0c09 [0,2,0,0,0,0|2,0,0]=4 2227 B11R1.16 C[C@H](OCF)C1CCCCC1 e071df90a9ce7beb69a8a72aa6f64c06 [0,2,0,0,0,0|1,0,1]=4 2228 B11R1.36 CC(=O)N(C)C1CCCCC1 ee6341c0949dc3b0f1e73cdf394e155f [0,2,0,0,0,0|1,0,0]=3 2229 B11R1.36 CC(=O)N(C)C1CCCOC1 52e63e3a8032dcc401e8d65b641fc6cb [0,2,0,0,0,0|2,0,0]=4 2230 B11R1.36 CC(=O)N(C)C1CCOCC1 e548f3f1a7cbbd85fda416e97231c99e [0,2,0,0,0,0|2,0,0]=4 2231 B11R1.28 C#CCCOC1CCCCC1 153341cda14ca92ac12529fe8245b096 [0,2,0,0,0,0|1,0,1]=4 2232 B11R1.28 C#CCOCC1CCCCC1 e15197b6916af09d1cd4ddeb1d9e11f8 [0,2,0,0,0,0|1,0,1]=4 2233 B11R1.28 C/C=C/COC1CCCCC1 929ecd73692c9696febdbd59282ef2b3 [0,2,0,0,0,0|1,0,0]=3 2234 B11R1.28 C/C=C/COC1CCCCO1 bbe35b3854027d1c26bfb013dbaefa8c [0,2,0,0,0,0|2,0,0]=4 2235 B11R1.28 C/C=C/COC1CCCOC1 0272c2e15a562ed4475329613f41b058 [0,2,0,0,0,0|2,0,0]=4 2236 B11R1.28 C/C=C/COC1CCCSC1 e63b070e43887ab1bae34c9dcd77b2cd [0,2,0,0,0,0|2,0,0]=4 2237 B11R1.28 C/C=C/COC1CCOCC1 e87194828c4ffa5a652b0de1501ef48c [0,2,0,0,0,0|2,0,0]=4 2238 B11R1.28 C/C=C/COC1CCSCC1 f53377ae9807ee7d8e6478f367fa13b3 [0,2,0,0,0,0|2,0,0]=4 2239 B11R1.28 C/C=C/CO[C@@H]1CCCOC1 03bd2f02b81499e64ae096caf8cdf898 [0,2,0,0,0,0|2,0,0]=4 2240 B11R1.28 C/C=C/CO[C@H]1CCCOC1 5b3fae202d46db0b2609376c0d83534c [0,2,0,0,0,0|2,0,0]=4 2241 B11R1.28 C/C=C\COC1CCCCC1 3707de72c593da9001217120b8b4a78b [0,2,0,0,0,0|1,0,0]=3 2242 B11R1.28 C/C=C\COC1CCCCO1 2ae319e9a1c7161249cd36158acd7af6 [0,2,0,0,0,0|2,0,0]=4 2243 B11R1.28 C/C=C\COC1CCCOC1 340344556799692eb96c30595da8247c [0,2,0,0,0,0|2,0,0]=4 2244 B11R1.28 C/C=C\COC1CCCSC1 9d4f7996bc431055b6af9720380cfe22 [0,2,0,0,0,0|2,0,0]=4 2245 B11R1.28 C/C=C\COC1CCOCC1 3c4cd4bc6e18bfe3faedc4b0142a8f8b [0,2,0,0,0,0|2,0,0]=4 2246 B11R1.28 C/C=C\COC1CCSCC1 b9aabdfc099651afd1d042489ab48196 [0,2,0,0,0,0|2,0,0]=4 2247 B11R1.28 C/C=C\CO[C@@H]1CCCOC1 f23f7f57be6aee259348197ccee5cd94 [0,2,0,0,0,0|2,0,0]=4 2248 B11R1.28 C/C=C\CO[C@H]1CCCOC1 04ffe0007229ebccba43127d6dbd3a85 [0,2,0,0,0,0|2,0,0]=4 2249 B11R1.28 C=CCCNC1CCCCC1 37033c5679cab1747de8325a668ed17d [0,2,0,0,0,0|2,0,0]=4 2250 B11R1.28 C=CCCOC1CCCCC1 d3010c4986fc7af7404f06ae7395c5c7 [0,2,0,0,0,0|1,0,0]=3 2251 B11R1.28 C=CCCOC1CCCCO1 b2282d30cfbce080f4cacf855368db2a [0,2,0,0,0,0|2,0,0]=4 2252 B11R1.28 C=CCCOC1CCCOC1 89980fdf5ab12f3f201788ea83d87987 [0,2,0,0,0,0|2,0,0]=4 2253 B11R1.28 C=CCCOC1CCCSC1 5ca08241bfce4e5f6d893717c72157d0 [0,2,0,0,0,0|2,0,0]=4 2254 B11R1.28 C=CCCOC1CCOCC1 c50cc2bd60650af1a839c0772cd1cc8e [0,2,0,0,0,0|2,0,0]=4 2255 B11R1.28 C=CCCOC1CCSCC1 5f047ac366193da9f49049471dad3562 [0,2,0,0,0,0|2,0,0]=4 2256 B11R1.28 C=CCCO[C@@H]1CCCOC1 c9658a532f5baa603e0da5fe272d749f [0,2,0,0,0,0|2,0,0]=4 2257 B11R1.28 C=CCCO[C@H]1CCCOC1 4f8de2328550185b3963d73711d06d6d [0,2,0,0,0,0|2,0,0]=4 2258 B11R1.28 C=CCNCC1CCCCC1 a9f671ac3caf79c5700dd42ed181b6a3 [0,2,0,0,0,0|2,0,0]=4 2259 B11R1.28 C=CCOCC1CCCCC1 9848ef5b125783442bfb47c81d54c094 [0,2,0,0,0,0|1,0,0]=3 2260 B11R1.28 C=CCOCC1CCCCO1 88d040fd9e66bde0050106fed5f663cf [0,2,0,0,0,0|2,0,0]=4 2261 B11R1.28 C=CCOCC1CCCOC1 291655a7415d1ebb4978f77d5556fb18 [0,2,0,0,0,0|2,0,0]=4 2262 B11R1.28 C=CCOCC1CCOCC1 5c655c62affcb0edba933413d56a7736 [0,2,0,0,0,0|2,0,0]=4 2263 B11R1.28 C=CCOCC1CCSCC1 3b1646539f30571d4973742d1b0238f7 [0,2,0,0,0,0|2,0,0]=4 2264 B11R1.28 C=CCOC[C@@H]1CCCCO1 31cfe6cdcd22500441579b4c25f87a4f [0,2,0,0,0,0|2,0,0]=4 2265 B11R1.28 C=CCOC[C@@H]1CCCOC1 d4a84b0b674b962bd533891829e8f583 [0,2,0,0,0,0|2,0,0]=4 2266 B11R1.28 C=CCOC[C@H]1CCCCO1 04c85c8ac91cffa41a1d9470296e3b5a [0,2,0,0,0,0|2,0,0]=4 2267 B11R1.28 C=CCOC[C@H]1CCCOC1 eb4c6d11329795ac77affcbd3a68bfb1 [0,2,0,0,0,0|2,0,0]=4 2268 B11R1.28 CC#CCOC1CCCCC1 a9456c783b204fa3e068c84a5414e820 [0,2,0,0,0,0|1,0,1]=4 2269 B11R1.28 CC=CCNC1CCCCC1 f6e1007c626d5999ef6d3ff82d3c9604 [0,2,0,0,0,0|2,0,0]=4 2270 B11R1.28 CC=CCOC1CCCCC1 e62fb7160e45dd6841ea554e026d6df2 [0,2,0,0,0,0|1,0,0]=3 2271 B11R1.28 CC=CCOC1CCCCO1 04e0b83d70bef3a500c4a0298da11b93 [0,2,0,0,0,0|2,0,0]=4 2272 B11R1.28 CC=CCOC1CCCOC1 535f00491724ddaac26716d84dd60727 [0,2,0,0,0,0|2,0,0]=4 2273 B11R1.28 CC=CCOC1CCOCC1 62f5aa7f1a18508a5eb1ba471f12d7da [0,2,0,0,0,0|2,0,0]=4 2274 B11R1.28 CC=CCOC1CCSCC1 48cebea7821905d84e02d11a3a75a81e [0,2,0,0,0,0|2,0,0]=4 2275 B11R1.28 CCCCOC1CCCCC1 f5bd8d5f1c876320c48af2302e4c3043 [0,2,0,0,0,0|1,0,1]=4 2276 B11R1.28 CCCOCC1CCCCC1 a40e97204a11eb00ef961e0329142e58 [0,2,0,0,0,0|1,0,1]=4 2277 B11R1.28 CCOCCC1CCCCC1 41db2982246c499a6c04bf31353c607f [0,2,0,0,0,0|1,0,1]=4 2278 B11R1.28 CCOCOC1CCCCC1 bce8c02398227889de43c612ff29ff76 [0,2,0,0,0,0|0,0,2]=4 2279 B11R1.28 COCCOC1CCCCC1 89747c8b73267e9a27e120d58cc56307 [0,2,0,0,0,0|0,0,2]=4 2280 B11R1.28 COCOCC1CCCCC1 a2256e490d9ce6f557bed254cd5f15ef [0,2,0,0,0,0|0,0,2]=4 2281 B11R1.28 CSCCOC1CCCCC1 22ac0590a2acde06c0b7b58e1c97187f [0,2,0,0,0,0|0,1,1]=4 2282 B11R1.28 CSCOCC1CCCCC1 c0e507d9b0b8d0f33654353ab733b4e9 [0,2,0,0,0,0|0,1,1]=4 2283 B11R1.28 Cl/C=C/COC1CCCCC1 ce2dde6fd054413ea15f2c1454632695 [0,2,0,0,0,0|1,0,0]=3 2284 B11R1.28 Cl/C=C/COC1CCCCO1 f3afd21c1b27e76e7efe01716e9a35d7 [0,2,0,0,0,0|2,0,0]=4 2285 B11R1.28 Cl/C=C/COC1CCCOC1 155ec647c0efb4e829632d4c9c1c651c [0,2,0,0,0,0|2,0,0]=4 2286 B11R1.28 Cl/C=C/COC1CCCSC1 7e88f7324a413239620e66a9eaa69616 [0,2,0,0,0,0|2,0,0]=4 2287 B11R1.28 Cl/C=C/COC1CCOCC1 25098257f589016252de522e8a0a2312 [0,2,0,0,0,0|2,0,0]=4 2288 B11R1.28 Cl/C=C/COC1CCSCC1 2e672171d28ffb1a727bb19fcad2483c [0,2,0,0,0,0|2,0,0]=4 2289 B11R1.28 Cl/C=C/CO[C@@H]1CCCOC1 9b48c1fdd1bb4301d096608a07e56a04 [0,2,0,0,0,0|2,0,0]=4 2290 B11R1.28 Cl/C=C/CO[C@H]1CCCOC1 2c65f6e4d2a1942aafaafadd0be86b33 [0,2,0,0,0,0|2,0,0]=4 2291 B11R1.28 Cl/C=C\COC1CCCCC1 11cff04688039188dbb3465dcc5f92eb [0,2,0,0,0,0|1,0,0]=3 2292 B11R1.28 Cl/C=C\COC1CCCCO1 21a35f9ae1f824a34515434bfc544f40 [0,2,0,0,0,0|2,0,0]=4 2293 B11R1.28 Cl/C=C\COC1CCCOC1 c4ff5d31f9d7e2fd3566f0adb37cb9d3 [0,2,0,0,0,0|2,0,0]=4 2294 B11R1.28 Cl/C=C\COC1CCCSC1 55db584946e61a69a2137170634c1762 [0,2,0,0,0,0|2,0,0]=4 2295 B11R1.28 Cl/C=C\COC1CCOCC1 de380e0a6ab653c0736fe7387b91679a [0,2,0,0,0,0|2,0,0]=4 2296 B11R1.28 Cl/C=C\COC1CCSCC1 47b25ff13cb5d1075d876079d44a9228 [0,2,0,0,0,0|2,0,0]=4 2297 B11R1.28 Cl/C=C\CO[C@@H]1CCCOC1 f9ad7de0706ca7bf864fcb05b82eb303 [0,2,0,0,0,0|2,0,0]=4 2298 B11R1.28 Cl/C=C\CO[C@H]1CCCOC1 8c913753ab0a367fff86b7b9bdc6d124 [0,2,0,0,0,0|2,0,0]=4 2299 B11R1.28 ClC=CCOC1CCCCC1 11f21a6bdd2c30a7735d799534dfa590 [0,2,0,0,0,0|1,0,0]=3 2300 B11R1.28 ClC=CCOC1CCCCO1 450bc7b47ed059f3b8d26ee8c60d4214 [0,2,0,0,0,0|2,0,0]=4 2301 B11R1.28 ClC=CCOC1CCCOC1 5569eb2e71500a921693ca0acd7a8939 [0,2,0,0,0,0|2,0,0]=4 2302 B11R1.28 ClC=CCOC1CCOCC1 66d369a6ab9684ef5a4bd15c77d3f8a7 [0,2,0,0,0,0|2,0,0]=4 2303 B11R1.28 ClC=CCOC1CCSCC1 92d84c2651931f781ad2b1e2574a6a95 [0,2,0,0,0,0|2,0,0]=4 2304 B11R1.28 FCCCOC1CCCCC1 da6d8f04453b061b9af4cd595a01691d [0,2,0,0,0,0|1,0,1]=4 2305 B11R1.28 FCCOCC1CCCCC1 72eea73dfa6eadd6da2ce328c0a192c0 [0,2,0,0,0,0|1,0,1]=4 2306 B11R1.28 FCOCCC1CCCCC1 47d5c12944f0e4db7a16d1e5b9471e6e [0,2,0,0,0,0|1,0,1]=4 2307 B11R1.28 IC#CCOC1CCCCC1 6619627f20b1db13ed9a2fe3862f3d99 [0,2,0,0,0,0|1,0,1]=4 2308 B11R1.28 N#CCCOC1CCCCC1 9fc3efb7674bbb97a91c8ea9ed4b8341 [0,2,0,0,0,0|1,0,1]=4 2309 B11R1.28 N#CCOCC1CCCCC1 33e99362dc177a017a45d7710a0a5811 [0,2,0,0,0,0|1,0,1]=4 2310 B11R1.28 N#CNCOC1CCCCC1 a8c0287aeea15abddbca8c47ee17f237 [0,2,0,0,0,0|1,0,1]=4 2311 B11R1.28 N#CSCOC1CCCCC1 1261b35fad0324d301252166def24394 [0,2,0,0,0,0|0,1,1]=4 2312 B11R1.28 O=CCCNC1CCCOC1 65269ac699fca721578ce6e2ea9f599b [0,2,0,0,0,0|2,0,0]=4 2313 B11R1.28 O=CCCNC1CCOCC1 13371183d4fca46aa56a0438533856d7 [0,2,0,0,0,0|2,0,0]=4 2314 B11R1.28 O=CCCNC1CCSCC1 f21da9d2f0b7e6943ef811bc29f7af54 [0,2,0,0,0,0|2,0,0]=4 2315 B11R1.28 O=CCCN[C@@H]1CCCOC1 28647d2b55756857dc761ff001ee8589 [0,2,0,0,0,0|2,0,0]=4 2316 B11R1.28 O=CCCN[C@H]1CCCOC1 2cef133abcb8c5758c7540eadd2ac14f [0,2,0,0,0,0|2,0,0]=4 2317 B11R1.28 O=CCCOC1C=CCCC1 5feda64cfca88d2bdc093d74288d60c6 [0,2,0,0,0,0|0,0,2]=4 2318 B11R1.28 O=CCCOC1CC=CCC1 beed134715fc88535fcc05c1b2193ce2 [0,2,0,0,0,0|0,0,2]=4 2319 B11R1.28 O=CCCOC1CCCCC1 645c96a53a3cbc5d81abe2f23a3ce3dd [0,2,0,0,0,0|0,0,0]=2 2320 B11R1.28 O=CCCOC1CCCCO1 54a4dbf23bbe0e0ef9d7403df910fc3b [0,2,0,0,0,0|1,0,0]=3 2321 B11R1.28 O=CCCOC1CCCOC1 d505233fbaa391a22f2e95c0f424fcf2 [0,2,0,0,0,0|1,0,0]=3 2322 B11R1.28 O=CCCOC1CCCSC1 547919c60df0b9c1a9b244c85e0cda42 [0,2,0,0,0,0|1,0,0]=3 2323 B11R1.28 O=CCCOC1CCOCC1 ba9cd8b54cc02e97a15fbaf55afc62ee [0,2,0,0,0,0|1,0,0]=3 2324 B11R1.28 O=CCCOC1CCSCC1 a9ff16b8eeac4279546f1131748045bf [0,2,0,0,0,0|1,0,0]=3 2325 B11R1.28 O=CCCO[C@@H]1CCCOC1 befbfe1280608682ff0ff398c8df937b [0,2,0,0,0,0|1,0,0]=3 2326 B11R1.28 O=CCCO[C@H]1CCCOC1 01084d62fa7c8bf8db5a686ba9966eab [0,2,0,0,0,0|1,0,0]=3 2327 B11R1.28 O=CCNCC1CCCCC1 2384e459251cdf4e13efbde379898487 [0,2,0,0,0,0|1,0,0]=3 2328 B11R1.28 O=CCNCC1CCCCO1 e34a82bc0f04e89e34ad8322fd2514ec [0,2,0,0,0,0|2,0,0]=4 2329 B11R1.28 O=CCNCC1CCCOC1 c6a913f3430bf8083f64f61ae15de9ce [0,2,0,0,0,0|2,0,0]=4 2330 B11R1.28 O=CCNCC1CCOCC1 d644d25fbf43d3f9dd19d31e71f069cc [0,2,0,0,0,0|2,0,0]=4 2331 B11R1.28 O=CCNCC1CCSCC1 84c7ca4896181167957b998a3331e2f5 [0,2,0,0,0,0|2,0,0]=4 2332 B11R1.28 O=CCNC[C@@H]1CCCOC1 5aa71edb1056d9bf6feae5b98a1f3a14 [0,2,0,0,0,0|2,0,0]=4 2333 B11R1.28 O=CCNC[C@H]1CCCOC1 d928a3aa88aef6bc46207a2dfadb0ad0 [0,2,0,0,0,0|2,0,0]=4 2334 B11R1.28 O=CCOCC1=CCCCC1 7e1519530d2e7496cae943486309b15b [0,2,0,0,0,0|0,0,2]=4 2335 B11R1.28 O=CCOCC1CC=CCC1 f39c1651690941029936ad9b22d9396d [0,2,0,0,0,0|0,0,2]=4 2336 B11R1.28 O=CCOCC1CCCCC1 5a2f7280d1bce864ba80d6bc8e83ff36 [0,2,0,0,0,0|0,0,0]=2 2337 B11R1.28 O=CCOCC1CCCCO1 91292454926d4369eb7f66eaf2c652a9 [0,2,0,0,0,0|1,0,0]=3 2338 B11R1.28 O=CCOCC1CCCOC1 17b1c21655cf1b68e5ef961957a8f44d [0,2,0,0,0,0|1,0,0]=3 2339 B11R1.28 O=CCOCC1CCOCC1 d82d1bcdd21fcaabe89a0ad81a686577 [0,2,0,0,0,0|1,0,0]=3 2340 B11R1.28 O=CCOCC1CCSCC1 09c5922a59d5afeabdad5dbc9dc82daf [0,2,0,0,0,0|1,0,0]=3 2341 B11R1.28 O=CCOCC1COCCO1 50b1f62352eb7ca73add1660dc21b6ae [0,2,0,0,0,0|2,0,0]=4 2342 B11R1.28 O=CCOC[C@@H]1CC=CCC1 876c40177d0f6317af54e2234d0b4685 [0,2,0,0,0,0|0,0,2]=4 2343 B11R1.28 O=CCOC[C@@H]1CCCCO1 f9c127b38bd1c4b88be283376fec901e [0,2,0,0,0,0|1,0,0]=3 2344 B11R1.28 O=CCOC[C@@H]1CCCOC1 bee4ccfebcc4e430903e809e7515d840 [0,2,0,0,0,0|1,0,0]=3 2345 B11R1.28 O=CCOC[C@@H]1COCCO1 ba53de2a7543a110a10dba5f413be832 [0,2,0,0,0,0|2,0,0]=4 2346 B11R1.28 O=CCOC[C@H]1CC=CCC1 35f5cf4fe77395f04b8079f8701de46d [0,2,0,0,0,0|0,0,2]=4 2347 B11R1.28 O=CCOC[C@H]1CCCCO1 8e7b529e748cdcc0d5c00876bb8614ec [0,2,0,0,0,0|1,0,0]=3 2348 B11R1.28 O=CCOC[C@H]1CCCOC1 c6247223f6f4b0ef4c6765bfe6f23190 [0,2,0,0,0,0|1,0,0]=3 2349 B11R1.28 O=CCOC[C@H]1COCCO1 c78c8d28dba0e6fbfc92622422336b38 [0,2,0,0,0,0|2,0,0]=4 2350 B11R1.28 O=CNCCC1CCCCC1 220c987def40116415ea87c985755b84 [0,2,0,0,0,0|1,0,0]=3 2351 B11R1.28 O=CNCCC1CCCCO1 f1a2bf8898129b06fd6a78dc89723693 [0,2,0,0,0,0|2,0,0]=4 2352 B11R1.28 O=CNCCC1CCCOC1 8f53ee72f7b032fe736848b9fedb526f [0,2,0,0,0,0|2,0,0]=4 2353 B11R1.28 O=CNCCC1CCOCC1 e2aa740f65d2b20bdd159bb246e12a64 [0,2,0,0,0,0|2,0,0]=4 2354 B11R1.28 O=CNCCC1CCSCC1 9348ba89d40ebc224bc7ce1914c13534 [0,2,0,0,0,0|2,0,0]=4 2355 B11R1.28 O=CNCCN1CCCCC1 e9adda18df1ce8475ea8a4e37a7726db [0,2,0,0,0,0|2,0,0]=4 2356 B11R1.28 SCCCOC1CCCCC1 da2c6989cda21de68fbeb93b91e0ede6 [0,2,0,0,0,0|0,1,1]=4 2357 B11R1.28 SCCOCC1CCCCC1 b675c36dd959cef4731af5e4a01c12fe [0,2,0,0,0,0|0,1,1]=4 2358 B11R1.40 C#CC(=O)NC1CCCOC1 8aef47fafc5936a5087e433789eb2ab6 [0,2,0,0,0,0|2,0,0]=4 2359 B11R1.40 C#CC(=O)NC1CCOCC1 6a2592f2f08c9295cdcd8b49e82ce6f3 [0,2,0,0,0,0|2,0,0]=4 2360 B11R1.40 C#CC(=O)N[C@@H]1CCCOC1 1a74976bd5da8d5b5dfb8afe8d1cb7a3 [0,2,0,0,0,0|2,0,0]=4 2361 B11R1.40 C#CC(=O)N[C@H]1CCCOC1 179f74b0d84d734e01ae68087e127058 [0,2,0,0,0,0|2,0,0]=4 2362 B11R1.40 C#CC(C)OC1CCCCC1 4445a32a708083389b325751576779da [0,2,0,0,0,0|1,0,1]=4 2363 B11R1.40 C#C[C@@H](C)OC1CCCCC1 d30b298f8b1bb8149c2b85f21649f73c [0,2,0,0,0,0|1,0,1]=4 2364 B11R1.40 C#C[C@H](C)OC1CCCCC1 10258065e0c1dd006cde4780f49ab887 [0,2,0,0,0,0|1,0,1]=4 2365 B11R1.40 C=C(C=O)OC1C=CCCC1 2bd6043758d7516063b1f564c39118c6 [0,2,0,0,0,0|0,0,2]=4 2366 B11R1.40 C=C(C=O)OC1CCCCC1 83442df048e84ca166f7cbc3e77a387f [0,2,0,0,0,0|0,0,0]=2 2367 B11R1.40 C=C(C=O)OC1CCCCO1 8c3648ea1cd3e5a4e39f46cf7f55857e [0,2,0,0,0,0|1,0,0]=3 2368 B11R1.40 C=C(C=O)OC1CCCOC1 6a432184142cc31ef974a50abc98ddbc [0,2,0,0,0,0|1,0,0]=3 2369 B11R1.40 C=C(C=O)OC1CCOCC1 157c9bbef8d6c6c80a412008c6fbcff7 [0,2,0,0,0,0|1,0,0]=3 2370 B11R1.40 C=C(C=O)OC1CCSCC1 746d9fa728c772180597c27198bc7f9d [0,2,0,0,0,0|1,0,0]=3 2371 B11R1.40 C=CC(=O)NC1CCCOC1 fac6086a0cf09519143aaf3e4e0b472c [0,2,0,0,0,0|2,0,0]=4 2372 B11R1.40 C=CC(=O)NC1CCOCC1 9a8347bdbe03dff46f52593e4fe5cfe4 [0,2,0,0,0,0|2,0,0]=4 2373 B11R1.40 C=CC(=O)NC1CCSCC1 dffe42385fbae1ae5b77fed073bc2b42 [0,2,0,0,0,0|2,0,0]=4 2374 B11R1.40 C=CC(=O)N[C@@H]1CCCOC1 0a72dffcab444b5f771dece69ec6893a [0,2,0,0,0,0|2,0,0]=4 2375 B11R1.40 C=CC(=O)N[C@H]1CCCOC1 4ec5d64daf548357784cec18136e8b8f [0,2,0,0,0,0|2,0,0]=4 2376 B11R1.40 C=CC(C)NC1CCCCC1 073c52b537dd42bece421133132117e6 [0,2,0,0,0,0|2,0,0]=4 2377 B11R1.40 C=CC(C)OC1CCCCC1 78b44d5fb2c128cddce3296498f79e1f [0,2,0,0,0,0|1,0,0]=3 2378 B11R1.40 C=CC(C)OC1CCCCO1 87954eafca6fc27fe1d4d3d2f018976b [0,2,0,0,0,0|2,0,0]=4 2379 B11R1.40 C=CC(C)OC1CCCOC1 a9222f71f5aded236e99431348954b4e [0,2,0,0,0,0|2,0,0]=4 2380 B11R1.40 C=CC(C)OC1CCCSC1 2f1af132afb88f5da40b66ef4283e921 [0,2,0,0,0,0|2,0,0]=4 2381 B11R1.40 C=CC(C)OC1CCOCC1 dc01a2cb5388254786ab11215e4923ae [0,2,0,0,0,0|2,0,0]=4 2382 B11R1.40 C=CC(C)OC1CCSCC1 7a68953896618bc0171ebdf1df64d0bf [0,2,0,0,0,0|2,0,0]=4 2383 B11R1.40 C=CC(C)O[C@@H]1CCCOC1 97c03038f699c4eecde2a6be9edb5608 [0,2,0,0,0,0|2,0,0]=4 2384 B11R1.40 C=CC(C)O[C@H]1CCCOC1 5488a62b674ff50f85a4f209d851b42c [0,2,0,0,0,0|2,0,0]=4 2385 B11R1.40 C=C[C@H](C)OC1CCCCC1 00bfa20141037096d67b1aca1c49d4f2 [0,2,0,0,0,0|1,0,0]=3 2386 B11R1.40 C=C[C@H](C)OC1CCCCO1 14fbbcc413d79f4bacda0ef4a7e74ff4 [0,2,0,0,0,0|2,0,0]=4 2387 B11R1.40 C=C[C@H](C)OC1CCCOC1 eacb259ff98a16a1e3dfff29fbc3b974 [0,2,0,0,0,0|2,0,0]=4 2388 B11R1.40 C=C[C@H](C)OC1CCOCC1 5f1144ab25acd4ce49cfcb25f4909de2 [0,2,0,0,0,0|2,0,0]=4 2389 B11R1.40 C=C[C@H](C)OC1CCSCC1 2daa132456d6e6adfdd9e83d70fd6011 [0,2,0,0,0,0|2,0,0]=4 2390 B11R1.40 CC(C#N)OC1CCCCC1 e5074473d85af91795675838e90ac32c [0,2,0,0,0,0|1,0,1]=4 2391 B11R1.40 CC(C=O)NC1CCCOC1 b17d9e8ea89feb39b823e1b77ed46056 [0,2,0,0,0,0|2,0,0]=4 2392 B11R1.40 CC(C=O)NC1CCOCC1 aea762986f13c4a095e3346dfcd10e17 [0,2,0,0,0,0|2,0,0]=4 2393 B11R1.40 CC(C=O)NC1CCSCC1 4cd96c930dae7537ec8f0ccfe4090586 [0,2,0,0,0,0|2,0,0]=4 2394 B11R1.40 CC(C=O)N[C@@H]1CCCOC1 4440fc4eabfecd43d28f5788eb7485e6 [0,2,0,0,0,0|2,0,0]=4 2395 B11R1.40 CC(C=O)N[C@H]1CCCOC1 5453e0db3a25e7ed79bfc7609e082d12 [0,2,0,0,0,0|2,0,0]=4 2396 B11R1.40 CC(C=O)OC1C=CCCC1 eb4bba6e7b115e514024a60b64cfd64d [0,2,0,0,0,0|0,0,2]=4 2397 B11R1.40 CC(C=O)OC1CC=CCC1 5114735008fdc5843faea366196ce446 [0,2,0,0,0,0|0,0,2]=4 2398 B11R1.40 CC(C=O)OC1CCCCC1 97a82b0c9906bf732600e31f004b8379 [0,2,0,0,0,0|0,0,0]=2 2399 B11R1.40 CC(C=O)OC1CCCCO1 f42f78c20b4ae3325048411e6d6ea3ee [0,2,0,0,0,0|1,0,0]=3 2400 B11R1.40 CC(C=O)OC1CCCOC1 b031b01cd5a7146b823633d5aff0f461 [0,2,0,0,0,0|1,0,0]=3 2401 B11R1.40 CC(C=O)OC1CCCSC1 d5924f7b4ae18a297c70b2bca4ac5289 [0,2,0,0,0,0|1,0,0]=3 2402 B11R1.40 CC(C=O)OC1CCOCC1 8b9290b09465c6b2fbce4ad11a8dfd76 [0,2,0,0,0,0|1,0,0]=3 2403 B11R1.40 CC(C=O)OC1CCSCC1 edfe9f8b53fa6986b0f6e4e241ac69e9 [0,2,0,0,0,0|1,0,0]=3 2404 B11R1.40 CC(C=O)O[C@@H]1CCCOC1 11f20fa1756386907c987f9c9d78cf7f [0,2,0,0,0,0|1,0,0]=3 2405 B11R1.40 CC(C=O)O[C@H]1CCCOC1 8f1b49002a2e0a2eaa149b034b75278e [0,2,0,0,0,0|1,0,0]=3 2406 B11R1.40 CC(CF)OC1CCCCC1 7c31c53507e51e0381a40db6249bf008 [0,2,0,0,0,0|1,0,1]=4 2407 B11R1.40 CC(CS)OC1CCCCC1 26a1d4c3acecebf120c303cf927727c9 [0,2,0,0,0,0|0,1,1]=4 2408 B11R1.40 CCC(=O)NC1CCCOC1 6a44e5ed4a68ff40ee26387827becf9a [0,2,0,0,0,0|2,0,0]=4 2409 B11R1.40 CCC(=O)NC1CCOCC1 0ecbabe059b9d557eb6b263d4b851ed7 [0,2,0,0,0,0|2,0,0]=4 2410 B11R1.40 CCC(=O)NC1CCSCC1 63146d5f136fa04f33c9c991b53d2ca9 [0,2,0,0,0,0|2,0,0]=4 2411 B11R1.40 CCC(=O)N[C@@H]1CCCOC1 07ed65afefafaafb25ccddc8b9d18cc2 [0,2,0,0,0,0|2,0,0]=4 2412 B11R1.40 CCC(=O)N[C@H]1CCCOC1 87319a9c3ec35612f157bccaab09fdd1 [0,2,0,0,0,0|2,0,0]=4 2413 B11R1.40 CCC(C)OC1CCCCC1 5314eadc109e4244fc32fa4504bd073c [0,2,0,0,0,0|1,0,1]=4 2414 B11R1.40 CC[C@@H](C)OC1CCCCC1 f2a6fb3afcec156ba44da6c293278c31 [0,2,0,0,0,0|1,0,1]=4 2415 B11R1.40 CC[C@H](C)OC1CCCCC1 591e7bf7445591bdfacfa2200dc9cfc6 [0,2,0,0,0,0|1,0,1]=4 2416 B11R1.40 CN(C=O)CC1CCCCC1 a4141b9f309b84a7bbfe4f3281518f11 [0,2,0,0,0,0|1,0,0]=3 2417 B11R1.40 CN(C=O)CC1CCCCO1 e4a553572762be3befb505361cb1f512 [0,2,0,0,0,0|2,0,0]=4 2418 B11R1.40 CN(C=O)CC1CCCOC1 fb065f5569f76eedfb92fb15d310b060 [0,2,0,0,0,0|2,0,0]=4 2419 B11R1.40 CN(C=O)CC1CCOCC1 812f359b4b951b179f6c73b5da161bd6 [0,2,0,0,0,0|2,0,0]=4 2420 B11R1.40 CN(C=O)CC1CCSCC1 1f6f27086697736b1cdb46bb2584235c [0,2,0,0,0,0|2,0,0]=4 2421 B11R1.40 C[C@H](C=O)NC1CCCOC1 b23348b7982bba99debba77d7160b448 [0,2,0,0,0,0|2,0,0]=4 2422 B11R1.40 C[C@H](C=O)NC1CCOCC1 8ca7dd739224e4bd1acc95145217af01 [0,2,0,0,0,0|2,0,0]=4 2423 B11R1.40 C[C@H](C=O)NC1CCSCC1 86c797da42269028b16e0ab82b6abbe0 [0,2,0,0,0,0|2,0,0]=4 2424 B11R1.40 C[C@H](C=O)N[C@@H]1CCCOC1 0283f65208d2c74a2f0db42b0f062582 [0,2,0,0,0,0|2,0,0]=4 2425 B11R1.40 C[C@H](C=O)N[C@H]1CCCOC1 c4688fc033b7a5588d33d39c6be7153e [0,2,0,0,0,0|2,0,0]=4 2426 B11R1.40 C[C@H](C=O)OC1C=CCCC1 4922acf3c7ea1208f612c428a4d134bc [0,2,0,0,0,0|0,0,2]=4 2427 B11R1.40 C[C@H](C=O)OC1CC=CCC1 a9d7c51de83208fc8e92e577d536d8d4 [0,2,0,0,0,0|0,0,2]=4 2428 B11R1.40 C[C@H](C=O)OC1CCCCC1 e6837a874b8b733d077efbf79aab57e4 [0,2,0,0,0,0|0,0,0]=2 2429 B11R1.40 C[C@H](C=O)OC1CCCCO1 6afcf4cdfde2392e75295f8b9921d29a [0,2,0,0,0,0|1,0,0]=3 2430 B11R1.40 C[C@H](C=O)OC1CCCOC1 de45ca1e5fb58d7efdeb35a0200b65bb [0,2,0,0,0,0|1,0,0]=3 2431 B11R1.40 C[C@H](C=O)OC1CCCSC1 3dfd969d935b4175e4a48235d62185b9 [0,2,0,0,0,0|1,0,0]=3 2432 B11R1.40 C[C@H](C=O)OC1CCOCC1 b3ce75672a54491d5ebdaf5a7c9c618b [0,2,0,0,0,0|1,0,0]=3 2433 B11R1.40 C[C@H](C=O)OC1CCSCC1 65084a412e35ed41031c1ffc72648cd1 [0,2,0,0,0,0|1,0,0]=3 2434 B11R1.40 C[C@H](C=O)O[C@@H]1CCCOC1 6e4102046defc9c61fca4511ecaebf31 [0,2,0,0,0,0|1,0,0]=3 2435 B11R1.40 C[C@H](C=O)O[C@H]1CCCOC1 0349b4cec1b546728a553d1cc17844e2 [0,2,0,0,0,0|1,0,0]=3 2436 B11R1.40 C[C@H](CS)OC1CCCCC1 f39eee7b9676656591d32605f5266cf1 [0,2,0,0,0,0|0,1,1]=4 2437 B11R1.40 N#CC(F)OC1CCCCC1 5a467b2368f73567e025d270446cb04d [0,2,0,0,0,0|1,0,1]=4 2438 B11R1.40 O=C(CF)NC1CCCOC1 374e78ec6ebec43e094f69eddb35aed8 [0,2,0,0,0,0|2,0,0]=4 2439 B11R1.40 O=C(CF)NC1CCOCC1 1d35b69ef86baf99dd026961b7dbce59 [0,2,0,0,0,0|2,0,0]=4 2440 B11R1.40 O=C(CF)N[C@@H]1CCCOC1 fa51cd16e98b0ab770f31f46f1f33cc0 [0,2,0,0,0,0|2,0,0]=4 2441 B11R1.40 O=C(CF)N[C@H]1CCCOC1 4bf00f909078d5c8b394a67173bf6d69 [0,2,0,0,0,0|2,0,0]=4 2442 B11R1.40 O=C(CO)NC1CCCOC1 e68fca1be22977985af541802f524cec [0,2,0,0,0,0|2,0,0]=4 2443 B11R1.40 O=C(CO)NC1CCOCC1 8828fb10e6c52a94af755f3aec00b4b8 [0,2,0,0,0,0|2,0,0]=4 2444 B11R1.40 O=C(CO)NC1CCSCC1 3ca7fb15e15b22a706514e8da635d23b [0,2,0,0,0,0|2,0,0]=4 2445 B11R1.40 O=C(CO)N[C@@H]1CCCOC1 53c5ab99580ab667aa55ce860987381b [0,2,0,0,0,0|2,0,0]=4 2446 B11R1.40 O=C(CO)N[C@H]1CCCOC1 982073ebf29b28f3868e25b25930c9a3 [0,2,0,0,0,0|2,0,0]=4 2447 B11R1.40 O=CC(=O)NC1CCCOC1 ec2a040ddbdccfd8c09a32ed3b67dc49 [0,2,0,0,0,0|2,0,0]=4 2448 B11R1.40 O=CC(=O)NC1CCOCC1 1a61c49163afe7f8f4559e9ea46fa08e [0,2,0,0,0,0|2,0,0]=4 2449 B11R1.40 O=CC(=O)NC1CCSCC1 cb8c3eb297c51e3a2f3e34cc57ba17a1 [0,2,0,0,0,0|2,0,0]=4 2450 B11R1.40 O=CC(=O)N[C@@H]1CCCOC1 9c8159713f0bb2a222953fb86d737934 [0,2,0,0,0,0|2,0,0]=4 2451 B11R1.40 O=CC(=O)N[C@H]1CCCOC1 5d933ee0d563dc1baeb7a7dc33ced734 [0,2,0,0,0,0|2,0,0]=4 2452 B11R1.91 C=C(Br)CNC1CCCCC1 20c58ced94c95fd156376955cd3fd9fb [0,2,0,0,0,0|2,0,0]=4 2453 B11R1.91 C=C(Br)COC1CCCCC1 4834c4be1a7a994be3cd4c57d39da00a [0,2,0,0,0,0|1,0,0]=3 2454 B11R1.91 C=C(Br)COC1CCCCO1 7c19c635189d48436a78d4d682b37dc2 [0,2,0,0,0,0|2,0,0]=4 2455 B11R1.91 C=C(Br)COC1CCCOC1 098cb0b564404f344542cb72ea444eba [0,2,0,0,0,0|2,0,0]=4 2456 B11R1.91 C=C(Br)COC1CCCSC1 10f69e7c4fd3bbb2e13e9fd1a776848b [0,2,0,0,0,0|2,0,0]=4 2457 B11R1.91 C=C(Br)COC1CCOCC1 f4f4cbd984f452472721fec797bf6e56 [0,2,0,0,0,0|2,0,0]=4 2458 B11R1.91 C=C(Br)COC1CCSCC1 7ad57e8bbc42d12f171e7ac34b02f9b6 [0,2,0,0,0,0|2,0,0]=4 2459 B11R1.91 C=C(Br)CO[C@@H]1CCCOC1 0554e75876336d556c2c53a517bec592 [0,2,0,0,0,0|2,0,0]=4 2460 B11R1.91 C=C(Br)CO[C@H]1CCCOC1 aff37e143dfaeff00d8fce8b15766d73 [0,2,0,0,0,0|2,0,0]=4 2461 B11R1.91 C=C(C)CNC1CCCCC1 6e13273d2f70189265915afc32701c47 [0,2,0,0,0,0|2,0,0]=4 2462 B11R1.91 C=C(C)COC1CCCCC1 50c8ef2211e3be911595ca55ab0d0453 [0,2,0,0,0,0|1,0,0]=3 2463 B11R1.91 C=C(C)COC1CCCCO1 8f5405a3f95dcf1a9b7db14018beee27 [0,2,0,0,0,0|2,0,0]=4 2464 B11R1.91 C=C(C)COC1CCCOC1 e37f4448c31c78275276507c185a62ee [0,2,0,0,0,0|2,0,0]=4 2465 B11R1.91 C=C(C)COC1CCCSC1 5bb89a22bb734bd6ab54c183cd508d42 [0,2,0,0,0,0|2,0,0]=4 2466 B11R1.91 C=C(C)COC1CCOCC1 3b8c0cea57a3b78c0705d15616fe0f9a [0,2,0,0,0,0|2,0,0]=4 2467 B11R1.91 C=C(C)COC1CCSCC1 da5de2d559a2575a93668f66ffc0d019 [0,2,0,0,0,0|2,0,0]=4 2468 B11R1.91 C=C(C)CO[C@@H]1CCCOC1 b2aa887d4df1642dd589a46789432bd0 [0,2,0,0,0,0|2,0,0]=4 2469 B11R1.91 C=C(C)CO[C@H]1CCCOC1 74e091080a5b7b39df0dfbc208d51d43 [0,2,0,0,0,0|2,0,0]=4 2470 B11R1.91 C=C(Cl)COC1CCCCC1 85797ac0f62fa9a575b998f3a2cafd13 [0,2,0,0,0,0|1,0,0]=3 2471 B11R1.91 C=C(Cl)COC1CCCCO1 93b51e08797d84b8f4f096daf173b74e [0,2,0,0,0,0|2,0,0]=4 2472 B11R1.91 C=C(Cl)COC1CCCOC1 3d121b2a766667404fc95924a758104f [0,2,0,0,0,0|2,0,0]=4 2473 B11R1.91 C=C(Cl)COC1CCCSC1 4da081c4a14b71e2b19be286c80a417d [0,2,0,0,0,0|2,0,0]=4 2474 B11R1.91 C=C(Cl)COC1CCOCC1 b60a3e828b915c6bcb7acec282dc375c [0,2,0,0,0,0|2,0,0]=4 2475 B11R1.91 C=C(Cl)COC1CCSCC1 a2ec5da6a65db67428f282a2d3dbeae4 [0,2,0,0,0,0|2,0,0]=4 2476 B11R1.91 C=C(Cl)CO[C@@H]1CCCOC1 5b563ca11fff26ab4214a76d481ce9bc [0,2,0,0,0,0|2,0,0]=4 2477 B11R1.91 C=C(Cl)CO[C@H]1CCCOC1 de691f915d29b0caffa2cb40daf92037 [0,2,0,0,0,0|2,0,0]=4 2478 B11R1.91 C=C(F)COC1CCCCC1 be5d809b154714d00f34c1201d024aea [0,2,0,0,0,0|1,0,0]=3 2479 B11R1.91 C=C(F)COC1CCCCO1 8b705ba2793f41fe1a2bb76a5d0b8dd5 [0,2,0,0,0,0|2,0,0]=4 2480 B11R1.91 C=C(F)COC1CCCOC1 e2ff0f1961aff88885327babb53fe3f2 [0,2,0,0,0,0|2,0,0]=4 2481 B11R1.91 C=C(F)COC1CCCSC1 3d35d946071b4e65d32f5849382c8e51 [0,2,0,0,0,0|2,0,0]=4 2482 B11R1.91 C=C(F)COC1CCOCC1 67cdee419f0c31324fad22c3bbcf3e83 [0,2,0,0,0,0|2,0,0]=4 2483 B11R1.91 C=C(F)COC1CCSCC1 2a5d3f9d584d1d8256952afe8a1e2d16 [0,2,0,0,0,0|2,0,0]=4 2484 B11R1.91 C=C(F)CO[C@@H]1CCCOC1 62c75b3fb5cddd4ec16d85523c4c0e3f [0,2,0,0,0,0|2,0,0]=4 2485 B11R1.91 C=C(F)CO[C@H]1CCCOC1 c1fb97fa583d430ecb874da170a12a87 [0,2,0,0,0,0|2,0,0]=4 2486 B11R1.91 C=C(I)COC1CCCCC1 79ca0476ce049479bd4e23516532418e [0,2,0,0,0,0|1,0,0]=3 2487 B11R1.91 C=C(I)COC1CCCCO1 d1ad9dcfd44d434b6dfaad964cd72f7d [0,2,0,0,0,0|2,0,0]=4 2488 B11R1.91 C=C(I)COC1CCOCC1 df74b136c5a8b914ff9d8abd75d9a10c [0,2,0,0,0,0|2,0,0]=4 2489 B11R1.91 C=C(I)COC1CCSCC1 1e3145cdb233578f7d06473233f71739 [0,2,0,0,0,0|2,0,0]=4 2490 B11R1.91 CC(=O)CNC1CCCCC1 41f3bbc8aa0b0ee4d56e1bb353997307 [0,2,0,0,0,0|1,0,0]=3 2491 B11R1.91 CC(=O)CNC1CCCCO1 640e2d5dd77a8849aa1935cd7a9aaaec [0,2,0,0,0,0|2,0,0]=4 2492 B11R1.91 CC(=O)CNC1CCOCC1 10b3387bc43639e331178a4c69daffef [0,2,0,0,0,0|2,0,0]=4 2493 B11R1.91 CC(=O)CNC1CCSCC1 75f6cddad8f4560df686e2d799a50eba [0,2,0,0,0,0|2,0,0]=4 2494 B11R1.91 CC(=O)COC1C=CCCC1 4a9c7793b48aa95192a70b82c4f26c86 [0,2,0,0,0,0|0,0,2]=4 2495 B11R1.91 CC(=O)COC1CCCCC1 763ec2b1245af52120f0b3066af09e15 [0,2,0,0,0,0|0,0,0]=2 2496 B11R1.91 CC(=O)COC1CCCCO1 3d4068b55a8ce6af68b0e3cc3b7d2997 [0,2,0,0,0,0|1,0,0]=3 2497 B11R1.91 CC(=O)COC1CCOCC1 78d69c5167fb6b3f9b2e72f96bf7e4f6 [0,2,0,0,0,0|1,0,0]=3 2498 B11R1.91 CC(=O)COC1CCSCC1 d4fa1c6f9f23997dc550dd796644a359 [0,2,0,0,0,0|1,0,0]=3 2499 B11R1.91 CC(=O)NCC1CCCCC1 13ef8179cc48c409da15977c5ecf76d3 [0,2,0,0,0,0|1,0,0]=3 2500 B11R1.91 CC(=O)NCC1CCCCO1 d41d6bb17f3dbf038f44a0f16313e24b [0,2,0,0,0,0|2,0,0]=4 2501 B11R1.91 CC(=O)NCC1CCCOC1 c162092dc9bd16e0593256fa1f9ecc04 [0,2,0,0,0,0|2,0,0]=4 2502 B11R1.91 CC(=O)NCC1CCOCC1 a250d52d0d92eb3951169ce5ef31c600 [0,2,0,0,0,0|2,0,0]=4 2503 B11R1.91 CC(=O)NCC1CCSCC1 1a220d480c47a704f778fa097ef9e650 [0,2,0,0,0,0|2,0,0]=4 2504 B11R1.91 CC(=O)NC[C@@H]1CCCOC1 7aa7e3d46556da04f95282ed5cd2d18d [0,2,0,0,0,0|2,0,0]=4 2505 B11R1.91 CC(=O)NC[C@H]1CCCOC1 084cc7a58a2d167832e33c785a7b8e6f [0,2,0,0,0,0|2,0,0]=4 2506 B11R1.91 CC(=O)OCN1CCCOC1 a435707ece880897c2100e8bac5dc365 [0,2,0,0,0,0|2,0,0]=4 2507 B11R1.91 CC(=O)OCN1CCCSC1 3cb1b90740ede26e7b067364b9666030 [0,2,0,0,0,0|2,0,0]=4 2508 B11R1.91 CC(=O)OCN1CCOCC1 d9ae0f642945963ffb89753dee635384 [0,2,0,0,0,0|2,0,0]=4 2509 B11R1.91 CC(=O)OCN1CCSCC1 e8cd7b236b32cf305e5aa75427d0e458 [0,2,0,0,0,0|2,0,0]=4 2510 B11R1.91 CC(C)COC1CCCCC1 7819b34cbd8ad7c57fa1b5b9ae584724 [0,2,0,0,0,0|1,0,1]=4 2511 B11R1.91 CC(C)OCC1CCCCC1 51cc2d63a8c37a12d3bab34a3922fdb2 [0,2,0,0,0,0|1,0,1]=4 2512 B11R1.91 CC(F)COC1CCCCC1 7994f2c32f011028084b3cffbdd02931 [0,2,0,0,0,0|1,0,1]=4 2513 B11R1.91 CC(S)COC1CCCCC1 df891f233fec9585db2fa6e81d33cca4 [0,2,0,0,0,0|0,1,1]=4 2514 B11R1.91 CN(C)COC1CCCCC1 a35bdd0bd9519c7e55c98714ae620f46 [0,2,0,0,0,0|1,0,1]=4 2515 B11R1.91 C[C@@H](F)COC1CCCCC1 edb6f87500f078cc9680d2382285d974 [0,2,0,0,0,0|1,0,1]=4 2516 B11R1.91 C[C@H](F)COC1CCCCC1 2dbbff1b6360423349c10857f3204dfa [0,2,0,0,0,0|1,0,1]=4 2517 B11R1.91 FC(F)COC1CCCCC1 f66dbd841dd2ac23f2c43fcde1a70677 [0,2,0,0,0,0|1,0,1]=4 2518 B11R1.91 NC(=O)CNC1CCCCC1 49e5840c39ba3b16bc013cd4a010e6e2 [0,2,0,0,0,0|1,0,0]=3 2519 B11R1.91 NC(=O)CNC1CCCCO1 77547d4c4aa5b337cc9f58bc45131765 [0,2,0,0,0,0|2,0,0]=4 2520 B11R1.91 NC(=O)CNC1CCCOC1 1007f91d868311dbb54465e7a6fcf67e [0,2,0,0,0,0|2,0,0]=4 2521 B11R1.91 NC(=O)CNC1CCOCC1 757770f7ab41f826c5d7d3c04b8e6998 [0,2,0,0,0,0|2,0,0]=4 2522 B11R1.91 NC(=O)CNC1CCSCC1 684cdd657024777f9fde6a50615fc77c [0,2,0,0,0,0|2,0,0]=4 2523 B11R1.91 NC(=O)CN[C@@H]1CCCOC1 2b3531d9c6e9cb00b997e4b5b96e0a39 [0,2,0,0,0,0|2,0,0]=4 2524 B11R1.91 NC(=O)CN[C@H]1CCCOC1 06c11d9089c484f923d9961e6c1bde57 [0,2,0,0,0,0|2,0,0]=4 2525 B11R1.91 NC(=O)COC1C=CCCC1 685f8fbd1472783d4b11bbc3863a0643 [0,2,0,0,0,0|0,0,2]=4 2526 B11R1.91 NC(=O)COC1CC=CCC1 b277d335224b1bfbf1561016917de774 [0,2,0,0,0,0|0,0,2]=4 2527 B11R1.91 NC(=O)COC1CCCCC1 0342972a414d125c2c7187722ddbb7ed [0,2,0,0,0,0|0,0,0]=2 2528 B11R1.91 NC(=O)COC1CCCCO1 b743e037b96fdfe795d73b2a6b3d677d [0,2,0,0,0,0|1,0,0]=3 2529 B11R1.91 NC(=O)COC1CCCOC1 3ce477607b16c3f723d795213b697118 [0,2,0,0,0,0|1,0,0]=3 2530 B11R1.91 NC(=O)COC1CCCSC1 114cee36eff1bbe73b442d1dcfd9e4d4 [0,2,0,0,0,0|1,0,0]=3 2531 B11R1.91 NC(=O)COC1CCOCC1 f5152c979e641dc0b61c7c82b273a315 [0,2,0,0,0,0|1,0,0]=3 2532 B11R1.91 NC(=O)COC1CCSCC1 171546b24ae9b4c03a058eedb55be2f5 [0,2,0,0,0,0|1,0,0]=3 2533 B11R1.91 NC(=O)CO[C@@H]1CCCOC1 f62eb70c2ae44d9967537ee070112b1b [0,2,0,0,0,0|1,0,0]=3 2534 B11R1.91 NC(=O)CO[C@H]1CCCOC1 c717b8751a6e62c85fba2d8d08c918e4 [0,2,0,0,0,0|1,0,0]=3 2535 B11R1.91 NC(=S)COC1CCCCC1 a9342e76e82f7be88546e871ebb9b1ee [0,2,0,0,0,0|0,1,0]=3 2536 B11R1.91 NC(=S)COC1CCOCC1 ffdcbef09732aa5c7b7d661ba4408ab3 [0,2,0,0,0,0|1,1,0]=4 2537 B11R1.91 NC(=S)COC1CCSCC1 fee8821892d08a3f893b992486641032 [0,2,0,0,0,0|1,1,0]=4 2538 B11R1.91 O=C(O)CNC1CCCCC1 6170fa39da854f2ae539e4442d25e354 [0,2,0,0,0,0|1,0,0]=3 2539 B11R1.91 O=C(O)CNC1CCCCO1 0601744de8bfaeac3efa0eaae34b0e2a [0,2,0,0,0,0|2,0,0]=4 2540 B11R1.91 O=C(O)CNC1CCCOC1 de8c0d47483c3f100833bbc04551e425 [0,2,0,0,0,0|2,0,0]=4 2541 B11R1.91 O=C(O)CNC1CCOCC1 de1a366c5915b7b602ff6be02564e839 [0,2,0,0,0,0|2,0,0]=4 2542 B11R1.91 O=C(O)CNC1CCSCC1 a1d4dcc34b9d978a9aada4af63ce44d5 [0,2,0,0,0,0|2,0,0]=4 2543 B11R1.91 O=C(O)CN[C@@H]1CCCOC1 a4936671de955a660a8b95906cfcf3fe [0,2,0,0,0,0|2,0,0]=4 2544 B11R1.91 O=C(O)CN[C@H]1CCCOC1 c38b7aafbfb095786d36e5a2e6d14252 [0,2,0,0,0,0|2,0,0]=4 2545 B11R1.91 O=C(O)COC1C=CCCC1 c3f7e6b0d0e179c5212602af0da237e3 [0,2,0,0,0,0|0,0,2]=4 2546 B11R1.91 O=C(O)COC1CC=CCC1 ca0b2885f3d3dd592d4501c37019d1e7 [0,2,0,0,0,0|0,0,2]=4 2547 B11R1.91 O=C(O)COC1CCCCC1 c56b55e54d9cc9b734edcd0ed0978f43 [0,2,0,0,0,0|0,0,0]=2 2548 B11R1.91 O=C(O)COC1CCCCO1 927e1af2807bd3dd35f5b1bd3c90f17b [0,2,0,0,0,0|1,0,0]=3 2549 B11R1.91 O=C(O)COC1CCCOC1 f10d417684ae0b4f2fe8858293490ec1 [0,2,0,0,0,0|1,0,0]=3 2550 B11R1.91 O=C(O)COC1CCCSC1 7272dae6ecc3c9c2a4ea28deac73fb75 [0,2,0,0,0,0|1,0,0]=3 2551 B11R1.91 O=C(O)COC1CCOCC1 d35c7985939bbbbf7d929dd6cf8e4d91 [0,2,0,0,0,0|1,0,0]=3 2552 B11R1.91 O=C(O)COC1CCSCC1 b2cb64231e512bfba5c6f77887ea953d [0,2,0,0,0,0|1,0,0]=3 2553 B11R1.91 O=C(O)CO[C@@H]1CCCOC1 0436b7ec633e33f771801ad9b698da19 [0,2,0,0,0,0|1,0,0]=3 2554 B11R1.91 O=C(O)CO[C@H]1CCCOC1 654ae1e30203a17364d5c0aea2fe9d02 [0,2,0,0,0,0|1,0,0]=3 2555 B11R1.91 O=S(O)COC1CCCCC1 ce98fa7fea4abd576b51cca8386c298a [0,2,0,0,0,0|0,0,1]=3 2556 B11R1.91 O=S(O)COC1CCCCO1 549820d26c23b99b83b069a8adf3da02 [0,2,0,0,0,0|1,0,1]=4 2557 B11R1.91 O=S(O)COC1CCOCC1 892c83c01b6eb95c32c547205fe7dac8 [0,2,0,0,0,0|1,0,1]=4 2558 B11R1.91 O=S(O)COC1CCSCC1 7a7ac83b887c8a8c22db976a1d24067d [0,2,0,0,0,0|1,0,1]=4 2559 B11R1.91 O=[N+]([O-])COC1CCCCC1 adeab912c75b92900c0bf5ab8a6cf0fc [0,2,0,0,0,0|0,0,1]=3 2560 B11R1.91 O=[N+]([O-])COC1CCCCO1 90bea1ae11d209eba6fa13a62d566644 [0,2,0,0,0,0|1,0,1]=4 2561 B11R1.91 O=[N+]([O-])COC1CCCOC1 c328828834ac3f6893d5c5ca40b75ce6 [0,2,0,0,0,0|1,0,1]=4 2562 B11R1.91 O=[N+]([O-])COC1CCCSC1 3b7c245cb06bd4dc351499d52f034950 [0,2,0,0,0,0|1,0,1]=4 2563 B11R1.91 O=[N+]([O-])COC1CCOCC1 e30c03b809b71576a0348ae93f4e87d9 [0,2,0,0,0,0|1,0,1]=4 2564 B11R1.91 O=[N+]([O-])COC1CCSCC1 ea3e44ac7709823ea66232c30de92d36 [0,2,0,0,0,0|1,0,1]=4 2565 B11R1.91 O=[N+]([O-])CO[C@@H]1CCCOC1 c733b99133f78bbb56c7976ac15ec0e7 [0,2,0,0,0,0|1,0,1]=4 2566 B11R1.91 O=[N+]([O-])CO[C@H]1CCCOC1 a8267e65989d88e996005c2c036301e0 [0,2,0,0,0,0|1,0,1]=4 2567 B11R1.900 C=CCNC1(CCCCC1)C 18c7c747b63ef0ff85fb3f56fbd9ce13 [0,2,0,0,0,0|2,0,0]=4 2568 B11R1.900 CC1(CCCCC1)CNC=O ad0c5162eb37dd9e89fca74bd3f240b6 [0,2,0,0,0,0|1,0,0]=3 2569 B11R1.900 CC1(CCCCC1)COCF 686fc016882805f86717b3be78fa7633 [0,2,0,0,0,0|1,0,1]=4 2570 B11R1.900 CC1(CCCCC1)NCC=O 61a92997acef783dbf7355a0c4415767 [0,2,0,0,0,0|1,0,0]=3 2571 B11R1.900 CC1(CCOCC1)CNC=O d3f19145ad4870748079bb00318062e0 [0,2,0,0,0,0|2,0,0]=4 2572 B11R1.900 CC1(CCOCC1)NCC=O 40f675ec6fd166d0a38f2e8cad5a8006 [0,2,0,0,0,0|2,0,0]=4 2573 B11R1.900 CCOCC1(CCCCC1)C 9481ac9c9e0c158c30ac6952725227ed [0,2,0,0,0,0|1,0,1]=4 2574 B11R1.900 CCOCC1(CCCCC1)F 13728f352d7598795a7cc2d9458061eb [0,2,0,0,0,0|1,0,1]=4 2575 B11R1.900 FCOCC1(CCCCC1)F 01560b83aae79cbc30407fe0bf73e77e [0,2,0,0,0,0|1,0,1]=4 2576 B11R1.900 O=CNCC1(CCCCC1)O 95b362e16186671878f4fc8c097bd7b7 [0,2,0,0,0,0|1,0,0]=3 2577 B11R1.900 O=CNCC1(CCOCC1)F 869627122379854e6d7168b88b12b53e [0,2,0,0,0,0|2,0,0]=4 2578 B11R1.900 O=CNCC1(CCOCC1)O d33c7f807915a2255972eb75e7dc306f [0,2,0,0,0,0|2,0,0]=4 2579 B11R1.900 O=CNCC1(CCSCC1)O 5215fa10b905fe709e33ce258341adf9 [0,2,0,0,0,0|2,0,0]=4 2580 B11R1.1253 C#CC1(CCCCC1)NC=O 189eb31aaf834cbc5f25fcd985163470 [0,2,0,0,0,0|1,0,0]=3 2581 B11R1.1253 CCC1(CCOCC1)NC=O 25b23765d45a59454e29598db2490e96 [0,2,0,0,0,0|2,0,0]=4 2582 B11R1.1253 O=CNC1(CCCCC1)CO e3b4c672acae9e42d424bda51edef9cb [0,2,0,0,0,0|1,0,0]=3 2583 B11R1.1253 O=CNC1(CCOCC1)CO 12924b1aa26b4c2928a987d56d655323 [0,2,0,0,0,0|2,0,0]=4 2584 B9R1.9 CCCNC1CC(=O)C1 367843f6c154ea9b1b2ab5b6982e35c8 [0,0,1,1,0,0|2,0,0]=4 2585 B9R1.9 CCCOC1CC(=O)C1 cb8b05388c0c6b6c847ea07bd6f740db [0,0,1,1,0,0|2,0,0]=4 2586 B9R1.9 CCOCC1CC(=O)C1 314fc2b69b99eb56a50a5b1c782af7e0 [0,0,1,1,0,0|2,0,0]=4 2587 B9R1.9 CCOCC1CC(=O)N1 4d4a394646263ac2a76d63e6bf0523d3 [0,0,1,1,0,0|2,0,0]=4 2588 B9R1.9 CCOC[C@@H]1CC(=O)N1 0014850b07eba2466726f06d24d9917a [0,0,1,1,0,0|2,0,0]=4 2589 B9R1.9 CCOC[C@H]1CC(=O)N1 7563fb6dd848526ece65c4c755fed6d6 [0,0,1,1,0,0|2,0,0]=4 2590 B9R1.18 COC[C@@H]1C[C@@H]1NC=O e8a9d54923fee9355d76b1ab2fc703fa [0,0,1,1,0,0|2,0,0]=4 2591 B9R1.18 COC[C@H]1C[C@@H]1NC=O 51a259aae5519abbdb003acfe8bc77a1 [0,0,1,1,0,0|2,0,0]=4 2592 B9R1.20 CCCNC1CC1C=O 5a1255ba47b3f9b77a8f94f9f9e96699 [0,0,1,1,0,0|2,0,0]=4 2593 B9R1.20 CCCOC1CC1C=O 31262bf4a61a94a8c2a2cb7b4ef3e962 [0,0,1,1,0,0|2,0,0]=4 2594 B9R1.27 CC1CCC(N1C=O)C 974bae1405fe69bfea26b733c8b4d59d [0,0,1,1,0,0|1,0,0]=3 2595 B9R1.27 C[C@@H]1CC[C@@H](N1C=O)C 28badcd7126a0fb280e7c12d2c3e5b86 [0,0,1,1,0,0|1,0,0]=3 2596 B9R1.27 C[C@@H]1CC[C@H](N1C=O)C 14117eb6b1ac6a4c8652c1fab96220d1 [0,0,1,1,0,0|1,0,0]=3 2597 B9R1.27 C[C@H]1CC[C@@H](N1C=O)C 0bd414895024833ff1abad1390ce1780 [0,0,1,1,0,0|1,0,0]=3 2598 B9R1.58 CCC1CN(C1)CC=O 5991f5887d4d26815f752c25d2b83d8c [0,0,1,1,0,0|2,0,0]=4 2599 B9R1.58 CCN1CC(C1)NC=O 654e5c797cd9e09b0a36d5eb4d57d46a [0,0,1,1,0,0|2,0,0]=4 2600 B9R1.58 COC1CC(C1)NC=O f38d38d31f56fdbc9fd4859d8075e88d [0,0,1,1,0,0|2,0,0]=4 2601 B9R1.58 CO[C@H]1C[C@@H](C1)NC=O b551bf8e0261066dcebf0954b2daeb3c [0,0,1,1,0,0|2,0,0]=4 2602 B9R1.58 CO[C@H]1C[C@H](C1)NC=O b6bfdf60e8203ef19524c38c27dd9e96 [0,0,1,1,0,0|2,0,0]=4 2603 B9R1.58 O=CNC1CC(C1)CO aa81e0701cc11451582d61bafa31ec68 [0,0,1,1,0,0|2,0,0]=4 2604 B9R1.58 O=CN[C@H]1C[C@@H](C1)CO 9e33625bc19eeaeea4fbd6df057d3a00 [0,0,1,1,0,0|2,0,0]=4 2605 B9R1.58 O=CN[C@H]1C[C@H](C1)CO a549ffc441fb198eec77bdb6f5d9ad9a [0,0,1,1,0,0|2,0,0]=4 2606 B9R1.73 CC(NC=O)C1COC1 9cad3b84e897cad45e98b83b30bbbaf6 [0,0,1,1,0,0|2,0,0]=4 2607 B9R1.73 CC(OCF)C1CCC1 06ac4485af71ed5ecf6e3ed79ce57e2a [0,0,1,1,0,0|1,0,1]=4 2608 B9R1.73 CCOC(C)C1CCC1 0b24261bffd5879ed99c8dff6e3e7277 [0,0,1,1,0,0|1,0,1]=4 2609 B9R1.73 CCO[C@@H](C)C1CCC1 8e815a4884bd12b4bd9f77f0cc4082b1 [0,0,1,1,0,0|1,0,1]=4 2610 B9R1.73 CN(CC=O)C1CCC1 4070207922d913418d9261706762628a [0,0,1,1,0,0|2,0,0]=4 2611 B9R1.73 C[C@@H](NC=O)C1COC1 f81ff31966704238e566ce6c33cda041 [0,0,1,1,0,0|2,0,0]=4 2612 B9R1.73 C[C@H](NC=O)C1COC1 59e975a1c44dcf7eb53f369bd553578d [0,0,1,1,0,0|2,0,0]=4 2613 B9R1.73 C[C@H](OCF)C1CCC1 a9c582dd064a7b048c1e71613faf2512 [0,0,1,1,0,0|1,0,1]=4 2614 B9R1.75 CC(CC1CC1)OCF a4cdbc285fe130812cfbb0eed0b3cd90 [0,0,1,1,0,0|1,0,1]=4 2615 B9R1.75 CCOC(C)CC1CC1 0f29d538d0c6398a5b46e339b080cd7b [0,0,1,1,0,0|1,0,1]=4 2616 B9R1.75 CN(CC=O)CC1CC1 660f525c3d97ae7acbd01c8e55aff13f [0,0,1,1,0,0|2,0,0]=4 2617 B9R1.4 CCC1CCN1CC=O aee48a138645dd7a756ef2b78311f413 [0,0,1,1,0,0|2,0,0]=4 2618 B9R1.4 COC1CCC1NC=O 0516ce26a02ed622900cc504f80eba14 [0,0,1,1,0,0|2,0,0]=4 2619 B9R1.4 COCC1CCN1C=O c8b8b5b0fdbcc9317c0fd4bfbe42e156 [0,0,1,1,0,0|2,0,0]=4 2620 B9R1.4 COC[C@@H]1CCN1C=O 4300e27a8cfd5eda3ca1f78e5c5877b6 [0,0,1,1,0,0|2,0,0]=4 2621 B9R1.4 COC[C@H]1CCN1C=O dc6d58be0dbd75769c416bde7f6785a9 [0,0,1,1,0,0|2,0,0]=4 2622 B9R1.4 CO[C@@H]1CC[C@@H]1NC=O 13b3ff47b5c1143e5efc5fc4a12ae663 [0,0,1,1,0,0|2,0,0]=4 2623 B9R1.4 CO[C@@H]1CC[C@H]1NC=O 5ace3a07ef2f61f85978acb689b55bb8 [0,0,1,1,0,0|2,0,0]=4 2624 B9R1.4 CO[C@H]1CC[C@@H]1NC=O 55fdc1b99ccc1745203679378dc7e779 [0,0,1,1,0,0|2,0,0]=4 2625 B9R1.4 CO[C@H]1CC[C@H]1NC=O 529d28774ce1207e0706afe7464d213a [0,0,1,1,0,0|2,0,0]=4 2626 B9R1.4 O=CN1CCC1CCO c85a94914843f4f69a819dff95e34c1e [0,0,1,1,0,0|2,0,0]=4 2627 B9R1.14 CCC1CCCN1C=O 9bfd3104fb9bd3ec80e56f7f40a87d09 [0,0,1,1,0,0|1,0,0]=3 2628 B9R1.14 CC[C@@H]1CCCN1C=O da9d0e05329f820d63cc29621bd7430d [0,0,1,1,0,0|1,0,0]=3 2629 B9R1.14 COC1CCCN1C=O 8aa7b22777bc471212d982f27b92f5fd [0,0,1,1,0,0|2,0,0]=4 2630 B9R1.14 O=CN1CCCC1CO 75b12ffa9bd2f35acc3b984d4ad2e6f7 [0,0,1,1,0,0|2,0,0]=4 2631 B9R1.14 O=CN1CCC[C@@H]1CF 45884ece6cccc8922acf889d282db837 [0,0,1,1,0,0|2,0,0]=4 2632 B9R1.14 O=CN1CCC[C@@H]1CO b2e4d0ee0a911eac6a5bfd92181e1f8a [0,0,1,1,0,0|2,0,0]=4 2633 B9R1.14 O=CN1CCC[C@H]1CF efa94b1e9832aaf370863a6f8233628a [0,0,1,1,0,0|2,0,0]=4 2634 B9R1.14 O=CN1CCC[C@H]1CO 6edb00daf504246f581ca4815eae2e10 [0,0,1,1,0,0|2,0,0]=4 2635 B9R1.16 CC1CC1COCC=O e38c4912a5bd244cfef6cdfcd630eadf [0,0,1,1,0,0|2,0,0]=4 2636 B9R1.16 CC1CC1NCCC=O 41a62504559929453219af6a8e069423 [0,0,1,1,0,0|2,0,0]=4 2637 B9R1.16 C[C@@H]1C[C@H]1COCC=O 7ae74dfc03906b5b41f7f9d5bbdb763b [0,0,1,1,0,0|2,0,0]=4 2638 B9R1.16 C[C@H]1C[C@@H]1COCC=O b02f0ce03a967d9b5a7484bce5693d9b [0,0,1,1,0,0|2,0,0]=4 2639 B9R1.16 C[C@H]1C[C@H]1COCC=O c17ac892c3cf503bcc9858e0bcb45921 [0,0,1,1,0,0|2,0,0]=4 2640 B9R1.17 CCOCCC1CCC1 b8fb156ada576d4ff345af9850e688ed [0,0,1,1,0,0|1,0,1]=4 2641 B9R1.17 FCOCCC1CCC1 ac390425974b2cdfe56e29e455e898e6 [0,0,1,1,0,0|1,0,1]=4 2642 B9R1.17 O=CCCCN1CCC1 c9421be176719d154eb5accc0053f780 [0,0,1,1,0,0|2,0,0]=4 2643 B9R1.17 O=CCCNC1CCC1 1b528abcf9d669c9f08c41d2e17cde6d [0,0,1,1,0,0|2,0,0]=4 2644 B9R1.17 O=CCCOC1CCC1 ca0325a8327dd5387ba03d5c4c035d7d [0,0,1,1,0,0|2,0,0]=4 2645 B9R1.17 O=CCNCC1CCC1 d9fc727438c262514562cfe2c9442588 [0,0,1,1,0,0|2,0,0]=4 2646 B9R1.17 O=CCOCC1CCC1 df39e2693a3babd07be9a7e868d03e5c [0,0,1,1,0,0|2,0,0]=4 2647 B9R1.17 O=CNCCC1CCC1 e202ec16281bf0e218ffc459925c1fd6 [0,0,1,1,0,0|1,0,0]=3 2648 B9R1.17 O=CNCCC1CCO1 cdf38e52e7d02ed5e20cbef43a20f6b9 [0,0,1,1,0,0|2,0,0]=4 2649 B9R1.17 O=CNCCC1COC1 b9ec2701a554368fc6ec06579c4cd9f5 [0,0,1,1,0,0|2,0,0]=4 2650 B9R1.17 O=CNCCN1CCC1 6730ab1f9f0bf6f2fcaf5bbea4cd4d18 [0,0,1,1,0,0|2,0,0]=4 2651 B9R1.17 O=CNCC[C@@H]1CCO1 7931fbc71d7a018e517df0f2d3977f68 [0,0,1,1,0,0|2,0,0]=4 2652 B9R1.39 CCCN[C@H]1CNC1=O d54fb2abe7455950df3e037f3ce21945 [0,0,1,1,0,0|2,0,0]=4 2653 B9R1.39 CCCOC1CCC1=O 6747d0d4bf3ca4d2474fd2057207f365 [0,0,1,1,0,0|2,0,0]=4 2654 B9R1.39 CCOCC1CCC1=O a06c32f97be82794ffc1ab53b750de7f [0,0,1,1,0,0|2,0,0]=4 2655 B9R1.39 CN1CCC1CNC=O 4ed43e8d18b2935d99bd7891c23f5d60 [0,0,1,1,0,0|2,0,0]=4 2656 B9R1.39 C[C@@H]1CC[C@@H]1NCC=O 010d1f07421a6ab7666be29e45bdb933 [0,0,1,1,0,0|2,0,0]=4 2657 B9R1.39 C[C@@H]1CC[C@H]1NCC=O 5bdea5e6a123d69d5ec9a77ce96f151b [0,0,1,1,0,0|2,0,0]=4 2658 B9R1.83 C=COCCNC1CC1 de194d8695caa8e793a0fd361853e44a [0,0,1,1,0,0|2,0,0]=4 2659 B9R1.83 C=COCCOC1CC1 dab1da01423ce24e3c6490deb4b0c2b7 [0,0,1,1,0,0|2,0,0]=4 2660 B9R1.83 CCOCCCC1CC1 58903da184310c5a30f3427e9b172b7e [0,0,1,1,0,0|1,0,1]=4 2661 B9R1.83 FCOCCCC1CC1 0b8c9326c555d9697fcaddb0289edb0e [0,0,1,1,0,0|1,0,1]=4 2662 B9R1.83 O=CCCCNC1CC1 90250eaeb8b0faae4f92ea1a0d59bfaf [0,0,1,1,0,0|2,0,0]=4 2663 B9R1.83 O=CCCCOC1CC1 8c56cd950e39548ad0d9b9606b829577 [0,0,1,1,0,0|2,0,0]=4 2664 B9R1.83 O=CCCNCC1CC1 7c4d27f4b68b41c8eddb041c82ef0a24 [0,0,1,1,0,0|2,0,0]=4 2665 B9R1.83 O=CCCOCC1CC1 daa9b247c38693dadc6d33a20c9e023c [0,0,1,1,0,0|2,0,0]=4 2666 B9R1.83 O=CCNCCC1CC1 c081918168c1dc9e5f44e991519eecf1 [0,0,1,1,0,0|2,0,0]=4 2667 B9R1.83 O=CCOCCC1CC1 e95c5fc4c9f9574f689822c866eeb674 [0,0,1,1,0,0|2,0,0]=4 2668 B9R1.83 O=CNCCOC1CC1 44267b449bf44e7f8fd59e98843644fe [0,0,1,1,0,0|2,0,0]=4 2669 B9R1.83 O=COCCOC1CC1 827a5d8c0ec3a0e23501930474206359 [0,0,1,1,0,0|1,0,0]=3 2670 B9R1.89 O=CN1CCCCCC1 4a543573026aecbb7f088b43cea970d5 [0,0,1,1,0,0|1,0,0]=3 2671 B9R1.89 O=CN1CCCOCC1 ac69421f50e86b391ee77e2bd7abf564 [0,0,1,1,0,0|2,0,0]=4 2672 B9R1.43 CCC(NC=O)C1CC1 618ac20a3738bad38f11073dfe0da608 [0,0,1,1,0,0|1,0,0]=3 2673 B9R1.43 CCC(OCF)C1CC1 53c2cec5cfb4e9b78548b7dbcf17e75b [0,0,1,1,0,0|1,0,1]=4 2674 B9R1.43 CCN(CC=O)C1CC1 ce70e3243ed3b268f1fcde1f3305661c [0,0,1,1,0,0|2,0,0]=4 2675 B9R1.43 CCOC(CC)C1CC1 15ad00b2d460aeaaf95244223bb6dfbf [0,0,1,1,0,0|1,0,1]=4 2676 B9R1.43 O=CNC(CO)C1CC1 31dd438de772b4bc7a174e2a13d1f11d [0,0,1,1,0,0|2,0,0]=4 2677 B9R1.43 O=CN[C@@H](CO)C1CC1 c7c4dd7fa3503aaf39c132229a3e6b0d [0,0,1,1,0,0|2,0,0]=4 2678 B9R1.43 O=CN[C@H](CO)C1CC1 e510b4ede0e0c3b330d7b4bf0311fc18 [0,0,1,1,0,0|2,0,0]=4 2679 B9R1.175 O=CNC1(CCC1)CO 07ab30e8d66ec0ccdb1f2f42524cc774 [0,0,1,1,0,0|2,0,0]=4 2680 B9R1.182 COCC1(CC1)NC=O db0dfd1c347ee63427cea44172a57fee [0,0,1,1,0,0|2,0,0]=4 2681 B9R2.47 O=CN1CC2CC2C1 36a8f9666de0b344dd5d7bcd36723907 [1,0,0,1,0,0|1,0,0]=3 2682 B9R2.65 O=CN1C2C1CCC2 35dd2a078e80056fcadb05b73d230f9b [1,0,0,1,0,0|1,0,0]=3 2683 B9R2.70 O=CN1CCC2C1C2 d206edc137cc271c5c4fc8f637217354 [1,0,0,1,0,0|1,0,0]=3 2684 B11R2.82 O=CCN1CCC2CC2C1 2886e1cc796bd771e503849d349134c1 [0,0,0,1,0,1|2,0,0]=4 2685 B11R2.82 O=CNC1CCC2CC2C1 686605d091aeb279fc9fe54d907ef9be [0,0,0,1,0,1|1,0,0]=3 2686 B11R2.82 O=CN[C@@H]1CCC2CC2C1 9cd586b972adc5459163ae8378b42d67 [0,0,0,1,0,1|1,0,0]=3 2687 B11R2.82 O=CN[C@H]1CCC2CC2C1 00b565f6996e947c4a7d33040a7b369c [0,0,0,1,0,1|1,0,0]=3 2688 B11R2.97 O=CCN1CC2CCC2C1 71491fb77620c293a0b23232eebcfa48 [0,0,0,1,0,1|2,0,0]=4 2689 B11R2.98 O=CCN1CC2C1CCC2 cbf272c12d6bfcdb405bc29fc3784d5c [0,0,0,1,0,1|2,0,0]=4 2690 B11R2.98 O=CCN1C[C@H]2[C@@H]1CCC2 b53ccf0b23c2c6884d4a847d04d91bf7 [0,0,0,1,0,1|2,0,0]=4 2691 B11R2.232 O=CN1C2CCC1COC2 2533ba6ff8c06e8007a63e63af81263f [0,0,0,1,0,1|1,0,0]=3 2692 B11R2.232 O=CN1C2CCCC1CC2 e6d6fa2e9f6a69fd2b5ab6c9e348687a [0,0,0,1,0,1|1,0,0]=3 2693 B11R2.232 O=CN1[C@@H]2CCC[C@H]1CC2 bbc1e7e126da1e5b5fdc64856ef8a497 [0,0,0,1,0,1|1,0,0]=3 2694 B11R2.232 O=CN1[C@@H]2CC[C@H]1COC2 837d7f681bb40d9148aaa859608fa4f5 [0,0,0,1,0,1|1,0,0]=3 2695 B11R2.321 O=CN1C2CCCCC1C2 d5126c4814dffad5558caf109dbc6533 [0,0,0,1,0,1|1,0,0]=3 2696 B11R2.635 O=CCN1C2C1CCCC2 88d39799d9fed4c6bd4b764ce7eacb12 [0,0,0,1,0,1|2,0,0]=4 2697 B11R2.641 O=CCN1CCOC2C1C2 eddb694aaa3f13c639dc290c07efdce2 [0,0,0,1,0,1|2,0,0]=4 2698 B11R2.349 CN1C[C@@H]2[C@H](C1)[C@H]2NC=O 9d1b22c51c62365c07a65f1eb5fff210 [0,1,0,1,0,0|2,0,0]=4 2699 B11R2.75 O=CCN1C2COCC1C2 51b57fd6a433767d951502062348c77a [0,1,0,1,0,0|2,0,0]=4 2700 B11R2.248 CCOC1CC2CCC1C2 2081ca2c52687c9ec26f6dd79cded3d3 [0,1,0,1,0,0|1,0,1]=4 2701 B11R2.248 CCOC1C[C@@H]2CC[C@H]1C2 a5999d34a2677bf36efe323919382388 [0,1,0,1,0,0|1,0,1]=4 2702 B11R2.248 CCO[C@@H]1C[C@H]2CC[C@@H]1C2 fb6639d2fcd765d3adf0e1abc7137940 [0,1,0,1,0,0|1,0,1]=4 2703 B11R2.248 CCO[C@H]1C[C@@H]2CC[C@H]1C2 d72504917e40d4f292729b43c8e19b0a [0,1,0,1,0,0|1,0,1]=4 2704 B11R2.248 CCO[C@H]1C[C@H]2CC[C@@H]1C2 831490b704d2a92add6f8aa3ab501137 [0,1,0,1,0,0|1,0,1]=4 2705 B11R2.248 FCOC1CC2CCC1C2 156bae4f90639dbe5119ef0ea91bd047 [0,1,0,1,0,0|1,0,1]=4 2706 B11R2.248 FCOC1C[C@@H]2CC[C@H]1C2 35bcf7f8841529dba13489f1a750d2f6 [0,1,0,1,0,0|1,0,1]=4 2707 B11R2.248 FCO[C@@H]1C[C@H]2CC[C@@H]1C2 fafa7dd19c0da52c7a1dec1a4d69020e [0,1,0,1,0,0|1,0,1]=4 2708 B11R2.248 FCO[C@H]1C[C@@H]2CC[C@H]1C2 400d28a6ca786a75e263652ad8ecc69b [0,1,0,1,0,0|1,0,1]=4 2709 B11R2.248 FCO[C@H]1C[C@H]2CC[C@@H]1C2 0d2d4a074ff78320b67cb055216567e9 [0,1,0,1,0,0|1,0,1]=4 2710 B11R2.248 O=CCN1CC2CCC1C2 2cb3b4ff197c764373f24eba2f60dff8 [0,1,0,1,0,0|2,0,0]=4 2711 B11R2.248 O=CCN1C[C@@H]2CC[C@H]1C2 d7903c50ddf4434a8e9fffe3754f5e71 [0,1,0,1,0,0|2,0,0]=4 2712 B11R2.248 O=CCN1C[C@H]2CC[C@@H]1C2 f26292df1b8be541c8d9469e3962bbdc [0,1,0,1,0,0|2,0,0]=4 2713 B11R2.248 O=CN[C@@H]1CN2CC[C@H]1C2 0d7e42f4e3681ad7c2a85fecde6d58b2 [0,1,0,1,0,0|2,0,0]=4 2714 B11R2.248 O=CN[C@@H]1C[N@]2CC[C@@H]1C2 c56abfc46a2dc2f45e3f854fd8789314 [0,1,0,1,0,0|2,0,0]=4 2715 B11R2.248 O=CN[C@H]1CN2CC[C@H]1C2 acd85e9bea3c5a70f2caf11c91611eea [0,1,0,1,0,0|2,0,0]=4 2716 B11R2.248 O=CN[C@H]1C[N@]2CC[C@@H]1C2 255e5fb31ca951f85ba209e453303f74 [0,1,0,1,0,0|2,0,0]=4 2717 B11R2.988 O=CN1CC2C1CCCC2 9a9d48d4faa9369ffd143ba3073ff209 [0,1,0,1,0,0|1,0,0]=3 2718 B11R2.988 O=CN1C[C@@H]2[C@H]1CCCC2 3c577a9059507038595aaa0a7b79f1d9 [0,1,0,1,0,0|1,0,0]=3 2719 B11R2.163 O=CN1CC2CCCC1C2 3ecd6319fc409d95674deeec537ab86c [0,1,0,1,0,0|1,0,0]=3 2720 B11R2.217 CN1CC2CC(C1)N2C=O ae394ec46e5f9e6aac6ea08e0090726a [0,1,0,1,0,0|2,0,0]=4 2721 B11R2.645 CCOC1CC2CC(C2)C1 655d12f00137879a75bd16ae8237d024 [0,1,0,1,0,0|1,0,1]=4 2722 B11R2.645 FCOC1CC2CC(C2)C1 f613d98d8c07f8432f195dbb120eba69 [0,1,0,1,0,0|1,0,1]=4 2723 B11R2.645 O=CCN1CC2CC(C1)O2 ee314479ad1f3d779b92816c3853380e [0,1,0,1,0,0|2,0,0]=4 2724 B11R2.645 O=CCN1C[C@H]2C[C@@H](C1)O2 9fb3962e86d2c1c0c758005df07a2c02 [0,1,0,1,0,0|2,0,0]=4 2725 B11R2.905 CC(C=O)N1C2C1CCC2 dc7bb95e6dc14a20c5a374a35aa641c4 [0,1,0,1,0,0|2,0,0]=4 2726 B11R2.905 C[C@H](C=O)N1C2C1CCC2 da37e20eb69beace2528a9034516771a [0,1,0,1,0,0|2,0,0]=4 2727 B11R2.905 O=CC(=O)N1C2C1CCC2 fe6df68038cebccfb677480ef1a8b941 [0,1,0,1,0,0|2,0,0]=4 2728 B11R2.911 CC(C=O)N1CCC2C1C2 078bda05485c3abf347cef6a2d40933b [0,1,0,1,0,0|2,0,0]=4 2729 B11R2.911 C[C@H](C=O)N1CCC2C1C2 a4639a7ea80c28ed8097f546445ab744 [0,1,0,1,0,0|2,0,0]=4 2730 B11R2.911 O=CC(=O)N1CCC2C1C2 12ccf0e1d6f2f40b52abb5da581b9981 [0,1,0,1,0,0|2,0,0]=4 2731 B11R2.914 CC(C=O)N1CC2CC2C1 8648a8e57426f829ee5750746f72eb39 [0,1,0,1,0,0|2,0,0]=4 2732 B11R2.914 C[C@H](C=O)N1CC2CC2C1 e2b89a919e2393fd07c7e564231368f9 [0,1,0,1,0,0|2,0,0]=4 2733 B11R2.914 O=CC(=O)N1CC2CC2C1 1e10a7f8c8ab560708591bb91cf5fb99 [0,1,0,1,0,0|2,0,0]=4 2734 B11R2.76 C=CCN1C2CCC1CC2 226e4948c627e2b05c4122f0de2d6d22 [0,1,0,1,0,0|2,0,0]=4 2735 B11R2.76 C=CCN1[C@H]2CC[C@@H]1CC2 cda7434da15c95c0c9b7ba32e5ac56f9 [0,1,0,1,0,0|2,0,0]=4 2736 B11R2.76 O=CCN1C2CCC1CC2 ae03750c1102a04dfcb48805e408986a [0,1,0,1,0,0|1,0,0]=3 2737 B11R2.76 O=CCN1[C@H]2CC[C@@H]1CC2 91e20d05f60e3b317a69b54e08777d71 [0,1,0,1,0,0|1,0,0]=3 2738 B11R2.157 C#CCOC1CC2CC2C1 674049afa6dbd0f17f1812d7966fc95a [0,1,0,1,0,0|1,0,1]=4 2739 B11R2.157 C#CCOC1C[C@@H]2C[C@@H]2C1 76ce4504d752c86e493f14b59c142955 [0,1,0,1,0,0|1,0,1]=4 2740 B11R2.157 C#CCO[C@@H]1C[C@@H]2C[C@@H]2C1 ffd4da4317ca1bb598fd288ee1d9a1ba [0,1,0,1,0,0|1,0,1]=4 2741 B11R2.157 C#CCO[C@H]1C[C@@H]2C[C@@H]2C1 06b7161d044a7d45f7c879c127e5ec30 [0,1,0,1,0,0|1,0,1]=4 2742 B11R2.157 C=CCOC1CC2CC2C1 5f522b41a2300244aa5ca98481e41b3c [0,1,0,1,0,0|1,0,0]=3 2743 B11R2.157 C=CCOC1C[C@@H]2C[C@@H]2C1 d0c05f035d51e994ff6034ecfcb2bd09 [0,1,0,1,0,0|1,0,0]=3 2744 B11R2.157 C=CCO[C@@H]1C[C@@H]2C[C@@H]2C1 5731b635fa6f1e4e4de24f1031e2532d [0,1,0,1,0,0|1,0,0]=3 2745 B11R2.157 C=CCO[C@H]1C[C@@H]2C[C@@H]2C1 cb9f64acf38488f78b03bd4bd5d0bb2a [0,1,0,1,0,0|1,0,0]=3 2746 B11R2.157 CCCOC1CC2CC2C1 6109945cbd2def0bae318d86b4758568 [0,1,0,1,0,0|1,0,1]=4 2747 B11R2.157 CCCOC1C[C@@H]2C[C@@H]2C1 f6db505b774d08e1fee6356a36bc7666 [0,1,0,1,0,0|1,0,1]=4 2748 B11R2.157 CCCO[C@@H]1C[C@@H]2C[C@@H]2C1 04d12717b6a842cf84598d5431008dfb [0,1,0,1,0,0|1,0,1]=4 2749 B11R2.157 CCCO[C@H]1C[C@@H]2C[C@@H]2C1 661bd758c76a14a990770db5f3e67736 [0,1,0,1,0,0|1,0,1]=4 2750 B11R2.157 COCOC1CC2CC2C1 66e852637fc374f3e241738fa926cec0 [0,1,0,1,0,0|0,0,2]=4 2751 B11R2.157 COCOC1C[C@@H]2C[C@@H]2C1 4d1bf8cbf12698b89017c77e22012b86 [0,1,0,1,0,0|0,0,2]=4 2752 B11R2.157 COCO[C@@H]1C[C@@H]2C[C@@H]2C1 cf85f037d0f59b49bf405f61fb278bb5 [0,1,0,1,0,0|0,0,2]=4 2753 B11R2.157 COCO[C@H]1C[C@@H]2C[C@@H]2C1 d4931af1d5afd8be81b8ab8ef7ad8775 [0,1,0,1,0,0|0,0,2]=4 2754 B11R2.157 CSCOC1CC2CC2C1 9aab6358c27f089ff4291a8058795154 [0,1,0,1,0,0|0,1,1]=4 2755 B11R2.157 CSCOC1C[C@@H]2C[C@@H]2C1 1b26c25608d9e0d71c5b0269e14dfcc7 [0,1,0,1,0,0|0,1,1]=4 2756 B11R2.157 CSCO[C@@H]1C[C@@H]2C[C@@H]2C1 79ca8216e0e634368e48b8d6524d0ead [0,1,0,1,0,0|0,1,1]=4 2757 B11R2.157 CSCO[C@H]1C[C@@H]2C[C@@H]2C1 06509252fdaa2cd069f70beb9b79d1e5 [0,1,0,1,0,0|0,1,1]=4 2758 B11R2.157 FCCOC1CC2CC2C1 fc42f73a6e265ed41cd8f0bd1c3138f4 [0,1,0,1,0,0|1,0,1]=4 2759 B11R2.157 FCCOC1C[C@@H]2C[C@@H]2C1 f90c54953b3006198709184b8f065071 [0,1,0,1,0,0|1,0,1]=4 2760 B11R2.157 FCCO[C@@H]1C[C@@H]2C[C@@H]2C1 898a26638476cd4d6a6ae26ee5f3799d [0,1,0,1,0,0|1,0,1]=4 2761 B11R2.157 FCCO[C@H]1C[C@@H]2C[C@@H]2C1 f6a291ed29c2dba489e2bfb6f7b05174 [0,1,0,1,0,0|1,0,1]=4 2762 B11R2.157 N#CCOC1CC2CC2C1 9895dfa7ff56f77cb863bed9622130dd [0,1,0,1,0,0|1,0,1]=4 2763 B11R2.157 N#CCOC1C[C@@H]2C[C@@H]2C1 9216ee4254a4427524ef4c775a6b4e8e [0,1,0,1,0,0|1,0,1]=4 2764 B11R2.157 N#CCO[C@@H]1C[C@@H]2C[C@@H]2C1 7eb56d942a7ebd76bf2b3d2646af5ff0 [0,1,0,1,0,0|1,0,1]=4 2765 B11R2.157 N#CCO[C@H]1C[C@@H]2C[C@@H]2C1 81398bf603776fa9f62da83650abca4a [0,1,0,1,0,0|1,0,1]=4 2766 B11R2.157 O=CCCN1CC2CC2C1 22adbcab35f0749e401d6cfd765775f5 [0,1,0,1,0,0|2,0,0]=4 2767 B11R2.157 O=CCOC1CC2CC2C1 8ba344f27f7eb2b735103abf19b8158a [0,1,0,1,0,0|0,0,0]=2 2768 B11R2.157 O=CCOC1C[C@@H]2C[C@@H]2C1 e353b07f829e98a9d5c790a070b3cbc7 [0,1,0,1,0,0|0,0,0]=2 2769 B11R2.157 O=CCO[C@@H]1C[C@@H]2C[C@@H]2C1 af3ca9b78af7496dbdb5708e8cb3b444 [0,1,0,1,0,0|0,0,0]=2 2770 B11R2.157 O=CCO[C@H]1C[C@@H]2C[C@@H]2C1 16b5a95858e275e7ec20b181805752c2 [0,1,0,1,0,0|0,0,0]=2 2771 B11R2.157 SCCOC1CC2CC2C1 2a5afad054321c7cdc8a60d3e55c4332 [0,1,0,1,0,0|0,1,1]=4 2772 B11R2.157 SCCOC1C[C@@H]2C[C@@H]2C1 7462f62d2503fe5f1d3988874b1984b7 [0,1,0,1,0,0|0,1,1]=4 2773 B11R2.157 SCCO[C@@H]1C[C@@H]2C[C@@H]2C1 b22e0a5d313dd4e402d6f01276b5a6e4 [0,1,0,1,0,0|0,1,1]=4 2774 B11R2.157 SCCO[C@H]1C[C@@H]2C[C@@H]2C1 aa030ef850fdc9acc14e74810d6c47ff [0,1,0,1,0,0|0,1,1]=4 2775 B11R2.238 C1CCC(CC1)OC2CC2 264083d7355d6967959ae346eed064fb [0,1,0,1,0,0|1,0,1]=4 2776 B11R2.258 O=CCCN1C2C1CCC2 7c8651bc62d8672b322d2f586b5483b7 [0,1,0,1,0,0|2,0,0]=4 2777 B11R2.927 C#CCOC1CCC2C1C2 ee581697d99a68ca14121802732d6d16 [0,1,0,1,0,0|1,0,1]=4 2778 B11R2.927 C#CCO[C@@H]1CC[C@@H]2[C@H]1C2 8424b09ce786122c9744fe6c5f7da3a6 [0,1,0,1,0,0|1,0,1]=4 2779 B11R2.927 C=CCOC1CCC2C1C2 87d174fdcadb136f7b813221ba82142b [0,1,0,1,0,0|1,0,0]=3 2780 B11R2.927 C=CCO[C@@H]1CC[C@@H]2[C@H]1C2 bc0d9b5bc42e6b629276110af1785a1a [0,1,0,1,0,0|1,0,0]=3 2781 B11R2.927 CCCOC1CCC2C1C2 5c2073fe79538f37015338c16dbd7c40 [0,1,0,1,0,0|1,0,1]=4 2782 B11R2.927 CCCO[C@@H]1CC[C@@H]2[C@H]1C2 f314f993b077521422f5f16e10278801 [0,1,0,1,0,0|1,0,1]=4 2783 B11R2.927 COCOC1CCC2C1C2 8832c1503c08d86e6754aadb7f00b8fb [0,1,0,1,0,0|0,0,2]=4 2784 B11R2.927 COCO[C@@H]1CC[C@@H]2[C@H]1C2 27667855f2ef0a5aaee2bb3a7574701d [0,1,0,1,0,0|0,0,2]=4 2785 B11R2.927 CSCOC1CCC2C1C2 a365a7b8308c961b75a78e471c67e370 [0,1,0,1,0,0|0,1,1]=4 2786 B11R2.927 CSCO[C@@H]1CC[C@@H]2[C@H]1C2 23c21685564685ff7d5305db6f995ecf [0,1,0,1,0,0|0,1,1]=4 2787 B11R2.927 FCCOC1CCC2C1C2 7ee45d7d2e92e84de9fc6d35e941da7e [0,1,0,1,0,0|1,0,1]=4 2788 B11R2.927 FCCO[C@@H]1CC[C@@H]2[C@H]1C2 2cf6aba0285b85666c3111647e922a16 [0,1,0,1,0,0|1,0,1]=4 2789 B11R2.927 N#CCOC1CCC2C1C2 149c78d6efc46347ca09b73a968801f5 [0,1,0,1,0,0|1,0,1]=4 2790 B11R2.927 N#CCO[C@@H]1CC[C@@H]2[C@H]1C2 f6bebe7efcf0dbcb5f5af959011f3eff [0,1,0,1,0,0|1,0,1]=4 2791 B11R2.927 O=CCCN1CCC2C1C2 60e12229b5a9cebb7db765ae9ec7a615 [0,1,0,1,0,0|2,0,0]=4 2792 B11R2.927 O=CCOC1CCC2C1C2 11b625b62c5cca50cfe3a39b3d324e97 [0,1,0,1,0,0|0,0,0]=2 2793 B11R2.927 O=CCO[C@@H]1CC[C@@H]2[C@H]1C2 50ef9ae44b7e08d265668d6ad18d78d6 [0,1,0,1,0,0|0,0,0]=2 2794 B11R2.927 SCCOC1CCC2C1C2 53e4a8c07f47910ff38f4e72934f611b [0,1,0,1,0,0|0,1,1]=4 2795 B11R2.927 SCCO[C@@H]1CC[C@@H]2[C@H]1C2 090d945030a2abdda0222850d998a45a [0,1,0,1,0,0|0,1,1]=4 2796 B11R2.824 CC(=O)N1C2CCC1CC2 03fa0afe35e2b1875ebccdc62e280ee5 [0,1,0,1,0,0|1,0,0]=3 2797 B11R2.824 CC(=O)N1[C@H]2CC[C@@H]1CC2 bb0824b30b24742919f8bc0e3edae056 [0,1,0,1,0,0|1,0,0]=3 2798 B11R2.860 NC(=O)CN1C2C1CCC2 3b47474411ebfdd191410570b68735bf [0,1,0,1,0,0|2,0,0]=4 2799 B11R2.860 O=C(O)CN1C2C1CCC2 c0fc82cf3662ea06a0ff8d5982dd3286 [0,1,0,1,0,0|2,0,0]=4 2800 B11R2.932 CC(C)OC1CCC2C1C2 07d3bb0f6fa51f8732bcdd41daed9ad4 [0,1,0,1,0,0|1,0,1]=4 2801 B11R2.932 CC(C)O[C@@H]1CC[C@@H]2[C@H]1C2 1be23c8ba963bca6eeb7e26e27c75e23 [0,1,0,1,0,0|1,0,1]=4 2802 B11R2.932 NC(=O)CN1CCC2C1C2 3815f2b03e3fb01cf99c2ca22a05e495 [0,1,0,1,0,0|2,0,0]=4 2803 B11R2.932 O=C(O)CN1CCC2C1C2 48ad542dcaee2147e97d4de3ec4b42d0 [0,1,0,1,0,0|2,0,0]=4 2804 B11R2.934 CC(C)OC1CC2CC2C1 e65f6a70e3071bb73e792e661c86e55b [0,1,0,1,0,0|1,0,1]=4 2805 B11R2.934 CC(C)OC1C[C@@H]2C[C@@H]2C1 007e1ddb41efc652a08fa1b8be4ca2f2 [0,1,0,1,0,0|1,0,1]=4 2806 B11R2.934 CC(C)O[C@@H]1C[C@@H]2C[C@@H]2C1 c48bc45c83be48403cb5e33120abf831 [0,1,0,1,0,0|1,0,1]=4 2807 B11R2.934 CC(C)O[C@H]1C[C@@H]2C[C@@H]2C1 ae008dc3513352211e69416859ed69bf [0,1,0,1,0,0|1,0,1]=4 2808 B11R2.934 NC(=O)CN1CC2CC2C1 b8287f861652f7008ce866b483810b51 [0,1,0,1,0,0|2,0,0]=4 2809 B11R2.934 O=C(O)CN1CC2CC2C1 3467b00848314b6822feff70d781421a [0,1,0,1,0,0|2,0,0]=4 2810 B11R2.1824 CC(=O)N1C2COCC1C2 ed66f8b6eadc42958e8cc3bafa6d0d5c [0,1,0,1,0,0|2,0,0]=4 2811 B11R2.1852 CC(=O)N1C2C1CCCC2 1ac38bd168268a7b023f716d059aa634 [0,1,0,1,0,0|1,0,0]=3 2812 B7R1.1 O=CN1CCSC1 deebe3649f7643e16cec43e0dece7683 [1,0,0,0,1,0|2,0,0]=4 2813 B7R1.6 CCOC1CCC1 1be1aa1621ba0b71d53802beb6ef9946 [0,0,0,0,2,0|1,0,1]=4 2814 B7R1.6 FCOC1CCC1 9e1f264b6931548d5472d7bf95e89d96 [0,0,0,0,2,0|1,0,1]=4 2815 B7R1.6 O=CCN1CCC1 c2093fa3a09c779905e30743087db6d6 [0,0,0,0,2,0|2,0,0]=4 2816 B7R1.6 O=CNC1COC1 910edb395eecbce8af210d974d8d054c [0,0,0,0,2,0|2,0,0]=4 2817 B11R1.117 CCOC1/C=C/CCCCC1 abf2246196c4ef31596e50aa932027ef [0,0,0,0,0,2|1,0,1]=4 2818 B11R1.117 CCOC1/C=C\CCCCC1 4423aca8181b7315cb102110ae25321b [0,0,0,0,0,2|1,0,1]=4 2819 B11R1.117 CCOC1C=CCCCCC1 4c0498546d74402c1ac2d3026b0d1471 [0,0,0,0,0,2|1,0,1]=4 2820 B11R1.117 CCOC1CC/C=C/CCC1 dfbedb66b3c9957dc849e0852c7e305d [0,0,0,0,0,2|1,0,1]=4 2821 B11R1.117 CCOC1CC/C=C\CCC1 63e275c4a61ab775429a8cd0245cc2d7 [0,0,0,0,0,2|1,0,1]=4 2822 B11R1.117 CCOC1CCC=CCCC1 80d261f8a890bfa74e09757eb2e73342 [0,0,0,0,0,2|1,0,1]=4 2823 B11R1.117 CCOC1CCCCCCC1 8de234ac4018711f0809089a1dbd7f4d [0,0,0,0,0,2|1,0,1]=4 2824 B11R1.117 CCO[C@@H]1CCC=CCCC1 855fa20408fc85ff54969a954670dd51 [0,0,0,0,0,2|1,0,1]=4 2825 B11R1.117 CCO[C@H]1/C=C/CCCCC1 35fa0159511dcaa848d796c12724494e [0,0,0,0,0,2|1,0,1]=4 2826 B11R1.117 CCO[C@H]1/C=C\CCCCC1 9faa883b1b12ae88d72c6724171fa26a [0,0,0,0,0,2|1,0,1]=4 2827 B11R1.117 FCOC1/C=C/CCCCC1 14e6a379d03c086a4ea82900e267a8df [0,0,0,0,0,2|1,0,1]=4 2828 B11R1.117 FCOC1/C=C\CCCCC1 a5f0fee61b6c3cb202ffcc81ce2db7df [0,0,0,0,0,2|1,0,1]=4 2829 B11R1.117 FCOC1C=CCCCCC1 d04bfe3f626e598505760b8fca8f78ee [0,0,0,0,0,2|1,0,1]=4 2830 B11R1.117 FCOC1CC/C=C/CCC1 b41b173749c56ed997a1bb899ca78efa [0,0,0,0,0,2|1,0,1]=4 2831 B11R1.117 FCOC1CC/C=C\CCC1 d76bf78db4e35de0840b2ddb6f4a7e39 [0,0,0,0,0,2|1,0,1]=4 2832 B11R1.117 FCOC1CCC=CCCC1 9293a6256dafa329fe1244def23a954f [0,0,0,0,0,2|1,0,1]=4 2833 B11R1.117 FCOC1CCCCCCC1 a2ade3c88ec76dedf0ca21d312063bec [0,0,0,0,0,2|1,0,1]=4 2834 B11R1.117 FCO[C@@H]1CCC=CCCC1 ea0ce7f75f17f873666c8628dd20d93d [0,0,0,0,0,2|1,0,1]=4 2835 B11R1.117 FCO[C@H]1/C=C/CCCCC1 5af450eb2c5d32e7478e75ab1b36caeb [0,0,0,0,0,2|1,0,1]=4 2836 B11R1.117 FCO[C@H]1/C=C\CCCCC1 b15eb6b9fe654cf0e1dfb511bf9a6797 [0,0,0,0,0,2|1,0,1]=4 2837 B11R1.117 O=CCN1CCCCCCC1 6fd1e0b32002f01aa833259ebd9f4b4e [0,0,0,0,0,2|2,0,0]=4 2838 B11R1.117 O=CNC1/C=C\CCCCC1 0a820374c9697ae84f9f2147b6caea46 [0,0,0,0,0,2|1,0,0]=3 2839 B11R1.117 O=CNC1CCCCCCC1 5c70e5da68cf4293563a7a3630027bae [0,0,0,0,0,2|1,0,0]=3