0 B9R0.2 C#CCCCCNC(=O)C 17a5fb310ae275da10c09cc8e56cb744 [0,0,0,0,0,0|2,0,2]=4 1 B9R0.2 C#CCCCNCC(=O)C 85b511946396328a4830c965f2348ae8 [0,0,0,0,0,0|2,0,2]=4 2 B9R0.2 C#CCCCNCC(=O)N 422b7eb983c8d6d4c6a758d9ab0f2df7 [0,0,0,0,0,0|2,0,2]=4 3 B9R0.2 C#CCCCNCC(=O)O 975c67599d89c29829229a46ede70bbb [0,0,0,0,0,0|1,0,2]=3 4 B9R0.2 C#CCCCOCC(=O)C de3c7e0bcdc679c333ea741fa094448e [0,0,0,0,0,0|2,0,2]=4 5 B9R0.2 C#CCCCOCC(=O)N 14a2f4968765ea6ed7f09f07a0b8db8d [0,0,0,0,0,0|2,0,2]=4 6 B9R0.2 C#CCCCOCC(=O)O 2f70653e4facc4c8d709313f8dc49158 [0,0,0,0,0,0|1,0,2]=3 7 B9R0.2 C#CCCCOCS(=O)O 29f2f36ea91b87fb43128c2c7982145c [0,0,0,0,0,0|2,0,2]=4 8 B9R0.2 C#CCCNCCC(=O)C b0de599e71706c38ab2308189ee5632b [0,0,0,0,0,0|2,0,2]=4 9 B9R0.2 C#CCCNCCC(=O)N 75d12e33ede0bd8f8903ae1ba5239d36 [0,0,0,0,0,0|2,0,2]=4 10 B9R0.2 C#CCCNCCC(=O)O f0943ce659e8236030e08bb793a8f150 [0,0,0,0,0,0|1,0,2]=3 11 B9R0.2 C#CCCNCCS(=O)O 66d714dc7d5862fe8cfea7f88734b5f1 [0,0,0,0,0,0|2,0,2]=4 12 B9R0.2 C#CCCOCCC(=O)C b8244bb9bfd056e8f9af77c283ea3633 [0,0,0,0,0,0|2,0,2]=4 13 B9R0.2 C#CCCOCCC(=O)N 3fb9e148bca1413b81a3d889789966a5 [0,0,0,0,0,0|2,0,2]=4 14 B9R0.2 C#CCCOCCC(=O)O 2c4ce5e28749673faf099da9626deea5 [0,0,0,0,0,0|1,0,2]=3 15 B9R0.2 C#CCNCCCC(=O)C fcdbd9383acaf798dc1d1cfe9c3fb1ec [0,0,0,0,0,0|2,0,2]=4 16 B9R0.2 C#CCNCCCC(=O)N e56db46af5c039e11cb1d1aa3b0634c7 [0,0,0,0,0,0|2,0,2]=4 17 B9R0.2 C#CCNCCCC(=O)O f5a7649eb03cadc3fa013b1b8dd09d6d [0,0,0,0,0,0|1,0,2]=3 18 B9R0.2 C#CCOCCCC(=O)C 262583a5c500c382f7e7a9ff6529f8ea [0,0,0,0,0,0|2,0,2]=4 19 B9R0.2 C#CCOCCCC(=O)N 7e37b09b4e6b21ea1d64ae2c91c7b976 [0,0,0,0,0,0|2,0,2]=4 20 B9R0.2 C/C=C/CCOCC(=O)N 1b4c278fa7da72d5ef7b5d74cc032b71 [0,0,0,0,0,0|2,0,2]=4 21 B9R0.2 C/C=C/CCOCC(=O)O d02eb75e5aadfb9961c8467e0504d028 [0,0,0,0,0,0|1,0,2]=3 22 B9R0.2 C/C=C/CNCCC(=O)N 2c66c5b06aebbc0554671340b76b821f [0,0,0,0,0,0|2,0,2]=4 23 B9R0.2 C/C=C/CNCCC(=O)O 320ccfadee70343ec534463874adee9c [0,0,0,0,0,0|1,0,2]=3 24 B9R0.2 C/C=C/CNCCS(=O)O d88302a45905a749b1c62df3b0b218da [0,0,0,0,0,0|2,0,2]=4 25 B9R0.2 C/C=C/COCCC(=O)C 858ea95d33d428d48407fa618083ad57 [0,0,0,0,0,0|2,0,2]=4 26 B9R0.2 C/C=C/COCCC(=O)N 9f1ef4b90fcdbe460fd864847b4fb003 [0,0,0,0,0,0|2,0,2]=4 27 B9R0.2 C/C=C/COCCC(=O)O de4483f9043c4323aa635f969181027c [0,0,0,0,0,0|1,0,2]=3 28 B9R0.2 C/C=C\CNCCC(=O)N d1ba06ad775bc882fa1fc61022310a26 [0,0,0,0,0,0|2,0,2]=4 29 B9R0.2 C/C=C\CNCCC(=O)O 3db27db0f3bf53817103cf733a337082 [0,0,0,0,0,0|1,0,2]=3 30 B9R0.2 C/C=C\CNCCS(=O)O b563b810dc1a25926eca1b23efe9707e [0,0,0,0,0,0|2,0,2]=4 31 B9R0.2 C/C=C\COCCC(=O)C 2a3ddac5ad4ddb2079c9ab12180deff2 [0,0,0,0,0,0|2,0,2]=4 32 B9R0.2 C/C=C\COCCC(=O)N 2f6e28aba292265c8dfbc55d4ac756f7 [0,0,0,0,0,0|2,0,2]=4 33 B9R0.2 C/C=C\COCCC(=O)O 77884cf4196c6ee578ac2dc56b34854b [0,0,0,0,0,0|1,0,2]=3 34 B9R0.2 C=C(Br)CCOCCCC 89aeee49c614e8b481f89262dbe440df [0,0,0,0,0,0|3,0,0]=3 35 B9R0.2 C=C(Br)CCOCCCF 08ac2e8fb91b2fcff0fda563b7ff8c56 [0,0,0,0,0,0|4,0,0]=4 36 B9R0.2 C=C(Br)CCOCCCS 61e491a5e045ff62deb7b9a7fa27f14e [0,0,0,0,0,0|4,0,0]=4 37 B9R0.2 C=C(Br)CCOCCOC a62c141e23f02e0dd3bd90886ea4c3c3 [0,0,0,0,0,0|4,0,0]=4 38 B9R0.2 C=C(Br)CCOCCSC 650adca430c56802c92cbb8dffeb10d2 [0,0,0,0,0,0|4,0,0]=4 39 B9R0.2 C=C(Br)CCOCOCC 9c266a169a6b731fe0e057eb8001d1f9 [0,0,0,0,0,0|4,0,0]=4 40 B9R0.2 C=C(Br)CNCCCCC d279768b5fdacaf2cda306ea756513dc [0,0,0,0,0,0|3,0,0]=3 41 B9R0.2 C=C(Br)CNCCCCCl 18e13d7050df2748c836843a207af4ab [0,0,0,0,0,0|4,0,0]=4 42 B9R0.2 C=C(Br)CNCCCCF 4fb3ccb693b8922bcc63a8e789f9407a [0,0,0,0,0,0|4,0,0]=4 43 B9R0.2 C=C(Br)CNCCCCO bcd7c7ee8dbd41f45c793181bbb5dc30 [0,0,0,0,0,0|4,0,0]=4 44 B9R0.2 C=C(Br)CNCCCCS 78f752f2c9899306dfd1d9f8ef8758fa [0,0,0,0,0,0|4,0,0]=4 45 B9R0.2 C=C(Br)CNCCCOC 9bf06ff187261bfc3f96278cfc538940 [0,0,0,0,0,0|4,0,0]=4 46 B9R0.2 C=C(Br)CNCCCSC 5bf91a1989c4567d484796b7ee4ab621 [0,0,0,0,0,0|4,0,0]=4 47 B9R0.2 C=C(Br)CNCCOCC 5cfec76638e46e12a20fb02de3362a4a [0,0,0,0,0,0|4,0,0]=4 48 B9R0.2 C=C(Br)CNCCSCC f9bba534ed4213216e82dd22ca5c021b [0,0,0,0,0,0|4,0,0]=4 49 B9R0.2 C=C(Br)COCCCCC d3362ef2dbe291c29da898c0e2060a14 [0,0,0,0,0,0|3,0,0]=3 50 B9R0.2 C=C(Br)COCCCCF cd90ef163e98b46dcbf73fd6b66f406e [0,0,0,0,0,0|4,0,0]=4 51 B9R0.2 C=C(Br)COCCCCS 6f8de5642f894539d555799ccbdcc37d [0,0,0,0,0,0|4,0,0]=4 52 B9R0.2 C=C(Br)COCCCOC cd22307043a4a4b2f52da469ae9be5f1 [0,0,0,0,0,0|4,0,0]=4 53 B9R0.2 C=C(Br)COCCCSC c0fa526ed600ecc0d780c699bd6db040 [0,0,0,0,0,0|4,0,0]=4 54 B9R0.2 C=C(Br)COCCOCC 499fdf490c6b0aa16a42dc6262ffdd3a [0,0,0,0,0,0|4,0,0]=4 55 B9R0.2 C=C(Br)COCCSCC 36301ec92908db3abda4d03a8faccc8e [0,0,0,0,0,0|4,0,0]=4 56 B9R0.2 C=C(C)CCCNCCBr 8986ff0e04952bb90f74c67731a75fd2 [0,0,0,0,0,0|4,0,0]=4 57 B9R0.2 C=C(C)CCCNCCC c3cac283cbd12fbf0ac91ae77d2206d5 [0,0,0,0,0,0|3,0,0]=3 58 B9R0.2 C=C(C)CCCNCCF d3c4c55543f36bd3903e059501c3d001 [0,0,0,0,0,0|4,0,0]=4 59 B9R0.2 C=C(C)CCCNCCI 184729b900abd96b8560210fbdea6404 [0,0,0,0,0,0|4,0,0]=4 60 B9R0.2 C=C(C)CCCNCCO 72fb4abcfc8c2de4dbf836b0a286d07d [0,0,0,0,0,0|4,0,0]=4 61 B9R0.2 C=C(C)CCCNCCS 14d4198a01b6e03d3a77d8b021a66905 [0,0,0,0,0,0|4,0,0]=4 62 B9R0.2 C=C(C)CCCOCCC 4f69b68cc6888e5abf6b0488c9a109cb [0,0,0,0,0,0|3,0,0]=3 63 B9R0.2 C=C(C)CCCOCCF 76308bdaa6e0eb46160468a356d7a021 [0,0,0,0,0,0|4,0,0]=4 64 B9R0.2 C=C(C)CCCOCCS a710447b0c92193b6683bcf667e183ab [0,0,0,0,0,0|4,0,0]=4 65 B9R0.2 C=C(C)CCCOCOC 53d906b0b2c23661dc9c041465ee2d83 [0,0,0,0,0,0|4,0,0]=4 66 B9R0.2 C=C(C)CCCOCSC 9ff01b72a38ffef747abe164c40eb460 [0,0,0,0,0,0|4,0,0]=4 67 B9R0.2 C=C(C)CCNCCCC 09dea3d5646408c299eb2754a1e1c1cd [0,0,0,0,0,0|3,0,0]=3 68 B9R0.2 C=C(C)CCNCCCCl 19de048ac51673d3aaa6bc3af0aa5d9d [0,0,0,0,0,0|4,0,0]=4 69 B9R0.2 C=C(C)CCNCCCF 2f6cde27e0b18a81893366038308fdcc [0,0,0,0,0,0|4,0,0]=4 70 B9R0.2 C=C(C)CCNCCCO 237e934407e2f80895a50d460e0c174d [0,0,0,0,0,0|4,0,0]=4 71 B9R0.2 C=C(C)CCNCCCS 4635bf0b3492075a5f5d59b65999782e [0,0,0,0,0,0|4,0,0]=4 72 B9R0.2 C=C(C)CCNCCOC aa8a0a94c006c73f923a51cdae3f1f8e [0,0,0,0,0,0|4,0,0]=4 73 B9R0.2 C=C(C)CCNCCSC d4578dbebf7d4724205bf99fa2f9ba72 [0,0,0,0,0,0|4,0,0]=4 74 B9R0.2 C=C(C)CCNCOCC f4de9c2329a0a38ab41bb7a5ba8afe05 [0,0,0,0,0,0|4,0,0]=4 75 B9R0.2 C=C(C)CCOCCCC 43e61bb8669727040bdbd33fc265d7ab [0,0,0,0,0,0|3,0,0]=3 76 B9R0.2 C=C(C)CCOCCCF 4f05183773f76ad70187bfb2b5db2add [0,0,0,0,0,0|4,0,0]=4 77 B9R0.2 C=C(C)CCOCCCS 54edad4905aa6a90dd74a875f3b8580c [0,0,0,0,0,0|4,0,0]=4 78 B9R0.2 C=C(C)CCOCCOC 67bd7d77bcb9250ea71c8a04c5abf232 [0,0,0,0,0,0|4,0,0]=4 79 B9R0.2 C=C(C)CCOCCSC 2419d01dab7f58e2ba353b19229cf906 [0,0,0,0,0,0|4,0,0]=4 80 B9R0.2 C=C(C)CCOCOCC 8f670049fe2e01cc3448c7e08491639e [0,0,0,0,0,0|4,0,0]=4 81 B9R0.2 C=C(C)CNCCCCC 1fe982b20ee6c93d1b92220bddb7f573 [0,0,0,0,0,0|3,0,0]=3 82 B9R0.2 C=C(C)CNCCCCCl b17281cb04bf565fb5b282dcd6071adf [0,0,0,0,0,0|4,0,0]=4 83 B9R0.2 C=C(C)CNCCCCF a4723fc738cce1ba2188e74635f5f9ae [0,0,0,0,0,0|4,0,0]=4 84 B9R0.2 C=C(C)CNCCCCO f295044566a501ed18f2fadfcbe93198 [0,0,0,0,0,0|4,0,0]=4 85 B9R0.2 C=C(C)CNCCCCS 1bb6b0faba82bc9dfa9cf2626a5de19e [0,0,0,0,0,0|4,0,0]=4 86 B9R0.2 C=C(C)CNCCCOC 0ac9088df74f601b70445d799c91be29 [0,0,0,0,0,0|4,0,0]=4 87 B9R0.2 C=C(C)CNCCCSC fd251088811ac4fee5625d3fe27b3427 [0,0,0,0,0,0|4,0,0]=4 88 B9R0.2 C=C(C)CNCCOCC 84c994c2359feab13720c16b66645287 [0,0,0,0,0,0|4,0,0]=4 89 B9R0.2 C=C(C)CNCCSCC fd8e3fc32786755a703764fd326a09da [0,0,0,0,0,0|4,0,0]=4 90 B9R0.2 C=C(C)COCCCCC a29929c8df945f31fba1ca688247acb0 [0,0,0,0,0,0|3,0,0]=3 91 B9R0.2 C=C(C)COCCCCF cf601ba6ef881d7ca1cf3f8cbe7608cb [0,0,0,0,0,0|4,0,0]=4 92 B9R0.2 C=C(C)COCCCCS 8620ff2b2c37e1b6d86f0c7727ba02cb [0,0,0,0,0,0|4,0,0]=4 93 B9R0.2 C=C(C)COCCCOC 2997bb7f8cda230019814f31b39c3495 [0,0,0,0,0,0|4,0,0]=4 94 B9R0.2 C=C(C)COCCCSC b8eaf779a617118d20a8c289148d24b7 [0,0,0,0,0,0|4,0,0]=4 95 B9R0.2 C=C(C)COCCOCC 49014f9a0948543aa38cd68db94b7916 [0,0,0,0,0,0|4,0,0]=4 96 B9R0.2 C=C(C)COCCSCC a78c536cb05957de27781c26ce16a376 [0,0,0,0,0,0|4,0,0]=4 97 B9R0.2 C=C(Cl)CNCCCCC 3426772373d2ee591d1567d95131ca5d [0,0,0,0,0,0|3,0,0]=3 98 B9R0.2 C=C(Cl)CNCCCCCl 07d951ac778f280fac6fa78677e22fc7 [0,0,0,0,0,0|4,0,0]=4 99 B9R0.2 C=C(Cl)CNCCCCO 9c5f92be763dae29ee5d1791e269975f [0,0,0,0,0,0|4,0,0]=4 100 B9R0.2 C=C(Cl)CNCCCCS 02c74a8e001567183ed97baf601b4796 [0,0,0,0,0,0|4,0,0]=4 101 B9R0.2 C=C(Cl)CNCCCOC b8e59472c0f665132bf0a12e4a413af7 [0,0,0,0,0,0|4,0,0]=4 102 B9R0.2 C=C(Cl)CNCCCSC 23413e5771406c085cf6dab86d815e15 [0,0,0,0,0,0|4,0,0]=4 103 B9R0.2 C=C(Cl)CNCCOCC 4f632e57b8f73797a4aba49f5bf9dc84 [0,0,0,0,0,0|4,0,0]=4 104 B9R0.2 C=C(Cl)CNCCSCC be34d3775f82bf388f4072c95a735932 [0,0,0,0,0,0|4,0,0]=4 105 B9R0.2 C=C(Cl)COCCCCC 57ce6103051dc6a3f88df4c556cae1cb [0,0,0,0,0,0|3,0,0]=3 106 B9R0.2 C=C(Cl)COCCCCF 567382900af5cdbe29a16c2ad078542b [0,0,0,0,0,0|4,0,0]=4 107 B9R0.2 C=C(Cl)COCCCCS 6d2e486e1ec1a305effa235ddd5681b2 [0,0,0,0,0,0|4,0,0]=4 108 B9R0.2 C=C(Cl)COCCCOC a468fb93755d9f5366e10bd900631531 [0,0,0,0,0,0|4,0,0]=4 109 B9R0.2 C=C(Cl)COCCCSC 9f18158a03f253996639947f3c3e438f [0,0,0,0,0,0|4,0,0]=4 110 B9R0.2 C=C(Cl)COCCOCC 421cc8d91a44a370d0764c174fc7914a [0,0,0,0,0,0|4,0,0]=4 111 B9R0.2 C=C(Cl)COCCSCC d345fb4a323db8f45f6ac36761aa1ebe [0,0,0,0,0,0|4,0,0]=4 112 B9R0.2 C=C(F)CNCCCCCl 761bebe0832055a65e98ed281f773c78 [0,0,0,0,0,0|4,0,0]=4 113 B9R0.2 C=C(F)CNCCCCO cb7a959baa54bf2f113c6a0aefb6408c [0,0,0,0,0,0|4,0,0]=4 114 B9R0.2 C=C(F)CNCCCSC df38254f0fa48a87c14ccc1978436327 [0,0,0,0,0,0|4,0,0]=4 115 B9R0.2 C=C(F)CNCCSCC 46da77e19d87bd39cb815986f8047e75 [0,0,0,0,0,0|4,0,0]=4 116 B9R0.2 C=C(F)COCCCCC 0f55d43253501cd8e5c46108728cd273 [0,0,0,0,0,0|3,0,0]=3 117 B9R0.2 C=C(F)COCCCCF d33e0990d3dfe90fd10847ec2a6c2d5d [0,0,0,0,0,0|4,0,0]=4 118 B9R0.2 C=C(F)COCCCCS 4b1e094f2ade4de23dfea50a3fbd3605 [0,0,0,0,0,0|4,0,0]=4 119 B9R0.2 C=C(F)COCCCOC 099ba9b5ad1513a7e3cbef2be9d1fdac [0,0,0,0,0,0|4,0,0]=4 120 B9R0.2 C=C(F)COCCCSC 3774eb63bb00bd17a7135027babe2992 [0,0,0,0,0,0|4,0,0]=4 121 B9R0.2 C=C(F)COCCOCC ad422a2bc0564566d990a9adfdecaac6 [0,0,0,0,0,0|4,0,0]=4 122 B9R0.2 C=C(F)COCCSCC bbd04362f0872b5ceba8a7a42c56bfb4 [0,0,0,0,0,0|4,0,0]=4 123 B9R0.2 C=C(I)COCCCCC c852b2428fca73d35ed637c77ee2c36e [0,0,0,0,0,0|3,0,0]=3 124 B9R0.2 C=C(I)COCCCCF 08ab89f0db0ad370ac41c4b15db42cba [0,0,0,0,0,0|4,0,0]=4 125 B9R0.2 C=C(I)COCCCOC 369b68cc758a31d752e1dc56f8ee0af7 [0,0,0,0,0,0|4,0,0]=4 126 B9R0.2 C=C(I)COCCCSC 5d0c97ba36352d4811d8649d537df4d6 [0,0,0,0,0,0|4,0,0]=4 127 B9R0.2 C=C(I)COCCOCC 0b5afc65e1ebe418868266904d39aa3a [0,0,0,0,0,0|4,0,0]=4 128 B9R0.2 C=C(I)COCCSCC e5211c118d8c61788b0570d5ad93a21c [0,0,0,0,0,0|4,0,0]=4 129 B9R0.2 C=C=CCCOCC(=O)O 3d2f778bfede470814833932641b8dd6 [0,0,0,0,0,0|1,0,3]=4 130 B9R0.2 C=CCCCCNC(=O)C e363a045dea279ada86c2460a8f9bcff [0,0,0,0,0,0|2,0,2]=4 131 B9R0.2 C=CCCCNCC(=O)C 6f9860b69421ae53f4aa8aab3f88206c [0,0,0,0,0,0|2,0,2]=4 132 B9R0.2 C=CCCCNCC(=O)N 8c050bcb16397c545676f8ccaf3ff612 [0,0,0,0,0,0|2,0,2]=4 133 B9R0.2 C=CCCCNCC(=O)O a6a74f703c15b040a944f1de5b7b31dd [0,0,0,0,0,0|1,0,2]=3 134 B9R0.2 C=CCCCOCC(=O)C d117c37583b469359d4bb73ae405c58e [0,0,0,0,0,0|2,0,2]=4 135 B9R0.2 C=CCCCOCC(=O)N a71db548756a9d786302c30982c036e5 [0,0,0,0,0,0|2,0,2]=4 136 B9R0.2 C=CCCCOCC(=O)O 1c361a5699eb9366896dc4e13da269f8 [0,0,0,0,0,0|1,0,2]=3 137 B9R0.2 C=CCCCOCS(=O)O c9d562aa38377771bc1c2a1e6304d1e4 [0,0,0,0,0,0|2,0,2]=4 138 B9R0.2 C=CCCNCCC(=O)C 931becbc31ffa1a17243333f7bced09b [0,0,0,0,0,0|2,0,2]=4 139 B9R0.2 C=CCCNCCC(=O)N 185ea1dfba44894df83c1b20bfe59e67 [0,0,0,0,0,0|2,0,2]=4 140 B9R0.2 C=CCCNCCC(=O)O 6eb4f7dd1144c7fedf5fea8b2859a1ee [0,0,0,0,0,0|1,0,2]=3 141 B9R0.2 C=CCCNCCS(=O)O d396b92b845845b863daeac25bb9a091 [0,0,0,0,0,0|2,0,2]=4 142 B9R0.2 C=CCCOCCC(=O)C 132546dab84893072980505fc0c16835 [0,0,0,0,0,0|2,0,2]=4 143 B9R0.2 C=CCCOCCC(=O)N aee188e7bbb14f2cdec6e6f3ddb9e064 [0,0,0,0,0,0|2,0,2]=4 144 B9R0.2 C=CCCOCCC(=O)O 4d70a4bce8840eff55803b219a083b32 [0,0,0,0,0,0|1,0,2]=3 145 B9R0.2 C=CCNCCCC(=O)N d7d54590933421a302fe06ba923c08bd [0,0,0,0,0,0|2,0,2]=4 146 B9R0.2 C=CCNCCCC(=O)O 524c2ab7faae5f35e54c1740aff30774 [0,0,0,0,0,0|1,0,2]=3 147 B9R0.2 C=CCOCCCC(=O)C 7c50ee2dd017285f672ea091a47723d2 [0,0,0,0,0,0|2,0,2]=4 148 B9R0.2 C=CCOCCCC(=O)N c9f1b7b97de59f816cade2621052d370 [0,0,0,0,0,0|2,0,2]=4 149 B9R0.2 C=COCCNCC(=O)O 8e73f67ff3897e4f73503772783dce81 [0,0,0,0,0,0|2,0,2]=4 150 B9R0.2 C=COCCOCC(=O)O 811f84f15057d7b4da539ff618db8abc [0,0,0,0,0,0|2,0,2]=4 151 B9R0.2 CC#CCCOCC(=O)N bc9abb0a0ba18b9bab73788c80785feb [0,0,0,0,0,0|2,0,2]=4 152 B9R0.2 CC#CCCOCC(=O)O ee60ee9c54d89ce6a41b3081a53bfa26 [0,0,0,0,0,0|1,0,2]=3 153 B9R0.2 CC#CCNCCC(=O)C f3d87c769e5454e79e92da2d21a3cce6 [0,0,0,0,0,0|2,0,2]=4 154 B9R0.2 CC#CCNCCC(=O)N ebcbe67b7bd6348e345cddf9035f7f51 [0,0,0,0,0,0|2,0,2]=4 155 B9R0.2 CC#CCNCCC(=O)O 131bf136c72ef6e324723e1b324707ae [0,0,0,0,0,0|1,0,2]=3 156 B9R0.2 CC#CCOCCC(=O)C e76a7e30c29f6f089c48b0c3f868f2dc [0,0,0,0,0,0|2,0,2]=4 157 B9R0.2 CC#CCOCCC(=O)N df127a1b63c7f132a7dbab5c374a339f [0,0,0,0,0,0|2,0,2]=4 158 B9R0.2 CC#CCOCCC(=O)O 5ac07d6c3659090ccf8b4b71d487a81f [0,0,0,0,0,0|1,0,2]=3 159 B9R0.2 CC(=O)CCCCNC#N b99e4a4b37bc351dc1ba90cb4e87757b [0,0,0,0,0,0|3,0,1]=4 160 B9R0.2 CC(=O)CCCCOCF 0d33928de36c1d78d8eec5a2c9d669de [0,0,0,0,0,0|3,0,0]=3 161 B9R0.2 CC(=O)CCCNCC#N ff3d6d942589238537f722daefbf213d [0,0,0,0,0,0|3,0,1]=4 162 B9R0.2 CC(=O)CCCNCCBr 1e005c174e2bef64faf35d14b6a15eea [0,0,0,0,0,0|3,0,0]=3 163 B9R0.2 CC(=O)CCCNCCF 9a338bc1bad25f0148e24f3766691141 [0,0,0,0,0,0|3,0,0]=3 164 B9R0.2 CC(=O)CCCNCCI af38eb95e88d6a5b58dd1b2dbaca4ac4 [0,0,0,0,0,0|3,0,0]=3 165 B9R0.2 CC(=O)CCCNCCO 047c4ea1e2699a309316392bf693b2f3 [0,0,0,0,0,0|3,0,0]=3 166 B9R0.2 CC(=O)CCCNCCS e726854461e235aec0dd95b143ec9df5 [0,0,0,0,0,0|3,0,0]=3 167 B9R0.2 CC(=O)CCCOCC#N caf3bb89150326b8ed85d677acf64490 [0,0,0,0,0,0|3,0,1]=4 168 B9R0.2 CC(=O)CCCOCC=O 7ff95c1b28ea07d48ab7c219ca5a33c9 [0,0,0,0,0,0|3,0,1]=4 169 B9R0.2 CC(=O)CCCOCCF 8be6dab59aed4b188d6918cf109dee02 [0,0,0,0,0,0|3,0,0]=3 170 B9R0.2 CC(=O)CCCOCCS 3982bfab81dc2189a86b86f7de9c7da1 [0,0,0,0,0,0|3,0,0]=3 171 B9R0.2 CC(=O)CCNCCC#N c31cd27b094f002c29d8712160ff7749 [0,0,0,0,0,0|3,0,1]=4 172 B9R0.2 CC(=O)CCNCCCCl 32ce94381c16df5d46d44616cf0bee6a [0,0,0,0,0,0|3,0,0]=3 173 B9R0.2 CC(=O)CCNCCCO 41ab0e7b58a0373c2b6f1dd023df8651 [0,0,0,0,0,0|3,0,0]=3 174 B9R0.2 CC(=O)CCNCCON 9bd97024ba9f3f633d947f18f3f9b348 [0,0,0,0,0,0|4,0,0]=4 175 B9R0.2 CC(=O)CCOCCC#N abcf2575f82c8fd6a857dd87387e2243 [0,0,0,0,0,0|3,0,1]=4 176 B9R0.2 CC(=O)CCOCCC=O 9224f481da653bff9a4e2ad03dac676e [0,0,0,0,0,0|3,0,1]=4 177 B9R0.2 CC(=O)CCOCCCF a3645cce14ff471e4950eb3d53ebfd63 [0,0,0,0,0,0|3,0,0]=3 178 B9R0.2 CC(=O)CCOCCCS 810c89f99c573084959f96ce51de3f91 [0,0,0,0,0,0|3,0,0]=3 179 B9R0.2 CC(=O)CNCCCC#N 05b19c126e792c52758658329df9a7a5 [0,0,0,0,0,0|3,0,1]=4 180 B9R0.2 CC(=O)CNCCCC=O 026ef0e39501edf9371f673edca5b759 [0,0,0,0,0,0|3,0,1]=4 181 B9R0.2 CC(=O)CNCCCCF 43ea4e8083d24c4c3ef19587abf733a4 [0,0,0,0,0,0|3,0,0]=3 182 B9R0.2 CC(=O)CNCCCCO 96082e5297f4b4820c770800699f2247 [0,0,0,0,0,0|3,0,0]=3 183 B9R0.2 CC(=O)COCCCC#N fa01b7de97b1d6402f22396109ad9d8d [0,0,0,0,0,0|3,0,1]=4 184 B9R0.2 CC(=O)COCCCC=O 0d2ce7c0ebccca7ce340f634fa8c3eb5 [0,0,0,0,0,0|3,0,1]=4 185 B9R0.2 CC(=O)COCCCCF 3914679278dfa87c5ec7633c52c8c323 [0,0,0,0,0,0|3,0,0]=3 186 B9R0.2 CC(=O)NCCCCC#N 480c9a37c58edee24bbae98d4ead4810 [0,0,0,0,0,0|3,0,1]=4 187 B9R0.2 CC(=O)NCCCCCCl 9810fdb3b44bef22ae3578265fbb7e47 [0,0,0,0,0,0|3,0,0]=3 188 B9R0.2 CC(=O)NCCCCCO 6528e540cd36869e25e869b54ef6b7c3 [0,0,0,0,0,0|3,0,0]=3 189 B9R0.2 CC(=O)NCCCNCF 62bca42e02ab81a45e4ff0c6351abf93 [0,0,0,0,0,0|4,0,0]=4 190 B9R0.2 CC(=O)NCCCNCO 328911bf7c359f53194dbd7fe75621ee [0,0,0,0,0,0|4,0,0]=4 191 B9R0.2 CC(=O)NCCCOCF d7af484a45d939e567ed9be2fdfcef29 [0,0,0,0,0,0|4,0,0]=4 192 B9R0.2 CC(=O)NCCNCCBr 0bc3c8d5066d4aa33943e4b0857cf6c6 [0,0,0,0,0,0|4,0,0]=4 193 B9R0.2 CC(=O)NCCNCCF e5a148d466ee8bdd46e3f53193cd7c0f [0,0,0,0,0,0|4,0,0]=4 194 B9R0.2 CC(=O)NCCNCCI 0d9e6b7a4537c1ae78381a1cc3fc3767 [0,0,0,0,0,0|4,0,0]=4 195 B9R0.2 CC(=O)NCCNCCO bfd2a90f03ebdd248fdc140ab742c195 [0,0,0,0,0,0|4,0,0]=4 196 B9R0.2 CC(=O)NCCNCCS 6c81a4371e671e42fa414011bb868b73 [0,0,0,0,0,0|4,0,0]=4 197 B9R0.2 CC(=O)NCCOCCF 0973cce223af140d06d4871f0bda3943 [0,0,0,0,0,0|4,0,0]=4 198 B9R0.2 CC(=O)NCCOCCO 57d4166bc7f64eeb4fe6b2614e2e763f [0,0,0,0,0,0|4,0,0]=4 199 B9R0.2 CC(=O)NCCOCCS fc352a6fdb39855a43a3d0ad8c15f379 [0,0,0,0,0,0|4,0,0]=4 200 B9R0.2 CC(=O)NCCSCCO 0bd987c0ecd20e315a5e853d68c36be8 [0,0,0,0,0,0|4,0,0]=4 201 B9R0.2 CC(=O)NCOCCCF deaf5b1d0ef27ef962c2ca811a35a90c [0,0,0,0,0,0|4,0,0]=4 202 B9R0.2 CC(=O)NCOCCCS d023d019387fabb31bb318524e9f4455 [0,0,0,0,0,0|4,0,0]=4 203 B9R0.2 CC(=O)OCCCOCF 839300b4a23ae7f13d770824ad5ba603 [0,0,0,0,0,0|4,0,0]=4 204 B9R0.2 CC(=O)OCCNCCBr 86e70651e2ef68f3f2552b68c9fd9535 [0,0,0,0,0,0|4,0,0]=4 205 B9R0.2 CC(=O)OCCNCCF bec963d44f70641aefa68f79b9e9f243 [0,0,0,0,0,0|4,0,0]=4 206 B9R0.2 CC(=O)OCCNCCI 512fc7b78f65a98aaa9b5a24a55dd29e [0,0,0,0,0,0|4,0,0]=4 207 B9R0.2 CC(=O)OCCNCCO fbc6a9b22162aa146956efcd3fed83de [0,0,0,0,0,0|4,0,0]=4 208 B9R0.2 CC(=O)OCCNCCS 0d342b6bb6a97266d2b38620542a908c [0,0,0,0,0,0|4,0,0]=4 209 B9R0.2 CC(=O)OCCOCCF 5233cd269967a92f3e4bf92bf7bbcb9d [0,0,0,0,0,0|4,0,0]=4 210 B9R0.2 CC(=O)OCCOCCS 63ea2c4adc5d14c13c2d8bc53161cf6c [0,0,0,0,0,0|4,0,0]=4 211 B9R0.2 CC(=O)OCNCCCCl 4c34a9d20da691b9859482fc9219ac0e [0,0,0,0,0,0|4,0,0]=4 212 B9R0.2 CC(=O)OCNCCCO 89aaf0a95b5cea62d4321235936deeff [0,0,0,0,0,0|4,0,0]=4 213 B9R0.2 CC(=O)OCOCCCF 2bfb3b9762b06c6017d0cd676ab47db2 [0,0,0,0,0,0|4,0,0]=4 214 B9R0.2 CC(=O)OCOCCCS 3586e68ace2929307ff5b4a00f63eae7 [0,0,0,0,0,0|4,0,0]=4 215 B9R0.2 CC(=O)SCCCOCF ecb8a4614547fadbca0fb1f1162b5bb0 [0,0,0,0,0,0|4,0,0]=4 216 B9R0.2 CC(=O)SCCNCCBr 28247f14417b5defeb7e6bdd7dd5021d [0,0,0,0,0,0|4,0,0]=4 217 B9R0.2 CC(=O)SCCNCCF 835856e3f2db7662391fc6484f38c8cb [0,0,0,0,0,0|4,0,0]=4 218 B9R0.2 CC(=O)SCCNCCI fcdbc2d86c2b5cb0212add9d1e2bb2ea [0,0,0,0,0,0|4,0,0]=4 219 B9R0.2 CC(=O)SCCNCCO f793beb03d64f0dfcb25ac2a3004ffc4 [0,0,0,0,0,0|4,0,0]=4 220 B9R0.2 CC(=O)SCCNCCS a8b4ffd28b3fdb169094ab15c01c2bf5 [0,0,0,0,0,0|4,0,0]=4 221 B9R0.2 CC(=O)SCCOCCF 97f7396d15109ed2126bfd23c7da33fa [0,0,0,0,0,0|4,0,0]=4 222 B9R0.2 CC(=O)SCCOCCS 749ecc917cc404f091b4a3e262baed35 [0,0,0,0,0,0|4,0,0]=4 223 B9R0.2 CC(O)CCCNCCBr 846a80d7bd351c20925246d05170fa0a [0,0,0,0,0,0|3,0,1]=4 224 B9R0.2 CC(O)CCCNCCF c8e3887a2439ccb3592fe170015fe6da [0,0,0,0,0,0|3,0,1]=4 225 B9R0.2 CC(O)CCCNCCI d049963d4683c730c11fc2ac87702d47 [0,0,0,0,0,0|3,0,1]=4 226 B9R0.2 CC(O)CCCNCCO 0303877d92750e8a64756316fc4bb9e6 [0,0,0,0,0,0|3,0,1]=4 227 B9R0.2 CC(O)CCCNCCS c6438b2d80c9f6ff85d85ecf0e281737 [0,0,0,0,0,0|3,0,1]=4 228 B9R0.2 CC(O)CCNCCCCl 0a32bed6279f094ef9401ca250c5ffa2 [0,0,0,0,0,0|3,0,1]=4 229 B9R0.2 CC(O)CCNCCCF 9569faec1da967f7c66c5e0a60d104de [0,0,0,0,0,0|3,0,1]=4 230 B9R0.2 CC(O)CCNCCCO 87acb0957134460d35e20a94643a56a5 [0,0,0,0,0,0|3,0,1]=4 231 B9R0.2 CC(O)CCNCCCS c89ad0b413e9833571309ce26aa67448 [0,0,0,0,0,0|3,0,1]=4 232 B9R0.2 CC(O)CNCCCCCl 65186c06faac50c9aeb9e91831d3a163 [0,0,0,0,0,0|3,0,1]=4 233 B9R0.2 CC(O)CNCCCCF b87c1fb327b802173c8612462c330132 [0,0,0,0,0,0|3,0,1]=4 234 B9R0.2 CC(O)CNCCCCO ce2dc7373bb7b816c2a9a5d12a2b9a76 [0,0,0,0,0,0|3,0,1]=4 235 B9R0.2 CC(O)CNCCCCS 730d016fdad462f5c9daec1e7d2aec50 [0,0,0,0,0,0|3,0,1]=4 236 B9R0.2 CC/C=C/CNCC(=O)C bb03016005aff92d60de25a5fb2dde7e [0,0,0,0,0,0|2,0,2]=4 237 B9R0.2 CC/C=C/CNCC(=O)N 48059c8d89eacab83d2ef80706455f01 [0,0,0,0,0,0|2,0,2]=4 238 B9R0.2 CC/C=C/CNCC(=O)O 608fca61d210069d4fe6cf3ba8d9b082 [0,0,0,0,0,0|1,0,2]=3 239 B9R0.2 CC/C=C/COCC(=O)C 5aaebc977bb6e5ae3b7dabe2f590edd8 [0,0,0,0,0,0|2,0,2]=4 240 B9R0.2 CC/C=C/COCC(=O)N 713c914f23ecec665a855260c3f6940a [0,0,0,0,0,0|2,0,2]=4 241 B9R0.2 CC/C=C/COCC(=O)O 47aadf9bd1a62be7751b0a2fca80ef8b [0,0,0,0,0,0|1,0,2]=3 242 B9R0.2 CC/C=C/COCS(=O)O b0cb372b04d2defa6fc2884893f1c842 [0,0,0,0,0,0|2,0,2]=4 243 B9R0.2 CC/C=C\COCC(=O)N 52f4757b5a31ccc4a1fcfe8b24404167 [0,0,0,0,0,0|2,0,2]=4 244 B9R0.2 CC/C=C\COCC(=O)O 21a75a85140d898476b2fb3f38c071e1 [0,0,0,0,0,0|1,0,2]=3 245 B9R0.2 CC=CCNCCC(=O)C 35fd160582ff98ad73df55f025e71a01 [0,0,0,0,0,0|2,0,2]=4 246 B9R0.2 CC=CCNCCC(=O)N cf9f0a2d0106defcb5146d803c4dc168 [0,0,0,0,0,0|2,0,2]=4 247 B9R0.2 CC=CCNCCC(=O)O 5c13e7fcfabbe27240aa9f1486a09b86 [0,0,0,0,0,0|1,0,2]=3 248 B9R0.2 CC=CCOCCC(=O)C 443b60d752a4c425d5fcb35df4bd4e1f [0,0,0,0,0,0|2,0,2]=4 249 B9R0.2 CC=CCOCCC(=O)N d78c99ebbe8ef49cc4ff16be18b2d3f9 [0,0,0,0,0,0|2,0,2]=4 250 B9R0.2 CC=CCOCCC(=O)O 34847ee459642c229d44db8cb0176d10 [0,0,0,0,0,0|1,0,2]=3 251 B9R0.2 CCC#CCNCC(=O)N 65e479d571798659f338d6f6230f5711 [0,0,0,0,0,0|2,0,2]=4 252 B9R0.2 CCC#CCOCC(=O)N d2629aaab215be83b0539498e1c6b9ae [0,0,0,0,0,0|2,0,2]=4 253 B9R0.2 CCC#CCOCC(=O)O abd394d0e091b202a9408b79384836eb [0,0,0,0,0,0|1,0,2]=3 254 B9R0.2 CCCCCCNC(=O)C 39216d9115deaeddca0efb3bbde5d8cb [0,0,0,0,0,0|2,0,0]=2 255 B9R0.2 CCCCCCNC(C)C b4470bdb41ca94cf2ace2a9a22274307 [0,0,0,0,0,0|3,0,1]=4 256 B9R0.2 CCCCCCOC(C)C 7177762ff96f664d7658fbf17ddec082 [0,0,0,0,0,0|3,0,1]=4 257 B9R0.2 CCCCCNCC(=O)C 08234591298ac478e9a5e187e3c7cd4f [0,0,0,0,0,0|2,0,0]=2 258 B9R0.2 CCCCCNCC(=O)N df1b9e1446c7d44676f292e2874ccd31 [0,0,0,0,0,0|2,0,0]=2 259 B9R0.2 CCCCCNCC(=O)O 50016d51731d942cf0c89f16645029e7 [0,0,0,0,0,0|1,0,0]=1 260 B9R0.2 CCCCCNCC(C)C 2a266c7fc85c9a2097a02175858c3e33 [0,0,0,0,0,0|3,0,1]=4 261 B9R0.2 CCCCCNCC(C)O 9e9132e8083003550d3545b55a454f7b [0,0,0,0,0,0|2,0,1]=3 262 B9R0.2 CCCCCNCC(F)F 546ed23aa626cb81583b04244998e9ea [0,0,0,0,0,0|3,0,1]=4 263 B9R0.2 CCCCCNCN(C)C cc00a7884694b92aef8507ef5e7e7b05 [0,0,0,0,0,0|4,0,0]=4 264 B9R0.2 CCCCCNC[C@@H](C)O 089be76a49b8d969c37e3bf761f099cf [0,0,0,0,0,0|2,0,1]=3 265 B9R0.2 CCCCCNC[C@H](C)O 5a490e8ff74a89416bf9c7c48d9e8ab5 [0,0,0,0,0,0|2,0,1]=3 266 B9R0.2 CCCCCNC[N+](=O)[O-] 4ffec53d6d65ed1a475cd4f2a3234fbe [0,0,0,0,0,0|2,0,1]=3 267 B9R0.2 CCCCCOCC(=O)C 499380b88b419c17c81350fa0478ac8c [0,0,0,0,0,0|2,0,0]=2 268 B9R0.2 CCCCCOCC(=O)N ac3a2c078e0201ad0c0dae7872f135fb [0,0,0,0,0,0|2,0,0]=2 269 B9R0.2 CCCCCOCC(=O)O 880094d6a378029586dbdb044c20be8e [0,0,0,0,0,0|1,0,0]=1 270 B9R0.2 CCCCCOCC(=S)N 2157e345254c9ce27b0fedd6edd60b5b [0,0,0,0,0,0|2,1,0]=3 271 B9R0.2 CCCCCOCC(C)C a6db06e9998ef0b98995e61e46447184 [0,0,0,0,0,0|3,0,1]=4 272 B9R0.2 CCCCCOCC(C)F eea869a5391d0127cad74008c90486f9 [0,0,0,0,0,0|3,0,1]=4 273 B9R0.2 CCCCCOCC(C)S 1bb6ad855d7b5438b56773aa5b3dc08b [0,0,0,0,0,0|2,1,1]=4 274 B9R0.2 CCCCCOCC(F)F 7959a5412761a52345173213c0a3fe31 [0,0,0,0,0,0|3,0,1]=4 275 B9R0.2 CCCCCOCN(C)C b0d8f24f2252be6a84119d1d5f4bf089 [0,0,0,0,0,0|4,0,0]=4 276 B9R0.2 CCCCCOCS(=O)O b56ed3ff0a872daa7a558b28dc11bf7a [0,0,0,0,0,0|2,0,0]=2 277 B9R0.2 CCCCCOC[C@@H](C)F 9a29c6c5b8fac1212082a3622373ef64 [0,0,0,0,0,0|3,0,1]=4 278 B9R0.2 CCCCCOC[C@H](C)F 994b6cd7a84a65d29551f84dadbfb8db [0,0,0,0,0,0|3,0,1]=4 279 B9R0.2 CCCCCOC[N+](=O)[O-] 7029c11439826706543058f3e0154ee4 [0,0,0,0,0,0|2,0,1]=3 280 B9R0.2 CCCCNC/C=C(/C)\I 96ab734b7ce21482610c71b6ec7a0087 [0,0,0,0,0,0|3,0,1]=4 281 B9R0.2 CCCCNC/C=C(\C)/Cl cc815245be4b93926fd334c586089c95 [0,0,0,0,0,0|3,0,1]=4 282 B9R0.2 CCCCNCC=C(C)C fecf7e997f5d1af1b094a02b011b0ef1 [0,0,0,0,0,0|3,0,1]=4 283 B9R0.2 CCCCNCC=C(C)Cl 2e3d05b023f03cd9b003c981af64ea51 [0,0,0,0,0,0|3,0,1]=4 284 B9R0.2 CCCCNCC=C(C)I 30884b68d06af4a4b3dead6018681c13 [0,0,0,0,0,0|3,0,1]=4 285 B9R0.2 CCCCNCC=C(Cl)Cl c4cb9460d98eafb7c67ffb885b4343a6 [0,0,0,0,0,0|3,0,1]=4 286 B9R0.2 CCCCNCCC(=O)C 23aeaf3a105e0d1d74c9a684b3a6ae92 [0,0,0,0,0,0|2,0,0]=2 287 B9R0.2 CCCCNCCC(=O)N 2d98b6dd492f5bb47b303e933495165d [0,0,0,0,0,0|2,0,0]=2 288 B9R0.2 CCCCNCCC(=O)O 2d9ff059f34708cc77b9165028ecaefa [0,0,0,0,0,0|1,0,0]=1 289 B9R0.2 CCCCNCCC(=S)N 7a74028cfb8507b34fa2a8c0010aaa96 [0,0,0,0,0,0|2,1,0]=3 290 B9R0.2 CCCCNCCC(C)C 44a9470711d30a7f4f911ef0e5708bda [0,0,0,0,0,0|3,0,1]=4 291 B9R0.2 CCCCNCCC(C)O a3707e567169e0cb89818b82dd0db2ad [0,0,0,0,0,0|2,0,1]=3 292 B9R0.2 CCCCNCCC(F)F f6b630447e80f020d036db13b3666b19 [0,0,0,0,0,0|3,0,1]=4 293 B9R0.2 CCCCNCCN(C)C 276e58670905c90d29cab37bd4cde7f0 [0,0,0,0,0,0|4,0,0]=4 294 B9R0.2 CCCCNCCS(=O)C ae9a13c0fc24ec4aec99b86861ef96f8 [0,0,0,0,0,0|3,0,0]=3 295 B9R0.2 CCCCNCCS(=O)O d1550f302fc03798fde8c440dd73fdb7 [0,0,0,0,0,0|2,0,0]=2 296 B9R0.2 CCCCNCC[C@@H](C)O b4194f7259d3966751a8302ac0afc5f6 [0,0,0,0,0,0|2,0,1]=3 297 B9R0.2 CCCCNCC[C@H](C)O 2bd9e0d91881457396737c14485be5ce [0,0,0,0,0,0|2,0,1]=3 298 B9R0.2 CCCCNCOC(=O)C f747ae8d75ae5077cb457c21af32c3d4 [0,0,0,0,0,0|3,0,0]=3 299 B9R0.2 CCCCNCSC(=O)N c68e80692e27dc4bcd1af702e7ea36a7 [0,0,0,0,0,0|3,0,0]=3 300 B9R0.2 CCCCOC/C=C(/C)\Cl 960fdaf47adbe5ca8fe9706c44ec1044 [0,0,0,0,0,0|3,0,1]=4 301 B9R0.2 CCCCOC/C=C(/C)\I b03bc4260bec39be9cf79aca08c38129 [0,0,0,0,0,0|3,0,1]=4 302 B9R0.2 CCCCOC/C=C(\C)/Cl 743307406907de86af1ae076bd836ab4 [0,0,0,0,0,0|3,0,1]=4 303 B9R0.2 CCCCOCC=C(C)C 761455161b359ecdf381fb2c7e2674d3 [0,0,0,0,0,0|3,0,1]=4 304 B9R0.2 CCCCOCC=C(C)Cl 48d4f013d4d198147254b8b64c0376c6 [0,0,0,0,0,0|3,0,1]=4 305 B9R0.2 CCCCOCC=C(C)I b84310eb2159cdbf6c2e4af756a6961c [0,0,0,0,0,0|3,0,1]=4 306 B9R0.2 CCCCOCC=C(Cl)Cl d0b56f5b497e46da48877a2a743f5f62 [0,0,0,0,0,0|3,0,1]=4 307 B9R0.2 CCCCOCCC(=O)C 6113a5294b2f420804d815edd80f0f40 [0,0,0,0,0,0|2,0,0]=2 308 B9R0.2 CCCCOCCC(=O)N 5eb5a710abf4db2a2dded5d930468391 [0,0,0,0,0,0|2,0,0]=2 309 B9R0.2 CCCCOCCC(=O)O f7b98599c570a58f82c0818a4675303f [0,0,0,0,0,0|1,0,0]=1 310 B9R0.2 CCCCOCCC(C)C 957ebfe7946e25745350d003aae73b70 [0,0,0,0,0,0|3,0,1]=4 311 B9R0.2 CCCCOCCC(F)F e0eb329f82786f9e804b9c4e3afd51ae [0,0,0,0,0,0|3,0,1]=4 312 B9R0.2 CCCCOCCN(C)C ff1cbc5eb8ee420c66fac7f9df7f979c [0,0,0,0,0,0|4,0,0]=4 313 B9R0.2 CCCCOCCS(=O)C c23ab1353236b7d3fb5d5b7810b75cb1 [0,0,0,0,0,0|3,0,0]=3 314 B9R0.2 CCCCOCC[N+](=O)[O-] 449ae182546390483eb4b610198267f3 [0,0,0,0,0,0|2,0,1]=3 315 B9R0.2 CCCCOCNC(=O)C c90275af9c3de9eb05be63b1efa3b4d9 [0,0,0,0,0,0|3,0,0]=3 316 B9R0.2 CCCCOCNC(=O)N c8570fe5b0fca07c49ea855c2c714e28 [0,0,0,0,0,0|3,0,0]=3 317 B9R0.2 CCCCOCOC(=O)C 52b453d7294c4b6acb8f00c70315374a [0,0,0,0,0,0|3,0,0]=3 318 B9R0.2 CCCCOCSC(=O)N d1d81793d91d56bfe6b40ff2fdeafcee [0,0,0,0,0,0|3,0,0]=3 319 B9R0.2 CCCNC/C=C/C(=O)O 2dd1b47b43d39c78f5fbca7c7571ff45 [0,0,0,0,0,0|1,0,2]=3 320 B9R0.2 CCCNCC#CC(=O)N e74eaee5e1f71e6fbf24a351a3deeba4 [0,0,0,0,0,0|2,0,2]=4 321 B9R0.2 CCCNCC#CC(=O)O a4ffabb1fc463a4c83e7684cb826c3e8 [0,0,0,0,0,0|1,0,2]=3 322 B9R0.2 CCCNCC=CC(=O)O f6d198a3c4819b4eb753a38590475072 [0,0,0,0,0,0|1,0,2]=3 323 B9R0.2 CCCNCCC=C(C)C ced8054c93d3346fab5137bb99fb0f73 [0,0,0,0,0,0|3,0,1]=4 324 B9R0.2 CCCNCCC=C(F)F 3981bbaf3e3910f0824696327c10e0cb [0,0,0,0,0,0|3,0,1]=4 325 B9R0.2 CCCNCCCC(=O)C 59b56db2c5ba6f2408c45d91cf5d07cf [0,0,0,0,0,0|2,0,0]=2 326 B9R0.2 CCCNCCCC(=O)N ad3cbfcffc5634ad25d1d1d605d0c75d [0,0,0,0,0,0|2,0,0]=2 327 B9R0.2 CCCNCCCC(=O)O 2c6599e2a5de3ceb0ce4fd582834477f [0,0,0,0,0,0|1,0,0]=1 328 B9R0.2 CCCNCCCC(C)C 56db38ca7131898df70223675d651c95 [0,0,0,0,0,0|3,0,1]=4 329 B9R0.2 CCCNCCCC(C)O 6371182df2267961651c217c5a9d8ec2 [0,0,0,0,0,0|2,0,1]=3 330 B9R0.2 CCCNCCCN(C)C 565fce1d806476fa729807ee12ce30bc [0,0,0,0,0,0|4,0,0]=4 331 B9R0.2 CCCNCCCS(=O)C bf3c6efa073e1467345d7cbddc3f20fe [0,0,0,0,0,0|3,0,0]=3 332 B9R0.2 CCCNCCC[N+](=O)[O-] c841f283b784f56925ce8adc6d0317ec [0,0,0,0,0,0|2,0,1]=3 333 B9R0.2 CCCNCCNC(=O)C 8ec9c538248c1278a7a78c753f9b558d [0,0,0,0,0,0|3,0,0]=3 334 B9R0.2 CCCNCCNC(=O)N eba9cf87c3d4b4412b3b52d629da0618 [0,0,0,0,0,0|3,0,0]=3 335 B9R0.2 CCCNCCNC(=S)N 1f8f9d9753f751fa31be35918f676917 [0,0,0,0,0,0|3,1,0]=4 336 B9R0.2 CCCNCCOC(=O)C 1f7e1f87180a6b7613488d41ed0bd627 [0,0,0,0,0,0|3,0,0]=3 337 B9R0.2 CCCNCCSC(=O)C 9a734654dda6d6cb5b5c8675b98c7ffb [0,0,0,0,0,0|3,0,0]=3 338 B9R0.2 CCCOC/C=C/C(=O)O 687938439e6711299f4c9234a05e83ff [0,0,0,0,0,0|1,0,2]=3 339 B9R0.2 CCCOCC#CC(=O)O 973b316b9915a74f4553e52fb7cc188e [0,0,0,0,0,0|1,0,2]=3 340 B9R0.2 CCCOCC=CC(=O)O 08e8672bb8b818ca24be0e027803b17f [0,0,0,0,0,0|1,0,2]=3 341 B9R0.2 CCCOCCC=C(C)C ff6fc9b7b0a2446d5a1ca048cc1d0112 [0,0,0,0,0,0|3,0,1]=4 342 B9R0.2 CCCOCCC=C(F)F b6ba6e0b93a8e2b72e4e1e6aa2b1e736 [0,0,0,0,0,0|3,0,1]=4 343 B9R0.2 CCCOCCCC(=O)C 3197867314079ee7d28a75ba48b024e1 [0,0,0,0,0,0|2,0,0]=2 344 B9R0.2 CCCOCCCC(=O)N 070095bcac514fc69d894401c1bbf694 [0,0,0,0,0,0|2,0,0]=2 345 B9R0.2 CCCOCCCC(=O)O 0bf29d754b3e882141bfdc8089deee25 [0,0,0,0,0,0|1,0,0]=1 346 B9R0.2 CCCOCCCC(C)C c11f5e919ab6207bf876cd919599bef7 [0,0,0,0,0,0|3,0,1]=4 347 B9R0.2 CCCOCCCN(C)C a5a11dc7f53dac0e7d443525259da51c [0,0,0,0,0,0|4,0,0]=4 348 B9R0.2 CCCOCCC[N+](=O)[O-] 04dd13287e8e1e4ca4b0686285155fd0 [0,0,0,0,0,0|2,0,1]=3 349 B9R0.2 CCCOCCNC(=O)C 2d108407d153229ed52501407a328bfe [0,0,0,0,0,0|3,0,0]=3 350 B9R0.2 CCCOCCNC(=O)N de0f07e5faa70e06a173f52c30b9f0f6 [0,0,0,0,0,0|3,0,0]=3 351 B9R0.2 CCCOCCNC(=S)N 16d02dff3ac7ad964ad82d0352824645 [0,0,0,0,0,0|3,1,0]=4 352 B9R0.2 CCCOCCOC(=O)C f41b865aa303cc7ca2bd22086d82154a [0,0,0,0,0,0|3,0,0]=3 353 B9R0.2 CCCOCCSC(=O)C e5fbc3852cf2e5bc0f0d48122e1eb071 [0,0,0,0,0,0|3,0,0]=3 354 B9R0.2 CCNCCCCC(=O)N e58565c8abd8e5ef4e9f04f253e40e9c [0,0,0,0,0,0|2,0,0]=2 355 B9R0.2 CCNCCCCC(=O)O c85642c501ae78ad2dab942f5836991c [0,0,0,0,0,0|1,0,0]=1 356 B9R0.2 CCNCCCCC(F)F 2dd047592be1958476fa43859c85a716 [0,0,0,0,0,0|3,0,1]=4 357 B9R0.2 CCNCCCCN(C)C bd4636e7f8e238c7c023973181018ff7 [0,0,0,0,0,0|4,0,0]=4 358 B9R0.2 CCNCCCNC(=O)C 81f3181e8e4443de7d578da2748320f4 [0,0,0,0,0,0|3,0,0]=3 359 B9R0.2 CCNCCOCC(=O)O c0319d2f7183e13649b4e14cf4dc44f0 [0,0,0,0,0,0|2,0,0]=2 360 B9R0.2 CCNCCSCC(=O)O e5cfcab4344048d57fb6458a9d7ade29 [0,0,0,0,0,0|2,0,0]=2 361 B9R0.2 CCOCCC#CC(=O)O 5ed97ccd5b3164e44f8f6133f43dc81c [0,0,0,0,0,0|1,0,2]=3 362 B9R0.2 CCOCCCCC(=O)C ecee09a6206772fa3d500ecaf82261c4 [0,0,0,0,0,0|2,0,0]=2 363 B9R0.2 CCOCCCCC(=O)N 6c8808518c393835c53b3e5d4f87702a [0,0,0,0,0,0|2,0,0]=2 364 B9R0.2 CCOCCCCC(=O)O dd3c266ef7ca2d55081985bcebc78969 [0,0,0,0,0,0|1,0,0]=1 365 B9R0.2 CCOCCCCC(C)C 342635d8f7fe78b6b1c62374e4a1ad34 [0,0,0,0,0,0|3,0,1]=4 366 B9R0.2 CCOCCCCN(C)C dea41cf883e4c072591bc50e93d6cb14 [0,0,0,0,0,0|4,0,0]=4 367 B9R0.2 CCOCCCC[N+](=O)[O-] a85cb5ce9cacb21db238c9921387a33e [0,0,0,0,0,0|2,0,1]=3 368 B9R0.2 CCOCCCNC(=O)C c5dadd69f1df46bcde7d3d147d2b830b [0,0,0,0,0,0|3,0,0]=3 369 B9R0.2 CCOCCCOC(=O)C 521ac746c4773e46268f3042c9c9e91c [0,0,0,0,0,0|3,0,0]=3 370 B9R0.2 CCOCCCO[N+](=O)[O-] 671da1fb10fc3d567c6bf28af17e030a [0,0,0,0,0,0|3,0,1]=4 371 B9R0.2 CCOCCCSC(=O)C c7c25084ef75859ffb4a847bdfcca873 [0,0,0,0,0,0|3,0,0]=3 372 B9R0.2 CCOCCNCC(=O)C c70f97bf0fb0c82014fed6cd7123cc8c [0,0,0,0,0,0|3,0,0]=3 373 B9R0.2 CCOCCNCC(=O)N 3b5f517f3d8c2ef294352600c8c9b118 [0,0,0,0,0,0|3,0,0]=3 374 B9R0.2 CCOCCNCC(=O)O fe73b6ce227ade0e3d2aa05ce85c310f [0,0,0,0,0,0|2,0,0]=2 375 B9R0.2 CCOCCNCC(C)O 611c0ca058030afcafaa92e361f179d4 [0,0,0,0,0,0|3,0,1]=4 376 B9R0.2 CCOCCNC[C@@H](C)O 6d9cab9a552edc18dd5f7603d3564ae0 [0,0,0,0,0,0|3,0,1]=4 377 B9R0.2 CCOCCNC[C@H](C)O 223aa1e1127120cb9bd81fef9db0a862 [0,0,0,0,0,0|3,0,1]=4 378 B9R0.2 CCOCCNC[N+](=O)[O-] 4175c271de284048d160adbc7d65dfb3 [0,0,0,0,0,0|3,0,1]=4 379 B9R0.2 CCOCCOCC(=O)C f2abab147e228f0c5e3f118094e5ae3e [0,0,0,0,0,0|3,0,0]=3 380 B9R0.2 CCOCCOCC(=O)N 3ad6244a0d9450d5a5ee70e3e3bc3564 [0,0,0,0,0,0|3,0,0]=3 381 B9R0.2 CCOCCOCC(=O)O 8e941570ee8b640c0974e53e117ac279 [0,0,0,0,0,0|2,0,0]=2 382 B9R0.2 CCOCCOCC(=S)N 103575ab75fa8d822aa7f597dd049006 [0,0,0,0,0,0|3,1,0]=4 383 B9R0.2 CCOCCOCS(=O)O fb882a20738b84ef6449d6e0c5b98fe6 [0,0,0,0,0,0|3,0,0]=3 384 B9R0.2 CCOCCOC[N+](=O)[O-] e62aef0441a3fc8f97d6d061db537a58 [0,0,0,0,0,0|3,0,1]=4 385 B9R0.2 CCOCCSCC(=O)N b5b59951777a4ee8ec00ef909fa6de61 [0,0,0,0,0,0|3,0,0]=3 386 B9R0.2 CCOCNCCC(=O)N 6177828bcdee622faa4bdfda48444dbf [0,0,0,0,0,0|3,0,0]=3 387 B9R0.2 CCOCNCCC(=O)O bb666c5cb5cf95e40e356d52c764ed2e [0,0,0,0,0,0|2,0,0]=2 388 B9R0.2 CCOCNCCC(=S)N 02e8c7ee947599c82ae0865f0a86cea7 [0,0,0,0,0,0|3,1,0]=4 389 B9R0.2 CCOCNCCC(C)O 3138bbeaedff2fa3dde2a5a9e1e37e46 [0,0,0,0,0,0|3,0,1]=4 390 B9R0.2 CCOCNCCS(=O)C aefadde1b8f1947b5e4d5f729c1077f8 [0,0,0,0,0,0|4,0,0]=4 391 B9R0.2 CCOCNCCS(=O)O f8f861d97ea8aa233c72f81ebad77555 [0,0,0,0,0,0|3,0,0]=3 392 B9R0.2 CCOCNCC[C@@H](C)O 0c1a73cdbcd329869c52458b6af4331f [0,0,0,0,0,0|3,0,1]=4 393 B9R0.2 CCOCNCC[C@H](C)O 003c7a0673a396cd2acd25751a1511c1 [0,0,0,0,0,0|3,0,1]=4 394 B9R0.2 CCOCOCCC(=O)C 7c05b5d301547a7a379eefc6a013d22c [0,0,0,0,0,0|3,0,0]=3 395 B9R0.2 CCOCOCCC(=O)N 3d7e10bb5e2a2f79b8dd828c61ceb02d [0,0,0,0,0,0|3,0,0]=3 396 B9R0.2 CCOCOCCC(=O)O 799c8960883074d9b3c3c270cb41a5e2 [0,0,0,0,0,0|2,0,0]=2 397 B9R0.2 CCOCOCCS(=O)C f04de07af9056c7493e646cd0008b732 [0,0,0,0,0,0|4,0,0]=4 398 B9R0.2 CCOCOCC[N+](=O)[O-] 5ae05fb500bf5821f315ec55599a34e8 [0,0,0,0,0,0|3,0,1]=4 399 B9R0.2 CCOCOCNC(=O)C 38793e0f0c107944ea14ab71c800590b [0,0,0,0,0,0|4,0,0]=4 400 B9R0.2 CCOCOCNC(=O)N 28e1c9c579e5e1a6385c8449366f4b0f [0,0,0,0,0,0|4,0,0]=4 401 B9R0.2 CCSCCNCC(=O)C fad72d0b95c2a13f990a448abba15424 [0,0,0,0,0,0|3,0,0]=3 402 B9R0.2 CCSCCNCC(=O)N bccfd35d4715d090e7874f4dd415c742 [0,0,0,0,0,0|3,0,0]=3 403 B9R0.2 CCSCCNCC(=O)O d9a8c386d66ab795d4b3734359c61f59 [0,0,0,0,0,0|2,0,0]=2 404 B9R0.2 CCSCCNCC(C)O 255c79b1ecfe5100a12c3f45792442aa [0,0,0,0,0,0|3,0,1]=4 405 B9R0.2 CCSCCNC[C@@H](C)O dce2c609bf5c9629ce4288427c7c1b86 [0,0,0,0,0,0|3,0,1]=4 406 B9R0.2 CCSCCNC[C@H](C)O 57cfac9b9d430cd163d92566fb0015bb [0,0,0,0,0,0|3,0,1]=4 407 B9R0.2 CCSCCNC[N+](=O)[O-] 1ca4c5bb5dce9d5271b633e8c10d3fb3 [0,0,0,0,0,0|3,0,1]=4 408 B9R0.2 CCSCCOCC(=O)C 3e35f56d483cc24657d76c6dcc48c959 [0,0,0,0,0,0|3,0,0]=3 409 B9R0.2 CCSCCOCC(=O)N 0972d7ab007eadd2c654a3805821636b [0,0,0,0,0,0|3,0,0]=3 410 B9R0.2 CCSCCOCC(=O)O 7dcca9bd15b343f0086a7f56a35270d1 [0,0,0,0,0,0|2,0,0]=2 411 B9R0.2 CCSCCOCC(=S)N 38236435aacc9403c87c58a73275fb72 [0,0,0,0,0,0|3,1,0]=4 412 B9R0.2 CCSCCOCS(=O)O e5bd6861eda4deca7d76ab102e54b1cd [0,0,0,0,0,0|3,0,0]=3 413 B9R0.2 CCSCCOC[N+](=O)[O-] 4067a3c579700f15d131efac1237ea82 [0,0,0,0,0,0|3,0,1]=4 414 B9R0.2 COCCCCNC(=O)C 4f652cda1775947bb169784843d0beab [0,0,0,0,0,0|3,0,0]=3 415 B9R0.2 COCCCNCC(=O)C e4b3d782ce022664507161af9801f346 [0,0,0,0,0,0|3,0,0]=3 416 B9R0.2 COCCCNCC(=O)N 253b9b2bf64092c65099b8983595bf88 [0,0,0,0,0,0|3,0,0]=3 417 B9R0.2 COCCCNCC(=O)O bb99ed747e50bacf9b72c7121db02d06 [0,0,0,0,0,0|2,0,0]=2 418 B9R0.2 COCCCNCC(C)O 3fa2a5428f19c5ffc20a47da566fdcc9 [0,0,0,0,0,0|3,0,1]=4 419 B9R0.2 COCCCNC[C@@H](C)O 19ff1dcbdf3c48021f5a90586903a0ef [0,0,0,0,0,0|3,0,1]=4 420 B9R0.2 COCCCNC[C@H](C)O d9eaf91d3d886af5c13acd54dbb750ef [0,0,0,0,0,0|3,0,1]=4 421 B9R0.2 COCCCNC[N+](=O)[O-] 6c6f97ec06277440e01a9ee08655bfca [0,0,0,0,0,0|3,0,1]=4 422 B9R0.2 COCCCOCC(=O)C b6c57de0e6612bd98a91c89c61f27b6a [0,0,0,0,0,0|3,0,0]=3 423 B9R0.2 COCCCOCC(=O)N 5aa082b1cc6858ba28beda9b2b4239f2 [0,0,0,0,0,0|3,0,0]=3 424 B9R0.2 COCCCOCC(=O)O ec52a61a98845b6bf28deaf0b8243269 [0,0,0,0,0,0|2,0,0]=2 425 B9R0.2 COCCCOCC(=S)N b976529c229d76456887f6939753ca43 [0,0,0,0,0,0|3,1,0]=4 426 B9R0.2 COCCCOCS(=O)O 30a0c66debfd98ba2944bef18623071e [0,0,0,0,0,0|3,0,0]=3 427 B9R0.2 COCCCOC[N+](=O)[O-] 4c3b8e29bc16ba3712fc93feb872d9e1 [0,0,0,0,0,0|3,0,1]=4 428 B9R0.2 COCCNCCC(=O)C cc50741b4bcb596f77bf55fe047b2330 [0,0,0,0,0,0|3,0,0]=3 429 B9R0.2 COCCNCCC(=O)N 914219fcbf815befada20a4804c3ce40 [0,0,0,0,0,0|3,0,0]=3 430 B9R0.2 COCCNCCC(=O)O 30d6a6eb8d13e89f1e6baa6cbd54590b [0,0,0,0,0,0|2,0,0]=2 431 B9R0.2 COCCNCCC(=S)N 3664a9179cecc8b38de918a3eef9e3a2 [0,0,0,0,0,0|3,1,0]=4 432 B9R0.2 COCCNCCC(C)O 5a263a3731f96a2126baacd5857d34eb [0,0,0,0,0,0|3,0,1]=4 433 B9R0.2 COCCNCCS(=O)C e07673a803a60e97b3f99b6405f40904 [0,0,0,0,0,0|4,0,0]=4 434 B9R0.2 COCCNCCS(=O)O 0633dfd0f3b2fc17d4f5fa9f8817f72d [0,0,0,0,0,0|3,0,0]=3 435 B9R0.2 COCCNCC[C@@H](C)O f612119892ead8b98da5c14432e134c2 [0,0,0,0,0,0|3,0,1]=4 436 B9R0.2 COCCNCC[C@H](C)O a9e2983c33d9a1a4326532535161c921 [0,0,0,0,0,0|3,0,1]=4 437 B9R0.2 COCCNCOC(=O)C 7c792011f968ec1a1d9667b50dc4d640 [0,0,0,0,0,0|4,0,0]=4 438 B9R0.2 COCCNCSC(=O)N 6e0c1158d779849192578c4315d1632c [0,0,0,0,0,0|4,0,0]=4 439 B9R0.2 COCCOCCC(=O)C 42b719221818bf1f4cbfe81de3e7676a [0,0,0,0,0,0|3,0,0]=3 440 B9R0.2 COCCOCCC(=O)N b528d747387ce99b70a79f06142776d7 [0,0,0,0,0,0|3,0,0]=3 441 B9R0.2 COCCOCCC(=O)O 25825b2e7473038d51278d15c2f9a50b [0,0,0,0,0,0|2,0,0]=2 442 B9R0.2 COCCOCCS(=O)C 86bcbfcb08f01b0bfbc64141840f37ac [0,0,0,0,0,0|4,0,0]=4 443 B9R0.2 COCCOCC[N+](=O)[O-] 8b567efe8f609ac1ae9aa930e20db26f [0,0,0,0,0,0|3,0,1]=4 444 B9R0.2 COCCOCNC(=O)C 6d3810fe234d43670afe9476c6ccf397 [0,0,0,0,0,0|4,0,0]=4 445 B9R0.2 COCCOCNC(=O)N 13765b7ac1b3e526c6031cc120f0e07e [0,0,0,0,0,0|4,0,0]=4 446 B9R0.2 COCCOCOC(=O)C 3c0c9969f08b445ef676eb92f534751f [0,0,0,0,0,0|4,0,0]=4 447 B9R0.2 COCCOCSC(=O)N b520f5d19f9fd890441b1ccf27837fd2 [0,0,0,0,0,0|4,0,0]=4 448 B9R0.2 COCNC/C=C/C(=O)O 0fa427a6486acbb4d373241fedb0a10e [0,0,0,0,0,0|2,0,2]=4 449 B9R0.2 COCNCC#CC(=O)O 2d7890b6633f44ec9c2455a9abf7b600 [0,0,0,0,0,0|2,0,2]=4 450 B9R0.2 COCNCC=CC(=O)O 6df88093ebd1ff3e1f049de99a96ca09 [0,0,0,0,0,0|2,0,2]=4 451 B9R0.2 COCNCCCC(=O)N 143230c9cc7fa1e72cc2f06c39df6405 [0,0,0,0,0,0|3,0,0]=3 452 B9R0.2 COCNCCCC(=O)O 64bd770f694cab9d693114f7ad1b17c7 [0,0,0,0,0,0|2,0,0]=2 453 B9R0.2 COCNCCCS(=O)C e17e29574333d704c9897ae7e2793f42 [0,0,0,0,0,0|4,0,0]=4 454 B9R0.2 COCNCCNC(=O)C b12b12639159c20bcc2d1c1086116477 [0,0,0,0,0,0|4,0,0]=4 455 B9R0.2 COCOC/C=C/C(=O)O 54f81693b4cd346c35998d208561a80c [0,0,0,0,0,0|2,0,2]=4 456 B9R0.2 COCOCC#CC(=O)O 666a8309680cb3811e622a1133a23c12 [0,0,0,0,0,0|2,0,2]=4 457 B9R0.2 COCOCC=CC(=O)O ad57febf4e8b32f0fa5c10f2425d4372 [0,0,0,0,0,0|2,0,2]=4 458 B9R0.2 COCOCCCC(=O)C f43054086d226c36ed78969c345787dd [0,0,0,0,0,0|3,0,0]=3 459 B9R0.2 COCOCCCC(=O)N e23220792a5c66edc9d24bfa8410fe19 [0,0,0,0,0,0|3,0,0]=3 460 B9R0.2 COCOCCC[N+](=O)[O-] 0492055c711e9ae5acd7659d4d4f707e [0,0,0,0,0,0|3,0,1]=4 461 B9R0.2 COCOCCNC(=O)C 3efb8e5988f380a09e447f8453fc669b [0,0,0,0,0,0|4,0,0]=4 462 B9R0.2 COCOCCNC(=O)N a7688870d978d2b267f34650c562056e [0,0,0,0,0,0|4,0,0]=4 463 B9R0.2 COCOCCOC(=O)C c1d21b4657b103686de2e70024d8053c [0,0,0,0,0,0|4,0,0]=4 464 B9R0.2 COCOCCSC(=O)C 08a4a36a589b662a246281790c16f756 [0,0,0,0,0,0|4,0,0]=4 465 B9R0.2 CS(=O)CCCNCCF a7f5f9f6004c775a6d5f7e619c031a1e [0,0,0,0,0,0|4,0,0]=4 466 B9R0.2 CS(=O)CCCNCCO 475661cce2b0f0a50ea2d5e882b9de0d [0,0,0,0,0,0|4,0,0]=4 467 B9R0.2 CS(=O)CCCNCCS 17ab50e4687ebdd306981c4446e2983c [0,0,0,0,0,0|4,0,0]=4 468 B9R0.2 CS(=O)CCNCCCCl a6172a204190f51c76e8b9d42b8ab81e [0,0,0,0,0,0|4,0,0]=4 469 B9R0.2 CS(=O)CCNCCCF 1d8ca03ccc8ee39c7db5f429eccc93cf [0,0,0,0,0,0|4,0,0]=4 470 B9R0.2 CS(=O)CCNCCCO d14cc530c45b1a203d3d3eb1e9f81a62 [0,0,0,0,0,0|4,0,0]=4 471 B9R0.2 CS(=O)CCNCCCS b689e8fdd1abf99e85c01e3af8c3b061 [0,0,0,0,0,0|4,0,0]=4 472 B9R0.2 CS(=O)CCOCCCF b2d20f8c00cb33511ad5dd154685d73b [0,0,0,0,0,0|4,0,0]=4 473 B9R0.2 CS(=O)CCOCCCS 34f7c62298978ab6289d98144f16f05f [0,0,0,0,0,0|4,0,0]=4 474 B9R0.2 CSCCCCNC(=O)C fe724d5efdffb6641eb31ec001ed77cf [0,0,0,0,0,0|3,0,0]=3 475 B9R0.2 CSCCCNCC(=O)C 7623274f83bea32ce27bf9f8465c7872 [0,0,0,0,0,0|3,0,0]=3 476 B9R0.2 CSCCCNCC(=O)N c17d1c1629e4c317e4eed7952120063f [0,0,0,0,0,0|3,0,0]=3 477 B9R0.2 CSCCCNCC(=O)O 1ee764be5870ee9d6a465670ba4c3b41 [0,0,0,0,0,0|2,0,0]=2 478 B9R0.2 CSCCCNCC(C)O 70ba937df7d6587395a5fab866fc28ac [0,0,0,0,0,0|3,0,1]=4 479 B9R0.2 CSCCCNC[C@@H](C)O ec89de1321ce8438e9244c3e8270c36c [0,0,0,0,0,0|3,0,1]=4 480 B9R0.2 CSCCCNC[C@H](C)O 475d2e539a8bb49c6c6a6ef930e9a225 [0,0,0,0,0,0|3,0,1]=4 481 B9R0.2 CSCCCNC[N+](=O)[O-] eaa3cc7c01d90353a32c09d980a4b3ae [0,0,0,0,0,0|3,0,1]=4 482 B9R0.2 CSCCCOCC(=O)C 5454163a2a07a4d14ee03189c1897a43 [0,0,0,0,0,0|3,0,0]=3 483 B9R0.2 CSCCCOCC(=O)N 2e0057c06fe69bc4ebfba942e29937f8 [0,0,0,0,0,0|3,0,0]=3 484 B9R0.2 CSCCCOCC(=O)O eaeded9547b84d8ef5e124eca9ee4fd2 [0,0,0,0,0,0|2,0,0]=2 485 B9R0.2 CSCCCOCC(=S)N a2b0801751a8138d1ac189d672136fd8 [0,0,0,0,0,0|3,1,0]=4 486 B9R0.2 CSCCCOCS(=O)O ce4c6dcc5702edc8a1f1476bdf7c2f85 [0,0,0,0,0,0|3,0,0]=3 487 B9R0.2 CSCCCOC[N+](=O)[O-] 641c7f961e8534e86618aea7c2c1cd23 [0,0,0,0,0,0|3,0,1]=4 488 B9R0.2 CSCCNCCC(=O)C 9db4a522309238a4c3a74c333f9036b6 [0,0,0,0,0,0|3,0,0]=3 489 B9R0.2 CSCCNCCC(=O)N fac02100e52f701d38c4b7d7284e2345 [0,0,0,0,0,0|3,0,0]=3 490 B9R0.2 CSCCNCCC(=O)O 808165acc4fc0c35acf13aa79babe8b9 [0,0,0,0,0,0|2,0,0]=2 491 B9R0.2 CSCCNCCC(=S)N 4fef1bf71d23c53fe5d79854811db0b2 [0,0,0,0,0,0|3,1,0]=4 492 B9R0.2 CSCCNCCC(C)O 4a4c316f91a0372beec10a189d68dd5b [0,0,0,0,0,0|3,0,1]=4 493 B9R0.2 CSCCNCCS(=O)C c6a736592b0f693ea813f1641c54e2f8 [0,0,0,0,0,0|4,0,0]=4 494 B9R0.2 CSCCNCCS(=O)O 99197a60045cf31ddb8e82dcbb474020 [0,0,0,0,0,0|3,0,0]=3 495 B9R0.2 CSCCNCC[C@@H](C)O 7a799516c179e00cbc9167de39b00a4c [0,0,0,0,0,0|3,0,1]=4 496 B9R0.2 CSCCNCC[C@H](C)O 186d378f131bc2cabd51a436e26a9ce8 [0,0,0,0,0,0|3,0,1]=4 497 B9R0.2 CSCCNCOC(=O)C 4a9417d660a2b8f603a487e0613a69d1 [0,0,0,0,0,0|4,0,0]=4 498 B9R0.2 CSCCNCSC(=O)N a1fd6553d05c66e08ee049d4adcde546 [0,0,0,0,0,0|4,0,0]=4 499 B9R0.2 CSCCOCCC(=O)C b7c06c5f50bd774c354bac5b4a853359 [0,0,0,0,0,0|3,0,0]=3 500 B9R0.2 CSCCOCCC(=O)N 260135039720ecae997fb6d7d7eeb00c [0,0,0,0,0,0|3,0,0]=3 501 B9R0.2 CSCCOCCC(=O)O bd1672f73e380f6fe93fe8a89c7b9218 [0,0,0,0,0,0|2,0,0]=2 502 B9R0.2 CSCCOCCS(=O)C 523f86987ced443a666b87f6e3cb1410 [0,0,0,0,0,0|4,0,0]=4 503 B9R0.2 CSCCOCC[N+](=O)[O-] 6545d6e413c2362a50d9798704247e49 [0,0,0,0,0,0|3,0,1]=4 504 B9R0.2 CSCCOCNC(=O)C 4aec0f27a328a0ad9a769e1bb9447e51 [0,0,0,0,0,0|4,0,0]=4 505 B9R0.2 CSCCOCNC(=O)N 8c5ffb8a66065a58c05a78768de1c67a [0,0,0,0,0,0|4,0,0]=4 506 B9R0.2 CSCCOCOC(=O)C 4ce161e7666f6d339ad656d877b5738e [0,0,0,0,0,0|4,0,0]=4 507 B9R0.2 CSCCOCSC(=O)N 5337a3208db83b9435de4d6c888ff7d5 [0,0,0,0,0,0|4,0,0]=4 508 B9R0.2 CSCNC/C=C/C(=O)O 7c226f0048c34d5bb97b0870c0873d3b [0,0,0,0,0,0|2,0,2]=4 509 B9R0.2 CSCNCC#CC(=O)O c96d606de47d4c3a5312f4c25d7c9b77 [0,0,0,0,0,0|2,0,2]=4 510 B9R0.2 CSCNCC=CC(=O)O b8b6d8f69bf1687618553648a2d97d05 [0,0,0,0,0,0|2,0,2]=4 511 B9R0.2 CSCNCCCC(=O)N 9c78a0b9068d8a3cc8f8317328f3766a [0,0,0,0,0,0|3,0,0]=3 512 B9R0.2 CSCNCCCC(=O)O 7eae2fdc26b7518d89f6059c70e462f4 [0,0,0,0,0,0|2,0,0]=2 513 B9R0.2 CSCNCCCS(=O)C 48eed52a7a09b80857dcff8c731ff71d [0,0,0,0,0,0|4,0,0]=4 514 B9R0.2 CSCNCCNC(=O)C 0c83ce960241de6e2f8a77c5156cf9ec [0,0,0,0,0,0|4,0,0]=4 515 B9R0.2 CSCOC/C=C/C(=O)O d0647dc68632bd0d847ac45201ae5914 [0,0,0,0,0,0|2,0,2]=4 516 B9R0.2 CSCOCC#CC(=O)O 1c62f84ae4020df1a235e921ae287599 [0,0,0,0,0,0|2,0,2]=4 517 B9R0.2 CSCOCC=CC(=O)O 37540b99283d1f3b0431d790f6db1d9c [0,0,0,0,0,0|2,0,2]=4 518 B9R0.2 CSCOCCCC(=O)C 37d7fc5efc38029b2c30ac3a6898185c [0,0,0,0,0,0|3,0,0]=3 519 B9R0.2 CSCOCCCC(=O)N bfccc78da96541a29149f439ea148b47 [0,0,0,0,0,0|3,0,0]=3 520 B9R0.2 CSCOCCC[N+](=O)[O-] fcf3fd7d1dd5c693d6c40576f6a68f99 [0,0,0,0,0,0|3,0,1]=4 521 B9R0.2 CSCOCCNC(=O)C 8bf9fe079133cd630591ad7e21810fd8 [0,0,0,0,0,0|4,0,0]=4 522 B9R0.2 CSCOCCNC(=O)N 5323ec38aa7014de1cb11978f57edeee [0,0,0,0,0,0|4,0,0]=4 523 B9R0.2 CSCOCCOC(=O)C 85f658ca31404ad6a9d937e79a707f17 [0,0,0,0,0,0|4,0,0]=4 524 B9R0.2 C[C@@H](O)CCNCCCF 521c04738e2931c8a66f22d645802491 [0,0,0,0,0,0|3,0,1]=4 525 B9R0.2 C[C@@H](O)CCNCCCO 879875d53905068a86ee9621ae8c2b21 [0,0,0,0,0,0|3,0,1]=4 526 B9R0.2 C[C@@H](O)CCNCCCS ebf487901d26eddea2cf7ce80728d7f7 [0,0,0,0,0,0|3,0,1]=4 527 B9R0.2 C[C@@H](O)CNCCCCCl 491b5c1622254008509a4ba8e9ab1cd6 [0,0,0,0,0,0|3,0,1]=4 528 B9R0.2 C[C@@H](O)CNCCCCF fe799b76acda16431cb6fa5d25600b49 [0,0,0,0,0,0|3,0,1]=4 529 B9R0.2 C[C@@H](O)CNCCCCO fa414208f6ad4c98dcfebb658b545113 [0,0,0,0,0,0|3,0,1]=4 530 B9R0.2 C[C@@H](O)CNCCCCS 84fb62362fb54da5594d3cc03c2130c9 [0,0,0,0,0,0|3,0,1]=4 531 B9R0.2 C[C@H](O)CCNCCCF d124f436f6525e8f868f951a59d90c84 [0,0,0,0,0,0|3,0,1]=4 532 B9R0.2 C[C@H](O)CCNCCCO a698db67babc45413efb0087ad25aad2 [0,0,0,0,0,0|3,0,1]=4 533 B9R0.2 C[C@H](O)CCNCCCS 35694b8a490fc55e24732d5b3a080a19 [0,0,0,0,0,0|3,0,1]=4 534 B9R0.2 C[C@H](O)CNCCCCCl 10f974d9cf94c158b1c6d32ae2032c20 [0,0,0,0,0,0|3,0,1]=4 535 B9R0.2 C[C@H](O)CNCCCCF bcc3069b5de5f2b89ea30d65e6f3b680 [0,0,0,0,0,0|3,0,1]=4 536 B9R0.2 C[C@H](O)CNCCCCO a15a5bb9bd70a0ca5b76d0de8e96df0c [0,0,0,0,0,0|3,0,1]=4 537 B9R0.2 C[C@H](O)CNCCCCS 57a34e18d1e9185556f58eb4a371705c [0,0,0,0,0,0|3,0,1]=4 538 B9R0.2 N#CCCCNCC(=O)N 70b7f20154e1dc2261d79ee8ddbdbae3 [0,0,0,0,0,0|3,0,1]=4 539 B9R0.2 N#CCCCNCC(=O)O 20724fe6156a1af746594ec9feab0e68 [0,0,0,0,0,0|2,0,1]=3 540 B9R0.2 N#CCCCOCC(=O)N a8342065e65627c8f214f3db56f9266b [0,0,0,0,0,0|3,0,1]=4 541 B9R0.2 N#CCCCOCC(=O)O 45398b7196d099d83805223b6a8c644f [0,0,0,0,0,0|2,0,1]=3 542 B9R0.2 N#CCCCOCS(=O)O 49be9478e93923d14afcf867661ff067 [0,0,0,0,0,0|3,0,1]=4 543 B9R0.2 N#CCCNCCC(=O)N ee73d06faaeeda2ac48b6152f61c3f12 [0,0,0,0,0,0|3,0,1]=4 544 B9R0.2 N#CCCNCCC(=O)O 7abc0d2ce742a2d67238e0ee16b48f38 [0,0,0,0,0,0|2,0,1]=3 545 B9R0.2 N#CCCNCCS(=O)O 1d56fb621e11b0b9e1f468dbd419fe7b [0,0,0,0,0,0|3,0,1]=4 546 B9R0.2 N#CCCOCCC(=O)N 8eb32a248154e47ca15b06a50ae03c64 [0,0,0,0,0,0|3,0,1]=4 547 B9R0.2 N#CCCOCCC(=O)O d6c21a81de880815349a7606c778d8cd [0,0,0,0,0,0|2,0,1]=3 548 B9R0.2 N#CCNCCCC(=O)N 3b917f0e5e51e29e3d5a94faa2473d57 [0,0,0,0,0,0|3,0,1]=4 549 B9R0.2 N#CCNCCCC(=O)O d49027464fcde58fe65757855e67264b [0,0,0,0,0,0|2,0,1]=3 550 B9R0.2 N#CCOCCCC(=O)N 1325ab485ae2143ff06bb15a6aa2498a [0,0,0,0,0,0|3,0,1]=4 551 B9R0.2 N#CNCCCCC(=O)N f49369528c61631094103e3f43cc7580 [0,0,0,0,0,0|3,0,1]=4 552 B9R0.2 N#CNCCCCC(=O)O e91eb9cdc63c12d1e3fbf5ecea30450d [0,0,0,0,0,0|2,0,1]=3 553 B9R0.2 N#CNCCOCC(=O)O d2166dd78405e5ac73f7d50421551618 [0,0,0,0,0,0|3,0,1]=4 554 B9R0.2 N#CSCOCCC(=O)O e158ff07236598b8e33d50cec9484cd7 [0,0,0,0,0,0|3,0,1]=4 555 B9R0.2 NC(=O)CCCCNC=O 3e503141f2993c5300de2e080e6cd43c [0,0,0,0,0,0|3,0,1]=4 556 B9R0.2 NC(=O)CCCCNCF 75b2f82846bbe7e40aabc87d3f624ba8 [0,0,0,0,0,0|3,0,0]=3 557 B9R0.2 NC(=O)CCCCNCO ce36ffe4a318fba229276c91570ce122 [0,0,0,0,0,0|3,0,0]=3 558 B9R0.2 NC(=O)CCCCOCF 3777af8fc371a79c0dfdc0eb4e0712f1 [0,0,0,0,0,0|3,0,0]=3 559 B9R0.2 NC(=O)CCCNCC=O a643217445c23b78f95058989a303128 [0,0,0,0,0,0|3,0,1]=4 560 B9R0.2 NC(=O)CCCNCCBr 159e952c22dd14d98be643253e87144f [0,0,0,0,0,0|3,0,0]=3 561 B9R0.2 NC(=O)CCCNCCF 86bd028566db889d0e9f083596f5b81e [0,0,0,0,0,0|3,0,0]=3 562 B9R0.2 NC(=O)CCCNCCI c000d4b42ca6db0272d6873d5a06bf59 [0,0,0,0,0,0|3,0,0]=3 563 B9R0.2 NC(=O)CCCNCCO b82c97f586c37f6864f17e6a0759093e [0,0,0,0,0,0|3,0,0]=3 564 B9R0.2 NC(=O)CCCNCCS 33c260f6f564fe8a054bf0687069a0d8 [0,0,0,0,0,0|3,0,0]=3 565 B9R0.2 NC(=O)CCCOCC=O 57550c358bd48a572738286d32dacaf1 [0,0,0,0,0,0|3,0,1]=4 566 B9R0.2 NC(=O)CCCOCCF bed05ecccde6fc2e5c6ab1fb3d493a56 [0,0,0,0,0,0|3,0,0]=3 567 B9R0.2 NC(=O)CCCOCCS 52144b28c666090309e74c56c2a6cead [0,0,0,0,0,0|3,0,0]=3 568 B9R0.2 NC(=O)CCNCCC=O 03233488ecadae1146314c18f07a59ca [0,0,0,0,0,0|3,0,1]=4 569 B9R0.2 NC(=O)CCNCCCCl ffdfddf334a4ea28c728c2af5495031a [0,0,0,0,0,0|3,0,0]=3 570 B9R0.2 NC(=O)CCNCCCF 546af48d5e9ca27f1f573d73dbdb91c5 [0,0,0,0,0,0|3,0,0]=3 571 B9R0.2 NC(=O)CCNCCCO 12b0fb311596dc7373666db7dc43ab52 [0,0,0,0,0,0|3,0,0]=3 572 B9R0.2 NC(=O)CCNCCCS 9243a2bf1af632bb9baa3f382cc42b61 [0,0,0,0,0,0|3,0,0]=3 573 B9R0.2 NC(=O)CCOCCC=O 48a1244b45b68be890fbe7059462fe02 [0,0,0,0,0,0|3,0,1]=4 574 B9R0.2 NC(=O)CCOCCCF 78700fed2a3a54da0b4cefaac5cc6c00 [0,0,0,0,0,0|3,0,0]=3 575 B9R0.2 NC(=O)CCOCCCS 6cc247be50b065fba7a87c9d06bbeeb0 [0,0,0,0,0,0|3,0,0]=3 576 B9R0.2 NC(=O)CNCCCC=O 04c7aa833df1a457e4f1c1022205edc1 [0,0,0,0,0,0|3,0,1]=4 577 B9R0.2 NC(=O)CNCCCCCl 91b0d249813b9537c494010e0ff56806 [0,0,0,0,0,0|3,0,0]=3 578 B9R0.2 NC(=O)CNCCCCF 266a75105972b45ec53bdac26e4a879c [0,0,0,0,0,0|3,0,0]=3 579 B9R0.2 NC(=O)CNCCCCO 62ce2ccbca019bf132f148964623dade [0,0,0,0,0,0|3,0,0]=3 580 B9R0.2 NC(=O)CNCCCCS bd0394cf878f53354803b1f45e074f43 [0,0,0,0,0,0|3,0,0]=3 581 B9R0.2 NC(=O)COCCCC=O 3331eea59f5b213a8bc883bc25322ee4 [0,0,0,0,0,0|3,0,1]=4 582 B9R0.2 NC(=O)COCCCCF 14dff0e8e926e633d931e978e32c3d09 [0,0,0,0,0,0|3,0,0]=3 583 B9R0.2 NC(=O)COCCCCS 287c58cd717f129e5b7b2b33f356b434 [0,0,0,0,0,0|3,0,0]=3 584 B9R0.2 NC(=O)CSCCOCF 14682c52a5f07c528fa50fb51a4972f8 [0,0,0,0,0,0|4,0,0]=4 585 B9R0.2 NC(=O)NCCNCCBr 7b6a394120d98a26f1dfd558f05e07cd [0,0,0,0,0,0|4,0,0]=4 586 B9R0.2 NC(=O)NCCNCCF 35eef7ae71cc5353feac8e98a190f74f [0,0,0,0,0,0|4,0,0]=4 587 B9R0.2 NC(=O)NCCNCCI d917443d376c7dfdc07bbf005fce671c [0,0,0,0,0,0|4,0,0]=4 588 B9R0.2 NC(=O)NCCNCCO 2e9bc9ca7cc738e7b6594bad09ee0eb9 [0,0,0,0,0,0|4,0,0]=4 589 B9R0.2 NC(=O)NCCNCCS 4313366d691e8e9d57893f29664e4c12 [0,0,0,0,0,0|4,0,0]=4 590 B9R0.2 NC(=O)NCCOCCF 129f1e5c1f899d2f884fde6cbd9ca046 [0,0,0,0,0,0|4,0,0]=4 591 B9R0.2 NC(=O)NCCOCCS 79cf9a460b8e495c164eb27ce997fa62 [0,0,0,0,0,0|4,0,0]=4 592 B9R0.2 NC(=O)NCOCCCF d7a0112763cf1b00f62d3ac950564c44 [0,0,0,0,0,0|4,0,0]=4 593 B9R0.2 NC(=O)NCOCCCS 23550992a6fb2bd448026e7fb1bfb826 [0,0,0,0,0,0|4,0,0]=4 594 B9R0.2 NC(=O)SCNCCCCl 84fe23d07629c40540b095d1764b1d9c [0,0,0,0,0,0|4,0,0]=4 595 B9R0.2 NC(=O)SCNCCCO f6394a384382d5519237e2b0a9bd88b2 [0,0,0,0,0,0|4,0,0]=4 596 B9R0.2 NC(=O)SCOCCCF 2b6ed421c8f12eae9673459ab6cd6345 [0,0,0,0,0,0|4,0,0]=4 597 B9R0.2 NC(=O)SCOCCCS 2d42f2e5d53bbeef8f8598ad5ca8ce9d [0,0,0,0,0,0|4,0,0]=4 598 B9R0.2 NC(=S)CCNCCCF 805155b546f434c7412ce20b3049b3dd [0,0,0,0,0,0|3,1,0]=4 599 B9R0.2 NC(=S)CCNCCCO 75ed61683774dafebc495cba1abb320f [0,0,0,0,0,0|3,1,0]=4 600 B9R0.2 NC(=S)CCNCCCS 0b28be36689f39c6df7ad71695f37a02 [0,0,0,0,0,0|3,1,0]=4 601 B9R0.2 NC(=S)COCCCCF 7ba045ff5e578e6979af6ed388990604 [0,0,0,0,0,0|3,1,0]=4 602 B9R0.2 NOCCNCCC(=O)N 03ffc32aa3bc80027ebbc766920b3bd9 [0,0,0,0,0,0|4,0,0]=4 603 B9R0.2 NOCCNCCC(=O)O 97fb15aec87da8ce11a044d05cf9bad9 [0,0,0,0,0,0|3,0,0]=3 604 B9R0.2 O=C(O)/C=C/CNCCBr 9d755d7205a20dbe522663a089879b3a [0,0,0,0,0,0|2,0,2]=4 605 B9R0.2 O=C(O)/C=C/CNCCF b3131ced97b234b1289a5013b1e1c61c [0,0,0,0,0,0|2,0,2]=4 606 B9R0.2 O=C(O)/C=C/CNCCI ce769c9f0428b17440c76351c7e11247 [0,0,0,0,0,0|2,0,2]=4 607 B9R0.2 O=C(O)/C=C/CNCCO 93a89649b619dea89e7c11dfa7f7aa9d [0,0,0,0,0,0|2,0,2]=4 608 B9R0.2 O=C(O)/C=C/CNCCS 92abc05d6e84073df2dee1d135db5373 [0,0,0,0,0,0|2,0,2]=4 609 B9R0.2 O=C(O)/C=C/COCCF db5f7eff06251f8978f4f7d07daa01c2 [0,0,0,0,0,0|2,0,2]=4 610 B9R0.2 O=C(O)/C=C/COCCS 8a3013d354f5503b5682b578d368f0da [0,0,0,0,0,0|2,0,2]=4 611 B9R0.2 O=C(O)C#CCCOCF 497471b5d152ca87009def7b479dda07 [0,0,0,0,0,0|2,0,2]=4 612 B9R0.2 O=C(O)C#CCNCCF d916459483df03f83c79ddd8bf132a9a [0,0,0,0,0,0|2,0,2]=4 613 B9R0.2 O=C(O)C#CCNCCO 722522d57a7ff166b18ef92858ffaa37 [0,0,0,0,0,0|2,0,2]=4 614 B9R0.2 O=C(O)C#CCNCCS 84314e71a56c3f572abb0c5396cd84b3 [0,0,0,0,0,0|2,0,2]=4 615 B9R0.2 O=C(O)C#CCOCCF c436c74f3f0efb85e9b0d2a7bf2c9974 [0,0,0,0,0,0|2,0,2]=4 616 B9R0.2 O=C(O)C#CCOCCS 40f63cd55bd624dcf535531443872eb1 [0,0,0,0,0,0|2,0,2]=4 617 B9R0.2 O=C(O)C=CCNCCBr cf334d8d753b9386bfc69e4cfdf7de70 [0,0,0,0,0,0|2,0,2]=4 618 B9R0.2 O=C(O)C=CCNCCF 777a9c85e85fbc73694a5651e8be607e [0,0,0,0,0,0|2,0,2]=4 619 B9R0.2 O=C(O)C=CCNCCI 1b842602153f6c762c46e27cd24adee8 [0,0,0,0,0,0|2,0,2]=4 620 B9R0.2 O=C(O)C=CCNCCO 9ade19e93c03b7906f649b0ba2e47aaa [0,0,0,0,0,0|2,0,2]=4 621 B9R0.2 O=C(O)C=CCNCCS 6895181496316641d5fbe1ba3f2cbad9 [0,0,0,0,0,0|2,0,2]=4 622 B9R0.2 O=C(O)C=CCOCCF 6a1cced9ceb263fe986a90f4d7cb48be [0,0,0,0,0,0|2,0,2]=4 623 B9R0.2 O=C(O)C=CCOCCS 129f928d26e6fb7bee7caf0418eb6896 [0,0,0,0,0,0|2,0,2]=4 624 B9R0.2 O=C(O)CCCCNCF f1da66cc537567fc1409c1b8a001e59a [0,0,0,0,0,0|2,0,0]=2 625 B9R0.2 O=C(O)CCCCNCO a429407eaab02fb376aa947f0797c09f [0,0,0,0,0,0|2,0,0]=2 626 B9R0.2 O=C(O)CCCCOCF 272aa66e75d0e45407420628e364d2e7 [0,0,0,0,0,0|2,0,0]=2 627 B9R0.2 O=C(O)CCCNCCF 0ab78b72bdcdd94b4fcf99e3ac56449a [0,0,0,0,0,0|2,0,0]=2 628 B9R0.2 O=C(O)CCCNCCI 7033442a1b0a8ae6af132618bc1c6df8 [0,0,0,0,0,0|2,0,0]=2 629 B9R0.2 O=C(O)CCCNCCO aaad7be98a5cc430b61cd9b864cc9997 [0,0,0,0,0,0|2,0,0]=2 630 B9R0.2 O=C(O)CCCNCCS ec86078ea056d643545478c3e7a92429 [0,0,0,0,0,0|2,0,0]=2 631 B9R0.2 O=C(O)CCCOCCS d487913876e55d03c8afd0183250981c [0,0,0,0,0,0|2,0,0]=2 632 B9R0.2 O=C(O)CCNC/C=C/Cl 5d212c009cbd6e0333406b94db80def8 [0,0,0,0,0,0|2,0,2]=4 633 B9R0.2 O=C(O)CCNC/C=C\Cl 2ed01caa28591236085182ea8dcca007 [0,0,0,0,0,0|2,0,2]=4 634 B9R0.2 O=C(O)CCNC/C=C\O cc7c46dff9df63934b5a7f5ec4dd9c26 [0,0,0,0,0,0|2,0,2]=4 635 B9R0.2 O=C(O)CCNCCCCl 1f163366118bc570454513ac2f5e8fbb [0,0,0,0,0,0|2,0,0]=2 636 B9R0.2 O=C(O)CCNCCCF a17270c122f9805cda800592e5e91910 [0,0,0,0,0,0|2,0,0]=2 637 B9R0.2 O=C(O)CCNCCCO 11321b019c242b6c5e41fa5801169200 [0,0,0,0,0,0|2,0,0]=2 638 B9R0.2 O=C(O)CCNCCCS 9bd4ee04c37720e288052c22d2384dc9 [0,0,0,0,0,0|2,0,0]=2 639 B9R0.2 O=C(O)CCOC/C=C/Cl 2abbf4f0a2f661f4f26a27c9c78f4901 [0,0,0,0,0,0|2,0,2]=4 640 B9R0.2 O=C(O)CCOC/C=C\Cl df258de9bfd0d6613f70e3f829bf6607 [0,0,0,0,0,0|2,0,2]=4 641 B9R0.2 O=C(O)CCOCC#CI 8f9cd9db656bb0ed1fc94804ce868e17 [0,0,0,0,0,0|2,0,2]=4 642 B9R0.2 O=C(O)CCOCC=CCl 37717d633b95d88c1da7144f16178a4e [0,0,0,0,0,0|2,0,2]=4 643 B9R0.2 O=C(O)CCOCCCF 20d201b31423e454de60bb0a61187076 [0,0,0,0,0,0|2,0,0]=2 644 B9R0.2 O=C(O)CCOCCCS 63a015d01ea8847197749ff6208e8461 [0,0,0,0,0,0|2,0,0]=2 645 B9R0.2 O=C(O)CNCC#CCO 1548a91f4dc34d49239e48b7d1d36174 [0,0,0,0,0,0|2,0,2]=4 646 B9R0.2 O=C(O)CNCCCCCl 738ccc3cf8a76961c1007f23612565a7 [0,0,0,0,0,0|2,0,0]=2 647 B9R0.2 O=C(O)CNCCCCF 87df936d60601b25837503e691186b45 [0,0,0,0,0,0|2,0,0]=2 648 B9R0.2 O=C(O)CNCCCCO 8e5b81d8439207e41841bfd4f00422f6 [0,0,0,0,0,0|2,0,0]=2 649 B9R0.2 O=C(O)CNCCCCS 453564c18d03243292ce248980af0648 [0,0,0,0,0,0|2,0,0]=2 650 B9R0.2 O=C(O)COCCCCF 12acb17f17ee14046729a98f278631b2 [0,0,0,0,0,0|2,0,0]=2 651 B9R0.2 O=C(O)COCCCCS fb95717e8a0986d68c391e1936081030 [0,0,0,0,0,0|2,0,0]=2 652 B9R0.2 O=C(O)COCCNCF 902de3e0c3be70f497e3e8e70e7c0f34 [0,0,0,0,0,0|3,0,0]=3 653 B9R0.2 O=C(O)COCCNCO 4781d798b4b2130de47b72b21dee42b8 [0,0,0,0,0,0|3,0,0]=3 654 B9R0.2 O=C(O)COCCOCF 0f4018af36089db8a76afc74213c9dbd [0,0,0,0,0,0|3,0,0]=3 655 B9R0.2 O=C(O)CSCCNCF 51afe936143cd16b6a26fab50de7edfe [0,0,0,0,0,0|3,0,0]=3 656 B9R0.2 O=C(O)CSCCNCO b8a631e6ee072d2b9882ae854b7ed0da [0,0,0,0,0,0|3,0,0]=3 657 B9R0.2 O=CCCCNCC(=O)O 00744a469b104f3f873a6267c7e8ee73 [0,0,0,0,0,0|2,0,1]=3 658 B9R0.2 O=CCCCOCC(=O)O b0cdc41918441c731c2718b00d81dcd2 [0,0,0,0,0,0|2,0,1]=3 659 B9R0.2 O=CCCCOCS(=O)O 1dcdf7c86a879bcb167a68d25aac0ae8 [0,0,0,0,0,0|3,0,1]=4 660 B9R0.2 O=CCCNCCC(=O)O 65f36927815c9ad4e958ab911ae7459a [0,0,0,0,0,0|2,0,1]=3 661 B9R0.2 O=CCCNCCS(=O)O 5006ea26c2ce1237cdc32fc6352f753b [0,0,0,0,0,0|3,0,1]=4 662 B9R0.2 O=CCCOCCC(=O)O c361370d412c815155a03ec5c084d013 [0,0,0,0,0,0|2,0,1]=3 663 B9R0.2 O=CCNCCCC(=O)O b0fd6156dd240d44b8433e7a48df34bb [0,0,0,0,0,0|2,0,1]=3 664 B9R0.2 O=CNCCOCC(=O)O 46eb792ba4fe9d95e9ffe2e93cf32521 [0,0,0,0,0,0|3,0,1]=4 665 B9R0.2 O=COCCOCC(=O)O f3b4d97927494a2173d02be67bcc6a7f [0,0,0,0,0,0|3,0,1]=4 666 B9R0.2 O=S(O)CCNCCCF 0577de8adf853e021288f6381be8d968 [0,0,0,0,0,0|3,0,0]=3 667 B9R0.2 O=S(O)CCNCCCO b80775135ee13215474068b2db2ca5f5 [0,0,0,0,0,0|3,0,0]=3 668 B9R0.2 O=S(O)CCNCCCS fac970679249a41c630115703fcdd583 [0,0,0,0,0,0|3,0,0]=3 669 B9R0.2 O=S(O)COCCCCF 87791b3ea13bba76918751e06f5547fc [0,0,0,0,0,0|3,0,0]=3 670 B9R0.2 O=[N+]([O-])CCCCOCF 34ce3e9d4d4d044f38a6aab6e619804c [0,0,0,0,0,0|3,0,1]=4 671 B9R0.2 O=[N+]([O-])CCCNCCBr d97095d3096a81dd930ebcedc04afbfa [0,0,0,0,0,0|3,0,1]=4 672 B9R0.2 O=[N+]([O-])CCCNCCF 866c99d5d1c1fc2d40f4c58712fa6470 [0,0,0,0,0,0|3,0,1]=4 673 B9R0.2 O=[N+]([O-])CCCNCCI 66e47e6a14740eb0763c09765a180df4 [0,0,0,0,0,0|3,0,1]=4 674 B9R0.2 O=[N+]([O-])CCCNCCO 90f7f1659f973a0f0c96081c2531565c [0,0,0,0,0,0|3,0,1]=4 675 B9R0.2 O=[N+]([O-])CCCNCCS 8f48d9df371474654d00d20ceb451b89 [0,0,0,0,0,0|3,0,1]=4 676 B9R0.2 O=[N+]([O-])CCCOCCF 62b985c0a336b3da1fccbd61f9e0c129 [0,0,0,0,0,0|3,0,1]=4 677 B9R0.2 O=[N+]([O-])CCCOCCS 25f467362081a8714aa87462895c6ca2 [0,0,0,0,0,0|3,0,1]=4 678 B9R0.2 O=[N+]([O-])CCOCCCF 7f1d2dd6dac2fc4741d02c0c8c1f0cc2 [0,0,0,0,0,0|3,0,1]=4 679 B9R0.2 O=[N+]([O-])CCOCCCS ec5a51751798205dbe11e69c7a70e2da [0,0,0,0,0,0|3,0,1]=4 680 B9R0.2 O=[N+]([O-])CNCCCCCl d9106dc6d2931e6c2d7691c418a88654 [0,0,0,0,0,0|3,0,1]=4 681 B9R0.2 O=[N+]([O-])CNCCCCO c7b7bbbbbed0b17d54f2de7fbc9b845d [0,0,0,0,0,0|3,0,1]=4 682 B9R0.2 O=[N+]([O-])CNCCCCS ae5d8a496c45c148d58c60bfe8aee958 [0,0,0,0,0,0|3,0,1]=4 683 B9R0.2 O=[N+]([O-])COCCCCF 83dc5c762a6de902172ff9280deee049 [0,0,0,0,0,0|3,0,1]=4 684 B9R0.2 O=[N+]([O-])COCCCCS 4943a5e360ef82844e727f1f756fbb9d [0,0,0,0,0,0|3,0,1]=4 685 B8R0.4 C#CCCCCNC=O fab4e18c7200300872a81b2f8c434fc9 [1,0,0,0,0,0|1,0,2]=4 686 B8R0.4 C#CCCCCNCC 3fcf9ac93459248fb13bcf29c085c540 [1,0,0,0,0,0|2,0,1]=4 687 B8R0.4 C#CCCCCOCC 289e2b02f0139725ae39a923782166d5 [1,0,0,0,0,0|2,0,1]=4 688 B8R0.4 C#CCCCNCC=O 414eda3adfc1222b484fdc6699f74335 [1,0,0,0,0,0|1,0,2]=4 689 B8R0.4 C#CCCCNCCC 5741edfb5fc37a0fd94ab80872f199ae [1,0,0,0,0,0|2,0,1]=4 690 B8R0.4 C#CCCCOCC=O 2bd65d8b9d5cba6b9cf170827e92955f [1,0,0,0,0,0|1,0,2]=4 691 B8R0.4 C#CCCCOCCC f6e548e043c266c18f3f2bc45e2b26e7 [1,0,0,0,0,0|2,0,1]=4 692 B8R0.4 C#CCCNCCC=O bc9ca51a96083c72c5825d8142093fbc [1,0,0,0,0,0|1,0,2]=4 693 B8R0.4 C#CCCNCCCC d822834a6bb9f412f2c9985f130cc8f3 [1,0,0,0,0,0|2,0,1]=4 694 B8R0.4 C#CCCOCCC=O 7ad6db0675809531b0be56beb69dc38e [1,0,0,0,0,0|1,0,2]=4 695 B8R0.4 C#CCCOCCCC 85c008a45b6353cea119cc5cda149ac2 [1,0,0,0,0,0|2,0,1]=4 696 B8R0.4 C#CCNCCCC=O db8630cf98ea651c43d6ca8234e0542b [1,0,0,0,0,0|1,0,2]=4 697 B8R0.4 C#CCNCCCCC 6449ee4961bcec0a8b702070fb728670 [1,0,0,0,0,0|2,0,1]=4 698 B8R0.4 C#CCOCCCC=O b1ce2abc243e0e37befceddf354af1b6 [1,0,0,0,0,0|1,0,2]=4 699 B8R0.4 C#CCOCCCCC b060b391600b8a6b8af1e059657888e9 [1,0,0,0,0,0|2,0,1]=4 700 B8R0.4 C/C=C/CCCOCC 29e30394c7c806aedb2c26dcf7eb5a9a [1,0,0,0,0,0|2,0,1]=4 701 B8R0.4 C/C=C/CCOCC=O 5db978802355adcac3a83b93d1859621 [1,0,0,0,0,0|1,0,2]=4 702 B8R0.4 C/C=C/CCOCCC f366940c9b8e42845e1a3a54e7e58d66 [1,0,0,0,0,0|2,0,1]=4 703 B8R0.4 C/C=C/CNCCCC ce13f55ef8680a347af127fe05187ac2 [1,0,0,0,0,0|2,0,1]=4 704 B8R0.4 C/C=C/COCCC=O a43ce373801c50acebabd363747860bf [1,0,0,0,0,0|1,0,2]=4 705 B8R0.4 C/C=C/COCCCC 386b5fceec7ebb1bc8f3283962203eeb [1,0,0,0,0,0|2,0,1]=4 706 B8R0.4 C/C=C\CCCOCC 4d6755ca0163dc89f5ab91481d285f2d [1,0,0,0,0,0|2,0,1]=4 707 B8R0.4 C/C=C\CNCCCC b9e7ddbf697616b15bea928cc6394f2f [1,0,0,0,0,0|2,0,1]=4 708 B8R0.4 C/C=C\COCCC=O c26106eb88bd1cd81d1af342374c2631 [1,0,0,0,0,0|1,0,2]=4 709 B8R0.4 C/C=C\COCCCC c8285cb0cc053e0461398a5e6fb02665 [1,0,0,0,0,0|2,0,1]=4 710 B8R0.4 C=CCCCCNC=O d1a18970ef82160dc43ff2316b351101 [1,0,0,0,0,0|1,0,2]=4 711 B8R0.4 C=CCCCCNCC cad9e93d76afc8b0fa381258c4e7ac39 [1,0,0,0,0,0|2,0,0]=3 712 B8R0.4 C=CCCCCNCF 66d1b08c51ad91b8d794558a3082c457 [1,0,0,0,0,0|3,0,0]=4 713 B8R0.4 C=CCCCCNCO 0b537372ef9331045a9745fddf549658 [1,0,0,0,0,0|3,0,0]=4 714 B8R0.4 C=CCCCCOCC 60183f731400a1b7f9d49b3e8c9e971a [1,0,0,0,0,0|2,0,0]=3 715 B8R0.4 C=CCCCCOCF 652425cff1f9489e7dc290eddd18987a [1,0,0,0,0,0|3,0,0]=4 716 B8R0.4 C=CCCCNCC=O c6aa5d9295ee6884dda33ba20309e113 [1,0,0,0,0,0|1,0,2]=4 717 B8R0.4 C=CCCCNCCBr 43c775c72da8acf09a20a8db6ce741dc [1,0,0,0,0,0|3,0,0]=4 718 B8R0.4 C=CCCCNCCC ed9f94bd82f276e8a415d35039c9b633 [1,0,0,0,0,0|2,0,0]=3 719 B8R0.4 C=CCCCNCCF 5aae0c269d267d53802179e4cab94afb [1,0,0,0,0,0|3,0,0]=4 720 B8R0.4 C=CCCCNCCI 441ba7fe4c9dcc0c4d21c4a2bd530b1a [1,0,0,0,0,0|3,0,0]=4 721 B8R0.4 C=CCCCNCCO 8a1b35dc4f0997056aa8d06819d9c2fe [1,0,0,0,0,0|3,0,0]=4 722 B8R0.4 C=CCCCNCCS 2ab638d6017ad22dc1c1beb467a58251 [1,0,0,0,0,0|3,0,0]=4 723 B8R0.4 C=CCCCNCOC 617d1097d149d47807c995b2155094d5 [1,0,0,0,0,0|3,0,0]=4 724 B8R0.4 C=CCCCNCSC 2d25245ea1d2bd3af11d66f6de12b1b9 [1,0,0,0,0,0|3,0,0]=4 725 B8R0.4 C=CCCCOCC=O 2f101ef2b5e28437d61e44d8f0dff410 [1,0,0,0,0,0|1,0,2]=4 726 B8R0.4 C=CCCCOCCC 5f646296a8d9f451f6f7524888b9f8ed [1,0,0,0,0,0|2,0,0]=3 727 B8R0.4 C=CCCCOCCF 053da209f8e2fcf3d41519ae567dccd2 [1,0,0,0,0,0|3,0,0]=4 728 B8R0.4 C=CCCCOCCS 230273a3bde125da52158385e7b68364 [1,0,0,0,0,0|3,0,0]=4 729 B8R0.4 C=CCCCOCOC 1dd3d998493040ba8df98fd517ea651d [1,0,0,0,0,0|3,0,0]=4 730 B8R0.4 C=CCCCOCSC 7dc13b8df2da34a1b6ef8defe10e2334 [1,0,0,0,0,0|3,0,0]=4 731 B8R0.4 C=CCCNCCC=O dc8c76cf5e14247b5bfc6b4c26a93331 [1,0,0,0,0,0|1,0,2]=4 732 B8R0.4 C=CCCNCCCC bba294da38688174bb39fbd588941b97 [1,0,0,0,0,0|2,0,0]=3 733 B8R0.4 C=CCCNCCCCl 2f80890407d24a4d727a764aa3314000 [1,0,0,0,0,0|3,0,0]=4 734 B8R0.4 C=CCCNCCCF a727d01dc8aa52a771e9ef8cbecd1bb2 [1,0,0,0,0,0|3,0,0]=4 735 B8R0.4 C=CCCNCCCO fe03ee5320fba7694ee66066e81064aa [1,0,0,0,0,0|3,0,0]=4 736 B8R0.4 C=CCCNCCCS b5e2dc034d60fce9646b396f0e9d8f84 [1,0,0,0,0,0|3,0,0]=4 737 B8R0.4 C=CCCNCCOC d3b2c39d815d8d99aea063862b21fe54 [1,0,0,0,0,0|3,0,0]=4 738 B8R0.4 C=CCCNCCSC edc60d95e6e1f18c1ede12af162c8143 [1,0,0,0,0,0|3,0,0]=4 739 B8R0.4 C=CCCNCOCC 019c5c2eeb83b0d217acda6f874337c0 [1,0,0,0,0,0|3,0,0]=4 740 B8R0.4 C=CCCOCCC=O ec149354374d31933709b7996ee520e0 [1,0,0,0,0,0|1,0,2]=4 741 B8R0.4 C=CCCOCCCC 97ba8da216ed199156e3ec05890dcca1 [1,0,0,0,0,0|2,0,0]=3 742 B8R0.4 C=CCCOCCCF 3fad1ee7845cd193dab2bfc519ad2d31 [1,0,0,0,0,0|3,0,0]=4 743 B8R0.4 C=CCCOCCCS 40f27123e6e7a95472850525bbd82a49 [1,0,0,0,0,0|3,0,0]=4 744 B8R0.4 C=CCCOCCOC 022351562bd5b75ccdae2ce8a7420e05 [1,0,0,0,0,0|3,0,0]=4 745 B8R0.4 C=CCCOCCSC e83f2d78c318b4d5cdd4b25f8f4a6571 [1,0,0,0,0,0|3,0,0]=4 746 B8R0.4 C=CCCOCOCC b8653c6722f9d17f50ddc249f7a52472 [1,0,0,0,0,0|3,0,0]=4 747 B8R0.4 C=CCNCCCCC 011aacf19cd9f1faf70789f3f05aca79 [1,0,0,0,0,0|2,0,0]=3 748 B8R0.4 C=CCNCCCCCl 7aa8200102028ee39ddc7037de8d12db [1,0,0,0,0,0|3,0,0]=4 749 B8R0.4 C=CCNCCCCO 14862b294c4ab4be3b007c7c745e5432 [1,0,0,0,0,0|3,0,0]=4 750 B8R0.4 C=CCNCCCCS 48716fb5cc0bbebca36df7c37e5da77d [1,0,0,0,0,0|3,0,0]=4 751 B8R0.4 C=CCNCCCOC 923ce876ed91c87e8cbdf04842c12511 [1,0,0,0,0,0|3,0,0]=4 752 B8R0.4 C=CCNCCCSC 2d032fa75f30b2a66e30d570a29670d9 [1,0,0,0,0,0|3,0,0]=4 753 B8R0.4 C=CCNCCOCC 0140e609049b0aacf5d7bcd5e635cff9 [1,0,0,0,0,0|3,0,0]=4 754 B8R0.4 C=CCNCCSCC 608250712d81357a0c1b58128fe908dc [1,0,0,0,0,0|3,0,0]=4 755 B8R0.4 C=CCOCCCC=O 2fcafdb9cf3caf9087f3fbeee3f94cae [1,0,0,0,0,0|1,0,2]=4 756 B8R0.4 C=CCOCCCCC fcddc90e6084facec8d1d12eaaa08ee7 [1,0,0,0,0,0|2,0,0]=3 757 B8R0.4 C=CCOCCCCF 3ed7f37d0c490b735d4b7f46fe9299e9 [1,0,0,0,0,0|3,0,0]=4 758 B8R0.4 C=CCOCCCCS 5ee463a1daba4f9e9a9624695a91cccc [1,0,0,0,0,0|3,0,0]=4 759 B8R0.4 C=CCOCCCOC 6cdd1cb4e7f2bc1ad50092d2e92d5ed9 [1,0,0,0,0,0|3,0,0]=4 760 B8R0.4 C=CCOCCCSC 5081ad9926844b88206c1580515c6c03 [1,0,0,0,0,0|3,0,0]=4 761 B8R0.4 C=CCOCCOCC f2504b53763d9ba810aab3f8ab9269df [1,0,0,0,0,0|3,0,0]=4 762 B8R0.4 C=CCOCCSCC 4edb0350a839460b0e73853c19953683 [1,0,0,0,0,0|3,0,0]=4 763 B8R0.4 C=COCCCNCC d89071dcdb3acfadefaa437a059ee19e [1,0,0,0,0,0|3,0,0]=4 764 B8R0.4 C=COCCNCCC 28cdbba6a7c35ff41b7005cb4f953384 [1,0,0,0,0,0|3,0,0]=4 765 B8R0.4 C=COCCOCCC d3d0232a519269e090de053aa19caca6 [1,0,0,0,0,0|3,0,0]=4 766 B8R0.4 CC#CCCOCC=O 4c04347fb225e9caa89db4068f49522e [1,0,0,0,0,0|1,0,2]=4 767 B8R0.4 CC#CCNCCC=O 695aaa08bc1098a9ad9b2ad16ca9a18d [1,0,0,0,0,0|1,0,2]=4 768 B8R0.4 CC#CCOCCC=O 12f959adc804eb71938fa75dc36ad2f6 [1,0,0,0,0,0|1,0,2]=4 769 B8R0.4 CC/C=C/COCC=O 397bbf00664315773de6e24f33c3ac9b [1,0,0,0,0,0|1,0,2]=4 770 B8R0.4 CC/C=C\COCC=O 59f6dd0fa4df871899af277da158060d [1,0,0,0,0,0|1,0,2]=4 771 B8R0.4 CC=CCCCOCC 5c3740efae5691bcaf9a76740bada28e [1,0,0,0,0,0|2,0,1]=4 772 B8R0.4 CC=CCNCCC=O 2a80025488f2160a303377e7638af432 [1,0,0,0,0,0|1,0,2]=4 773 B8R0.4 CC=CCNCCCC 6c09d356389ec0afd4d9be0c8efbc370 [1,0,0,0,0,0|2,0,1]=4 774 B8R0.4 CC=CCOCCC=O 11b79e80ce2ed0bdd15b0d17abab0682 [1,0,0,0,0,0|1,0,2]=4 775 B8R0.4 CC=CCOCCCC 071b2f24d4974b0b4fcd0a0845303916 [1,0,0,0,0,0|2,0,1]=4 776 B8R0.4 CCC#CCOCC=O 99290f74ddb0278e9538fb31d6282bff [1,0,0,0,0,0|1,0,2]=4 777 B8R0.4 CCCCCCNC#N bb02e52ec524ebcb56f04e4bf9b34243 [1,0,0,0,0,0|2,0,1]=4 778 B8R0.4 CCCCCCNC=O e5c1cbb738d0eb89b1d21f4508106baa [1,0,0,0,0,0|1,0,0]=2 779 B8R0.4 CCCCCCNCC 007e02c518c21b960782cd7d67a6f9d7 [1,0,0,0,0,0|2,0,1]=4 780 B8R0.4 CCCCCCNCF fcc33172a41ee2d3e601afc70a912863 [1,0,0,0,0,0|2,0,1]=4 781 B8R0.4 CCCCCCNCO fee4d07ce0e7c74e0c9bf65bf9405250 [1,0,0,0,0,0|1,0,1]=3 782 B8R0.4 CCCCCCOCC 9345e14939c0037a8cd7124fa95af69b [1,0,0,0,0,0|2,0,1]=4 783 B8R0.4 CCCCCCOCF 5545a0a4abb65fe9a326f72bb8454219 [1,0,0,0,0,0|2,0,1]=4 784 B8R0.4 CCCCCNCC#N 0c9f40f537b6e3cc81cf454315cbd283 [1,0,0,0,0,0|2,0,1]=4 785 B8R0.4 CCCCCNCC=O 8ada82f0f40b5a52493af2d9d7bdb07d [1,0,0,0,0,0|1,0,0]=2 786 B8R0.4 CCCCCNCCBr 089f5434d612eac8e3264fb2af68de09 [1,0,0,0,0,0|2,0,1]=4 787 B8R0.4 CCCCCNCCC e1899f21e9e3263889e806dca2898495 [1,0,0,0,0,0|2,0,1]=4 788 B8R0.4 CCCCCNCCF 08736e9d031b962149008af4dbbae1ec [1,0,0,0,0,0|2,0,1]=4 789 B8R0.4 CCCCCNCCI 451535c8d9a592fc4903d9a80bb5e070 [1,0,0,0,0,0|2,0,1]=4 790 B8R0.4 CCCCCNCCO f9b71f37f65a5dd4fd3f51e1e821c5a0 [1,0,0,0,0,0|1,0,1]=3 791 B8R0.4 CCCCCNCCS 8d24f5c417bfd50b34a0c81d07c624ad [1,0,0,0,0,0|1,1,1]=4 792 B8R0.4 CCCCCNCOC 39758a02c0fddd5394c0093195bca6be [1,0,0,0,0,0|3,0,0]=4 793 B8R0.4 CCCCCNCSC a12f2c65341920caab6c80b675bb648f [1,0,0,0,0,0|3,0,0]=4 794 B8R0.4 CCCCCOCC#N 000a9d63180c20d434c83376e668a582 [1,0,0,0,0,0|2,0,1]=4 795 B8R0.4 CCCCCOCC=O 95ddace22ad0ae385e1b30e1a33c697f [1,0,0,0,0,0|1,0,0]=2 796 B8R0.4 CCCCCOCCC c08adbc8512009f4d669d9cfc0c3fe67 [1,0,0,0,0,0|2,0,1]=4 797 B8R0.4 CCCCCOCCF b565148eef0c482ff0e6a7dc3e323e46 [1,0,0,0,0,0|2,0,1]=4 798 B8R0.4 CCCCCOCCS c4cd0a419631483dc8c725004b7f7323 [1,0,0,0,0,0|1,1,1]=4 799 B8R0.4 CCCCCOCOC b5b3100512c55f3430f83e20b695c569 [1,0,0,0,0,0|3,0,0]=4 800 B8R0.4 CCCCCOCSC a7f8dc7f97f2742c2c3f78a6bcb15d4b [1,0,0,0,0,0|3,0,0]=4 801 B8R0.4 CCCCNC/C=C/Cl aefc90227738a0a04d85ff4e3fb94a96 [1,0,0,0,0,0|2,0,1]=4 802 B8R0.4 CCCCNC/C=C\Cl 95b879f76fb0ff759a3b6bfdbdb337b9 [1,0,0,0,0,0|2,0,1]=4 803 B8R0.4 CCCCNC/C=C\O 030dd5950e83ae29a206c0c1dbd703ac [1,0,0,0,0,0|1,0,1]=3 804 B8R0.4 CCCCNCCC#N 21edaa6d14ae0b8b41d896f5ebbcc463 [1,0,0,0,0,0|2,0,1]=4 805 B8R0.4 CCCCNCCC=O cc5d699181445c3bad4f64b752b1821b [1,0,0,0,0,0|1,0,0]=2 806 B8R0.4 CCCCNCCCC 83f5cde9216aaf13647a8beda79dab35 [1,0,0,0,0,0|2,0,1]=4 807 B8R0.4 CCCCNCCCCl 0f00c3c3f44f250cab48b92e5412d8a7 [1,0,0,0,0,0|2,0,1]=4 808 B8R0.4 CCCCNCCCF c8a2e79bdb0d1cc8343903c43e081085 [1,0,0,0,0,0|2,0,1]=4 809 B8R0.4 CCCCNCCCO 49b3fdf08e01f17758987c7a7e8bba30 [1,0,0,0,0,0|1,0,1]=3 810 B8R0.4 CCCCNCCCS ebec18e8f39c6ffc0f0fe747a0704631 [1,0,0,0,0,0|1,1,1]=4 811 B8R0.4 CCCCNCCOC e55b55af56c3c637798ec9c85f7b8020 [1,0,0,0,0,0|3,0,0]=4 812 B8R0.4 CCCCNCCON dd65b96d468031dc7885056626818eac [1,0,0,0,0,0|3,0,0]=4 813 B8R0.4 CCCCNCCSC 59b636301e9a63ee9269f9fefc2f0cbb [1,0,0,0,0,0|3,0,0]=4 814 B8R0.4 CCCCOC/C=C/Cl 568b090b21b75e4cb48d2918836f8eba [1,0,0,0,0,0|2,0,1]=4 815 B8R0.4 CCCCOC/C=C\Cl 9d90a4fa764ef1d03091eed959904ce8 [1,0,0,0,0,0|2,0,1]=4 816 B8R0.4 CCCCOCC=CCl 0f3a0d8674fc69f02691e3930c83fca6 [1,0,0,0,0,0|2,0,1]=4 817 B8R0.4 CCCCOCCC#N d96485889b3a21063dcc51f113b3be83 [1,0,0,0,0,0|2,0,1]=4 818 B8R0.4 CCCCOCCC=O 72658ceb532935f03c9214743d27894e [1,0,0,0,0,0|1,0,0]=2 819 B8R0.4 CCCCOCCCC a5b0ef99667fb81b30d5c592594cbe40 [1,0,0,0,0,0|2,0,1]=4 820 B8R0.4 CCCCOCCCF 45b018660e48781496e6d186d7b4c5cd [1,0,0,0,0,0|2,0,1]=4 821 B8R0.4 CCCCOCCCS 0d2d1055462c2504dc523af75dd3766f [1,0,0,0,0,0|1,1,1]=4 822 B8R0.4 CCCCOCCOC 6735cacff3b7f7ef1ac59b3af2d64f94 [1,0,0,0,0,0|3,0,0]=4 823 B8R0.4 CCCCOCCSC 7ffec2766bbf61d3fb8039a26d074049 [1,0,0,0,0,0|3,0,0]=4 824 B8R0.4 CCCNCCCC#N 0e4bb5c930d4405af9112d69df156b92 [1,0,0,0,0,0|2,0,1]=4 825 B8R0.4 CCCNCCCC=O 7ef3dd3b1a5b87258ceb3eef303de84a [1,0,0,0,0,0|1,0,0]=2 826 B8R0.4 CCCNCCCCCl 86d3fabc966fee554ec309bcdb6a6f42 [1,0,0,0,0,0|2,0,1]=4 827 B8R0.4 CCCNCCCCF f801e13fe9947adffb3521a5945c4de9 [1,0,0,0,0,0|2,0,1]=4 828 B8R0.4 CCCNCCCCO 101d8adf768a1371279ab06c67e1a854 [1,0,0,0,0,0|1,0,1]=3 829 B8R0.4 CCCNCCCCS e81cbea71a1d34af60d6fe3b38b1645e [1,0,0,0,0,0|1,1,1]=4 830 B8R0.4 CCCNCCCOC 97e272a50a3dc43fab42b265af642693 [1,0,0,0,0,0|3,0,0]=4 831 B8R0.4 CCCNCCCSC a1fb4fe81d031e7dcffdf0d0cda484e8 [1,0,0,0,0,0|3,0,0]=4 832 B8R0.4 CCCOC/C=C/C=O 88e4ab35b9a1c04df8f17a2331d70828 [1,0,0,0,0,0|1,0,2]=4 833 B8R0.4 CCCOCCCC#N b3a2f594f5ca80ef3759bc59478543ea [1,0,0,0,0,0|2,0,1]=4 834 B8R0.4 CCCOCCCC=O 36a3d4a82e0ed496435ff747ce5facc5 [1,0,0,0,0,0|1,0,0]=2 835 B8R0.4 CCCOCCCCF 4b4695bfbe072018bc890c8e6fdbfb83 [1,0,0,0,0,0|2,0,1]=4 836 B8R0.4 CCCOCCCCS 0885ae66405cbad0900445dfe2d6de97 [1,0,0,0,0,0|1,1,1]=4 837 B8R0.4 CCCOCCCOC 8f84ed15eeef50c54bbb8786899dacf1 [1,0,0,0,0,0|3,0,0]=4 838 B8R0.4 CCCOCCCSC 8c60126d0675ea04220b398e82d839b9 [1,0,0,0,0,0|3,0,0]=4 839 B8R0.4 CCCOCCNC=O 698de65c018187ef4a1695deaa4ff61b [1,0,0,0,0,0|2,0,0]=3 840 B8R0.4 CCCOCCNCO 8595bcbbbf5fd075137f627b7ec6b8b8 [1,0,0,0,0,0|2,0,1]=4 841 B8R0.4 CCCOCCOC=O 55073fa6df391382112376726b3f158f [1,0,0,0,0,0|2,0,0]=3 842 B8R0.4 CCNCCCCC#N 9e15e29ecbde2ec66e303cda1d143969 [1,0,0,0,0,0|2,0,1]=4 843 B8R0.4 CCNCCCCCCl d0609d1c7cda7ae2e8395ed8f09a6278 [1,0,0,0,0,0|2,0,1]=4 844 B8R0.4 CCNCCCCCO d908c3b79a6fe3de0920b09f17e57911 [1,0,0,0,0,0|1,0,1]=3 845 B8R0.4 CCNCCCCOC 2651322fa047b3732accc75cc3da11da [1,0,0,0,0,0|3,0,0]=4 846 B8R0.4 CCNCCCCSC 49c922b465a04d36e231bfa2a39a115f [1,0,0,0,0,0|3,0,0]=4 847 B8R0.4 CCNCCOCCO ab40f68d3f552d1a5970b56d1caa576b [1,0,0,0,0,0|2,0,1]=4 848 B8R0.4 CCNCCSCCO 0756ee7e2e7cb3b848634875dd09b614 [1,0,0,0,0,0|2,0,1]=4 849 B8R0.4 CCOCCCCC#N a89281f5bb95502482baedf76edf677f [1,0,0,0,0,0|2,0,1]=4 850 B8R0.4 CCOCCCCC=O d263cb2a99b9780b9b3058ad6e318449 [1,0,0,0,0,0|1,0,0]=2 851 B8R0.4 CCOCCCCOC 884278e30d78a09f4fe2f7feb30d0d3f [1,0,0,0,0,0|3,0,0]=4 852 B8R0.4 CCOCCCCSC c32f6fe4365f04c7fe23f7790fb72a1b [1,0,0,0,0,0|3,0,0]=4 853 B8R0.4 CCOCCCNC=O 0935cc0e22c341f4c068e5af7412e4dc [1,0,0,0,0,0|2,0,0]=3 854 B8R0.4 CCOCCCNCO bfe6253cc19f5ad9b4c9906398627a21 [1,0,0,0,0,0|2,0,1]=4 855 B8R0.4 CCOCCNCC=O 9b6362b955c81d6a818d07f93060ce81 [1,0,0,0,0,0|2,0,0]=3 856 B8R0.4 CCOCCNCCO d1a45d737dc86da6f39330718d51704a [1,0,0,0,0,0|2,0,1]=4 857 B8R0.4 CCOCCOCC=O 0f0b31cfd13d5d1ef62013c36758792f [1,0,0,0,0,0|2,0,0]=3 858 B8R0.4 CCOCNCCCO 23eae121855a8a5e5052222178789d02 [1,0,0,0,0,0|2,0,1]=4 859 B8R0.4 CCOCOCCC=O 00ff08f097e74805397d4946d664ecfe [1,0,0,0,0,0|2,0,0]=3 860 B8R0.4 CCSCCNCC=O 8c2eb03b3d86184cc927f5d4b3c77ac6 [1,0,0,0,0,0|2,0,0]=3 861 B8R0.4 CCSCCNCCO 705a322c53733f80608fa2aca65490a0 [1,0,0,0,0,0|2,0,1]=4 862 B8R0.4 CCSCCOCC=O 6eeca61611fda4d213ea1a5d8f547156 [1,0,0,0,0,0|2,0,0]=3 863 B8R0.4 COCCCCNC=O 6e2b3dcc61de1f0bdb65d861415360be [1,0,0,0,0,0|2,0,0]=3 864 B8R0.4 COCCCCNCO 51786f99381d54403ea46d9383ba40cc [1,0,0,0,0,0|2,0,1]=4 865 B8R0.4 COCCCNCC=O 79f3770a5332c7aa2006f56f8caadfb2 [1,0,0,0,0,0|2,0,0]=3 866 B8R0.4 COCCCNCCO b882d8685487a56fc2c12e34e8e227c1 [1,0,0,0,0,0|2,0,1]=4 867 B8R0.4 COCCCOCC=O 0c2e972178898bc6d1628b2f4858b03c [1,0,0,0,0,0|2,0,0]=3 868 B8R0.4 COCCNC/C=C\O 13bebf1afca106dd27e870525bacfbef [1,0,0,0,0,0|2,0,1]=4 869 B8R0.4 COCCNCCC=O 231f83e2145cee673a577fcbc59607dc [1,0,0,0,0,0|2,0,0]=3 870 B8R0.4 COCCNCCCO f3bbaa1e3688613cc916b70ff8bfcc57 [1,0,0,0,0,0|2,0,1]=4 871 B8R0.4 COCCOCCC=O 2cddfa1660d37f7f1ab97a7bd88a1df8 [1,0,0,0,0,0|2,0,0]=3 872 B8R0.4 COCNCCCCO ca8efaa5098c48b237959f5a1a115e02 [1,0,0,0,0,0|2,0,1]=4 873 B8R0.4 COCOCCCC=O 684e0671f7887e8ada626a3c87e02a67 [1,0,0,0,0,0|2,0,0]=3 874 B8R0.4 COCOCCNC=O d2f3dc716da407412ea36aea7489896a [1,0,0,0,0,0|3,0,0]=4 875 B8R0.4 COCOCCOC=O 773d5ab92f0785e20c35a5ecfa8aef71 [1,0,0,0,0,0|3,0,0]=4 876 B8R0.4 CSCCCCNC=O c239594501a90b4a128618f0c7081c5b [1,0,0,0,0,0|2,0,0]=3 877 B8R0.4 CSCCCCNCO ae40ab4fa2d5d94966b509e075b958da [1,0,0,0,0,0|2,0,1]=4 878 B8R0.4 CSCCCNCC=O 639a0134481756177dfb6e8b26f25146 [1,0,0,0,0,0|2,0,0]=3 879 B8R0.4 CSCCCNCCO e9c80523ec93ea29d1d50e3a2efe78d7 [1,0,0,0,0,0|2,0,1]=4 880 B8R0.4 CSCCCOCC=O 9aff7a336ececb72c4fe588f28037e70 [1,0,0,0,0,0|2,0,0]=3 881 B8R0.4 CSCCNC/C=C\O 681ef3c26cbbe7632f3156f1e9d2b2b7 [1,0,0,0,0,0|2,0,1]=4 882 B8R0.4 CSCCNCCC=O 6a9c051f85f5257fb975b52def5686c5 [1,0,0,0,0,0|2,0,0]=3 883 B8R0.4 CSCCNCCCO f6b1a735d91925126b38940200756072 [1,0,0,0,0,0|2,0,1]=4 884 B8R0.4 CSCCOCCC=O b536dffbb68d78cf6840eddbe6be827c [1,0,0,0,0,0|2,0,0]=3 885 B8R0.4 CSCNCCCCO a8527b20316a926f95cc7546183714ca [1,0,0,0,0,0|2,0,1]=4 886 B8R0.4 CSCOCCCC=O 02e58623d80bf7d5cca843eacdf2cd45 [1,0,0,0,0,0|2,0,0]=3 887 B8R0.4 CSCOCCNC=O 06cab0f55d10d488e369b65237bc7019 [1,0,0,0,0,0|3,0,0]=4 888 B8R0.4 CSCOCCOC=O 6b8870cbaaae325b360a7cd8be5fab08 [1,0,0,0,0,0|3,0,0]=4 889 B8R0.4 N#CCCCCNC=O 3cd3800040138849f83fc8af50952e52 [1,0,0,0,0,0|2,0,1]=4 890 B8R0.4 N#CCCCNCC=O d854d0cd92fb97dc75a49fe1b07d6ea0 [1,0,0,0,0,0|2,0,1]=4 891 B8R0.4 N#CCCCOCC=O 5021bfa282317572b50730c05559236b [1,0,0,0,0,0|2,0,1]=4 892 B8R0.4 N#CCCNCCC=O 9cc2d29cdddc221cdc2d9562c603ab42 [1,0,0,0,0,0|2,0,1]=4 893 B8R0.4 N#CCCOCCC=O 7ec41fdd2ff1ba3ed3a0b9e19f3d2454 [1,0,0,0,0,0|2,0,1]=4 894 B8R0.4 N#CCNCCCC=O 10d777fdcdfc9a0ea350c9cb897ad0ef [1,0,0,0,0,0|2,0,1]=4 895 B8R0.4 N#CCOCCCC=O 5d03e3c86ae9653ce110fc1972a6bc02 [1,0,0,0,0,0|2,0,1]=4 896 B8R0.4 N#CNCCCCC=O cb223ce8e3f3f6933ad650f40cb8dd32 [1,0,0,0,0,0|2,0,1]=4 897 B8R0.4 NOCCNCCC=O a28664bdd7f1423388d38847fe6fa46f [1,0,0,0,0,0|3,0,0]=4 898 B8R0.4 O/C=C\CNCCCCl db29be0ef4ab6e7b81b2d735c091af58 [1,0,0,0,0,0|2,0,1]=4 899 B8R0.4 O/C=C\CNCCCO 14ada9ed5b23c992c320c0d37acff264 [1,0,0,0,0,0|2,0,1]=4 900 B8R0.4 O=CCCCCOCF 85b3ca7ddc0c3fb867d0185bbf0921f7 [1,0,0,0,0,0|2,0,0]=3 901 B8R0.4 O=CCCCNCCBr 5e09bfc9621932d4fb0368b0d04a42bb [1,0,0,0,0,0|2,0,0]=3 902 B8R0.4 O=CCCCNCCF 9ef00e7f50632796f91c39cf64b27b1e [1,0,0,0,0,0|2,0,0]=3 903 B8R0.4 O=CCCCNCCI abb8da695e5124ac987c7d8731b9762b [1,0,0,0,0,0|2,0,0]=3 904 B8R0.4 O=CCCCNCCO 1bdd2d1ee3e05ff4d3000e48e13914eb [1,0,0,0,0,0|2,0,0]=3 905 B8R0.4 O=CCCCNCCS 303aeb6b773578a67453b1630ba18dc2 [1,0,0,0,0,0|2,0,0]=3 906 B8R0.4 O=CCCCOCC=O a3d7179e2fd1cae25f7f53e552046696 [1,0,0,0,0,0|2,0,1]=4 907 B8R0.4 O=CCCCOCCF e7532aaece8a67865517c3b01b67c5ec [1,0,0,0,0,0|2,0,0]=3 908 B8R0.4 O=CCCCOCCS 991b115ad7b60aa47bc8f80580adc02b [1,0,0,0,0,0|2,0,0]=3 909 B8R0.4 O=CCCNCCCCl f16c75c276bf2599e9ae201a54b0ee63 [1,0,0,0,0,0|2,0,0]=3 910 B8R0.4 O=CCCNCCCO 20d68d5fd2c369dcd2205fd4753202b2 [1,0,0,0,0,0|2,0,0]=3 911 B8R0.4 O=CCCOCCC=O 9ddac43159e400089a6db60f04bc736c [1,0,0,0,0,0|2,0,1]=4 912 B8R0.4 O=CCCOCCCF 12bf2bf84237f34effc6d41e7d4e1236 [1,0,0,0,0,0|2,0,0]=3 913 B8R0.4 O=CCCOCCCS fa8d8cbc8a3558586641843cfd71f1ec [1,0,0,0,0,0|2,0,0]=3 914 B8R0.4 O=CCNCCCCCl 4eb32c99e72aaf8f46243cc4018004a5 [1,0,0,0,0,0|2,0,0]=3 915 B8R0.4 O=CCNCCCCO 7540d6cb2ce4253a8b70f8723f610795 [1,0,0,0,0,0|2,0,0]=3 916 B8R0.4 O=CCNCCCCS 87cb67d97c5146189dcb0b12c7de3eeb [1,0,0,0,0,0|2,0,0]=3 917 B8R0.4 O=CCOCCCCF 1f1ad11e7509bf0f0a0f4a0a60b01a6b [1,0,0,0,0,0|2,0,0]=3 918 B8R0.4 O=CCOCCCCS 65f9d64787faff90f142a6384e5b9a2f [1,0,0,0,0,0|2,0,0]=3 919 B8R0.4 O=CCOCCOCF bfda5f83f4865dfb775a71a596865b83 [1,0,0,0,0,0|3,0,0]=4 920 B8R0.4 O=CNCCCCCCl 66cea552e3781af1cb79b403cbf86bb3 [1,0,0,0,0,0|2,0,0]=3 921 B8R0.4 O=CNCCCCCO d786d8c3b7589bade0484b0d1e3b2e3b [1,0,0,0,0,0|2,0,0]=3 922 B8R0.4 O=CNCCOCCF c8a5c0eacdcd1d316a424c4005d58ef9 [1,0,0,0,0,0|3,0,0]=4 923 B8R0.4 O=CNCCOCCO 2965d694fa10a828f84ff41ee0bcab8c [1,0,0,0,0,0|3,0,0]=4 924 B8R0.4 O=CNCCOCCS fd3b3090b4eefe81cd9992494316f59f [1,0,0,0,0,0|3,0,0]=4 925 B8R0.4 O=CNCCSCCO 6350af265f31b9f5de0271d49057ec24 [1,0,0,0,0,0|3,0,0]=4 926 B8R0.4 O=COCCOCCF 3ac9afe53341268fdfe07221ba11eb92 [1,0,0,0,0,0|3,0,0]=4 927 B8R0.4 O=COCCOCCS e57473f45057007c5c8548c766fce976 [1,0,0,0,0,0|3,0,0]=4 928 B8R0.4 OCCCCCNCF 25d56bc8c15e4c20f5a184f918113f82 [1,0,0,0,0,0|2,0,1]=4 929 B8R0.4 OCCCCCNCO 038987fbd20376da0184e7a2bb8e961a [1,0,0,0,0,0|2,0,1]=4 930 B8R0.4 OCCCCNCCBr b8272bf99e189e04880dcfd730231b2b [1,0,0,0,0,0|2,0,1]=4 931 B8R0.4 OCCCCNCCF 2daa62cc0028d64bc29fafcad94d748e [1,0,0,0,0,0|2,0,1]=4 932 B8R0.4 OCCCCNCCI cdb4dde329b0741952f850c2dd02d1b5 [1,0,0,0,0,0|2,0,1]=4 933 B8R0.4 OCCCCNCCO e72d5640c9e9814577fc90927ba3cf97 [1,0,0,0,0,0|2,0,1]=4 934 B8R0.4 OCCCCNCCS 5d16d6e12c3caf8d554ea26242ff4070 [1,0,0,0,0,0|2,0,1]=4 935 B8R0.4 OCCCNCCCCl 44f2130d0900b9b9a2e68588ed818b63 [1,0,0,0,0,0|2,0,1]=4 936 B8R0.4 OCCCNCCCF 201bb160220db94d82abc76c90013df3 [1,0,0,0,0,0|2,0,1]=4 937 B8R0.4 OCCCNCCCO edf3eb30c42c02706057aad3f4a6d1c1 [1,0,0,0,0,0|2,0,1]=4 938 B8R0.4 OCCCNCCCS 75a172a7fa3542a9588af5e5e0868eac [1,0,0,0,0,0|2,0,1]=4 939 B8R0.4 OCCNCCCCCl a1e2d068725a16b76d30dd03cf072ef5 [1,0,0,0,0,0|2,0,1]=4 940 B8R0.4 OCCNCCCCF 7519fd252ff10beaab56e21a65ca208e [1,0,0,0,0,0|2,0,1]=4 941 B8R0.4 OCCNCCCCS 27274de9e3a3d0b9a3b84ebefc58a4e3 [1,0,0,0,0,0|2,0,1]=4 942 B8R0.4 OCNCCCCCCl e4dd2c6014a8adf50a81d9204a644674 [1,0,0,0,0,0|2,0,1]=4 943 B8R0.7 C#CCCNCC(=O)O a62cfb736e7f82a3494237514cacf08e [1,0,0,0,0,0|1,0,2]=4 944 B8R0.7 C#CCCOCC(=O)O 7b766f5b88fb0ecd599c5abf9efbeabf [1,0,0,0,0,0|1,0,2]=4 945 B8R0.7 C#CCNCCC(=O)O 6efd5e85084acab9c542105691239e32 [1,0,0,0,0,0|1,0,2]=4 946 B8R0.7 C#CCOCCC(=O)O 4db8817d78a49abe243c505f5b6fbd25 [1,0,0,0,0,0|1,0,2]=4 947 B8R0.7 C/C=C/CNCC(=O)O c42f2b1a73316da9e67d3841e3bba390 [1,0,0,0,0,0|1,0,2]=4 948 B8R0.7 C/C=C/COCC(=O)O 226b10d27bfff6e38810e52e502a3510 [1,0,0,0,0,0|1,0,2]=4 949 B8R0.7 C/C=C\CNCC(=O)O f297a0a2509c5e78c48c40fb1dbd770d [1,0,0,0,0,0|1,0,2]=4 950 B8R0.7 C/C=C\COCC(=O)O e58cd13c0ed7a7febac3a76fdbabc6bc [1,0,0,0,0,0|1,0,2]=4 951 B8R0.7 C=C(Br)CCOCCC 724052c822c0bef7448f44a794bff992 [1,0,0,0,0,0|3,0,0]=4 952 B8R0.7 C=C(Br)CNCCCC 7c9c44e81bf00a83350435698bbd8321 [1,0,0,0,0,0|3,0,0]=4 953 B8R0.7 C=C(Br)COCCCC ec6d613824c971053aa03d22d6526bd3 [1,0,0,0,0,0|3,0,0]=4 954 B8R0.7 C=C(C)CCCOCC 36ef5adff872f4dda81f11eae3241c37 [1,0,0,0,0,0|3,0,0]=4 955 B8R0.7 C=C(C)CCNCCC 4d1900f680cbfef6ffe5a77e2294dd65 [1,0,0,0,0,0|3,0,0]=4 956 B8R0.7 C=C(C)CCOCCC 845281f0f16ba18f3aad20093af18d36 [1,0,0,0,0,0|3,0,0]=4 957 B8R0.7 C=C(C)CNCCCC 47f5fb139675fc765be0663116650609 [1,0,0,0,0,0|3,0,0]=4 958 B8R0.7 C=C(C)COCCCC 260d3670dc084e87502d9a9ffe570e3c [1,0,0,0,0,0|3,0,0]=4 959 B8R0.7 C=C(Cl)CNCCCC 8cde48ce042cc357f299abd3d75de5f6 [1,0,0,0,0,0|3,0,0]=4 960 B8R0.7 C=C(Cl)COCCCC b9221f326393a29bb0b2b7fc0007ae8a [1,0,0,0,0,0|3,0,0]=4 961 B8R0.7 C=C(F)CNCCCC d50f3d468cf2542e6029912d15cd6fb8 [1,0,0,0,0,0|3,0,0]=4 962 B8R0.7 C=C(F)COCCCC 985eead93b4fa2eb0f6e6420dae41362 [1,0,0,0,0,0|3,0,0]=4 963 B8R0.7 C=C(I)COCCCC ad06c21e680b3d0f2a946d2102fcc07e [1,0,0,0,0,0|3,0,0]=4 964 B8R0.7 C=CCCNCC(=O)O 76a631439fa66be5cf3013ae0e834c6c [1,0,0,0,0,0|1,0,2]=4 965 B8R0.7 C=CCCOCC(=O)O 0512617a8ef9955ac95bbc007cf463ba [1,0,0,0,0,0|1,0,2]=4 966 B8R0.7 C=CCNCCC(=O)O 4a5debfd45f8c7320860717744993f2a [1,0,0,0,0,0|1,0,2]=4 967 B8R0.7 C=CCOCCC(=O)O 9ce82e4dfa256c2803f66fd7129065f2 [1,0,0,0,0,0|1,0,2]=4 968 B8R0.7 CC#CCNCC(=O)O 839a83969460cb5276f0ce2f33e20420 [1,0,0,0,0,0|1,0,2]=4 969 B8R0.7 CC#CCOCC(=O)O fcec6ff15e4ba99fb579eff8ab750539 [1,0,0,0,0,0|1,0,2]=4 970 B8R0.7 CC(=O)CCCOCF c94204172541830dae5131095b16871b [1,0,0,0,0,0|3,0,0]=4 971 B8R0.7 CC(=O)CCNCCBr 24723ec774300f363e1c4ef5edc15c1c [1,0,0,0,0,0|3,0,0]=4 972 B8R0.7 CC(=O)CCNCCF 40798bc4989369da7dcdf726fe0e87a1 [1,0,0,0,0,0|3,0,0]=4 973 B8R0.7 CC(=O)CCNCCI d7d5a1870b965338fecd7489cd9c07db [1,0,0,0,0,0|3,0,0]=4 974 B8R0.7 CC(=O)CCNCCO a83400d724de744cf447c1456bef989f [1,0,0,0,0,0|3,0,0]=4 975 B8R0.7 CC(=O)CCNCCS 47ae194edd083db7c9ba93ef9079950b [1,0,0,0,0,0|3,0,0]=4 976 B8R0.7 CC(=O)CCOCCF 7fad36a16ea18946b1976097922c5d63 [1,0,0,0,0,0|3,0,0]=4 977 B8R0.7 CC(=O)CCOCCS 9f3db6cd3be1dbc7c558d110015ffb61 [1,0,0,0,0,0|3,0,0]=4 978 B8R0.7 CC(=O)CNCCCF 01d09128914fbef0e9d6c6589849cfeb [1,0,0,0,0,0|3,0,0]=4 979 B8R0.7 CC(=O)CNCCCO 6b18feab134fa1608a1e961ad3762058 [1,0,0,0,0,0|3,0,0]=4 980 B8R0.7 CC(=O)CNCCCS 482b044f1453b6ed81cab115d2862b45 [1,0,0,0,0,0|3,0,0]=4 981 B8R0.7 CC(=O)COCCCF 7e71123e6763570d0b52e6653e8ee828 [1,0,0,0,0,0|3,0,0]=4 982 B8R0.7 CC(=O)COCCCS 638442dc16e5a63efd8808c1ef8dea5e [1,0,0,0,0,0|3,0,0]=4 983 B8R0.7 CC(=O)NCCCCCl ca2b0e10b9c67d6c9ac8f4d9ab4c2b88 [1,0,0,0,0,0|3,0,0]=4 984 B8R0.7 CC(=O)NCCCCO 57936c738ed3f822f33ee01b6260a94e [1,0,0,0,0,0|3,0,0]=4 985 B8R0.7 CC(=O)NCCCCS c05ad9ce2696d1887a7029e678ac4e5e [1,0,0,0,0,0|3,0,0]=4 986 B8R0.7 CC=CCNCC(=O)O ca4b4f47c78da4f7c20abbf90afdb294 [1,0,0,0,0,0|1,0,2]=4 987 B8R0.7 CC=CCOCC(=O)O c8d8ca65cbc2c5e4d49fda8c8e6e7f5b [1,0,0,0,0,0|1,0,2]=4 988 B8R0.7 CCCCCNC(=O)C da50d5d5f7d2f7c8f9763330c7139773 [1,0,0,0,0,0|2,0,0]=3 989 B8R0.7 CCCCNCC(=O)C 8dbf7bfa43a4d98486dbc3615b11d498 [1,0,0,0,0,0|2,0,0]=3 990 B8R0.7 CCCCNCC(=O)N 69585f0b9c8687120ac53dbaccd84fc0 [1,0,0,0,0,0|2,0,0]=3 991 B8R0.7 CCCCNCC(=O)O a8de0a477de91420770c0a272ef6f881 [1,0,0,0,0,0|1,0,0]=2 992 B8R0.7 CCCCNCC(C)O 931ffaa97d207c9fb7ebac0ec881f8e7 [1,0,0,0,0,0|2,0,1]=4 993 B8R0.7 CCCCNC[C@@H](C)O 4edb0f48a9a733f4509d2f3b0321ae53 [1,0,0,0,0,0|2,0,1]=4 994 B8R0.7 CCCCNC[C@H](C)O 57de7703f075876997013fb957b70c80 [1,0,0,0,0,0|2,0,1]=4 995 B8R0.7 CCCCNC[N+](=O)[O-] b37a4d591c4d5c287e1ebe6ace96f684 [1,0,0,0,0,0|2,0,1]=4 996 B8R0.7 CCCCOCC(=O)C badc4ff846862f74785a1abd49004213 [1,0,0,0,0,0|2,0,0]=3 997 B8R0.7 CCCCOCC(=O)N 34eb6fb5b7f360ec9fe33699fca54d51 [1,0,0,0,0,0|2,0,0]=3 998 B8R0.7 CCCCOCC(=O)O a087235172e11e6141c3e38f9ce4e4ce [1,0,0,0,0,0|1,0,0]=2 999 B8R0.7 CCCCOCC(=S)N 66f00256fcd5080323facaf554f24131 [1,0,0,0,0,0|2,1,0]=4 1000 B8R0.7 CCCCOCS(=O)O 6325931987c0950b79bb089ebdc78c41 [1,0,0,0,0,0|2,0,0]=3 1001 B8R0.7 CCCCOC[N+](=O)[O-] 94b3f3bcc50279ace071168fd7298364 [1,0,0,0,0,0|2,0,1]=4 1002 B8R0.7 CCCNCCC(=O)C d627d93187ac3c2b4a5879a831f73b21 [1,0,0,0,0,0|2,0,0]=3 1003 B8R0.7 CCCNCCC(=O)N 8a2306560cfefa8994234df81900436d [1,0,0,0,0,0|2,0,0]=3 1004 B8R0.7 CCCNCCC(=O)O 47226423aa5b665923516680070294a2 [1,0,0,0,0,0|1,0,0]=2 1005 B8R0.7 CCCNCCC(=S)N 9bd19729128b21bf5f6ba43475b023e4 [1,0,0,0,0,0|2,1,0]=4 1006 B8R0.7 CCCNCCC(C)O ccdd4aef6b342b7b92e15346bf177ff3 [1,0,0,0,0,0|2,0,1]=4 1007 B8R0.7 CCCNCCS(=O)C 8907fe98197a1b6e79d094b2d7a6d4a5 [1,0,0,0,0,0|3,0,0]=4 1008 B8R0.7 CCCNCCS(=O)O 9ce87a12381c4b5cfe3ec1783a75d72a [1,0,0,0,0,0|2,0,0]=3 1009 B8R0.7 CCCNCC[C@@H](C)O 96ed78371080616609e6a19f4bc6ef50 [1,0,0,0,0,0|2,0,1]=4 1010 B8R0.7 CCCNCC[C@H](C)O e223e4268330f6aea945d3b98613cfef [1,0,0,0,0,0|2,0,1]=4 1011 B8R0.7 CCCNCOC(=O)C 9a03e4459c640878e7dba532d4a06502 [1,0,0,0,0,0|3,0,0]=4 1012 B8R0.7 CCCNCSC(=O)N 21ecf184b2a8dc86141aa6b38ac15f2d [1,0,0,0,0,0|3,0,0]=4 1013 B8R0.7 CCCOCCC(=O)C 8597bbc8bbaf08f1a613a7aab0165313 [1,0,0,0,0,0|2,0,0]=3 1014 B8R0.7 CCCOCCC(=O)N c20536b6c03bcadb1169aacd62e340d9 [1,0,0,0,0,0|2,0,0]=3 1015 B8R0.7 CCCOCCC(=O)O 65883243788987d42449403fa915dd7d [1,0,0,0,0,0|1,0,0]=2 1016 B8R0.7 CCCOCCS(=O)C 2c35684313aa0effe020f10a0837e485 [1,0,0,0,0,0|3,0,0]=4 1017 B8R0.7 CCCOCC[N+](=O)[O-] 11f99b66cb4f802bc9ea03fcd4d8e421 [1,0,0,0,0,0|2,0,1]=4 1018 B8R0.7 CCCOCNC(=O)C 6e99cd8c316495881ee605429ae8a169 [1,0,0,0,0,0|3,0,0]=4 1019 B8R0.7 CCCOCNC(=O)N 0c3353a650f6a23c649d3b49f74f0755 [1,0,0,0,0,0|3,0,0]=4 1020 B8R0.7 CCCOCOC(=O)C 0e004ff978c0c5c886108e25bd8d5e38 [1,0,0,0,0,0|3,0,0]=4 1021 B8R0.7 CCCOCSC(=O)N a8d0da169e47db6ff5658c749b630f62 [1,0,0,0,0,0|3,0,0]=4 1022 B8R0.7 CCNC/C=C/C(=O)O d0499e3991f67013ba9a4ec4c13f446c [1,0,0,0,0,0|1,0,2]=4 1023 B8R0.7 CCNCC#CC(=O)O 451eb2c163912cae12c5d5f7dc6a6856 [1,0,0,0,0,0|1,0,2]=4 1024 B8R0.7 CCNCC=CC(=O)O e5cbdf981b4630f2923b926612b3f826 [1,0,0,0,0,0|1,0,2]=4 1025 B8R0.7 CCNCCCC(=O)N d2cce21c7501504eb75a33266b0e5999 [1,0,0,0,0,0|2,0,0]=3 1026 B8R0.7 CCNCCCC(=O)O 9ad241b55443dd68da66ff4694ff3500 [1,0,0,0,0,0|1,0,0]=2 1027 B8R0.7 CCNCCCS(=O)C 391b9e72626e76cdd4e5a903c9b4bc67 [1,0,0,0,0,0|3,0,0]=4 1028 B8R0.7 CCNCCNC(=O)C 826d20b3d4f7b158aa9991d8c5f577d5 [1,0,0,0,0,0|3,0,0]=4 1029 B8R0.7 CCOC/C=C/C(=O)O a4d627c90e9b839f6af237bc31e6e15a [1,0,0,0,0,0|1,0,2]=4 1030 B8R0.7 CCOCC#CC(=O)O c98c8c0a09bdc73b6fd1ff1e3aa38396 [1,0,0,0,0,0|1,0,2]=4 1031 B8R0.7 CCOCC=CC(=O)O fa82522b856262d89b9f085f9d67d294 [1,0,0,0,0,0|1,0,2]=4 1032 B8R0.7 CCOCCCC(=O)C d3d73835b0002e0a803c11778e6c42f8 [1,0,0,0,0,0|2,0,0]=3 1033 B8R0.7 CCOCCCC(=O)N 32b0b6c66e42630050975d53410c1100 [1,0,0,0,0,0|2,0,0]=3 1034 B8R0.7 CCOCCC[N+](=O)[O-] 71c6eb2b7e36ed7d09037020112f4423 [1,0,0,0,0,0|2,0,1]=4 1035 B8R0.7 CCOCCNC(=O)C 364422f97eb926237421a47e55dbdc32 [1,0,0,0,0,0|3,0,0]=4 1036 B8R0.7 CCOCCNC(=O)N 1d69caaced26be13153afb55af020221 [1,0,0,0,0,0|3,0,0]=4 1037 B8R0.7 CCOCCOC(=O)C 65c3fc557763a3804d7e247a1996cb75 [1,0,0,0,0,0|3,0,0]=4 1038 B8R0.7 CCOCNCC(=O)C 534404aa2bb4eb60a9a5f4f7d068a4cd [1,0,0,0,0,0|3,0,0]=4 1039 B8R0.7 CCOCNCC(=O)N 8c5834421c71bace2ac17791d8413420 [1,0,0,0,0,0|3,0,0]=4 1040 B8R0.7 CCOCNCC(=O)O 0cadae74986469dc80946ca8e9bb1b07 [1,0,0,0,0,0|2,0,0]=3 1041 B8R0.7 CCOCOCC(=O)C e044734fa15c25bee2b20056cca4f1a8 [1,0,0,0,0,0|3,0,0]=4 1042 B8R0.7 CCOCOCC(=O)N 4677b548e92ecffae954122455550d38 [1,0,0,0,0,0|3,0,0]=4 1043 B8R0.7 CCOCOCS(=O)O f0f6516ce26ef8345e6a1b5134db53f6 [1,0,0,0,0,0|3,0,0]=4 1044 B8R0.7 CCSCCNC(=O)C 8c3ea9957cae597313583e7951afded4 [1,0,0,0,0,0|3,0,0]=4 1045 B8R0.7 COCCCNC(=O)C 526fcf80a030c8c3912a63af41d08c51 [1,0,0,0,0,0|3,0,0]=4 1046 B8R0.7 COCCNCC(=O)C 961ddbf961717199cb7ccbe5fdba9647 [1,0,0,0,0,0|3,0,0]=4 1047 B8R0.7 COCCNCC(=O)N 137fcc310030132af81430a136880512 [1,0,0,0,0,0|3,0,0]=4 1048 B8R0.7 COCCNCC(=O)O 5ce813bb3dda5e9060aa6f61548b6a1a [1,0,0,0,0,0|2,0,0]=3 1049 B8R0.7 COCCOCC(=O)C c43dd4e6beb50da293ecb7edbd68b366 [1,0,0,0,0,0|3,0,0]=4 1050 B8R0.7 COCCOCC(=O)N 52e3a5cb41b7881a4ace23e25a8bc04a [1,0,0,0,0,0|3,0,0]=4 1051 B8R0.7 COCCOCC(=O)O 003ae303058ace8e592ced58cf4e05e5 [1,0,0,0,0,0|2,0,0]=3 1052 B8R0.7 COCCOCS(=O)O 9425fd968f35d546d46a8c1e3b670b55 [1,0,0,0,0,0|3,0,0]=4 1053 B8R0.7 COCNCCC(=O)N 75a34d6a21e65f0fa9c3ab03a203332a [1,0,0,0,0,0|3,0,0]=4 1054 B8R0.7 COCNCCC(=O)O 6cfc61f9f7468a99c69b381c4067bdfb [1,0,0,0,0,0|2,0,0]=3 1055 B8R0.7 COCNCCS(=O)O 9b0f09c32fdad7545dd3373c6db4845f [1,0,0,0,0,0|3,0,0]=4 1056 B8R0.7 COCOCCC(=O)C 85ebfe45bbace861b367f83c75d33358 [1,0,0,0,0,0|3,0,0]=4 1057 B8R0.7 COCOCCC(=O)N dacd263a3e35c03bcd8f525b496ade95 [1,0,0,0,0,0|3,0,0]=4 1058 B8R0.7 COCOCCC(=O)O 1302d1ad564a958c9ef097b350c13897 [1,0,0,0,0,0|2,0,0]=3 1059 B8R0.7 CSCCCNC(=O)C f4b4c7d4d652abb45039c5639b312853 [1,0,0,0,0,0|3,0,0]=4 1060 B8R0.7 CSCCNCC(=O)C 8b0311856afbb6796c6aad3a263d628d [1,0,0,0,0,0|3,0,0]=4 1061 B8R0.7 CSCCNCC(=O)N 4e8fca086c3faa7db23a74b3dfff0f2f [1,0,0,0,0,0|3,0,0]=4 1062 B8R0.7 CSCCNCC(=O)O f1b95c9de1a925845087f31bd4bae7df [1,0,0,0,0,0|2,0,0]=3 1063 B8R0.7 CSCCOCC(=O)C fd4e693f71d7966351ba22f8108e19ff [1,0,0,0,0,0|3,0,0]=4 1064 B8R0.7 CSCCOCC(=O)N c731f0739b7e1ef13acc36f6574a92da [1,0,0,0,0,0|3,0,0]=4 1065 B8R0.7 CSCCOCC(=O)O db65161c67ff612db3780dea90f2a2f8 [1,0,0,0,0,0|2,0,0]=3 1066 B8R0.7 CSCCOCS(=O)O 15541620354d70e96c81747abb1141b3 [1,0,0,0,0,0|3,0,0]=4 1067 B8R0.7 CSCNCCC(=O)N 2c9d140685046003cf9f9ad555d9359d [1,0,0,0,0,0|3,0,0]=4 1068 B8R0.7 CSCNCCC(=O)O 098fcb068b20e260bdec4c343b4671e9 [1,0,0,0,0,0|2,0,0]=3 1069 B8R0.7 CSCNCCS(=O)O 14787ffddc12e16cb93df9154674fbee [1,0,0,0,0,0|3,0,0]=4 1070 B8R0.7 CSCOCCC(=O)C b844a3f3dbea733d811f327fadd49286 [1,0,0,0,0,0|3,0,0]=4 1071 B8R0.7 CSCOCCC(=O)N 80656c5e91a3a0e1eab18691c1ff654d [1,0,0,0,0,0|3,0,0]=4 1072 B8R0.7 CSCOCCC(=O)O 729e28748e361be58000ab33275c6b91 [1,0,0,0,0,0|2,0,0]=3 1073 B8R0.7 N#CCCNCC(=O)O 7bfcf1dd2660ba45e086fc214d0fdf1b [1,0,0,0,0,0|2,0,1]=4 1074 B8R0.7 N#CCCOCC(=O)O 913a62d3473039da7a70e24bab5e1d23 [1,0,0,0,0,0|2,0,1]=4 1075 B8R0.7 N#CCNCCC(=O)O 26556793ee589201382d4a045c687d03 [1,0,0,0,0,0|2,0,1]=4 1076 B8R0.7 N#CCOCCC(=O)O 5682b245006f80100a85fc7fd38aef94 [1,0,0,0,0,0|2,0,1]=4 1077 B8R0.7 NC(=O)CCCNCF 69e545c202cd7c9a6342c69c6e6a5f59 [1,0,0,0,0,0|3,0,0]=4 1078 B8R0.7 NC(=O)CCCNCO f70a60c235672d89293f900a8d9cefa7 [1,0,0,0,0,0|3,0,0]=4 1079 B8R0.7 NC(=O)CCCOCF 15f9a4387dce16382a2e493f0dda5b13 [1,0,0,0,0,0|3,0,0]=4 1080 B8R0.7 NC(=O)CCNCCBr ef24ce00bd552b4c7b9798b47e83c534 [1,0,0,0,0,0|3,0,0]=4 1081 B8R0.7 NC(=O)CCNCCF 6b59759188d6118acfcc7c61e6ea8d88 [1,0,0,0,0,0|3,0,0]=4 1082 B8R0.7 NC(=O)CCNCCI 3bfe0d669e39520f94e74660ecea4a46 [1,0,0,0,0,0|3,0,0]=4 1083 B8R0.7 NC(=O)CCNCCO ea9a91e023644befadbf5d244e261bb0 [1,0,0,0,0,0|3,0,0]=4 1084 B8R0.7 NC(=O)CCNCCS c12ed7aa66bfc39da304ecb7c8d6cdd6 [1,0,0,0,0,0|3,0,0]=4 1085 B8R0.7 NC(=O)CCOCCF 21f605ef26e643b6ae8cba650c7f6b82 [1,0,0,0,0,0|3,0,0]=4 1086 B8R0.7 NC(=O)CCOCCS 2a5607f5a17aca280aa8d0bbb5f8e88b [1,0,0,0,0,0|3,0,0]=4 1087 B8R0.7 NC(=O)CNCCCCl 1db53d8b6e8ec0b45f5ac5aea65a66af [1,0,0,0,0,0|3,0,0]=4 1088 B8R0.7 NC(=O)CNCCCF b8df96f83ebeea4472e3f0cf574d5c10 [1,0,0,0,0,0|3,0,0]=4 1089 B8R0.7 NC(=O)CNCCCO f7f428c6be3a0f96cc03fd2549aaf101 [1,0,0,0,0,0|3,0,0]=4 1090 B8R0.7 NC(=O)CNCCCS 0cd1ecba18cd09d4875eb7edc039e565 [1,0,0,0,0,0|3,0,0]=4 1091 B8R0.7 NC(=O)COCCCF 4c181403b43bd0150828aba20f5caec7 [1,0,0,0,0,0|3,0,0]=4 1092 B8R0.7 NC(=O)COCCCS 4ccafd8c8a1e89284daea9397b358185 [1,0,0,0,0,0|3,0,0]=4 1093 B8R0.7 NOCCNCC(=O)O 567becea339978b1d5a450bf35e41e83 [1,0,0,0,0,0|3,0,0]=4 1094 B8R0.7 O=C(O)CCCNCF 670cea18bd6ba2b81ceecb2577e1a7ab [1,0,0,0,0,0|2,0,0]=3 1095 B8R0.7 O=C(O)CCCNCO 6267c5eeb1933064d917e4e814ad9722 [1,0,0,0,0,0|2,0,0]=3 1096 B8R0.7 O=C(O)CCNCCBr 29cc353153febf3a8c067ebc7d4659a9 [1,0,0,0,0,0|2,0,0]=3 1097 B8R0.7 O=C(O)CCNCCF cb03b3b8d9be6ed00316ec8fa58ea22d [1,0,0,0,0,0|2,0,0]=3 1098 B8R0.7 O=C(O)CCNCCI 1fb0bb507aa993f2a3522c41edc93100 [1,0,0,0,0,0|2,0,0]=3 1099 B8R0.7 O=C(O)CCNCCO 7fda1e67c117139da08349807b03ae85 [1,0,0,0,0,0|2,0,0]=3 1100 B8R0.7 O=C(O)CCNCCS e7b12ac116347e188c56484ce05a8410 [1,0,0,0,0,0|2,0,0]=3 1101 B8R0.7 O=C(O)CCOCCF fcf96ee60132be28c36745264cbf0317 [1,0,0,0,0,0|2,0,0]=3 1102 B8R0.7 O=C(O)CCOCCS 61b8e7b02af12e03f8a3747e8eb16780 [1,0,0,0,0,0|2,0,0]=3 1103 B8R0.7 O=C(O)CNCCCCl 6975978044558bce000c0ca780485b76 [1,0,0,0,0,0|2,0,0]=3 1104 B8R0.7 O=C(O)CNCCCF 69db0caef1002e94499cf44277421fb3 [1,0,0,0,0,0|2,0,0]=3 1105 B8R0.7 O=C(O)CNCCCO 15bb30af3bbf0b9503efbda60ef38d51 [1,0,0,0,0,0|2,0,0]=3 1106 B8R0.7 O=C(O)CNCCCS 69374183d65b27382aaeea8dfc3bb03c [1,0,0,0,0,0|2,0,0]=3 1107 B8R0.7 O=C(O)COCCCF da2984b4de14bdafc90cabbb14713902 [1,0,0,0,0,0|2,0,0]=3 1108 B8R0.7 O=C(O)COCCCS b637a7d4aac2c64b554918898eb44811 [1,0,0,0,0,0|2,0,0]=3 1109 B8R0.7 O=CCCNCC(=O)O bf4ced9bc1bbfa03663a8c8af093471d [1,0,0,0,0,0|2,0,1]=4 1110 B8R0.7 O=CCCOCC(=O)O ef6505414c853b0dfbd12bbe62edb448 [1,0,0,0,0,0|2,0,1]=4 1111 B8R0.7 O=CCNCCC(=O)O 2746d5d7d8507565af45509ba7bc6f1c [1,0,0,0,0,0|2,0,1]=4 1112 B8R0.7 O=CCOCCC(=O)O de14f86217b2e4a0f4d6c6c831b08e2c [1,0,0,0,0,0|2,0,1]=4 1113 B8R0.7 O=S(O)CCNCCF 6ae83f604fb3678c54ffa14683ab0e36 [1,0,0,0,0,0|3,0,0]=4 1114 B8R0.7 O=S(O)CCNCCO 7974b1bc97ad54f4d29705e06d65fa2c [1,0,0,0,0,0|3,0,0]=4 1115 B8R0.7 O=S(O)CCNCCS 55afdc590ce640566907268f0a80beef [1,0,0,0,0,0|3,0,0]=4 1116 B8R0.7 O=S(O)COCCCF 30d2ec6240fb1c16499271a4f6492117 [1,0,0,0,0,0|3,0,0]=4 1117 B8R0.7 O=S(O)COCCCS beb0163d74ad014150e5e05594464f98 [1,0,0,0,0,0|3,0,0]=4 1118 B10R0.3 C#CCN(C)CCCC(=O)O df36037997382d989391ab9c3c1245da [0,1,0,0,0,0|1,0,2]=4 1119 B10R0.3 C/C=C/C(C)OCCC(=O)O dbb965c51a69892a1dfd0ba104f90779 [0,1,0,0,0,0|1,0,2]=4 1120 B10R0.3 C=C(Br)CCOC(C)CCC 57ae5370dbb101cf05b084819c866051 [0,1,0,0,0,0|3,0,0]=4 1121 B10R0.3 C=C(Br)CNCC(C)CCC 01158ece276c4589112f631cc5aacee0 [0,1,0,0,0,0|3,0,0]=4 1122 B10R0.3 C=C(Br)CNCC(O)CCC 05d87dee446fbf32a74fdb1f5ec89fa6 [0,1,0,0,0,0|3,0,0]=4 1123 B10R0.3 C=C(Br)COCC(C)CCC ce1f1a95f4dfd1cc59e22abd3f24a6e9 [0,1,0,0,0,0|3,0,0]=4 1124 B10R0.3 C=C(C)CCCN(C)CCC 75006465112a90c261398bcee9c6c95f [0,1,0,0,0,0|3,0,0]=4 1125 B10R0.3 C=C(C)CCNC(C)CCC 066e16377fabd8862cb7ddfad9633e80 [0,1,0,0,0,0|3,0,0]=4 1126 B10R0.3 C=C(C)CCN[C@@H](C)CCC 867958bdbd356b96ba81be97aef0b458 [0,1,0,0,0,0|3,0,0]=4 1127 B10R0.3 C=C(C)CCOC(C)CCC 8fa09bb2c00eedb1ed94fbff88cca7ce [0,1,0,0,0,0|3,0,0]=4 1128 B10R0.3 C=C(C)CCO[C@@H](C)CCC 5464f8ae6acb897674a408c08d8b3d4c [0,1,0,0,0,0|3,0,0]=4 1129 B10R0.3 C=C(C)CCO[C@H](C)CCC afbed9022878a64f6e438d688f3a48fb [0,1,0,0,0,0|3,0,0]=4 1130 B10R0.3 C=C(C)CNCC(C)CCC e979d6822c4c46f5115dbaa2556050fa [0,1,0,0,0,0|3,0,0]=4 1131 B10R0.3 C=C(C)CNCC(O)CCC 157cbe69d068c66db6cc6cd36a28e480 [0,1,0,0,0,0|3,0,0]=4 1132 B10R0.3 C=C(C)COCC(C)CCC 9a3ff59309dd1a63d2fa3f6f3ad85e16 [0,1,0,0,0,0|3,0,0]=4 1133 B10R0.3 C=C(Cl)CNCC(O)CCC fbaedea6a74bafed944da32c77ed9e5e [0,1,0,0,0,0|3,0,0]=4 1134 B10R0.3 C=C(Cl)COCC(C)CCC ecae2f93fe70d690e001e03d019f5b55 [0,1,0,0,0,0|3,0,0]=4 1135 B10R0.3 C=C(F)CNCC(O)CCC e3abb259a559255e9b0236125851c9ae [0,1,0,0,0,0|3,0,0]=4 1136 B10R0.3 C=C(F)COCC(C)CCC 5142ba356979f7be6a3f27398f8187ba [0,1,0,0,0,0|3,0,0]=4 1137 B10R0.3 C=C(I)COCC(C)CCC 135d47aeb1bea42dd1864e269e3ebf2f [0,1,0,0,0,0|3,0,0]=4 1138 B10R0.3 C=CCC(C)CNCC(=O)O 6a3cca9f40c9ac386440862f6d3e07e5 [0,1,0,0,0,0|1,0,2]=4 1139 B10R0.3 C=CCC(C)COCC(=O)O bb31b55478d1d58571d02ffbf038de42 [0,1,0,0,0,0|1,0,2]=4 1140 B10R0.3 C=CCC(C)OCCC(=O)O ef1defb711d1cdddffb14859ff0a5028 [0,1,0,0,0,0|1,0,2]=4 1141 B10R0.3 C=CCC(O)CNCC(=O)O 8ba04d027c18298d8d4343dfb693f421 [0,1,0,0,0,0|1,0,2]=4 1142 B10R0.3 C=CCN(C)CCCC(=O)O 382ba004b96a83684fac5160dfcca5ef [0,1,0,0,0,0|1,0,2]=4 1143 B10R0.3 C=CC[C@@H](C)OCCC(=O)O 7fb523dcb126981013af9011c29cc6c9 [0,1,0,0,0,0|1,0,2]=4 1144 B10R0.3 C=CC[C@H](C)OCCC(=O)O 653998c21d52df34c649eb9e0f282aa5 [0,1,0,0,0,0|1,0,2]=4 1145 B10R0.3 CC#CC(C)OCCC(=O)O 75de59f15d3c8b9bd3a67699ef9ec252 [0,1,0,0,0,0|1,0,2]=4 1146 B10R0.3 CC(=O)CCCN(C)CCF a91071d5b795afc14d448c3e011ba44d [0,1,0,0,0,0|3,0,0]=4 1147 B10R0.3 CC(=O)CCCN(C)CCO bc18043393a2af47a96c5ee68b1ac7c8 [0,1,0,0,0,0|3,0,0]=4 1148 B10R0.3 CC(=O)CCNC(C)CCO bd3c2772a0eb522f313cd99da2a3d4e8 [0,1,0,0,0,0|3,0,0]=4 1149 B10R0.3 CC(=O)CCN[C@@H](C)CCO f2f879a4894e4b1f6ce0eb80c8100a95 [0,1,0,0,0,0|3,0,0]=4 1150 B10R0.3 CC(=O)CCN[C@H](C)CCO b929812d228a0b2695eeb0084db293c7 [0,1,0,0,0,0|3,0,0]=4 1151 B10R0.3 CC(=O)CNC[C@@H](O)CCO 027bd78a8514fcb3f54c2f3aaad0ad89 [0,1,0,0,0,0|3,0,0]=4 1152 B10R0.3 CC(=O)COC[C@@H](O)CCO 9dd4f702f7e1b7587912aee761a9032c [0,1,0,0,0,0|3,0,0]=4 1153 B10R0.3 CC(CC#N)NCCC(=O)O 5694abffa390a8817fe94408823003bc [0,1,0,0,0,0|2,0,1]=4 1154 B10R0.3 CC(CC#N)OCCC(=O)O 470089ef993afdc1a54bbd9ed6c52131 [0,1,0,0,0,0|2,0,1]=4 1155 B10R0.3 CC(CCO)CNCC(=O)N 50524a9bb7d2e0661a47b6f7822dd2f4 [0,1,0,0,0,0|3,0,0]=4 1156 B10R0.3 CC(CCO)CNCC(=O)O 84617bba6207aac5ac0f46051c943eee [0,1,0,0,0,0|2,0,0]=3 1157 B10R0.3 CC(CCO)NCCC(=O)N 36e35f9c375ec8d6020d7e1444a0450f [0,1,0,0,0,0|3,0,0]=4 1158 B10R0.3 CC(CCO)NCCC(=O)O 08bfd2141895d01441ea5a75c9051eb2 [0,1,0,0,0,0|2,0,0]=3 1159 B10R0.3 CC(CCO)NCCS(=O)O f8aa6fff140c75bd7ad1b587599147c3 [0,1,0,0,0,0|3,0,0]=4 1160 B10R0.3 CC=CC(C)OCCC(=O)O 1f0513acd8c961991097437620a98ec4 [0,1,0,0,0,0|1,0,2]=4 1161 B10R0.3 CCCC(=O)CNCC(=O)C 2f2bca955c317c66027ee57e4b8faaa3 [0,1,0,0,0,0|2,0,1]=4 1162 B10R0.3 CCCC(=O)CNCC(=O)N 3bf45dfe537089ee19de7c3b6190c7f7 [0,1,0,0,0,0|2,0,1]=4 1163 B10R0.3 CCCC(=O)CNCC(=O)O f6744a3232fc9ea52fb0c8708fe4d8b3 [0,1,0,0,0,0|1,0,1]=3 1164 B10R0.3 CCCC(=O)COCC(=O)C d084d6d5aefe17d20bd2d81df30cc1b6 [0,1,0,0,0,0|2,0,1]=4 1165 B10R0.3 CCCC(=O)COCC(=O)N 11fe1237cc753939463e7f691abbe7b2 [0,1,0,0,0,0|2,0,1]=4 1166 B10R0.3 CCCC(=O)COCS(=O)O ce1a544a65f32f032ce9d2c21ff82a48 [0,1,0,0,0,0|2,0,1]=4 1167 B10R0.3 CCCC(=O)NCCC(=O)N 45e453b3bbfc3dcf1cb5635d59295ccb [0,1,0,0,0,0|2,0,1]=4 1168 B10R0.3 CCCC(=O)NCCS(=O)O 9f696750cf56a0a5f3e78e86b2e771dd [0,1,0,0,0,0|2,0,1]=4 1169 B10R0.3 CCCC(=S)OCCC(=O)C 3192852c8bc2834f8b9f3940ade8bd14 [0,1,0,0,0,0|2,0,1]=4 1170 B10R0.3 CCCC(=S)OCCC(=O)N f57298a1aa63ed82abff6587443314da [0,1,0,0,0,0|2,0,1]=4 1171 B10R0.3 CCCC(=S)OCCC(=O)O 464e0bb047bef3541ae278d195f183f1 [0,1,0,0,0,0|1,0,1]=3 1172 B10R0.3 CCCC(C)CNCC(=O)C 507396644edd8a0794e79c3f4b2dcbaa [0,1,0,0,0,0|2,0,0]=3 1173 B10R0.3 CCCC(C)CNCC(=O)N ddfe63c45330b4f64973dec5935eb8f9 [0,1,0,0,0,0|2,0,0]=3 1174 B10R0.3 CCCC(C)CNCC(=O)O 2ffba48436204d35e7fcc4ce1ac9fb61 [0,1,0,0,0,0|1,0,0]=2 1175 B10R0.3 CCCC(C)CNCC(C)O 1185b2a8636321e34262b3a33c5278a2 [0,1,0,0,0,0|2,0,1]=4 1176 B10R0.3 CCCC(C)CNC[C@@H](C)O 159f6b788c84a4ebb0276c80ab93b9f6 [0,1,0,0,0,0|2,0,1]=4 1177 B10R0.3 CCCC(C)CNC[C@H](C)O 4bbbbe30e7f777af7b0c20a9e927e013 [0,1,0,0,0,0|2,0,1]=4 1178 B10R0.3 CCCC(C)COCC(=O)C 680a9eb06801e2e1ff47a08475f12e8f [0,1,0,0,0,0|2,0,0]=3 1179 B10R0.3 CCCC(C)COCC(=O)N 79d4f5f0a869cd8f1dc1c51cc7425632 [0,1,0,0,0,0|2,0,0]=3 1180 B10R0.3 CCCC(C)COCC(=O)O 4dbfc1e9ebcaa413b8c560b42d86399d [0,1,0,0,0,0|1,0,0]=2 1181 B10R0.3 CCCC(C)COCC(=S)N 3c3ec4a07eec4e3b2aa2f0700509cbaf [0,1,0,0,0,0|2,1,0]=4 1182 B10R0.3 CCCC(C)COCS(=O)O 5df686b7c5023ccf9053090e954242a3 [0,1,0,0,0,0|2,0,0]=3 1183 B10R0.3 CCCC(C)COC[N+](=O)[O-] 92b402ff4f6ad2f4a862c4230440f925 [0,1,0,0,0,0|2,0,1]=4 1184 B10R0.3 CCCC(C)NCCC(=O)C 588b6903644db0683f12442c3613ea4b [0,1,0,0,0,0|2,0,0]=3 1185 B10R0.3 CCCC(C)NCCC(=O)N 47bb3c0904a6f9da732fb91b7bb0ba70 [0,1,0,0,0,0|2,0,0]=3 1186 B10R0.3 CCCC(C)NCCC(=O)O d544e52962f774e7b0c43f59caac1512 [0,1,0,0,0,0|1,0,0]=2 1187 B10R0.3 CCCC(C)NCCC(=S)N 1c6c4392b3ff54d33e5f6f4907acdf72 [0,1,0,0,0,0|2,1,0]=4 1188 B10R0.3 CCCC(C)NCCC(C)O b9ae6e6bb30d9b793443a7c789bc7806 [0,1,0,0,0,0|2,0,1]=4 1189 B10R0.3 CCCC(C)NCCS(=O)C 2e576989aeec2f8e42319181ed2d9e17 [0,1,0,0,0,0|3,0,0]=4 1190 B10R0.3 CCCC(C)NCCS(=O)O 7398166435a0e42a17e1cb7014d067a0 [0,1,0,0,0,0|2,0,0]=3 1191 B10R0.3 CCCC(C)NCC[C@@H](C)O 884a24d7d7f17a05787a88a4608c1b73 [0,1,0,0,0,0|2,0,1]=4 1192 B10R0.3 CCCC(C)NCC[C@H](C)O 50b9a53fc6bd281bc66bfa40dede3046 [0,1,0,0,0,0|2,0,1]=4 1193 B10R0.3 CCCC(C)NCOC(=O)C 6d073bab7f0a8be7f7d45b9beda731cc [0,1,0,0,0,0|3,0,0]=4 1194 B10R0.3 CCCC(C)NCSC(=O)N 49ffda3d2c530fe5655c46a852a10b7f [0,1,0,0,0,0|3,0,0]=4 1195 B10R0.3 CCCC(C)OCCC(=O)C 3778cd23d00521ffbf2c28aaf2ea07be [0,1,0,0,0,0|2,0,0]=3 1196 B10R0.3 CCCC(C)OCCC(=O)N c3f80014430b01935093f4410f6be37b [0,1,0,0,0,0|2,0,0]=3 1197 B10R0.3 CCCC(C)OCCC(=O)O cd7765db58067b8d271ab27a4046a51d [0,1,0,0,0,0|1,0,0]=2 1198 B10R0.3 CCCC(C)OCCS(=O)C 784b139e67be0ed78e719532cfeb5251 [0,1,0,0,0,0|3,0,0]=4 1199 B10R0.3 CCCC(C)OCC[N+](=O)[O-] a2fd771b3c00fde2900b372e9ba54a98 [0,1,0,0,0,0|2,0,1]=4 1200 B10R0.3 CCCC(C)OCNC(=O)C 56ff2a1be364c376d2bbfacdd167be21 [0,1,0,0,0,0|3,0,0]=4 1201 B10R0.3 CCCC(C)OCNC(=O)N 12c47c7d5033a783acb7dbd651ed84d3 [0,1,0,0,0,0|3,0,0]=4 1202 B10R0.3 CCCC(C)OCOC(=O)C 19417bd9c03afa8e8541702643642c42 [0,1,0,0,0,0|3,0,0]=4 1203 B10R0.3 CCCC(C)OCSC(=O)N 655a0ba22934630291acc8ea3dd34e79 [0,1,0,0,0,0|3,0,0]=4 1204 B10R0.3 CCCC(O)CNCC(=O)N cb6ee76db4d7fc0aa6c023911b2d21b3 [0,1,0,0,0,0|2,0,0]=3 1205 B10R0.3 CCCC(O)CNCC(=O)O 6185231d2d1cdd5381a69894c5ca9dde [0,1,0,0,0,0|1,0,0]=2 1206 B10R0.3 CCCC(O)CNCC(C)O 4f4b0a2e534075e0adca91dea8585b8b [0,1,0,0,0,0|2,0,1]=4 1207 B10R0.3 CCCC(O)CNC[C@@H](C)O 8d1541dc165ecb5206799566ce3dd7c4 [0,1,0,0,0,0|2,0,1]=4 1208 B10R0.3 CCCC(O)CNC[C@H](C)O 3894c6e8861a6e9a701a00fbd58383b1 [0,1,0,0,0,0|2,0,1]=4 1209 B10R0.3 CCCC(O)CNC[N+](=O)[O-] 5515d2c55722ef48fba71dfdef0abee4 [0,1,0,0,0,0|2,0,1]=4 1210 B10R0.3 CCCN(C)C/C=C/C(=O)O 16706090ace252ea30acc0270329a425 [0,1,0,0,0,0|1,0,2]=4 1211 B10R0.3 CCCN(C)CC=CC(=O)O e55f2dc918ec3cc962fd1fa8ea3151f8 [0,1,0,0,0,0|1,0,2]=4 1212 B10R0.3 CCCN(C)CCCC(=O)C e453eeaabda979f73e4bb02dca502e16 [0,1,0,0,0,0|2,0,0]=3 1213 B10R0.3 CCCN(C)CCCC(=O)N 90cd7a22a132251f7d2dcd4e55a9d6a0 [0,1,0,0,0,0|2,0,0]=3 1214 B10R0.3 CCCN(C)CCCC(=O)O 9751eaee21e111646019663fdf1bce9f [0,1,0,0,0,0|1,0,0]=2 1215 B10R0.3 CCCN(C)CCCC(C)O bcb8921018679fc023b0f411f18b9d7c [0,1,0,0,0,0|2,0,1]=4 1216 B10R0.3 CCCN(C)CCC[N+](=O)[O-] bd45364b624c2260743433441f7cba26 [0,1,0,0,0,0|2,0,1]=4 1217 B10R0.3 CCCN(C)CCNC(=O)C 36128a19b984220157c266858e8cb52a [0,1,0,0,0,0|3,0,0]=4 1218 B10R0.3 CCCN(C)CCNC(=O)N 45380052e304957e88b03cdd56e27182 [0,1,0,0,0,0|3,0,0]=4 1219 B10R0.3 CCCN(C)CCOC(=O)C d27191e20fb0a08b26d3b2e2691328c1 [0,1,0,0,0,0|3,0,0]=4 1220 B10R0.3 CCCN(C)CCSC(=O)C 9fe3b0e7bcba658d6fc90e58ad36e0df [0,1,0,0,0,0|3,0,0]=4 1221 B10R0.3 CCC[C@@H](C)OCCC(=O)C b51690e8ce68e4f5d29359acf4cf0109 [0,1,0,0,0,0|2,0,0]=3 1222 B10R0.3 CCC[C@@H](C)OCCC(=O)N b7c851c86df9d174798e9828efb58acc [0,1,0,0,0,0|2,0,0]=3 1223 B10R0.3 CCC[C@@H](C)OCCC(=O)O 44d33eae61d440fb5b7c12da3bf4ec3d [0,1,0,0,0,0|1,0,0]=2 1224 B10R0.3 CCC[C@@H](C)OCCS(=O)C f9bb399bee303e684dedf50f3260f208 [0,1,0,0,0,0|3,0,0]=4 1225 B10R0.3 CCC[C@@H](C)OCOC(=O)C e6fd70965a39f8aec27c1274b67a4f46 [0,1,0,0,0,0|3,0,0]=4 1226 B10R0.3 CCC[C@@H](C)OCSC(=O)N 272ac9c1fb7e2ee26f93a15bd6695547 [0,1,0,0,0,0|3,0,0]=4 1227 B10R0.3 CCC[C@H](C)NCCC(=O)C 98424580f397d864b96e28f5052d84f4 [0,1,0,0,0,0|2,0,0]=3 1228 B10R0.3 CCC[C@H](C)NCCC(=O)N 90c2803fb614958ff1b8e6e83e896aae [0,1,0,0,0,0|2,0,0]=3 1229 B10R0.3 CCC[C@H](C)NCCC(=O)O bbc61fde1fc94950995749984d9e588f [0,1,0,0,0,0|1,0,0]=2 1230 B10R0.3 CCC[C@H](C)NCCC(C)O 35714d43a387d179596c938a096248ec [0,1,0,0,0,0|2,0,1]=4 1231 B10R0.3 CCC[C@H](C)NCCS(=O)C 79fd140b0deb1879055f3afb77c43e7c [0,1,0,0,0,0|3,0,0]=4 1232 B10R0.3 CCC[C@H](C)NCOC(=O)C 9a1b5f20f44937bb7ac0ca9c1ee9b55f [0,1,0,0,0,0|3,0,0]=4 1233 B10R0.3 CCC[C@H](C)NCSC(=O)N 2ff93306bc76735c36038887b444bd48 [0,1,0,0,0,0|3,0,0]=4 1234 B10R0.3 CCC[C@H](C)OCCC(=O)C d32458ec547f9bb264745e9ee2ac1a5a [0,1,0,0,0,0|2,0,0]=3 1235 B10R0.3 CCC[C@H](C)OCCC(=O)N b110810b812b48b12d783f572e935b38 [0,1,0,0,0,0|2,0,0]=3 1236 B10R0.3 CCC[C@H](C)OCCC(=O)O 0890830da3e1d264cc404d292d58748e [0,1,0,0,0,0|1,0,0]=2 1237 B10R0.3 CCC[C@H](C)OCCS(=O)C 4540b8ff4efdf2b98c244ebe9426ad42 [0,1,0,0,0,0|3,0,0]=4 1238 B10R0.3 CCC[C@H](C)OCOC(=O)C daeb82e12e273f657ab31c8e20810961 [0,1,0,0,0,0|3,0,0]=4 1239 B10R0.3 CCC[C@H](C)OCSC(=O)N 4402591febaf6f8426f7db0b2560d4fa [0,1,0,0,0,0|3,0,0]=4 1240 B10R0.3 CCNC(=O)CNCC(=O)O 5868f69ce9a819991fa9d054e5cade5b [0,1,0,0,0,0|2,0,1]=4 1241 B10R0.3 CCNC(=O)COCC(=O)O 55f7281944b5c807844d06a57ca67aed [0,1,0,0,0,0|2,0,1]=4 1242 B10R0.3 CCOC(=O)CNCC(=O)O 673a5c5a01e83fc2e5ca0210f3ce27ba [0,1,0,0,0,0|2,0,1]=4 1243 B10R0.3 CCOC(=O)COCC(=O)O 687aeb9b913df1140d633a4db778378f [0,1,0,0,0,0|2,0,1]=4 1244 B10R0.3 CCOC(C)CNCC(=O)N 4f9f4def3b911fd1cabf86db4289bf86 [0,1,0,0,0,0|3,0,0]=4 1245 B10R0.3 CCOC(C)CNCC(=O)O e9c3649a42578b1b1ebf161cc8f5de97 [0,1,0,0,0,0|2,0,0]=3 1246 B10R0.3 CCOC(C)COCC(=O)N 876445856327323fe71a204285c7ec19 [0,1,0,0,0,0|3,0,0]=4 1247 B10R0.3 CCOC(C)COCC(=O)O c71b783608e1cfb51637c1737d0ac103 [0,1,0,0,0,0|2,0,0]=3 1248 B10R0.3 CN(CC#N)CCCC(=O)O 60fd9d19c545dd2b6e6bae357c348324 [0,1,0,0,0,0|2,0,1]=4 1249 B10R0.3 CN(CC=O)CCCC(=O)O 67f0fb1d0af79e0700b8da074a931b71 [0,1,0,0,0,0|2,0,1]=4 1250 B10R0.3 CN(CCF)CCCC(=O)N df55986a1976ed997ac78a93ba7846a5 [0,1,0,0,0,0|3,0,0]=4 1251 B10R0.3 CN(CCF)CCCC(=O)O 4c38ea739b9635394e77f228ee5e138d [0,1,0,0,0,0|2,0,0]=3 1252 B10R0.3 CN(CCO)CCCC(=O)N bb03171d6f3ec905768299bc52f97413 [0,1,0,0,0,0|3,0,0]=4 1253 B10R0.3 CN(CCO)CCCC(=O)O e980326d3fdba0b0247c16f9a666c94f [0,1,0,0,0,0|2,0,0]=3 1254 B10R0.3 CN(CCS)CCCC(=O)N dd01beb1a1e3ed8de5c77dc9d3cd82be [0,1,0,0,0,0|3,0,0]=4 1255 B10R0.3 CN(CCS)CCCC(=O)O 113e86c829e2c3cd90c5cce1d77af364 [0,1,0,0,0,0|2,0,0]=3 1256 B10R0.3 COCC(C)COCC(=O)N e3b0eb6d1c3f537f974b92455988e355 [0,1,0,0,0,0|3,0,0]=4 1257 B10R0.3 COCC(C)NCCC(=O)C 2eed77af0d77284fe254324c3e7911b1 [0,1,0,0,0,0|3,0,0]=4 1258 B10R0.3 COCC(C)NCCC(=O)N 2884cca963cb7362eaad4b22c6f485cd [0,1,0,0,0,0|3,0,0]=4 1259 B10R0.3 COCC(C)NCCC(=O)O 3006a7722f50b2dead482d21ca01fc32 [0,1,0,0,0,0|2,0,0]=3 1260 B10R0.3 COCC(C)NCCS(=O)O 9d4eff2a9ead293a9bc2d175f3fa324d [0,1,0,0,0,0|3,0,0]=4 1261 B10R0.3 COCC(C)OCCC(=O)C 13f46aa78529fa2a31c9e85d815de6ed [0,1,0,0,0,0|3,0,0]=4 1262 B10R0.3 COCC(C)OCCC(=O)N 57971ee3ff05c995bd82575ff9e0540c [0,1,0,0,0,0|3,0,0]=4 1263 B10R0.3 COCC(C)OCCC(=O)O e39ee66cdd77b78a4c1d770bc296cd28 [0,1,0,0,0,0|2,0,0]=3 1264 B10R0.3 COCC(O)CNCC(=O)C 4422bba05fe6e2efd566e67f071d4431 [0,1,0,0,0,0|3,0,0]=4 1265 B10R0.3 COCC(O)CNCC(=O)N dd3237b84b36274a9a6e8212ab3fa8af [0,1,0,0,0,0|3,0,0]=4 1266 B10R0.3 COCC(O)CNCC(=O)O 52119a08736932bcdc1397e33d3d35d6 [0,1,0,0,0,0|2,0,0]=3 1267 B10R0.3 COCN(C)CCCC(=O)N 283dcad524f47c8c3a6a64b87dfabcf2 [0,1,0,0,0,0|3,0,0]=4 1268 B10R0.3 COCN(C)CCCC(=O)O af4527a064376eb42fa999e647112469 [0,1,0,0,0,0|2,0,0]=3 1269 B10R0.3 COC[C@@H](C)NCCC(=O)C 04e4ab558dd76f7f48f0a1e3b14bde14 [0,1,0,0,0,0|3,0,0]=4 1270 B10R0.3 COC[C@@H](C)NCCC(=O)N b7c4cd1f590b59865ad34879cdbd5ec5 [0,1,0,0,0,0|3,0,0]=4 1271 B10R0.3 COC[C@@H](C)NCCC(=O)O 65e998b1daa28d7cf193c27aad500787 [0,1,0,0,0,0|2,0,0]=3 1272 B10R0.3 COC[C@@H](C)OCCC(=O)C bfe65d4ce105145e590cfc8a1cb01467 [0,1,0,0,0,0|3,0,0]=4 1273 B10R0.3 COC[C@@H](C)OCCC(=O)N 6f71c54b02c88f6af3de5b9d69ea7439 [0,1,0,0,0,0|3,0,0]=4 1274 B10R0.3 COC[C@@H](C)OCCC(=O)O 1f31f493223f0d4d5e3a7f37a1229ce2 [0,1,0,0,0,0|2,0,0]=3 1275 B10R0.3 COC[C@@H](O)CNCC(=O)N 63656abaaa60538e06f222f41867735f [0,1,0,0,0,0|3,0,0]=4 1276 B10R0.3 COC[C@@H](O)CNCC(=O)O 7bd50784303fbb3f6c66531490522002 [0,1,0,0,0,0|2,0,0]=3 1277 B10R0.3 COC[C@H](C)COCC(=O)N 714ec69cb1b1abaec23a5692fa805e4b [0,1,0,0,0,0|3,0,0]=4 1278 B10R0.3 COC[C@H](C)NCCC(=O)C 7e51ab406a7d1bb7f7ea122073fd17e7 [0,1,0,0,0,0|3,0,0]=4 1279 B10R0.3 COC[C@H](C)NCCC(=O)N b28f3519d274ee26bd2351f516d07e1c [0,1,0,0,0,0|3,0,0]=4 1280 B10R0.3 COC[C@H](C)NCCC(=O)O b7aee2b96b3ff1cbc6f0249a05f914d6 [0,1,0,0,0,0|2,0,0]=3 1281 B10R0.3 COC[C@H](C)OCCC(=O)C 44aa5510ac38c12090d567bb101562a6 [0,1,0,0,0,0|3,0,0]=4 1282 B10R0.3 COC[C@H](C)OCCC(=O)N 6f871b76d79ddaec3dd8d250ff15b2d3 [0,1,0,0,0,0|3,0,0]=4 1283 B10R0.3 COC[C@H](C)OCCC(=O)O 9b21bad398f669b6ea0ca61facbd4694 [0,1,0,0,0,0|2,0,0]=3 1284 B10R0.3 CSCC(C)OCCC(=O)C 2d256ee1deb160a000ec725a2a86aa5a [0,1,0,0,0,0|3,0,0]=4 1285 B10R0.3 CSCC(C)OCCC(=O)N 1b058e504bb6f03671ea7365a3ac6244 [0,1,0,0,0,0|3,0,0]=4 1286 B10R0.3 CSCC(C)OCCC(=O)O 77f8b875b8d633a91fab5dab3717f6fd [0,1,0,0,0,0|2,0,0]=3 1287 B10R0.3 CSCN(C)CCCC(=O)N 4e0f439f78768eb66c80d3573eec6675 [0,1,0,0,0,0|3,0,0]=4 1288 B10R0.3 CSCN(C)CCCC(=O)O b5a176ab3ecb9b99a1b09fc720cbc703 [0,1,0,0,0,0|2,0,0]=3 1289 B10R0.3 C[C@@H](CCO)NCCC(=O)N a587a5011b99c76b5eec678b7a08b308 [0,1,0,0,0,0|3,0,0]=4 1290 B10R0.3 C[C@@H](CCO)NCCC(=O)O b7974eb5f54d88d07b869f797d8e8d77 [0,1,0,0,0,0|2,0,0]=3 1291 B10R0.3 C[C@H](CCO)NCCC(=O)N 118ddbe851f9562dd2a42129e34f5648 [0,1,0,0,0,0|3,0,0]=4 1292 B10R0.3 C[C@H](CCO)NCCC(=O)O d0ce9bdeed6e375dc7dd36721ecd209e [0,1,0,0,0,0|2,0,0]=3 1293 B10R0.3 N#CCC(O)CNCC(=O)O 11502be503e8756a86a6de400af33b18 [0,1,0,0,0,0|2,0,1]=4 1294 B10R0.3 N#CC[C@@H](O)CNCC(=O)O 896616bb13b950d07b7cc5848060f6c0 [0,1,0,0,0,0|2,0,1]=4 1295 B10R0.3 N#CC[C@H](O)CNCC(=O)O 29f969a289cdd1057f75dcdf6a75dacb [0,1,0,0,0,0|2,0,1]=4 1296 B10R0.3 NC(=O)CNC[C@@H](O)CCO b7fc42de113ecda087da5bde69334c93 [0,1,0,0,0,0|3,0,0]=4 1297 B10R0.3 NC(=O)COC[C@@H](O)CCO 05c1701138e6dad80995ff9891518277 [0,1,0,0,0,0|3,0,0]=4 1298 B10R0.3 O=C(O)CNC[C@@H](O)CCO 07c1856b839d5e4ec495cf7d893557af [0,1,0,0,0,0|2,0,0]=3 1299 B10R0.3 O=C(O)COC[C@@H](O)CCO e996c248f069277500d22b0236e850b4 [0,1,0,0,0,0|2,0,0]=3 1300 B10R0.3 O=S(O)COC[C@@H](O)CCO 8bb3433c2b4e22e774937000a2b0cf0e [0,1,0,0,0,0|3,0,0]=4 1301 B10R0.4 C#CCCCCCNC(=O)C 8cc52b8ad57e2efa8df930ede1ee0ae3 [0,1,0,0,0,0|1,0,2]=4 1302 B10R0.4 C#CCCCCNCC(=O)C 221ad1f3754bfb6ee0d87123ecd37375 [0,1,0,0,0,0|1,0,2]=4 1303 B10R0.4 C#CCCCCNCC(=O)N 201ceda22b6c6681e980e19b83e0e4dc [0,1,0,0,0,0|1,0,2]=4 1304 B10R0.4 C#CCCCCNCC(=O)O 053e69494a1edfe88d9aa7bec3f3ce0a [0,1,0,0,0,0|0,0,2]=3 1305 B10R0.4 C#CCCCCOCC(=O)C 55e1335d56e54afdd683a2ff76664186 [0,1,0,0,0,0|1,0,2]=4 1306 B10R0.4 C#CCCCCOCC(=O)N a9858b875dde392c740aae143e54deaa [0,1,0,0,0,0|1,0,2]=4 1307 B10R0.4 C#CCCCCOCC(=O)O 754c0ff3e6f0bdb78989a7e7ae9e5b08 [0,1,0,0,0,0|0,0,2]=3 1308 B10R0.4 C#CCCCCOCS(=O)O 472a1b6a25d85f647997bc259e5e065a [0,1,0,0,0,0|1,0,2]=4 1309 B10R0.4 C#CCCCNCCC(=O)C 09c0e3ba4e4ea154cedf8f8751d7d13e [0,1,0,0,0,0|1,0,2]=4 1310 B10R0.4 C#CCCCNCCC(=O)N 4b150cc73c0bc54201bf4b4e73e27a75 [0,1,0,0,0,0|1,0,2]=4 1311 B10R0.4 C#CCCCNCCC(=O)O b7ca33d5b8e1f01455f5334a9261cdbe [0,1,0,0,0,0|0,0,2]=3 1312 B10R0.4 C#CCCCNCCS(=O)O 8ec6a030fd70dfada4064e67b14a8699 [0,1,0,0,0,0|1,0,2]=4 1313 B10R0.4 C#CCCCOCCC(=O)C f5790eb6de8bb0e7b19179be71afc074 [0,1,0,0,0,0|1,0,2]=4 1314 B10R0.4 C#CCCCOCCC(=O)N 36eb425e486b249a8b65601d76db32ec [0,1,0,0,0,0|1,0,2]=4 1315 B10R0.4 C#CCCCOCCC(=O)O 0ad612bc2c2aebc206c6422ad51aca36 [0,1,0,0,0,0|0,0,2]=3 1316 B10R0.4 C#CCCNCCCC(=O)C 6a4f6d4e214c0beef202c76393cb518e [0,1,0,0,0,0|1,0,2]=4 1317 B10R0.4 C#CCCNCCCC(=O)N 4699b8c01dc4e188dd8affdbb9eaf9dd [0,1,0,0,0,0|1,0,2]=4 1318 B10R0.4 C#CCCNCCCC(=O)O 98b54ed437e79d33704ab26e28ebc0dd [0,1,0,0,0,0|0,0,2]=3 1319 B10R0.4 C#CCCOCCCC(=O)C 1620d881c10682ededee208a294409f2 [0,1,0,0,0,0|1,0,2]=4 1320 B10R0.4 C#CCCOCCCC(=O)N 7784a1cb4b5a0ef2c3dfc551d5c25f0f [0,1,0,0,0,0|1,0,2]=4 1321 B10R0.4 C#CCCOCCCC(=O)O a28174cefe569d9e990ac22fc9d3ad0e [0,1,0,0,0,0|0,0,2]=3 1322 B10R0.4 C#CCNCCCCC(=O)C 15d3ce56c98a1540cf9dea51a57319c3 [0,1,0,0,0,0|1,0,2]=4 1323 B10R0.4 C#CCNCCCCC(=O)N 77879df5967a3c70f354ab9f72d04ae2 [0,1,0,0,0,0|1,0,2]=4 1324 B10R0.4 C#CCNCCCCC(=O)O cfecfb6de6c4c4009e0973474be74f6b [0,1,0,0,0,0|0,0,2]=3 1325 B10R0.4 C#CCNCCOCC(=O)O 54e94f8c3cbb3a35fa6eb14025ab2f52 [0,1,0,0,0,0|1,0,2]=4 1326 B10R0.4 C#CCNCCSCC(=O)O 903520f5ea1fb9ebbead8000fddc17ba [0,1,0,0,0,0|1,0,2]=4 1327 B10R0.4 C#CCOCCCCC(=O)C 76d14948defa4fdc96cdebad776f6f0b [0,1,0,0,0,0|1,0,2]=4 1328 B10R0.4 C#CCOCCCCC(=O)N 8f9cd45a68ff12b539c696d5547cd19a [0,1,0,0,0,0|1,0,2]=4 1329 B10R0.4 C#CCOCCCCC(=O)O c227e22f1b2409fb86f11b652a50036a [0,1,0,0,0,0|0,0,2]=3 1330 B10R0.4 C#CCOCCNCC(=O)O ee0193822c8cc1ef2ac8153c432e7ac1 [0,1,0,0,0,0|1,0,2]=4 1331 B10R0.4 C#CCOCCOCC(=O)O 51b665eefb13146f3e2fde5f87115e58 [0,1,0,0,0,0|1,0,2]=4 1332 B10R0.4 C/C=C/CCCOCC(=O)N b25c1835c1c27a7e3a7808a28228ce6d [0,1,0,0,0,0|1,0,2]=4 1333 B10R0.4 C/C=C/CCCOCC(=O)O 7432494e77d961fe0bec79b7d3fd9b8c [0,1,0,0,0,0|0,0,2]=3 1334 B10R0.4 C/C=C/CCOCCC(=O)C bf0b57575115653a3e1e08bb33946b0b [0,1,0,0,0,0|1,0,2]=4 1335 B10R0.4 C/C=C/CCOCCC(=O)N 9bf37f145bf3703d212fc7890fd36415 [0,1,0,0,0,0|1,0,2]=4 1336 B10R0.4 C/C=C/CCOCCC(=O)O 916eacd333d21908cf84f63720010dfe [0,1,0,0,0,0|0,0,2]=3 1337 B10R0.4 C/C=C/CNCCCC(=O)N d8b69fcfe4c6a1e30df7e754e61fc166 [0,1,0,0,0,0|1,0,2]=4 1338 B10R0.4 C/C=C/CNCCCC(=O)O 13ef2ccb4733ce0119a0b85ad92302d4 [0,1,0,0,0,0|0,0,2]=3 1339 B10R0.4 C/C=C/COCCCC(=O)C 15ca9d08aac912f0da1bfa7cb59ec776 [0,1,0,0,0,0|1,0,2]=4 1340 B10R0.4 C/C=C/COCCCC(=O)N cad37fec9dd57d12720981fcf91425bb [0,1,0,0,0,0|1,0,2]=4 1341 B10R0.4 C/C=C/COCCCC(=O)O 797b589f4ff59b345d64adc4a9453f4d [0,1,0,0,0,0|0,0,2]=3 1342 B10R0.4 C/C=C\CCCNCC(=O)C 4ddf0d3010e4410fe3d390d9323118d1 [0,1,0,0,0,0|1,0,2]=4 1343 B10R0.4 C/C=C\CCCNCC(=O)N b5ee90ff88b717752df5ac0633ec6c7d [0,1,0,0,0,0|1,0,2]=4 1344 B10R0.4 C/C=C\CCCNCC(=O)O e1e9e131b6177d66418d3e1789832edd [0,1,0,0,0,0|0,0,2]=3 1345 B10R0.4 C/C=C\CCCOCC(=O)C f99e0cbd2a884d9925d3cf9210edd87f [0,1,0,0,0,0|1,0,2]=4 1346 B10R0.4 C/C=C\CCCOCC(=O)N 7fabf7ec56a7ff4410bf40fbc37ce92f [0,1,0,0,0,0|1,0,2]=4 1347 B10R0.4 C/C=C\CCCOCC(=O)O a10f8b8bf03efd0d18a4f726108b2616 [0,1,0,0,0,0|0,0,2]=3 1348 B10R0.4 C/C=C\CCCOCS(=O)O 235438e67f77931769918f78fc525279 [0,1,0,0,0,0|1,0,2]=4 1349 B10R0.4 C/C=C\CNCCCC(=O)N c93b2d5a87a97ed3f8f0836745199361 [0,1,0,0,0,0|1,0,2]=4 1350 B10R0.4 C/C=C\CNCCCC(=O)O 5654bb2e955ab88d7e5c4af35c7daf9b [0,1,0,0,0,0|0,0,2]=3 1351 B10R0.4 C/C=C\COCCCC(=O)C e4b141674307955ed1f5386cc4b2e467 [0,1,0,0,0,0|1,0,2]=4 1352 B10R0.4 C/C=C\COCCCC(=O)N 690d7b3824ec5ecf82ba288107e30faf [0,1,0,0,0,0|1,0,2]=4 1353 B10R0.4 C/C=C\COCCCC(=O)O 7adc08223c1d3f0b55e4c481022d842b [0,1,0,0,0,0|0,0,2]=3 1354 B10R0.4 C=C(Br)CCOCCCCC bd4199ae2f7609ded49d0b09d8c9a6f4 [0,1,0,0,0,0|2,0,0]=3 1355 B10R0.4 C=C(Br)CCOCCCCF ec423c3c09546db0a56b5dd1e5d51a36 [0,1,0,0,0,0|3,0,0]=4 1356 B10R0.4 C=C(Br)CCOCCCOC b3ea2c798440ed6eea7a067aa421ec37 [0,1,0,0,0,0|3,0,0]=4 1357 B10R0.4 C=C(Br)CCOCCCSC 900282c6671dba3b3dbc56a5896a8753 [0,1,0,0,0,0|3,0,0]=4 1358 B10R0.4 C=C(Br)CCOCCOCC 40bda1917799c42f83bc6da759678558 [0,1,0,0,0,0|3,0,0]=4 1359 B10R0.4 C=C(Br)CCOCCSCC c1981584fb3c022f4b82810773af21bd [0,1,0,0,0,0|3,0,0]=4 1360 B10R0.4 C=C(Br)CNCCCCCC 5aad58ea99227a55b09a67c24d1e7b9a [0,1,0,0,0,0|2,0,0]=3 1361 B10R0.4 C=C(Br)CNCCCCCCl 3683377d806108ce5214bde4a37f2642 [0,1,0,0,0,0|3,0,0]=4 1362 B10R0.4 C=C(Br)CNCCCCCF 2b52b4d093919c561081548241a7ba74 [0,1,0,0,0,0|3,0,0]=4 1363 B10R0.4 C=C(Br)CNCCCCCO 11422d2581a0d9e59b31c5ed5676f8c8 [0,1,0,0,0,0|3,0,0]=4 1364 B10R0.4 C=C(Br)CNCCCCOC 6be55f218c66cd44a4806d3ffbc8314c [0,1,0,0,0,0|3,0,0]=4 1365 B10R0.4 C=C(Br)CNCCCCSC 2f19a9d4399c7ab2c72d8f35e788ed2a [0,1,0,0,0,0|3,0,0]=4 1366 B10R0.4 C=C(Br)CNCCCOCC 11d450973db43e2cee70a7206297adc9 [0,1,0,0,0,0|3,0,0]=4 1367 B10R0.4 C=C(Br)CNCCCSCC dc0397aa1f44e77e9eba8b14c3510b83 [0,1,0,0,0,0|3,0,0]=4 1368 B10R0.4 C=C(Br)CNCCOCCC 1fd958cc709459e845c5bda42f04c922 [0,1,0,0,0,0|3,0,0]=4 1369 B10R0.4 C=C(Br)CNCOCCCC be81cdd270140d1323ac4c0d6431cadd [0,1,0,0,0,0|3,0,0]=4 1370 B10R0.4 C=C(Br)COCCCCCC dd72666212807c8ae20cc4e5d80424cb [0,1,0,0,0,0|2,0,0]=3 1371 B10R0.4 C=C(Br)COCCCCCF 3e42a6ab1d9047a0920c8d72e3c2051c [0,1,0,0,0,0|3,0,0]=4 1372 B10R0.4 C=C(Br)COCCCCOC 9863e7f380585af6e6d47abac7bfa9bd [0,1,0,0,0,0|3,0,0]=4 1373 B10R0.4 C=C(Br)COCCCCSC e7373a4dbf3b78bd563bf9e2c2a49e9a [0,1,0,0,0,0|3,0,0]=4 1374 B10R0.4 C=C(Br)COCCCOCC e78375cf3a224d7933758642e79739cb [0,1,0,0,0,0|3,0,0]=4 1375 B10R0.4 C=C(Br)COCCCSCC 9fc42a08862c59ccf081ee2c2a53a3d3 [0,1,0,0,0,0|3,0,0]=4 1376 B10R0.4 C=C(Br)COCCOCCC 2ab8ecfb9719319c486f7a5f711548ab [0,1,0,0,0,0|3,0,0]=4 1377 B10R0.4 C=C(Br)COCCSCCC 3f0163d5a869062d894ef5f368125a63 [0,1,0,0,0,0|3,0,0]=4 1378 B10R0.4 C=C(Br)COCOCCCC f79378cb6736a5bea9ab96dcaad0286a [0,1,0,0,0,0|3,0,0]=4 1379 B10R0.4 C=C(C)CCCNCCCC 10e9d5bc2148f814ac87779b16970bb2 [0,1,0,0,0,0|2,0,0]=3 1380 B10R0.4 C=C(C)CCCNCCCCl f540489ea420c5524569228a050ee86b [0,1,0,0,0,0|3,0,0]=4 1381 B10R0.4 C=C(C)CCCNCCCO 6fb4545ffd1221f6a8807cd5a1e832fc [0,1,0,0,0,0|3,0,0]=4 1382 B10R0.4 C=C(C)CCCNCCOC d9c65d188599361437b603b9b007c6ea [0,1,0,0,0,0|3,0,0]=4 1383 B10R0.4 C=C(C)CCCNCCSC 04ecdd8acf1ad6603b77a95bbeb479ef [0,1,0,0,0,0|3,0,0]=4 1384 B10R0.4 C=C(C)CCCOCCCC f556e23942a670bff2e32fedd43a44e3 [0,1,0,0,0,0|2,0,0]=3 1385 B10R0.4 C=C(C)CCCOCCCF fb1ca22e49dab629944c7aa2209f902a [0,1,0,0,0,0|3,0,0]=4 1386 B10R0.4 C=C(C)CCCOCCCS 89790dde51182f66982334a3deb1949e [0,1,0,0,0,0|3,0,0]=4 1387 B10R0.4 C=C(C)CCCOCCOC 3f0312a45e1ed067030fa8e02990b2c3 [0,1,0,0,0,0|3,0,0]=4 1388 B10R0.4 C=C(C)CCCOCCSC a749ddeb04d3f5de92173a618408a78a [0,1,0,0,0,0|3,0,0]=4 1389 B10R0.4 C=C(C)CCCOCOCC cfb1f2e4d292ad6bbec9e3945b66d7a7 [0,1,0,0,0,0|3,0,0]=4 1390 B10R0.4 C=C(C)CCNCCCCC 6827c3721728b6bdd5fb962e657afed6 [0,1,0,0,0,0|2,0,0]=3 1391 B10R0.4 C=C(C)CCNCCCCCl 988ee59931bccd7395f971f3fc52b91b [0,1,0,0,0,0|3,0,0]=4 1392 B10R0.4 C=C(C)CCNCCCCF b608b808f5f1abbe8b3eb0d8ec2a08f3 [0,1,0,0,0,0|3,0,0]=4 1393 B10R0.4 C=C(C)CCNCCCCO 8ed233854aa3368c8ee9924b9a675702 [0,1,0,0,0,0|3,0,0]=4 1394 B10R0.4 C=C(C)CCNCCCCS 497c221c8cd4bf33b1c9b025e8bef7f6 [0,1,0,0,0,0|3,0,0]=4 1395 B10R0.4 C=C(C)CCNCCCOC 7f37bbe15d40ae864ba95b43292254f2 [0,1,0,0,0,0|3,0,0]=4 1396 B10R0.4 C=C(C)CCNCCCSC c4b9523e1ec5747273dfc555cf39dda3 [0,1,0,0,0,0|3,0,0]=4 1397 B10R0.4 C=C(C)CCNCCOCC 1800ec5cfe4142bc612dd1f509192ae9 [0,1,0,0,0,0|3,0,0]=4 1398 B10R0.4 C=C(C)CCNCCSCC 7c73eef38dde53179af76784a65d2fc7 [0,1,0,0,0,0|3,0,0]=4 1399 B10R0.4 C=C(C)CCOCCCCC bd422e129da3de0d5182ac59fdf2b775 [0,1,0,0,0,0|2,0,0]=3 1400 B10R0.4 C=C(C)CCOCCCCF e4790618cb40fee49e0b6f0ad58d7a0b [0,1,0,0,0,0|3,0,0]=4 1401 B10R0.4 C=C(C)CCOCCCCS c9c1ee6054586073f927103c1494ff4d [0,1,0,0,0,0|3,0,0]=4 1402 B10R0.4 C=C(C)CCOCCCOC 9920c6fd3cea02f4ff0d9a82b6cc4f11 [0,1,0,0,0,0|3,0,0]=4 1403 B10R0.4 C=C(C)CCOCCCSC 30b64bf6cb0144e399d0d84c6208f555 [0,1,0,0,0,0|3,0,0]=4 1404 B10R0.4 C=C(C)CCOCCOCC 717eb9110ef1db276eaa8e419a3c583c [0,1,0,0,0,0|3,0,0]=4 1405 B10R0.4 C=C(C)CCOCCSCC d7f38404c9df91d4dbef07dce206e8d0 [0,1,0,0,0,0|3,0,0]=4 1406 B10R0.4 C=C(C)CNCCCCCC 57e2209f6875fc62d2bad933ad5990a8 [0,1,0,0,0,0|2,0,0]=3 1407 B10R0.4 C=C(C)CNCCCCCCl fc71394fc509464e551e48a2a5ce6a75 [0,1,0,0,0,0|3,0,0]=4 1408 B10R0.4 C=C(C)CNCCCCCF 19480ed5793900ec08b2586dd8530498 [0,1,0,0,0,0|3,0,0]=4 1409 B10R0.4 C=C(C)CNCCCCCO b7e6fe19836fc90c96094879e234ddd4 [0,1,0,0,0,0|3,0,0]=4 1410 B10R0.4 C=C(C)CNCCCCOC 46c6208a0d912234174593184d360a2f [0,1,0,0,0,0|3,0,0]=4 1411 B10R0.4 C=C(C)CNCCCCSC 26fd49b12816d97ef60eb8a0a958f022 [0,1,0,0,0,0|3,0,0]=4 1412 B10R0.4 C=C(C)CNCCCOCC 12ed76af4b696f63a0ce483fc167ac9b [0,1,0,0,0,0|3,0,0]=4 1413 B10R0.4 C=C(C)CNCCCSCC 0c15c4af69a37dfbcef41c4fc3572bf1 [0,1,0,0,0,0|3,0,0]=4 1414 B10R0.4 C=C(C)CNCCOCCC ebb6318b7890a67000ace34e52e289a8 [0,1,0,0,0,0|3,0,0]=4 1415 B10R0.4 C=C(C)CNCOCCCC 63ac43ea31441851b42c38ad22dae608 [0,1,0,0,0,0|3,0,0]=4 1416 B10R0.4 C=C(C)COCCCCCC 18580082a3e432d96826bd208c01f2c4 [0,1,0,0,0,0|2,0,0]=3 1417 B10R0.4 C=C(C)COCCCCCF 7f54c7932dc6e69b5ecb34c8420d6c0a [0,1,0,0,0,0|3,0,0]=4 1418 B10R0.4 C=C(C)COCCCCOC 0be2b3d96d5fe0e536c691f2eb818238 [0,1,0,0,0,0|3,0,0]=4 1419 B10R0.4 C=C(C)COCCCCSC f6e74284d36a5d31e6ad5a7655271836 [0,1,0,0,0,0|3,0,0]=4 1420 B10R0.4 C=C(C)COCCCOCC 97304696b54ca3ec3c8ee3158199e4f9 [0,1,0,0,0,0|3,0,0]=4 1421 B10R0.4 C=C(C)COCCCSCC 015baf081e11c8b4bab8d4d54b7040ae [0,1,0,0,0,0|3,0,0]=4 1422 B10R0.4 C=C(C)COCCOCCC d8af08c783e9745d16b0d028ef34c042 [0,1,0,0,0,0|3,0,0]=4 1423 B10R0.4 C=C(C)COCCSCCC bd0b2179c4b75b02a6deedd231177823 [0,1,0,0,0,0|3,0,0]=4 1424 B10R0.4 C=C(C)COCOCCCC 2e2c972b240fbb17ab6db9efb68dbea2 [0,1,0,0,0,0|3,0,0]=4 1425 B10R0.4 C=C(Cl)CNCCCCCC ba5adaf38bac8653992345ea7a9d6593 [0,1,0,0,0,0|2,0,0]=3 1426 B10R0.4 C=C(Cl)CNCCCCCCl f03deb986329dd1ccc614c68fa07fda4 [0,1,0,0,0,0|3,0,0]=4 1427 B10R0.4 C=C(Cl)CNCCCCCO 4a5ab65e89bea2085d0bdabfbaba8a0a [0,1,0,0,0,0|3,0,0]=4 1428 B10R0.4 C=C(Cl)CNCCCCOC 4e3ddb081acffbfc8ae75a34b4f006b8 [0,1,0,0,0,0|3,0,0]=4 1429 B10R0.4 C=C(Cl)CNCCCCSC 0445906aaae265d8676085f51f1735f6 [0,1,0,0,0,0|3,0,0]=4 1430 B10R0.4 C=C(Cl)CNCCCOCC bbfe9469fcba1874249e4ab9562b1c3e [0,1,0,0,0,0|3,0,0]=4 1431 B10R0.4 C=C(Cl)CNCCOCCC 71d78cfe81b6bc82d6f82706cf34a4d1 [0,1,0,0,0,0|3,0,0]=4 1432 B10R0.4 C=C(Cl)COCCCCCC 90c6c4185c44a77006fc9e2e499a0eab [0,1,0,0,0,0|2,0,0]=3 1433 B10R0.4 C=C(Cl)COCCCCCF 13ce435e93cc46775f79f00722aca9b8 [0,1,0,0,0,0|3,0,0]=4 1434 B10R0.4 C=C(Cl)COCCCCOC 057076643c72b393554ce9879ab4879e [0,1,0,0,0,0|3,0,0]=4 1435 B10R0.4 C=C(Cl)COCCCCSC 8203cb80ab2e00dd7537e86415b7d604 [0,1,0,0,0,0|3,0,0]=4 1436 B10R0.4 C=C(Cl)COCCCOCC bb058e533eb9947d78628feb38e460fe [0,1,0,0,0,0|3,0,0]=4 1437 B10R0.4 C=C(Cl)COCCCSCC e8fda4d7d6c22f5fb7b1f2dc6a2b42fb [0,1,0,0,0,0|3,0,0]=4 1438 B10R0.4 C=C(Cl)COCCOCCC 96b48f6aa861425d6e0db12c6d1eceeb [0,1,0,0,0,0|3,0,0]=4 1439 B10R0.4 C=C(Cl)COCCSCCC 6c294846987157a1030aa9587910ea42 [0,1,0,0,0,0|3,0,0]=4 1440 B10R0.4 C=C(Cl)COCOCCCC 3d7eeff6c6fd8795888ed50830545871 [0,1,0,0,0,0|3,0,0]=4 1441 B10R0.4 C=C(F)CNCCCCCC f83516f668b336b0229c934406813e90 [0,1,0,0,0,0|2,0,0]=3 1442 B10R0.4 C=C(F)CNCCCCCCl d29b3a8835826f03fd41a0d4889a8238 [0,1,0,0,0,0|3,0,0]=4 1443 B10R0.4 C=C(F)CNCCCCCO da3af5d2c5320c4022a99446b038b646 [0,1,0,0,0,0|3,0,0]=4 1444 B10R0.4 C=C(F)CNCCOCCC 95311204fa2b8f442945d656f49dda03 [0,1,0,0,0,0|3,0,0]=4 1445 B10R0.4 C=C(F)COCCCCCC 14d179349839635633c1a8bbe576d8e0 [0,1,0,0,0,0|2,0,0]=3 1446 B10R0.4 C=C(F)COCCCCCF 84e53d186707014e6375b171a6448df1 [0,1,0,0,0,0|3,0,0]=4 1447 B10R0.4 C=C(F)COCCCCOC 925aca084404a016557ddfcfec89da6b [0,1,0,0,0,0|3,0,0]=4 1448 B10R0.4 C=C(F)COCCCCSC f2c1ed16601e373a6fb2a1bab65044a2 [0,1,0,0,0,0|3,0,0]=4 1449 B10R0.4 C=C(F)COCCCOCC 2a584f5191e0551ea2dd82d18cc8f5ed [0,1,0,0,0,0|3,0,0]=4 1450 B10R0.4 C=C(F)COCCCSCC 134fdfec9349898021df75161ed6af19 [0,1,0,0,0,0|3,0,0]=4 1451 B10R0.4 C=C(F)COCCOCCC 9e276c07d2273eda3dfd26c213885662 [0,1,0,0,0,0|3,0,0]=4 1452 B10R0.4 C=C(F)COCCSCCC bbf490485c3c3bf547143b009afb0e14 [0,1,0,0,0,0|3,0,0]=4 1453 B10R0.4 C=C(I)COCCCCCC 122b373be56fb0f4806cbe68ff87c42a [0,1,0,0,0,0|2,0,0]=3 1454 B10R0.4 C=C(I)COCCCCCF 0633fb84409f2258fee73af2c2270748 [0,1,0,0,0,0|3,0,0]=4 1455 B10R0.4 C=C(I)COCCCCOC c4ccbeffad29d92ca3e250fb0af6d609 [0,1,0,0,0,0|3,0,0]=4 1456 B10R0.4 C=C(I)COCCCOCC 60915c7ad923d09ab57756216f57c255 [0,1,0,0,0,0|3,0,0]=4 1457 B10R0.4 C=C(I)COCCCSCC 9b44f6d7dc362b5b73ce7d3ee2eac0fc [0,1,0,0,0,0|3,0,0]=4 1458 B10R0.4 C=C(I)COCCOCCC ee1c3264f2555ce0706e17dd11e8c2ba [0,1,0,0,0,0|3,0,0]=4 1459 B10R0.4 C=C(I)COCOCCCC fbf1d62f1f88ef6100270d3724438509 [0,1,0,0,0,0|3,0,0]=4 1460 B10R0.4 C=C=CCCOCCC(=O)O 36731dea7a47ff84487187a5cdba8dcc [0,1,0,0,0,0|0,0,3]=4 1461 B10R0.4 C=CCCCCCNC(=O)C f02f227ef07d7627d48ebb8926ddb9fe [0,1,0,0,0,0|1,0,2]=4 1462 B10R0.4 C=CCCCCNCC(=O)C d4656945f366a9d0818e9e76353daf2b [0,1,0,0,0,0|1,0,2]=4 1463 B10R0.4 C=CCCCCNCC(=O)N 1a4b2a13fe51dd21b0f488561910ca90 [0,1,0,0,0,0|1,0,2]=4 1464 B10R0.4 C=CCCCCNCC(=O)O 0a5c0aa41b8a418ca63d9c52b3af9bba [0,1,0,0,0,0|0,0,2]=3 1465 B10R0.4 C=CCCCCOCC(=O)C 48cbf00be7eed401858778b40eb31e38 [0,1,0,0,0,0|1,0,2]=4 1466 B10R0.4 C=CCCCCOCC(=O)N 398c2f7e4b30af79a0a22e202b5b8d3d [0,1,0,0,0,0|1,0,2]=4 1467 B10R0.4 C=CCCCCOCC(=O)O cb2fa521222587e3021c2fae70958356 [0,1,0,0,0,0|0,0,2]=3 1468 B10R0.4 C=CCCCCOCS(=O)O 70aa1b304b309a3ea35cf440f48ffe99 [0,1,0,0,0,0|1,0,2]=4 1469 B10R0.4 C=CCCCNCCC(=O)C c0610930b81d09a23b99259d385a8e1c [0,1,0,0,0,0|1,0,2]=4 1470 B10R0.4 C=CCCCNCCC(=O)N 2321c22d4742d69fef5771a0d5289a21 [0,1,0,0,0,0|1,0,2]=4 1471 B10R0.4 C=CCCCNCCC(=O)O 92047546031e5472718936e8674175a4 [0,1,0,0,0,0|0,0,2]=3 1472 B10R0.4 C=CCCCNCCS(=O)O 6cc54ffdc22e6126d21d6b980b47c274 [0,1,0,0,0,0|1,0,2]=4 1473 B10R0.4 C=CCCCOCCC(=O)C aaf7df9ced6c1e3654d79565c7674c5e [0,1,0,0,0,0|1,0,2]=4 1474 B10R0.4 C=CCCCOCCC(=O)N f2f5178d09e5116ba56522a7dee24d30 [0,1,0,0,0,0|1,0,2]=4 1475 B10R0.4 C=CCCCOCCC(=O)O 6737b7acf8edcb773be3c12c9590a3b5 [0,1,0,0,0,0|0,0,2]=3 1476 B10R0.4 C=CCCNCCCC(=O)C 17e970d0c5824e2b028f94e526110965 [0,1,0,0,0,0|1,0,2]=4 1477 B10R0.4 C=CCCNCCCC(=O)N eeb61d95d8598c914690c6e0191f8ac4 [0,1,0,0,0,0|1,0,2]=4 1478 B10R0.4 C=CCCNCCCC(=O)O da3b42b51cbf87e7b2494d17b8ac7f6f [0,1,0,0,0,0|0,0,2]=3 1479 B10R0.4 C=CCCOCCCC(=O)C 7747672577a9f8f405d52d673530b99e [0,1,0,0,0,0|1,0,2]=4 1480 B10R0.4 C=CCCOCCCC(=O)N 1e2c01c23afc956b32c4c25db19ab031 [0,1,0,0,0,0|1,0,2]=4 1481 B10R0.4 C=CCCOCCCC(=O)O 43c029708142e3a5ef8331e455444c11 [0,1,0,0,0,0|0,0,2]=3 1482 B10R0.4 C=CCNCCCCC(=O)N cb783f6fdc9088c5cf415d48db1fc6ff [0,1,0,0,0,0|1,0,2]=4 1483 B10R0.4 C=CCNCCCCC(=O)O 40e4988a260bae226de0ef694170aaa0 [0,1,0,0,0,0|0,0,2]=3 1484 B10R0.4 C=CCNCCOCC(=O)O 69dc3a167188cafc46debe9b8b8de67d [0,1,0,0,0,0|1,0,2]=4 1485 B10R0.4 C=CCNCCSCC(=O)O f2eab477636613d4509f21d58250a374 [0,1,0,0,0,0|1,0,2]=4 1486 B10R0.4 C=CCOCCCCC(=O)C 3d3614bec0a8b097e6d7599d14730099 [0,1,0,0,0,0|1,0,2]=4 1487 B10R0.4 C=CCOCCCCC(=O)N 632ba5f07a37fd06fa7ceab73e42b50d [0,1,0,0,0,0|1,0,2]=4 1488 B10R0.4 C=CCOCCCCC(=O)O fb29bee7adeaeb4edbb2783380a11af9 [0,1,0,0,0,0|0,0,2]=3 1489 B10R0.4 C=CCOCCNCC(=O)O 30b9a1bd2936ecd3590b92335bf1791f [0,1,0,0,0,0|1,0,2]=4 1490 B10R0.4 C=CCOCCOCC(=O)O 57740fa1672a42170578f3c0922a012f [0,1,0,0,0,0|1,0,2]=4 1491 B10R0.4 C=COCCCNCC(=O)O 5d76324bb7dc51ab853b002fc2a3b8bf [0,1,0,0,0,0|1,0,2]=4 1492 B10R0.4 C=COCCNCCC(=O)O 36edd71ad946eb97f575abde17f7e86c [0,1,0,0,0,0|1,0,2]=4 1493 B10R0.4 C=COCCOCCC(=O)O 5e162282a9957b55e148c12efa4a80e5 [0,1,0,0,0,0|1,0,2]=4 1494 B10R0.4 CC#CCCCOCC(=O)N bbcf6de8166b9e531200ab203ae01d62 [0,1,0,0,0,0|1,0,2]=4 1495 B10R0.4 CC#CCCCOCC(=O)O 2de1c93fb989703176b9484ad7a46440 [0,1,0,0,0,0|0,0,2]=3 1496 B10R0.4 CC#CCCOCCC(=O)C 10965a7f1bd43c5799a088345a9da4cb [0,1,0,0,0,0|1,0,2]=4 1497 B10R0.4 CC#CCCOCCC(=O)N 6c5076be4350602dfadc422ea7fa5e1e [0,1,0,0,0,0|1,0,2]=4 1498 B10R0.4 CC#CCCOCCC(=O)O c82bfbd0e4b691d439eaafcab2bac58c [0,1,0,0,0,0|0,0,2]=3 1499 B10R0.4 CC#CCNCCCC(=O)C 8c297251b513a5d7b530b37de176311a [0,1,0,0,0,0|1,0,2]=4 1500 B10R0.4 CC#CCNCCCC(=O)N f76e41df2081fafb2a1cfe26d2289d60 [0,1,0,0,0,0|1,0,2]=4 1501 B10R0.4 CC#CCOCCCC(=O)C 817dc83d0e6a497d6c3d28bed1f328b2 [0,1,0,0,0,0|1,0,2]=4 1502 B10R0.4 CC#CCOCCCC(=O)N 7093c3ef0907c4ece0c95f591dc17b4c [0,1,0,0,0,0|1,0,2]=4 1503 B10R0.4 CC(=O)CCCCCNC#N 409bc619e788e3e40cb6c642cabe4440 [0,1,0,0,0,0|2,0,1]=4 1504 B10R0.4 CC(=O)CCCCNCC#N 40a43ad7996cd8b892d299ac36b06a67 [0,1,0,0,0,0|2,0,1]=4 1505 B10R0.4 CC(=O)CCCCNCCBr f3ddce1f9a1062cede3a27a1b630ea15 [0,1,0,0,0,0|2,0,0]=3 1506 B10R0.4 CC(=O)CCCCNCCF 8711dcf185e3a6f218d23593dbe2fb8a [0,1,0,0,0,0|2,0,0]=3 1507 B10R0.4 CC(=O)CCCCNCCI 0f0054e4955e683ecb2e2ae5c2bd1b57 [0,1,0,0,0,0|2,0,0]=3 1508 B10R0.4 CC(=O)CCCCNCCO 6335f44acfc8ae8a1c74a2effeffdaa9 [0,1,0,0,0,0|2,0,0]=3 1509 B10R0.4 CC(=O)CCCCNCCS 9086c15c5cb71c0d777519e498536740 [0,1,0,0,0,0|2,0,0]=3 1510 B10R0.4 CC(=O)CCCCOCC#N 2ac82280cdf5d25bb50f7f563cada336 [0,1,0,0,0,0|2,0,1]=4 1511 B10R0.4 CC(=O)CCCCOCC=O 2df6a73c930107619b2607a0e979711f [0,1,0,0,0,0|2,0,1]=4 1512 B10R0.4 CC(=O)CCCCOCCF 0c6e1aa2ddd2547de23cc588f8d80289 [0,1,0,0,0,0|2,0,0]=3 1513 B10R0.4 CC(=O)CCCCOCCS ac88dd646f017b673d2dbc45961aa74f [0,1,0,0,0,0|2,0,0]=3 1514 B10R0.4 CC(=O)CCCNCCC#N 6fbf1792348aeb88f6b4a60e1f149d55 [0,1,0,0,0,0|2,0,1]=4 1515 B10R0.4 CC(=O)CCCNCCCCl f1625dacee073cbb4f019dbe32494f50 [0,1,0,0,0,0|2,0,0]=3 1516 B10R0.4 CC(=O)CCCNCCCO 8b11019ccb106855d75ac6c8c4c3fe63 [0,1,0,0,0,0|2,0,0]=3 1517 B10R0.4 CC(=O)CCCNCCON 39790c28c5f61ebb20ba71839a2b130e [0,1,0,0,0,0|3,0,0]=4 1518 B10R0.4 CC(=O)CCCOCCC#N 51632f252ba12c76cfafca65076c950b [0,1,0,0,0,0|2,0,1]=4 1519 B10R0.4 CC(=O)CCCOCCC=O 03837868c30ee241350d840ba60401f3 [0,1,0,0,0,0|2,0,1]=4 1520 B10R0.4 CC(=O)CCCOCCCF e44a9d620794f28a8e038989a8cb2ae7 [0,1,0,0,0,0|2,0,0]=3 1521 B10R0.4 CC(=O)CCCOCCCS 224ce1d62cb0cc546747e7754a42aa6c [0,1,0,0,0,0|2,0,0]=3 1522 B10R0.4 CC(=O)CCNCCCC#N 2d94a0c85a2787f88dcec1ac2151aac2 [0,1,0,0,0,0|2,0,1]=4 1523 B10R0.4 CC(=O)CCNCCCCCl e92127d9f4fec06f947ca88e6cf4a50b [0,1,0,0,0,0|2,0,0]=3 1524 B10R0.4 CC(=O)CCNCCCCO 9f6c569b44bc6c4cbc16c08a781c9532 [0,1,0,0,0,0|2,0,0]=3 1525 B10R0.4 CC(=O)CCNCCCCS e5b279c159671291cf92ca332011d729 [0,1,0,0,0,0|2,0,0]=3 1526 B10R0.4 CC(=O)CCOCCCC#N 3439ab62b1a4306d077e747b17b52b3f [0,1,0,0,0,0|2,0,1]=4 1527 B10R0.4 CC(=O)CCOCCCC=O 9149a1f574a0cb9767d812b54caf8a48 [0,1,0,0,0,0|2,0,1]=4 1528 B10R0.4 CC(=O)CCOCCCCF ef2acd71a360f46e90e912d973dfe5aa [0,1,0,0,0,0|2,0,0]=3 1529 B10R0.4 CC(=O)CCOCCCCS 64f0dae486fcb36ef0baae73a313556f [0,1,0,0,0,0|2,0,0]=3 1530 B10R0.4 CC(=O)CNCCCCC#N 53f755c9bfefbdb59dbbf9cf96d922ae [0,1,0,0,0,0|2,0,1]=4 1531 B10R0.4 CC(=O)CNCCCCC=O 49629e63e0c1345e1b84ffb393898803 [0,1,0,0,0,0|2,0,1]=4 1532 B10R0.4 CC(=O)CNCCCCCF 14ed717f1f055fc3ffebcb0f3bb7f6ab [0,1,0,0,0,0|2,0,0]=3 1533 B10R0.4 CC(=O)CNCCCCCO 64da7cdb6d2a9c33dc01f9b5a780e4d4 [0,1,0,0,0,0|2,0,0]=3 1534 B10R0.4 CC(=O)CNCCCCON 6a3e418a35568089bc4305289fe8ac4a [0,1,0,0,0,0|3,0,0]=4 1535 B10R0.4 CC(=O)CNCCOCCO 8ea13ba16758a75b0bcc35b8e83bf47c [0,1,0,0,0,0|3,0,0]=4 1536 B10R0.4 CC(=O)COCCCCC#N 9685ae7527fc647038a51c190d3f08a1 [0,1,0,0,0,0|2,0,1]=4 1537 B10R0.4 CC(=O)COCCCCC=O 0cd5ef4918e08b4005cacaed0a9bf732 [0,1,0,0,0,0|2,0,1]=4 1538 B10R0.4 CC(=O)COCCCCCF 7aec6ce84a2c3f216e8ae40d950f6334 [0,1,0,0,0,0|2,0,0]=3 1539 B10R0.4 CC(=O)NCCCCCC#N 7d7e326f6079d51d23d33d7387b5ecf1 [0,1,0,0,0,0|2,0,1]=4 1540 B10R0.4 CC(=O)NCCCCCCCl f93e4eee74ea26870e48ebdfc4f07177 [0,1,0,0,0,0|2,0,0]=3 1541 B10R0.4 CC(=O)NCCCCCCO f4c6533638e4e2bcf3850e47e46df271 [0,1,0,0,0,0|2,0,0]=3 1542 B10R0.4 CC(=O)NCCCCNCF 94f7a1b3278570de8c715e37e1dcf0ca [0,1,0,0,0,0|3,0,0]=4 1543 B10R0.4 CC(=O)NCCCCNCO e6647a1b243aad41fd7326b293fd03aa [0,1,0,0,0,0|3,0,0]=4 1544 B10R0.4 CC(=O)NCCCNCCBr c5bf390cd67244fca61da70915510836 [0,1,0,0,0,0|3,0,0]=4 1545 B10R0.4 CC(=O)NCCCNCCF f8ff6e78a0b6723aaef82e909ce5720e [0,1,0,0,0,0|3,0,0]=4 1546 B10R0.4 CC(=O)NCCCNCCI 0de04304c15cab824a38ac9a68c8e1e3 [0,1,0,0,0,0|3,0,0]=4 1547 B10R0.4 CC(=O)NCCCNCCO b274a6a1d4ab3e94648bbf11af3ef134 [0,1,0,0,0,0|3,0,0]=4 1548 B10R0.4 CC(=O)NCCCNCCS 41661afeb2b495a1bbb2a54ed94fa12e [0,1,0,0,0,0|3,0,0]=4 1549 B10R0.4 CC(=O)NCCCOCCF 4ad9c4165362180f03ca3aa90e51bcb7 [0,1,0,0,0,0|3,0,0]=4 1550 B10R0.4 CC(=O)NCCCOCCO d8642d86f9828c421395b8828e5c16cc [0,1,0,0,0,0|3,0,0]=4 1551 B10R0.4 CC(=O)NCCCOCCS 3b07ad0b6908d97f82e6873ea849aae9 [0,1,0,0,0,0|3,0,0]=4 1552 B10R0.4 CC(=O)NCCNCCCCl 8fba596d613f4b68048c6d94ab716ca0 [0,1,0,0,0,0|3,0,0]=4 1553 B10R0.4 CC(=O)NCCNCCCF f5d4e6c9754b001a61d157a4a538fc1c [0,1,0,0,0,0|3,0,0]=4 1554 B10R0.4 CC(=O)NCCNCCCO 73c1d5863baf1d3692da6c1a9ef51c9d [0,1,0,0,0,0|3,0,0]=4 1555 B10R0.4 CC(=O)NCCNCCCS 269b9c47bec531a179181d78c765c1e4 [0,1,0,0,0,0|3,0,0]=4 1556 B10R0.4 CC(=O)NCCOCCCF 2becad5a9f97e4fc020b39d932707461 [0,1,0,0,0,0|3,0,0]=4 1557 B10R0.4 CC(=O)NCCOCCCO 27c8507b9090ddb34bd1e400a65f0b8a [0,1,0,0,0,0|3,0,0]=4 1558 B10R0.4 CC(=O)NCCOCCCS 191fb12c2753f5ade5a99b66e3307c62 [0,1,0,0,0,0|3,0,0]=4 1559 B10R0.4 CC(=O)NCOCCCCF cad6f34847e6176f7df91d583f48dee6 [0,1,0,0,0,0|3,0,0]=4 1560 B10R0.4 CC(=O)OCCCCOCF a6ecf178f253a13fd8b9cfaafe1c5ad5 [0,1,0,0,0,0|3,0,0]=4 1561 B10R0.4 CC(=O)OCCCNCCBr 45a0a8174cda65b2e44638eae2c64930 [0,1,0,0,0,0|3,0,0]=4 1562 B10R0.4 CC(=O)OCCCNCCF fc4e3af37c2a7f8d6298a7e753d83411 [0,1,0,0,0,0|3,0,0]=4 1563 B10R0.4 CC(=O)OCCCNCCI b0edef5bff44063cb018d810c54c48f6 [0,1,0,0,0,0|3,0,0]=4 1564 B10R0.4 CC(=O)OCCCNCCO e2803970c3f8d243d9acff5748815b6d [0,1,0,0,0,0|3,0,0]=4 1565 B10R0.4 CC(=O)OCCCNCCS 89c9ea4e3ec4c55fa7a152a453b47394 [0,1,0,0,0,0|3,0,0]=4 1566 B10R0.4 CC(=O)OCCCOCCF 5f3f1ac838e36ba2208c4cb9b2008f58 [0,1,0,0,0,0|3,0,0]=4 1567 B10R0.4 CC(=O)OCCCOCCS a1361bf0f855c56236284cad6a3785a9 [0,1,0,0,0,0|3,0,0]=4 1568 B10R0.4 CC(=O)OCCNCCCCl 280b1e41ef151e8cbea1eb2b99e4ff17 [0,1,0,0,0,0|3,0,0]=4 1569 B10R0.4 CC(=O)OCCNCCCO 51fe93c4d3aab91af9bdaa8c00548018 [0,1,0,0,0,0|3,0,0]=4 1570 B10R0.4 CC(=O)OCCOCCCF 2a933cd1cb7eefce70344b2c7e8690c8 [0,1,0,0,0,0|3,0,0]=4 1571 B10R0.4 CC(=O)OCCOCCCS 7e37feca2385a7a728603133e92174e3 [0,1,0,0,0,0|3,0,0]=4 1572 B10R0.4 CC(=O)OCNCCCCCl c6ce680dd8c75299bd47ddb4bc10ea8e [0,1,0,0,0,0|3,0,0]=4 1573 B10R0.4 CC(=O)OCNCCCCO 751748afd380707c2c1db4ffae00d8f0 [0,1,0,0,0,0|3,0,0]=4 1574 B10R0.4 CC(=O)OCNCCCCS 89f792939757bf4a8c9cbb69115e249e [0,1,0,0,0,0|3,0,0]=4 1575 B10R0.4 CC(=O)OCOCCCCF 1c9cd9bca1f3bbf754de3fe868d711b8 [0,1,0,0,0,0|3,0,0]=4 1576 B10R0.4 CC(=O)OCOCCCCS 33c7cb81f6187c0519a6e6fbc3514b90 [0,1,0,0,0,0|3,0,0]=4 1577 B10R0.4 CC(=O)SCCCNCCBr 780f9ec3be60a8458eb6357b9fd1c08d [0,1,0,0,0,0|3,0,0]=4 1578 B10R0.4 CC(=O)SCCCNCCF b48968f8db7c3dd0def78f3d888d0a2f [0,1,0,0,0,0|3,0,0]=4 1579 B10R0.4 CC(=O)SCCCNCCI ba5737b7c52e01afa4f82737958f9e2c [0,1,0,0,0,0|3,0,0]=4 1580 B10R0.4 CC(=O)SCCCNCCO 5000c666fe4fb650808aed10db1ef00e [0,1,0,0,0,0|3,0,0]=4 1581 B10R0.4 CC(=O)SCCCNCCS 4fd02c4a7fb2c3262ceda0ebb32a69ec [0,1,0,0,0,0|3,0,0]=4 1582 B10R0.4 CC(=O)SCCCOCCF 7684fcfe029a04cab31730213eee5b24 [0,1,0,0,0,0|3,0,0]=4 1583 B10R0.4 CC(=O)SCCCOCCS e28ec23673de9eab3a4aaf3626e01c49 [0,1,0,0,0,0|3,0,0]=4 1584 B10R0.4 CC(=O)SCCNCCCCl 3c7624e99dfb7dc951eb1538069298bf [0,1,0,0,0,0|3,0,0]=4 1585 B10R0.4 CC(=O)SCCNCCCO 6985e2acae772c13ca35b6b74b2f6f07 [0,1,0,0,0,0|3,0,0]=4 1586 B10R0.4 CC(=O)SCCOCCCF 9935c18df2f33081a212c42d502352d8 [0,1,0,0,0,0|3,0,0]=4 1587 B10R0.4 CC(=O)SCCOCCCS 39535cd37f3d82059f56b126d11d2a7d [0,1,0,0,0,0|3,0,0]=4 1588 B10R0.4 CC(O)CCCCNCCBr 082aa61a43b4ae24e97dc8dc27e0617b [0,1,0,0,0,0|2,0,1]=4 1589 B10R0.4 CC(O)CCCCNCCF fcad69d23d8f8b6d73e8fe73ecadf10d [0,1,0,0,0,0|2,0,1]=4 1590 B10R0.4 CC(O)CCCCNCCI 09c72fb600d7103fca29c52ed7574123 [0,1,0,0,0,0|2,0,1]=4 1591 B10R0.4 CC(O)CCCCNCCO 96ac3f35be2ba96964968bf323d9528d [0,1,0,0,0,0|2,0,1]=4 1592 B10R0.4 CC(O)CCCCNCCS 59ba7dabda2b2948401e41a344a5416c [0,1,0,0,0,0|2,0,1]=4 1593 B10R0.4 CC(O)CCCNCCCCl 9c73c18991be2cecb23fd6845fd71184 [0,1,0,0,0,0|2,0,1]=4 1594 B10R0.4 CC(O)CCCNCCCO 241e3e1148b49054f259a4ddacea48eb [0,1,0,0,0,0|2,0,1]=4 1595 B10R0.4 CC(O)CCNCCCCCl 012cc92abe043a1075336b235b2541f8 [0,1,0,0,0,0|2,0,1]=4 1596 B10R0.4 CC(O)CCNCCCCF f1a44121d0a1c93486e40096f2c41443 [0,1,0,0,0,0|2,0,1]=4 1597 B10R0.4 CC(O)CCNCCCCO b59c8b3cfc77a09216e14ef55d7f056e [0,1,0,0,0,0|2,0,1]=4 1598 B10R0.4 CC(O)CCNCCCCS a99e8933301e024e39186feb2449ca31 [0,1,0,0,0,0|2,0,1]=4 1599 B10R0.4 CC(O)CNCCCCCCl 24183013a514e071995d76af67113767 [0,1,0,0,0,0|2,0,1]=4 1600 B10R0.4 CC(O)CNCCCCCF 3dc2b7902c178afc86e568248171ebbe [0,1,0,0,0,0|2,0,1]=4 1601 B10R0.4 CC(O)CNCCCCCO 5cbb8fc264125b25339100f6507f43cc [0,1,0,0,0,0|2,0,1]=4 1602 B10R0.4 CC/C=C/CCOCC(=O)N d1421ab41ec4e67e7439f8e61270bde8 [0,1,0,0,0,0|1,0,2]=4 1603 B10R0.4 CC/C=C/CCOCC(=O)O d3d91f905900557afa774e13b9df6026 [0,1,0,0,0,0|0,0,2]=3 1604 B10R0.4 CC/C=C/CNCCC(=O)N 6cb2c917d5af9bf377035843a4695253 [0,1,0,0,0,0|1,0,2]=4 1605 B10R0.4 CC/C=C/CNCCC(=O)O f46933b8a0cdc6ec2c9ac3cc8433f0e6 [0,1,0,0,0,0|0,0,2]=3 1606 B10R0.4 CC/C=C/CNCCS(=O)O 74ab818661eb1f1b254e518a72102fb7 [0,1,0,0,0,0|1,0,2]=4 1607 B10R0.4 CC/C=C/COCCC(=O)C 2dc1865446afb33ed37e07b902852ecb [0,1,0,0,0,0|1,0,2]=4 1608 B10R0.4 CC/C=C/COCCC(=O)N 4fa9c4b7b421d0801a468b189f9f35b7 [0,1,0,0,0,0|1,0,2]=4 1609 B10R0.4 CC/C=C/COCCC(=O)O bc21ad1147514419b82e1623220c1d48 [0,1,0,0,0,0|0,0,2]=3 1610 B10R0.4 CC/C=C\CCNCC(=O)C 674bd22b0cd010d41d505c09d41c180d [0,1,0,0,0,0|1,0,2]=4 1611 B10R0.4 CC/C=C\CCNCC(=O)N ddeb73805c89bf3dea86451f0dd78f30 [0,1,0,0,0,0|1,0,2]=4 1612 B10R0.4 CC/C=C\CCNCC(=O)O cbcffdadc0ca4c78c680764fb8ad852e [0,1,0,0,0,0|0,0,2]=3 1613 B10R0.4 CC/C=C\CCOCC(=O)C db3103c50306a75ddf1da7bcd896a8bc [0,1,0,0,0,0|1,0,2]=4 1614 B10R0.4 CC/C=C\CCOCC(=O)N f4348407fd1dd2efaaa1a2e2a4bab226 [0,1,0,0,0,0|1,0,2]=4 1615 B10R0.4 CC/C=C\CCOCC(=O)O 2cec0b1c660697fcd461620b82c4e65a [0,1,0,0,0,0|0,0,2]=3 1616 B10R0.4 CC/C=C\CCOCS(=O)O a8b65a3ef3bf19a062220b0cf61fba73 [0,1,0,0,0,0|1,0,2]=4 1617 B10R0.4 CC/C=C\COCCC(=O)C 04919423a318ab1488e818904079b6e6 [0,1,0,0,0,0|1,0,2]=4 1618 B10R0.4 CC/C=C\COCCC(=O)N fb8867835b1e74ce8448d8ae5631dce1 [0,1,0,0,0,0|1,0,2]=4 1619 B10R0.4 CC/C=C\COCCC(=O)O dfb691c23445a1d9807090e9e95064da [0,1,0,0,0,0|0,0,2]=3 1620 B10R0.4 CC=C=CCCOCC(=O)O 0a8d160d61785fd5ac9c1a6498cf73ce [0,1,0,0,0,0|0,0,3]=4 1621 B10R0.4 CC=CCCCOCC(=O)N f91adee965831e7d152cd849bd526373 [0,1,0,0,0,0|1,0,2]=4 1622 B10R0.4 CC=CCCCOCC(=O)O eb02a0583e7477549f7236d3495e3904 [0,1,0,0,0,0|0,0,2]=3 1623 B10R0.4 CC=CCNCCCC(=O)C 667f2be9628f98e73724939a6a97c665 [0,1,0,0,0,0|1,0,2]=4 1624 B10R0.4 CC=CCNCCCC(=O)N b7deb4bdb15b867a9938e7e27c4ba8db [0,1,0,0,0,0|1,0,2]=4 1625 B10R0.4 CC=CCNCCCC(=O)O 8df01a8428c77adf160d0ed2cf7f78d3 [0,1,0,0,0,0|0,0,2]=3 1626 B10R0.4 CC=CCOCCCC(=O)C d123e87caa80ee11e37d22666bf25e99 [0,1,0,0,0,0|1,0,2]=4 1627 B10R0.4 CC=CCOCCCC(=O)N 6195c247f985d0395c3ea5f69a10ba38 [0,1,0,0,0,0|1,0,2]=4 1628 B10R0.4 CC=CCOCCCC(=O)O fe986269b6907663d554820fb9f32f8e [0,1,0,0,0,0|0,0,2]=3 1629 B10R0.4 CCC#CCCOCC(=O)N 3bca9a605d85c13e3ba5b16921cf227e [0,1,0,0,0,0|1,0,2]=4 1630 B10R0.4 CCC#CCCOCC(=O)O 9a6310bfcfd292d4532f447a214df326 [0,1,0,0,0,0|0,0,2]=3 1631 B10R0.4 CCC#CCOCCC(=O)C a0252c900749b769c6960dccf0e3b70f [0,1,0,0,0,0|1,0,2]=4 1632 B10R0.4 CCC#CCOCCC(=O)N 79a93a130d6f6a4f75b1c12940b37b84 [0,1,0,0,0,0|1,0,2]=4 1633 B10R0.4 CCC#CCOCCC(=O)O 75768181b61be90473cf0be9a0f219b7 [0,1,0,0,0,0|0,0,2]=3 1634 B10R0.4 CCC/C=C/CNCC(=O)C 83412db4e188a90de018ccffc17822f0 [0,1,0,0,0,0|1,0,2]=4 1635 B10R0.4 CCC/C=C/CNCC(=O)N 6ff8ed2dae1af1a7a2c7971fca4b3618 [0,1,0,0,0,0|1,0,2]=4 1636 B10R0.4 CCC/C=C/CNCC(=O)O d333e5f143db479d98cf398543834293 [0,1,0,0,0,0|0,0,2]=3 1637 B10R0.4 CCC/C=C/COCC(=O)C 51ecfd1ad2b1b3230afe1a67b7017270 [0,1,0,0,0,0|1,0,2]=4 1638 B10R0.4 CCC/C=C/COCC(=O)N 99053f82e8417b5a8f52e09679b48b3e [0,1,0,0,0,0|1,0,2]=4 1639 B10R0.4 CCC/C=C/COCC(=O)O 72aab2c6b05e394fdc94d7b08198a96f [0,1,0,0,0,0|0,0,2]=3 1640 B10R0.4 CCC/C=C/COCS(=O)O 05f3cfcdd1baf5bd61bf05652f5d7f05 [0,1,0,0,0,0|1,0,2]=4 1641 B10R0.4 CCC/C=C\CNCC(=O)C c564a810aec1964074ebad48d376fd75 [0,1,0,0,0,0|1,0,2]=4 1642 B10R0.4 CCC/C=C\CNCC(=O)N 31518d996916ff257507c68c01a41110 [0,1,0,0,0,0|1,0,2]=4 1643 B10R0.4 CCC/C=C\CNCC(=O)O d0f8354af0548992aeb3cd8704b042da [0,1,0,0,0,0|0,0,2]=3 1644 B10R0.4 CCC/C=C\COCC(=O)C c725377077d9bfe08c0fd8002d9d607d [0,1,0,0,0,0|1,0,2]=4 1645 B10R0.4 CCC/C=C\COCC(=O)N 2c3401af78beb5f6cfc16e08d45ebabc [0,1,0,0,0,0|1,0,2]=4 1646 B10R0.4 CCC/C=C\COCC(=O)O 34e137c4a3c55da23e210818c1ae134e [0,1,0,0,0,0|0,0,2]=3 1647 B10R0.4 CCC/C=C\COCS(=O)O ecd6bfa6afd7530e6d9adcf1a42e4196 [0,1,0,0,0,0|1,0,2]=4 1648 B10R0.4 CCCC#CCOCC(=O)N 357eec76001732158bce3a5fd442c4de [0,1,0,0,0,0|1,0,2]=4 1649 B10R0.4 CCCC#CCOCC(=O)O 73563ca30f87abc33eb077bf6f4b8dcb [0,1,0,0,0,0|0,0,2]=3 1650 B10R0.4 CCCCCCCNC(=O)C 7ff946498704aad8136855c3c0214f94 [0,1,0,0,0,0|1,0,0]=2 1651 B10R0.4 CCCCCCCNC(C)C 4c96ea7e499316e0ee9e00c46c63a3c1 [0,1,0,0,0,0|2,0,1]=4 1652 B10R0.4 CCCCCCCOC(C)C 27a0a967f36a71c677ab3969b10f24e8 [0,1,0,0,0,0|2,0,1]=4 1653 B10R0.4 CCCCCCNCC(=O)C e3842b8fd2cae14899e78886113beba0 [0,1,0,0,0,0|1,0,0]=2 1654 B10R0.4 CCCCCCNCC(=O)N 3fae3fcfcc109d047ed465f3e2b847e2 [0,1,0,0,0,0|1,0,0]=2 1655 B10R0.4 CCCCCCNCC(=O)O fb02da52628d24bba2741502ccbc57e6 [0,1,0,0,0,0|0,0,0]=1 1656 B10R0.4 CCCCCCNCC(C)C 1a2401845907eef233dd59227daa3a68 [0,1,0,0,0,0|2,0,1]=4 1657 B10R0.4 CCCCCCNCC(C)O ecfd31bbb27d5c1b28261e6fc506454e [0,1,0,0,0,0|1,0,1]=3 1658 B10R0.4 CCCCCCNCC(F)F 51de30cede759daf5c5775a3c38fc031 [0,1,0,0,0,0|2,0,1]=4 1659 B10R0.4 CCCCCCNCN(C)C 26324c882932f0cac86240d88ad97394 [0,1,0,0,0,0|3,0,0]=4 1660 B10R0.4 CCCCCCNC[C@@H](C)O a3e47df10174193eaf313b4168d20a56 [0,1,0,0,0,0|1,0,1]=3 1661 B10R0.4 CCCCCCNC[C@H](C)O 2eab26b642fa93ab5109cc9827db8367 [0,1,0,0,0,0|1,0,1]=3 1662 B10R0.4 CCCCCCNC[N+](=O)[O-] 1fd8a99199d76e18db48a45a032494df [0,1,0,0,0,0|1,0,1]=3 1663 B10R0.4 CCCCCCOCC(=O)C c622979e72a3edd318802db3f6123eee [0,1,0,0,0,0|1,0,0]=2 1664 B10R0.4 CCCCCCOCC(=O)N 9c51cacea528460eb1c6e4fbed6a2905 [0,1,0,0,0,0|1,0,0]=2 1665 B10R0.4 CCCCCCOCC(=O)O d5f902343f3fbf5baaa362a21e128151 [0,1,0,0,0,0|0,0,0]=1 1666 B10R0.4 CCCCCCOCC(=S)N 4a6619ae0c5d9b426d785374d9a55b11 [0,1,0,0,0,0|1,1,0]=3 1667 B10R0.4 CCCCCCOCC(C)C b37c8621ec273a7e26019a803a340e20 [0,1,0,0,0,0|2,0,1]=4 1668 B10R0.4 CCCCCCOCC(C)F dd97ca256682a6fda25577541eecbd12 [0,1,0,0,0,0|2,0,1]=4 1669 B10R0.4 CCCCCCOCC(C)S acb8c91dce03e86d867592ce1fe72f17 [0,1,0,0,0,0|1,1,1]=4 1670 B10R0.4 CCCCCCOCC(F)F a26442e14ba2eb739a794efc864e9e28 [0,1,0,0,0,0|2,0,1]=4 1671 B10R0.4 CCCCCCOCN(C)C fae992de96d645d231407619a49196c0 [0,1,0,0,0,0|3,0,0]=4 1672 B10R0.4 CCCCCCOCS(=O)O 2b6780218bd3498af4d92344e34b6465 [0,1,0,0,0,0|1,0,0]=2 1673 B10R0.4 CCCCCCOC[C@@H](C)F 1f30b59f94e8f4e91c0bf18fdb80d473 [0,1,0,0,0,0|2,0,1]=4 1674 B10R0.4 CCCCCCOC[C@H](C)F 3be682a709018eb770bbeb667cf57929 [0,1,0,0,0,0|2,0,1]=4 1675 B10R0.4 CCCCCCOC[N+](=O)[O-] 8de73a02b11721ecdeb3033a6923b71d [0,1,0,0,0,0|1,0,1]=3 1676 B10R0.4 CCCCCNC/C=C(/C)\I 888f407c9912c682883282c5fa449bc3 [0,1,0,0,0,0|2,0,1]=4 1677 B10R0.4 CCCCCNC/C=C(\C)/Cl 177e0edb752142a6e20de7fca3adb5b2 [0,1,0,0,0,0|2,0,1]=4 1678 B10R0.4 CCCCCNCC=C(C)C 86a525cd8e4a6b34c066789a57566e47 [0,1,0,0,0,0|2,0,1]=4 1679 B10R0.4 CCCCCNCC=C(C)Cl 50118f3abc69b2d8e563f0002063ccb1 [0,1,0,0,0,0|2,0,1]=4 1680 B10R0.4 CCCCCNCC=C(C)I b6202e36bf5cc884706cc14a806fb748 [0,1,0,0,0,0|2,0,1]=4 1681 B10R0.4 CCCCCNCC=C(Cl)Cl 5136b9f992f51363dbc2dc99f2b06cb6 [0,1,0,0,0,0|2,0,1]=4 1682 B10R0.4 CCCCCNCCC(=O)C 2bb7295af3afb64defefb63687bea421 [0,1,0,0,0,0|1,0,0]=2 1683 B10R0.4 CCCCCNCCC(=O)N da2ae5cebf00ff2bc6648f8e9deea068 [0,1,0,0,0,0|1,0,0]=2 1684 B10R0.4 CCCCCNCCC(=O)O c651e7e992c1332ced5d27852e6267f0 [0,1,0,0,0,0|0,0,0]=1 1685 B10R0.4 CCCCCNCCC(=S)N 57b8a362f1c0fd1078f9dcd4c9c7bfb9 [0,1,0,0,0,0|1,1,0]=3 1686 B10R0.4 CCCCCNCCC(C)C 2083eb70c05c1741486a9f522b36bddf [0,1,0,0,0,0|2,0,1]=4 1687 B10R0.4 CCCCCNCCC(C)O 4e6a420569190052d94ccc1ca80cf85c [0,1,0,0,0,0|1,0,1]=3 1688 B10R0.4 CCCCCNCCC(F)F 2f119b6c8f73dfa1dd588f26a6cdc939 [0,1,0,0,0,0|2,0,1]=4 1689 B10R0.4 CCCCCNCCN(C)C d883db9ee430a1f80a9c4d5349cbc7d7 [0,1,0,0,0,0|3,0,0]=4 1690 B10R0.4 CCCCCNCCS(=O)C 889c2eb0c8cfc530bc8152471af86a27 [0,1,0,0,0,0|2,0,0]=3 1691 B10R0.4 CCCCCNCCS(=O)O 40a9496c737aacfd55e5b85a03b28772 [0,1,0,0,0,0|1,0,0]=2 1692 B10R0.4 CCCCCNCC[C@@H](C)O 3f00e28351ebf7b139dd29392d26fe0f [0,1,0,0,0,0|1,0,1]=3 1693 B10R0.4 CCCCCNCC[C@H](C)O 38a781c8f9bc47db57981751900f43d6 [0,1,0,0,0,0|1,0,1]=3 1694 B10R0.4 CCCCCNCOC(=O)C 35ef47aef23a171936e6801a261865e1 [0,1,0,0,0,0|2,0,0]=3 1695 B10R0.4 CCCCCNCSC(=O)N f0087a849ed0984cde78f3cd83990d19 [0,1,0,0,0,0|2,0,0]=3 1696 B10R0.4 CCCCCOC/C=C(/C)\Cl aa962184d6cd966db0085f8251712374 [0,1,0,0,0,0|2,0,1]=4 1697 B10R0.4 CCCCCOC/C=C(/C)\I 888a413f21dfbd656fc488c73a67a4d6 [0,1,0,0,0,0|2,0,1]=4 1698 B10R0.4 CCCCCOC/C=C(\C)/Cl 4c8af2dec5ba3b4dfe6107e44ddef16b [0,1,0,0,0,0|2,0,1]=4 1699 B10R0.4 CCCCCOCC=C(C)C d6a15546708c44b4ae5a35a9bc35cd2c [0,1,0,0,0,0|2,0,1]=4 1700 B10R0.4 CCCCCOCC=C(C)Cl 520db63c0e141892ce317b451f1cdca4 [0,1,0,0,0,0|2,0,1]=4 1701 B10R0.4 CCCCCOCC=C(C)I f3bc6ca17f79771d527e93998bd60d7e [0,1,0,0,0,0|2,0,1]=4 1702 B10R0.4 CCCCCOCC=C(Cl)Cl a9ef19df0da06f7529f6bc192935a65b [0,1,0,0,0,0|2,0,1]=4 1703 B10R0.4 CCCCCOCCC(=O)C 7d336bbb7dc5619074d320d9d5eeebd1 [0,1,0,0,0,0|1,0,0]=2 1704 B10R0.4 CCCCCOCCC(=O)N 3ccf202c6633a29591d963976a663b22 [0,1,0,0,0,0|1,0,0]=2 1705 B10R0.4 CCCCCOCCC(=O)O 183ac3fdf6b059104c4c0237bab12aa8 [0,1,0,0,0,0|0,0,0]=1 1706 B10R0.4 CCCCCOCCC(C)C 1aa9f5e40c826e008fbbf8f79c7f1fea [0,1,0,0,0,0|2,0,1]=4 1707 B10R0.4 CCCCCOCCC(F)F 8d7e702fe2461f122e465b548868eb7b [0,1,0,0,0,0|2,0,1]=4 1708 B10R0.4 CCCCCOCCN(C)C 316463ff546cb9d7401f931a893e13eb [0,1,0,0,0,0|3,0,0]=4 1709 B10R0.4 CCCCCOCCS(=O)C 3d066bbbe37fbbf288a2e425fa4215eb [0,1,0,0,0,0|2,0,0]=3 1710 B10R0.4 CCCCCOCC[N+](=O)[O-] 1b20814dc46e660675c4441c70877217 [0,1,0,0,0,0|1,0,1]=3 1711 B10R0.4 CCCCCOCNC(=O)C 3014ea30bb40b67aa6a1ce125b435cc1 [0,1,0,0,0,0|2,0,0]=3 1712 B10R0.4 CCCCCOCNC(=O)N 878e32bdf57fabeb01ffaf0ffaaa0fb1 [0,1,0,0,0,0|2,0,0]=3 1713 B10R0.4 CCCCCOCOC(=O)C 62a840560a1a56a085f7882cc96ba1f5 [0,1,0,0,0,0|2,0,0]=3 1714 B10R0.4 CCCCCOCSC(=O)N e50a2eecc4d190b7254a33158f696a5a [0,1,0,0,0,0|2,0,0]=3 1715 B10R0.4 CCCCNC/C=C/C(=O)O 47b1a103370b1a6a86bcade53e559dd6 [0,1,0,0,0,0|0,0,2]=3 1716 B10R0.4 CCCCNCC#CC(=O)N 7265e951a49d0602acc14cd2a8d78d2a [0,1,0,0,0,0|1,0,2]=4 1717 B10R0.4 CCCCNCC#CC(=O)O 8b42ea6f5918936295863b52eb2b06d1 [0,1,0,0,0,0|0,0,2]=3 1718 B10R0.4 CCCCNCC=CC(=O)O f8dc0eb33b8e1238b7e6a28f8075ce7a [0,1,0,0,0,0|0,0,2]=3 1719 B10R0.4 CCCCNCCC=C(C)C d9b770f84c8be90ca1d17cd0fdf54f4c [0,1,0,0,0,0|2,0,1]=4 1720 B10R0.4 CCCCNCCC=C(F)F 9ae42a82a088d60fa48f1f87f8af4410 [0,1,0,0,0,0|2,0,1]=4 1721 B10R0.4 CCCCNCCCC(=O)C a2bda33665ed49237506dfdf7a5fb684 [0,1,0,0,0,0|1,0,0]=2 1722 B10R0.4 CCCCNCCCC(=O)N 87f3fa3fa2631822b8cd0b48fa13e9d9 [0,1,0,0,0,0|1,0,0]=2 1723 B10R0.4 CCCCNCCCC(=O)O 638f7b21d5bd5641b607514c8fb8caf4 [0,1,0,0,0,0|0,0,0]=1 1724 B10R0.4 CCCCNCCCC(C)C 1e31d9dbabf6be9187dab46866ffb34e [0,1,0,0,0,0|2,0,1]=4 1725 B10R0.4 CCCCNCCCC(C)O e267dad3accc230faa3bc9e16d970474 [0,1,0,0,0,0|1,0,1]=3 1726 B10R0.4 CCCCNCCCN(C)C a9ece33d88b6945bef9242ad3211e89b [0,1,0,0,0,0|3,0,0]=4 1727 B10R0.4 CCCCNCCCS(=O)C 362c770b2b09d0f84e497dc89cd0ad5b [0,1,0,0,0,0|2,0,0]=3 1728 B10R0.4 CCCCNCCC[N+](=O)[O-] 9badc35f02019bf5a2d94b33d537eb49 [0,1,0,0,0,0|1,0,1]=3 1729 B10R0.4 CCCCNCCNC(=O)C a0257fcf7897366323909d66114b6809 [0,1,0,0,0,0|2,0,0]=3 1730 B10R0.4 CCCCNCCNC(=O)N 1a45d5f5665165b9b8dd6ffa58910f21 [0,1,0,0,0,0|2,0,0]=3 1731 B10R0.4 CCCCNCCNC(=S)N 68d42aefa24cd3e143f48cb2aaf40548 [0,1,0,0,0,0|2,1,0]=4 1732 B10R0.4 CCCCNCCOC(=O)C dac752d37b046d20aa6fa7632de515a6 [0,1,0,0,0,0|2,0,0]=3 1733 B10R0.4 CCCCNCCSC(=O)C 0ac4a109a3992122f41a3a955bc15a16 [0,1,0,0,0,0|2,0,0]=3 1734 B10R0.4 CCCCOC/C=C/C(=O)O f8be4ebbb6c99643b3f6245797365927 [0,1,0,0,0,0|0,0,2]=3 1735 B10R0.4 CCCCOCC#CC(=O)O 38cad6637629b89e3c26c481e48db3f0 [0,1,0,0,0,0|0,0,2]=3 1736 B10R0.4 CCCCOCC=CC(=O)O a5c4798b7a417df05ba6cec5bd7ffd88 [0,1,0,0,0,0|0,0,2]=3 1737 B10R0.4 CCCCOCCC=C(C)C 12c3c1f2c9c2d69ab18de77f0a3087ea [0,1,0,0,0,0|2,0,1]=4 1738 B10R0.4 CCCCOCCC=C(F)F 4247e81b97f3d644b8cc6c5e74c22a00 [0,1,0,0,0,0|2,0,1]=4 1739 B10R0.4 CCCCOCCCC(=O)C f0df1029dafc15690be3f3c094f0ad8e [0,1,0,0,0,0|1,0,0]=2 1740 B10R0.4 CCCCOCCCC(=O)N 4bd9e362912f487ea2067ef12f3cd6d1 [0,1,0,0,0,0|1,0,0]=2 1741 B10R0.4 CCCCOCCCC(C)C eabf9177db773ec6de5ecc0edcb5d082 [0,1,0,0,0,0|2,0,1]=4 1742 B10R0.4 CCCCOCCCN(C)C 3d03ebce4d0f7c18096b62da2a143ba7 [0,1,0,0,0,0|3,0,0]=4 1743 B10R0.4 CCCCOCCC[N+](=O)[O-] c60851539260d222712dcc317d0e301f [0,1,0,0,0,0|1,0,1]=3 1744 B10R0.4 CCCCOCCNC(=O)C ddcfe368ad37fbe3701a827b8b343f83 [0,1,0,0,0,0|2,0,0]=3 1745 B10R0.4 CCCCOCCNC(=O)N c72709ebb46b5df20e6ec26959a0b816 [0,1,0,0,0,0|2,0,0]=3 1746 B10R0.4 CCCCOCCNC(=S)N eff954b001d8ddbce591cf28cceeb035 [0,1,0,0,0,0|2,1,0]=4 1747 B10R0.4 CCCCOCCOC(=O)C 8f9bbeb4cacbf148ed1331b02f645662 [0,1,0,0,0,0|2,0,0]=3 1748 B10R0.4 CCCCOCCSC(=O)C cd6988dd5f5d2697eb1fd4eec9b07d56 [0,1,0,0,0,0|2,0,0]=3 1749 B10R0.4 CCCCOCNCC(=O)C af2d8785a5c96c78e17462ebf7d0cbc7 [0,1,0,0,0,0|2,0,0]=3 1750 B10R0.4 CCCCOCNCC(=O)N 988bad330cf6d13d6255498b143b0d74 [0,1,0,0,0,0|2,0,0]=3 1751 B10R0.4 CCCCOCNCC(=O)O fd1573ef0e57ade41e912b86193789e2 [0,1,0,0,0,0|1,0,0]=2 1752 B10R0.4 CCCCOCNCC(C)O e801f8fbb8dbf94952cf78a13997aeca [0,1,0,0,0,0|2,0,1]=4 1753 B10R0.4 CCCCOCNC[C@@H](C)O 21eb3572cca9b48817c622887eeb3000 [0,1,0,0,0,0|2,0,1]=4 1754 B10R0.4 CCCCOCNC[C@H](C)O 06bdb6bf0acd2ace0c8a3b2a16d610e6 [0,1,0,0,0,0|2,0,1]=4 1755 B10R0.4 CCCCOCOCC(=O)C de19627aa5bea52305b73b51889c5d58 [0,1,0,0,0,0|2,0,0]=3 1756 B10R0.4 CCCCOCOCC(=O)N 926e206db980bd2c1eefa23df0a6017c [0,1,0,0,0,0|2,0,0]=3 1757 B10R0.4 CCCCOCOCC(=O)O 44a077c696800f20f8f77d9f489d7e0a [0,1,0,0,0,0|1,0,0]=2 1758 B10R0.4 CCCCOCOCC(=S)N 7bce85c79fb5c7dcd59f127bf172def2 [0,1,0,0,0,0|2,1,0]=4 1759 B10R0.4 CCCCOCOCS(=O)O 0d28fd59ab2c1caf0be048f6d50b3ee6 [0,1,0,0,0,0|2,0,0]=3 1760 B10R0.4 CCCNCCCCC(=O)C ab2c95adbd41ecce6f11ada83f1aa463 [0,1,0,0,0,0|1,0,0]=2 1761 B10R0.4 CCCNCCCCC(=O)N e1e10e2e68cec95857cb4c3cfc282eaf [0,1,0,0,0,0|1,0,0]=2 1762 B10R0.4 CCCNCCCCC(=O)O d7ced2df62e692539bca6ff33ab8a797 [0,1,0,0,0,0|0,0,0]=1 1763 B10R0.4 CCCNCCCCC(C)C f22e74f3c92982d86e30c1bb0f3509d3 [0,1,0,0,0,0|2,0,1]=4 1764 B10R0.4 CCCNCCCCC(C)O 2f69e7bc2a7ca500502a3e5f1c138b9b [0,1,0,0,0,0|1,0,1]=3 1765 B10R0.4 CCCNCCCCC(F)F f74b67ced21d59e110d7cf2236c9ab87 [0,1,0,0,0,0|2,0,1]=4 1766 B10R0.4 CCCNCCCCN(C)C b1a24a72e2d949934a5a6300b3a57bac [0,1,0,0,0,0|3,0,0]=4 1767 B10R0.4 CCCNCCCC[C@@H](C)O 6ce0e83e6e0d1b17039df927d769e87a [0,1,0,0,0,0|1,0,1]=3 1768 B10R0.4 CCCNCCCNC(=O)C 889a8f130116f443d6fd6e1232ef1497 [0,1,0,0,0,0|2,0,0]=3 1769 B10R0.4 CCCNCCCOC(=O)C e1cec712d82f801a0d54d1944e98e203 [0,1,0,0,0,0|2,0,0]=3 1770 B10R0.4 CCCNCCCOC(=S)C 40e323e060fdbe24e644b61798d29294 [0,1,0,0,0,0|2,1,0]=4 1771 B10R0.4 CCCNCCCSC(=O)C 2889b29bc4848ab93d3dd022a17fab90 [0,1,0,0,0,0|2,0,0]=3 1772 B10R0.4 CCCNCCOCC(=O)N 55e2f24709483252c53a6fbd0fb9b0cc [0,1,0,0,0,0|2,0,0]=3 1773 B10R0.4 CCCNCCOCC(=O)O 6a2b5a7e2d583d3c6ba150b8c3cc16e1 [0,1,0,0,0,0|1,0,0]=2 1774 B10R0.4 CCCNCCSCC(=O)O 94cff0686c4de2d0110011adc5739807 [0,1,0,0,0,0|1,0,0]=2 1775 B10R0.4 CCCOCCC#CC(=O)O f4d5055400d31c308ce57b5764e65d8e [0,1,0,0,0,0|0,0,2]=3 1776 B10R0.4 CCCOCCCCC(=O)C fd3e516a01dea40bc28ef8e85abe7b9e [0,1,0,0,0,0|1,0,0]=2 1777 B10R0.4 CCCOCCCCC(=O)N 40ac037ce19926aee318707e134df4d3 [0,1,0,0,0,0|1,0,0]=2 1778 B10R0.4 CCCOCCCCC(=O)O b2ac1b83aca818e80a2df2f954405a9e [0,1,0,0,0,0|0,0,0]=1 1779 B10R0.4 CCCOCCCCC(C)C f86f1fee85db6c4439132050b4d45955 [0,1,0,0,0,0|2,0,1]=4 1780 B10R0.4 CCCOCCCCN(C)C f4bdce3025f9c0207403b9cfca0595af [0,1,0,0,0,0|3,0,0]=4 1781 B10R0.4 CCCOCCCC[N+](=O)[O-] 2181f5b73d6454537469cc2f7f8b27c8 [0,1,0,0,0,0|1,0,1]=3 1782 B10R0.4 CCCOCCCNC(=O)C 7a5b85034a356fda536fac05ed90cc22 [0,1,0,0,0,0|2,0,0]=3 1783 B10R0.4 CCCOCCCOC(=O)C a4e530952a94d07d0a2346bd1f1072e5 [0,1,0,0,0,0|2,0,0]=3 1784 B10R0.4 CCCOCCCOC(=S)C e8f51948c1c639d29ee2a2976dba4012 [0,1,0,0,0,0|2,1,0]=4 1785 B10R0.4 CCCOCCCO[N+](=O)[O-] d0001c016963f63b379d4a106d2dcf78 [0,1,0,0,0,0|2,0,1]=4 1786 B10R0.4 CCCOCCCSC(=O)C 79a61e06633112b372a67f8d0e405976 [0,1,0,0,0,0|2,0,0]=3 1787 B10R0.4 CCCOCCNCC(=O)C ca708ee5deb46f0d1f0948a3a215a9a0 [0,1,0,0,0,0|2,0,0]=3 1788 B10R0.4 CCCOCCNCC(=O)N 499e078e27ce3bb485f1b0506d848c22 [0,1,0,0,0,0|2,0,0]=3 1789 B10R0.4 CCCOCCNCC(=O)O 9f97370ef19b48f601d53c72298be028 [0,1,0,0,0,0|1,0,0]=2 1790 B10R0.4 CCCOCCNCC(C)O 883d1c984751dd118682e5292e4351b5 [0,1,0,0,0,0|2,0,1]=4 1791 B10R0.4 CCCOCCNC[C@@H](C)O 7e13fb025234b05ec2b8676f9c175057 [0,1,0,0,0,0|2,0,1]=4 1792 B10R0.4 CCCOCCNC[C@H](C)O c006c7951defa00f65e2f537374c008d [0,1,0,0,0,0|2,0,1]=4 1793 B10R0.4 CCCOCCNC[N+](=O)[O-] a29ccfc962b2cf66d72f0253da169c70 [0,1,0,0,0,0|2,0,1]=4 1794 B10R0.4 CCCOCCOCC(=O)C 8a0436c09947b0d42e02b341d19a096c [0,1,0,0,0,0|2,0,0]=3 1795 B10R0.4 CCCOCCOCC(=O)N 3866f23c4fa43d0a1bf33adf8a9fdb4c [0,1,0,0,0,0|2,0,0]=3 1796 B10R0.4 CCCOCCOCC(=O)O c681b062af673d5355b0c992bcf9a03b [0,1,0,0,0,0|1,0,0]=2 1797 B10R0.4 CCCOCCOCC(=S)N fe02c18187ae644ef397aa18313ea058 [0,1,0,0,0,0|2,1,0]=4 1798 B10R0.4 CCCOCCOCS(=O)O 641ce035092cbb18e98331d2c45bc1fa [0,1,0,0,0,0|2,0,0]=3 1799 B10R0.4 CCCOCCOC[N+](=O)[O-] f9e98a86abaf175fc17689aab83eacf8 [0,1,0,0,0,0|2,0,1]=4 1800 B10R0.4 CCCOCCSCC(=O)N bc153a2b3523cf3bf07bbcd570f99185 [0,1,0,0,0,0|2,0,0]=3 1801 B10R0.4 CCCSCCOCC(=O)N 7023129cea31bb4e24776462cec680cf [0,1,0,0,0,0|2,0,0]=3 1802 B10R0.4 CCCSCCOCC(=O)O f1f74803f7accfdcb460a94fed60dea0 [0,1,0,0,0,0|1,0,0]=2 1803 B10R0.4 CCCSCCOC[N+](=O)[O-] bad44bfb95358bb93e4266c15a35ed43 [0,1,0,0,0,0|2,0,1]=4 1804 B10R0.4 CCNCCCCCC(=O)N 7e47cb6936cef048a9728be65f4ed153 [0,1,0,0,0,0|1,0,0]=2 1805 B10R0.4 CCNCCCCCC(=O)O 656d004177b3de742f8798a032b0925d [0,1,0,0,0,0|0,0,0]=1 1806 B10R0.4 CCNCCCCCC(C)C 44d0ce1c493c68ed6f77d5a4ff674f45 [0,1,0,0,0,0|2,0,1]=4 1807 B10R0.4 CCNCCCCCN(C)C 9002eb7272027465e16e9a532a042d29 [0,1,0,0,0,0|3,0,0]=4 1808 B10R0.4 CCNCCCCNC(=O)C 56499de7750c75071aaf8455aae5ba93 [0,1,0,0,0,0|2,0,0]=3 1809 B10R0.4 CCNCCOCCC(=O)O 8d7e5678fe9a8ff06a1e01887f882b5a [0,1,0,0,0,0|1,0,0]=2 1810 B10R0.4 CCOCCCCCC(=O)N 6f015e258b6f4d9a91ad4bf4c5e0b833 [0,1,0,0,0,0|1,0,0]=2 1811 B10R0.4 CCOCCCCCC(=O)O 8d0433351c28cc9400e6f6da602a903d [0,1,0,0,0,0|0,0,0]=1 1812 B10R0.4 CCOCCCCCC(C)C 4039d0e82f922e3764f8c5fcab65c456 [0,1,0,0,0,0|2,0,1]=4 1813 B10R0.4 CCOCCCCCN(C)C bbc35baeface79058032b4135cdd3719 [0,1,0,0,0,0|3,0,0]=4 1814 B10R0.4 CCOCCCCOC(=O)C 136f9e9edd7237f018da84644cfcf35d [0,1,0,0,0,0|2,0,0]=3 1815 B10R0.4 CCOCCCNCC(=O)C 26586e90bfaea7cf445b6081e122678a [0,1,0,0,0,0|2,0,0]=3 1816 B10R0.4 CCOCCCNCC(=O)N 2952db3e5f20311a04f3e3495052fa44 [0,1,0,0,0,0|2,0,0]=3 1817 B10R0.4 CCOCCCNCC(=O)O 682f6d420ba5c774818f236d90f0fb13 [0,1,0,0,0,0|1,0,0]=2 1818 B10R0.4 CCOCCCNCC(C)O ad4a068b99e57be5377ca0ec04f2bcfa [0,1,0,0,0,0|2,0,1]=4 1819 B10R0.4 CCOCCCNC[C@@H](C)O 9688c5af15787a17cb5b63018c5524b6 [0,1,0,0,0,0|2,0,1]=4 1820 B10R0.4 CCOCCCNC[C@H](C)O fdd8bce48032164768af5e2352b4e1a9 [0,1,0,0,0,0|2,0,1]=4 1821 B10R0.4 CCOCCCNC[N+](=O)[O-] c666a454e9dbd46b6218c73a1fa383fa [0,1,0,0,0,0|2,0,1]=4 1822 B10R0.4 CCOCCCOCC(=O)C 454eab324c0bac50570ee31f562f3c52 [0,1,0,0,0,0|2,0,0]=3 1823 B10R0.4 CCOCCCOCC(=O)N 9c11d1061e2cebe4ab6d2a5f319743ed [0,1,0,0,0,0|2,0,0]=3 1824 B10R0.4 CCOCCCOCC(=O)O 2de1613f4b1376069d28111d2a4e00b4 [0,1,0,0,0,0|1,0,0]=2 1825 B10R0.4 CCOCCCOCC(=S)N ca8df5991c42aad55917aefa1dde12e2 [0,1,0,0,0,0|2,1,0]=4 1826 B10R0.4 CCOCCCOCS(=O)O 3d8fd95333e4857454fb6fed7dae58e7 [0,1,0,0,0,0|2,0,0]=3 1827 B10R0.4 CCOCCCOC[N+](=O)[O-] ea361ab3d23c92374097bd61f66bb274 [0,1,0,0,0,0|2,0,1]=4 1828 B10R0.4 CCOCCNCCC(=O)C 42430d43d72579f1aa89e578526bfc0d [0,1,0,0,0,0|2,0,0]=3 1829 B10R0.4 CCOCCNCCC(=O)N 512af3b4d45ce7bdd6387c00668babc5 [0,1,0,0,0,0|2,0,0]=3 1830 B10R0.4 CCOCCNCCC(=O)O ff34e42923fba256fb9a0dd7fcb988eb [0,1,0,0,0,0|1,0,0]=2 1831 B10R0.4 CCOCCNCCC(=S)N e2094e47decf19629bbbb13a52e5dbdf [0,1,0,0,0,0|2,1,0]=4 1832 B10R0.4 CCOCCNCCC(C)O b390a94d6125fd156f49fd0f55a910b8 [0,1,0,0,0,0|2,0,1]=4 1833 B10R0.4 CCOCCNCCS(=O)C 41e61f51bfec89a99f4a4a6a5c12f5bd [0,1,0,0,0,0|3,0,0]=4 1834 B10R0.4 CCOCCNCCS(=O)O 3a3bd4b6053fb466c198571a8a56f1cb [0,1,0,0,0,0|2,0,0]=3 1835 B10R0.4 CCOCCNCC[C@@H](C)O c98bb3460e7f453f9bdc14bd282e9c29 [0,1,0,0,0,0|2,0,1]=4 1836 B10R0.4 CCOCCNCC[C@H](C)O 93fea68d3ef31be98140e19b8692c68e [0,1,0,0,0,0|2,0,1]=4 1837 B10R0.4 CCOCCNCOC(=O)C db281c6c231a3b4a3bca1210d0e14ab4 [0,1,0,0,0,0|3,0,0]=4 1838 B10R0.4 CCOCCNCSC(=O)N 0c876618a748d11d2abad8d8be2b88a5 [0,1,0,0,0,0|3,0,0]=4 1839 B10R0.4 CCOCCOCCC(=O)C dc05f05df855c503e821df8f6f768970 [0,1,0,0,0,0|2,0,0]=3 1840 B10R0.4 CCOCCOCCC(=O)N d49dca4b1c0e0e8feb71d8f8dcfa61ce [0,1,0,0,0,0|2,0,0]=3 1841 B10R0.4 CCOCCOCCC(=O)O 96b40bef50a9547a8511d5d75c98b3cd [0,1,0,0,0,0|1,0,0]=2 1842 B10R0.4 CCOCCOCCS(=O)C ade7e54f3293e6481ea3b53ae3e4cb66 [0,1,0,0,0,0|3,0,0]=4 1843 B10R0.4 CCOCCOCC[N+](=O)[O-] bf4862b835674a5748d66875676e4671 [0,1,0,0,0,0|2,0,1]=4 1844 B10R0.4 CCOCCOCNC(=O)C 59aaf2f011c18b9cbd71d467bbab44b1 [0,1,0,0,0,0|3,0,0]=4 1845 B10R0.4 CCOCCOCNC(=O)N 7c3bffd5d8f745ebcddacf7e61298647 [0,1,0,0,0,0|3,0,0]=4 1846 B10R0.4 CCOCCOCOC(=O)C f528dc21c4c896cc3d46268104c145b0 [0,1,0,0,0,0|3,0,0]=4 1847 B10R0.4 CCOCCOCSC(=O)N 4b2e6ecbee79996eb8c212e26b000c8c [0,1,0,0,0,0|3,0,0]=4 1848 B10R0.4 CCOCNC/C=C/C(=O)O 2875c981ec79c893eafb4a6f15f0c999 [0,1,0,0,0,0|1,0,2]=4 1849 B10R0.4 CCOCNCC#CC(=O)O 07753d2524434ce660704166d831380e [0,1,0,0,0,0|1,0,2]=4 1850 B10R0.4 CCOCNCC=CC(=O)O b7037b5f4256548a82996c2c775a2b30 [0,1,0,0,0,0|1,0,2]=4 1851 B10R0.4 CCOCNCCCC(=O)N 5c6b8bd80d092c52353cc7cbafb7c046 [0,1,0,0,0,0|2,0,0]=3 1852 B10R0.4 CCOCNCCCC(=O)O de9a120840675433ed34e7d1ceef9f57 [0,1,0,0,0,0|1,0,0]=2 1853 B10R0.4 CCOCNCCNC(=O)C c5a63df692b6715af5ffbfd8bde967a1 [0,1,0,0,0,0|3,0,0]=4 1854 B10R0.4 CCOCOC/C=C/C(=O)O 3a239d5167d5d5441a7edf345b5ed409 [0,1,0,0,0,0|1,0,2]=4 1855 B10R0.4 CCOCOCC#CC(=O)O 9fd8239bd681102debb1e17d97e4c1e2 [0,1,0,0,0,0|1,0,2]=4 1856 B10R0.4 CCOCOCC=CC(=O)O a538502bdb45503f331579e779e48792 [0,1,0,0,0,0|1,0,2]=4 1857 B10R0.4 CCOCOCCC[N+](=O)[O-] c3a09c96905a4fc118807c0c95dcaa14 [0,1,0,0,0,0|2,0,1]=4 1858 B10R0.4 CCOCOCCOC(=O)C e441b22fc4f0a21ac0be40ea2d3db001 [0,1,0,0,0,0|3,0,0]=4 1859 B10R0.4 CCSCCCCNC(=O)C a92a124e17ab18927891ca9e4716ceb8 [0,1,0,0,0,0|2,0,0]=3 1860 B10R0.4 CCSCCCNCC(=O)C e1d13e283a2d771ef21f5de250f59362 [0,1,0,0,0,0|2,0,0]=3 1861 B10R0.4 CCSCCCNCC(=O)N 9a0dfe2dcddc4c53687d0aa5d215b5c7 [0,1,0,0,0,0|2,0,0]=3 1862 B10R0.4 CCSCCCNCC(=O)O 4844b03ae0e8362029b66cb17ab7da38 [0,1,0,0,0,0|1,0,0]=2 1863 B10R0.4 CCSCCCNCC(C)O 2ae047b03815bd8fa410b8cc27ffa5ec [0,1,0,0,0,0|2,0,1]=4 1864 B10R0.4 CCSCCCNC[C@@H](C)O eafaa085e66682b9ccc3dab441e2baba [0,1,0,0,0,0|2,0,1]=4 1865 B10R0.4 CCSCCCNC[C@H](C)O 9ef3d1db1f4c349ed8fdbbe7059f56e4 [0,1,0,0,0,0|2,0,1]=4 1866 B10R0.4 CCSCCCOCC(=O)C c02cf25c3006eccd2ce0cd99c6e30a5c [0,1,0,0,0,0|2,0,0]=3 1867 B10R0.4 CCSCCCOCC(=O)N 7ce2062b91df77726ba9945e1153225f [0,1,0,0,0,0|2,0,0]=3 1868 B10R0.4 CCSCCCOCC(=O)O 40fb12fd65694580de8c81fcc6657b85 [0,1,0,0,0,0|1,0,0]=2 1869 B10R0.4 CCSCCCOCC(=S)N 540208f987d6e8bf720f75cb2911b6e9 [0,1,0,0,0,0|2,1,0]=4 1870 B10R0.4 CCSCCCOC[N+](=O)[O-] 61540ad120268a4317724d3664355701 [0,1,0,0,0,0|2,0,1]=4 1871 B10R0.4 CCSCCNCCC(=O)C dc17725a3c49e266625d9c0ecdf1b483 [0,1,0,0,0,0|2,0,0]=3 1872 B10R0.4 CCSCCNCCC(=O)N 1e33e4f1241193b6db9ef905ff017ddb [0,1,0,0,0,0|2,0,0]=3 1873 B10R0.4 CCSCCNCCC(=O)O 8a1f405a9850c68a6f54d79446f1ff8f [0,1,0,0,0,0|1,0,0]=2 1874 B10R0.4 CCSCCNCCC(=S)N 7ec7e6af408dd4132c6cc28efcdc5e2b [0,1,0,0,0,0|2,1,0]=4 1875 B10R0.4 CCSCCNCCC(C)O 18725e6afa4659f729f9a504bad949a6 [0,1,0,0,0,0|2,0,1]=4 1876 B10R0.4 CCSCCNCCS(=O)C 35a5c4a4640d8df1ecaa7d93fa39562f [0,1,0,0,0,0|3,0,0]=4 1877 B10R0.4 CCSCCNCCS(=O)O b2e1578e0f846641ec3fd6e927b37f40 [0,1,0,0,0,0|2,0,0]=3 1878 B10R0.4 CCSCCNCC[C@@H](C)O a9990d55afb50c01e3334e3bb8a1bea8 [0,1,0,0,0,0|2,0,1]=4 1879 B10R0.4 CCSCCNCC[C@H](C)O a180e4faae517b27311900944a178843 [0,1,0,0,0,0|2,0,1]=4 1880 B10R0.4 CCSCCNCOC(=O)C c9c4dd950a39e644fb36b368d1c04707 [0,1,0,0,0,0|3,0,0]=4 1881 B10R0.4 CCSCCNCSC(=O)N 7bf3b6ea53286df2ba2e2b7db4416a26 [0,1,0,0,0,0|3,0,0]=4 1882 B10R0.4 CCSCCOCCC(=O)C 457f1bc970e68f8ecb238d68447adf89 [0,1,0,0,0,0|2,0,0]=3 1883 B10R0.4 CCSCCOCCC(=O)N 7ff7c7f40078631343e2bc35874d378f [0,1,0,0,0,0|2,0,0]=3 1884 B10R0.4 CCSCCOCCC(=O)O 547cb9bae4885e95f673de9975307679 [0,1,0,0,0,0|1,0,0]=2 1885 B10R0.4 CCSCCOCCS(=O)C 5c3b6e02c4d264aaa3d6b8f066ea3359 [0,1,0,0,0,0|3,0,0]=4 1886 B10R0.4 CCSCCOCC[N+](=O)[O-] 8dd164f5a965844fb46e134ebd65a0f0 [0,1,0,0,0,0|2,0,1]=4 1887 B10R0.4 CCSCCOCNC(=O)C 314e3af97768302ff4d4f1dc3f062853 [0,1,0,0,0,0|3,0,0]=4 1888 B10R0.4 CCSCCOCNC(=O)N d55142e3d3f10504625a374bd5ae93ee [0,1,0,0,0,0|3,0,0]=4 1889 B10R0.4 CCSCCOCOC(=O)C 799c553332db5fd2d517025547009c9e [0,1,0,0,0,0|3,0,0]=4 1890 B10R0.4 CCSCCOCSC(=O)N 1c07a0fcb13b8a089b023d5eb8593ed0 [0,1,0,0,0,0|3,0,0]=4 1891 B10R0.4 COCCCCCNC(=O)C bf09c8275c5b54d3f2dfe84453f1edeb [0,1,0,0,0,0|2,0,0]=3 1892 B10R0.4 COCCCCNCC(=O)C cbfa920fe125fc55313b8605fe9796ca [0,1,0,0,0,0|2,0,0]=3 1893 B10R0.4 COCCCCNCC(=O)N e97389396baa30b92652b95205d0fbf3 [0,1,0,0,0,0|2,0,0]=3 1894 B10R0.4 COCCCCNCC(=O)O e7016d96fdd719c414f251fdf8041599 [0,1,0,0,0,0|1,0,0]=2 1895 B10R0.4 COCCCCNCC(C)O 1ddb5560abf61a36272459c1e1e06c1f [0,1,0,0,0,0|2,0,1]=4 1896 B10R0.4 COCCCCNC[C@@H](C)O a10c2f65db665caef5a13399777e34d0 [0,1,0,0,0,0|2,0,1]=4 1897 B10R0.4 COCCCCNC[C@H](C)O 1c02f8d0bb6f8040f694605d637e737b [0,1,0,0,0,0|2,0,1]=4 1898 B10R0.4 COCCCCNC[N+](=O)[O-] f05ce3937c5dc81a023a1d986a6664f0 [0,1,0,0,0,0|2,0,1]=4 1899 B10R0.4 COCCCCOCC(=O)C 1fb872d7e0dc73f602bada9dd9543de8 [0,1,0,0,0,0|2,0,0]=3 1900 B10R0.4 COCCCCOCC(=O)N 31cb5c3dcd7c7bf79498cddf4923ef6e [0,1,0,0,0,0|2,0,0]=3 1901 B10R0.4 COCCCCOCC(=O)O c66cf56e8604e7dab5e9dc4c5dc31662 [0,1,0,0,0,0|1,0,0]=2 1902 B10R0.4 COCCCCOCC(=S)N cc3bc55d36307ddca081a2fc0abe66c4 [0,1,0,0,0,0|2,1,0]=4 1903 B10R0.4 COCCCCOCS(=O)O 20791ed6c56a23a1b38fc4d9c1ebd8b8 [0,1,0,0,0,0|2,0,0]=3 1904 B10R0.4 COCCCCOC[N+](=O)[O-] a452bf72c351b178030542e2bf60337e [0,1,0,0,0,0|2,0,1]=4 1905 B10R0.4 COCCCNCCC(=O)C 5360de16b201f8614b5bf4d4f61c69e7 [0,1,0,0,0,0|2,0,0]=3 1906 B10R0.4 COCCCNCCC(=O)N f81a8f69aadabd2d693e8ff8cdedf4ce [0,1,0,0,0,0|2,0,0]=3 1907 B10R0.4 COCCCNCCC(=O)O 5acb8958d3874c29f59ad4b29733fb60 [0,1,0,0,0,0|1,0,0]=2 1908 B10R0.4 COCCCNCCC(=S)N 0021e70532159e5584e8ee645c177e88 [0,1,0,0,0,0|2,1,0]=4 1909 B10R0.4 COCCCNCCC(C)O d5a7633f1811705245c3d698f9d7dc0a [0,1,0,0,0,0|2,0,1]=4 1910 B10R0.4 COCCCNCCS(=O)C 9d606fb100309d8ee48d6c35dbb300ff [0,1,0,0,0,0|3,0,0]=4 1911 B10R0.4 COCCCNCCS(=O)O aba0c384f1e3738329f0303c2db159da [0,1,0,0,0,0|2,0,0]=3 1912 B10R0.4 COCCCNCC[C@@H](C)O 56b5b5408d2c15d9f4415cf06cc55dc7 [0,1,0,0,0,0|2,0,1]=4 1913 B10R0.4 COCCCNCC[C@H](C)O 9279e0fcb1c4aa02aa9d4c2b6c2e9ff3 [0,1,0,0,0,0|2,0,1]=4 1914 B10R0.4 COCCCNCOC(=O)C 23d2a7c005c67e9466413c3762438d2b [0,1,0,0,0,0|3,0,0]=4 1915 B10R0.4 COCCCNCSC(=O)N ad6300735d227d003284a366b9bc539e [0,1,0,0,0,0|3,0,0]=4 1916 B10R0.4 COCCCOCCC(=O)C ce9ab677788967ce42aba7517b03235f [0,1,0,0,0,0|2,0,0]=3 1917 B10R0.4 COCCCOCCC(=O)N 485c4d9f1d228242ae17f5efde4b3a88 [0,1,0,0,0,0|2,0,0]=3 1918 B10R0.4 COCCCOCCC(=O)O d4eb4dab6784cb2fb1076332406f0b6e [0,1,0,0,0,0|1,0,0]=2 1919 B10R0.4 COCCCOCCS(=O)C e3fbea74de7ebe5eb53cb2ef5f0f59bf [0,1,0,0,0,0|3,0,0]=4 1920 B10R0.4 COCCCOCC[N+](=O)[O-] ab466db579d8c42237deceb62924351b [0,1,0,0,0,0|2,0,1]=4 1921 B10R0.4 COCCCOCNC(=O)C c6a21628d310915dbd91616369975ac4 [0,1,0,0,0,0|3,0,0]=4 1922 B10R0.4 COCCCOCNC(=O)N 3665ccbeb518897ea0f76c96a1681060 [0,1,0,0,0,0|3,0,0]=4 1923 B10R0.4 COCCCOCOC(=O)C e2b95f88f62d2b4f019edb36c7330682 [0,1,0,0,0,0|3,0,0]=4 1924 B10R0.4 COCCCOCSC(=O)N 693f44fc468a6068cc44fe90c218e1c2 [0,1,0,0,0,0|3,0,0]=4 1925 B10R0.4 COCCNC/C=C/C(=O)O b1d04a179acee46908956917264c8cc5 [0,1,0,0,0,0|1,0,2]=4 1926 B10R0.4 COCCNCC#CC(=O)O 7f896907828465adac320dbfa42d3eb1 [0,1,0,0,0,0|1,0,2]=4 1927 B10R0.4 COCCNCC=CC(=O)O ef0e4ce163e3241834baff0dae811c80 [0,1,0,0,0,0|1,0,2]=4 1928 B10R0.4 COCCNCCCC(=O)C 55f45a09a65d1215663de3b544f7bffa [0,1,0,0,0,0|2,0,0]=3 1929 B10R0.4 COCCNCCCC(=O)N 3366a20ef5f34fb858c3abad3caa2a69 [0,1,0,0,0,0|2,0,0]=3 1930 B10R0.4 COCCNCCCC(=O)O 80c02cc92019d5cbde133d36aaa74f6c [0,1,0,0,0,0|1,0,0]=2 1931 B10R0.4 COCCNCCCC(C)O dbc00069a293067f4bf4bbf830236f5d [0,1,0,0,0,0|2,0,1]=4 1932 B10R0.4 COCCNCCCS(=O)C 716ede4642555cc29be0d0f223556db3 [0,1,0,0,0,0|3,0,0]=4 1933 B10R0.4 COCCNCCC[N+](=O)[O-] 2391ccb0e57636a1af082a1947e0c866 [0,1,0,0,0,0|2,0,1]=4 1934 B10R0.4 COCCNCCNC(=O)C 012fdc825acd11c8dfde2ddf9b6033bd [0,1,0,0,0,0|3,0,0]=4 1935 B10R0.4 COCCNCCNC(=O)N 5a6b3c590b54d400813b843bd66be5f9 [0,1,0,0,0,0|3,0,0]=4 1936 B10R0.4 COCCNCCOC(=O)C 41f2f7cc571a232e04f11ea73e45b71a [0,1,0,0,0,0|3,0,0]=4 1937 B10R0.4 COCCNCCSC(=O)C 9f8defb5a89865a0ebdee36eeb344561 [0,1,0,0,0,0|3,0,0]=4 1938 B10R0.4 COCCOC/C=C/C(=O)O 66070973a0357b16620bc879320e93c3 [0,1,0,0,0,0|1,0,2]=4 1939 B10R0.4 COCCOCC#CC(=O)O efa7e98de9cba4622bbd17aaef09bdce [0,1,0,0,0,0|1,0,2]=4 1940 B10R0.4 COCCOCC=CC(=O)O f37127939adc5d6a066eae4cdb179c6b [0,1,0,0,0,0|1,0,2]=4 1941 B10R0.4 COCCOCCCC(=O)C 814d4c7715849242ef07ecf4e095ea3c [0,1,0,0,0,0|2,0,0]=3 1942 B10R0.4 COCCOCCCC(=O)N bba16ea9a96393ace4cf5b7a8814abe8 [0,1,0,0,0,0|2,0,0]=3 1943 B10R0.4 COCCOCCCC(=O)O 72bf5da1d6d66c17ef3fa61bc44b144e [0,1,0,0,0,0|1,0,0]=2 1944 B10R0.4 COCCOCCC[N+](=O)[O-] bdb2b8247f6e15724a9dac5d97146f46 [0,1,0,0,0,0|2,0,1]=4 1945 B10R0.4 COCCOCCNC(=O)C 6502d0369038154947ac9fdccd2b7af8 [0,1,0,0,0,0|3,0,0]=4 1946 B10R0.4 COCCOCCNC(=O)N 2668c62551f69d396728d2ad357a98d2 [0,1,0,0,0,0|3,0,0]=4 1947 B10R0.4 COCCOCCOC(=O)C eda7928b9df3dc76fb36c1c55466538e [0,1,0,0,0,0|3,0,0]=4 1948 B10R0.4 COCCOCCSC(=O)C ce58280ec9b3fc1d9121d859ae1a6cb1 [0,1,0,0,0,0|3,0,0]=4 1949 B10R0.4 COCCOCNCC(=O)C ad09f469b1f8eecf95535296592baff5 [0,1,0,0,0,0|3,0,0]=4 1950 B10R0.4 COCCOCNCC(=O)N b5a3f90fee57b4622cc722805975c93a [0,1,0,0,0,0|3,0,0]=4 1951 B10R0.4 COCCOCNCC(=O)O cd266e853014bc3bf1df1688ada37b80 [0,1,0,0,0,0|2,0,0]=3 1952 B10R0.4 COCCOCOCC(=O)C f7cb9a29b0cd52b023e2aaaaeaa9724c [0,1,0,0,0,0|3,0,0]=4 1953 B10R0.4 COCCOCOCC(=O)N 3ba27543fb6a2e9b76b85944938540bb [0,1,0,0,0,0|3,0,0]=4 1954 B10R0.4 COCCOCOCC(=O)O 33e2dc082653111369a9ebb0f3dd1517 [0,1,0,0,0,0|2,0,0]=3 1955 B10R0.4 COCCOCOCS(=O)O 741b908d6ee252fe53edabd64cab4f25 [0,1,0,0,0,0|3,0,0]=4 1956 B10R0.4 COCNCCCCC(=O)N 85c058a17ec321a858a8ef8d4a5f2f44 [0,1,0,0,0,0|2,0,0]=3 1957 B10R0.4 COCNCCCCC(=O)O ab3a9a9d4707dc728acea20d8c742102 [0,1,0,0,0,0|1,0,0]=2 1958 B10R0.4 COCNCCCNC(=O)C fdc4b16487a47148515913e8d6f705dd [0,1,0,0,0,0|3,0,0]=4 1959 B10R0.4 COCNCCOCC(=O)O 6547e77a18253d21f97f7a9f8e829291 [0,1,0,0,0,0|2,0,0]=3 1960 B10R0.4 COCNCCSCC(=O)O 111b0bec8abf6ce7a99b740e747e3a45 [0,1,0,0,0,0|2,0,0]=3 1961 B10R0.4 COCOCCC#CC(=O)O 20e4e7012eaa24c0ebd7801ec30bf8cb [0,1,0,0,0,0|1,0,2]=4 1962 B10R0.4 COCOCCCCC(=O)C 31ba6cdadd5f588fbe30e1778be6a744 [0,1,0,0,0,0|2,0,0]=3 1963 B10R0.4 COCOCCCCC(=O)N b601d7a15bdc64cf284ed2c6beda8bf6 [0,1,0,0,0,0|2,0,0]=3 1964 B10R0.4 COCOCCCCC(=O)O 1b557b71d3e61c8258a3d16cc8108d48 [0,1,0,0,0,0|1,0,0]=2 1965 B10R0.4 COCOCCCC[N+](=O)[O-] a198f1988a875a067786d1c16323565a [0,1,0,0,0,0|2,0,1]=4 1966 B10R0.4 COCOCCCNC(=O)C c9901dc2e4338c84855ac20d4dd2e762 [0,1,0,0,0,0|3,0,0]=4 1967 B10R0.4 COCOCCCOC(=O)C 435fe90aab0c06e14091d4ad570ada54 [0,1,0,0,0,0|3,0,0]=4 1968 B10R0.4 COCOCCCSC(=O)C d7e90dde8cc8bbcfa0f8a11c68e4d1fc [0,1,0,0,0,0|3,0,0]=4 1969 B10R0.4 COCOCCNCC(=O)C 9b50ab044b34f0dc944726806b2ec9e5 [0,1,0,0,0,0|3,0,0]=4 1970 B10R0.4 COCOCCNCC(=O)N 259b28bf6d8eb2832603b263e43d9d54 [0,1,0,0,0,0|3,0,0]=4 1971 B10R0.4 COCOCCNCC(=O)O dff72b6a005901315460df825cad1590 [0,1,0,0,0,0|2,0,0]=3 1972 B10R0.4 COCOCCOCC(=O)C 4a912d13970b6b518270a299ef5c4e59 [0,1,0,0,0,0|3,0,0]=4 1973 B10R0.4 COCOCCOCC(=O)N 91430a25ce96bee49e14594e8bc66465 [0,1,0,0,0,0|3,0,0]=4 1974 B10R0.4 COCOCCOCC(=O)O dbe7814731404918520e20e0c8a9d8a0 [0,1,0,0,0,0|2,0,0]=3 1975 B10R0.4 COCOCCOCS(=O)O 641aee0b35bc5ebd8cbc6e62312b988b [0,1,0,0,0,0|3,0,0]=4 1976 B10R0.4 COCOCCSCC(=O)N 32b6f0d95c5226e25d017a5ea82fa361 [0,1,0,0,0,0|3,0,0]=4 1977 B10R0.4 CS(=O)CCCNCCCF 79e4ed23164655965e04b4704dcf9475 [0,1,0,0,0,0|3,0,0]=4 1978 B10R0.4 CS(=O)CCCNCCCO 744403b5ce1a6c4ada71011b321debb3 [0,1,0,0,0,0|3,0,0]=4 1979 B10R0.4 CS(=O)CCCNCCCS a105d7460b1c06077a0b6f0569ae646a [0,1,0,0,0,0|3,0,0]=4 1980 B10R0.4 CS(=O)CCNCCCCCl 2fd3ece6ed8101e4d7bdffe3e507e32b [0,1,0,0,0,0|3,0,0]=4 1981 B10R0.4 CS(=O)CCNCCCCF cef552319dbe471fc71dde77abb88227 [0,1,0,0,0,0|3,0,0]=4 1982 B10R0.4 CS(=O)CCNCCCCO b18ae202575c535e13586edb63e335b4 [0,1,0,0,0,0|3,0,0]=4 1983 B10R0.4 CS(=O)CCNCCCCS 931aa57304185024fad4257457a8f5ae [0,1,0,0,0,0|3,0,0]=4 1984 B10R0.4 CS(=O)CCOCCCCF 5a0ee14b6403d612e39537bbe47922e9 [0,1,0,0,0,0|3,0,0]=4 1985 B10R0.4 CS(=O)CCOCCCCS 84f190a233a6099b47a35132563194b3 [0,1,0,0,0,0|3,0,0]=4 1986 B10R0.4 CSCCCCNCC(=O)N be908afb84997a5fe3c895d3fa896e8c [0,1,0,0,0,0|2,0,0]=3 1987 B10R0.4 CSCCCCNCC(=O)O fe5f17285810fe796abbdf4483e3c94f [0,1,0,0,0,0|1,0,0]=2 1988 B10R0.4 CSCCCCNCC(C)O 21dab1f3998b56289acf4659f5f54399 [0,1,0,0,0,0|2,0,1]=4 1989 B10R0.4 CSCCCCNC[C@@H](C)O 287f2516a96cd407b1182b6a17761c3b [0,1,0,0,0,0|2,0,1]=4 1990 B10R0.4 CSCCCCNC[C@H](C)O 002880fb4526d8803fe72a049a805455 [0,1,0,0,0,0|2,0,1]=4 1991 B10R0.4 CSCCCCNC[N+](=O)[O-] d03b0762a5c2c102b37b1ce8be1f1319 [0,1,0,0,0,0|2,0,1]=4 1992 B10R0.4 CSCCCCOCC(=O)N 0dad99c49ad626422ed7bea97669fab3 [0,1,0,0,0,0|2,0,0]=3 1993 B10R0.4 CSCCCCOCC(=O)O 6959643b4f26b002ad25adcfb835b476 [0,1,0,0,0,0|1,0,0]=2 1994 B10R0.4 CSCCCCOC[N+](=O)[O-] 806232387b6f81d27ee4bd0867b66f92 [0,1,0,0,0,0|2,0,1]=4 1995 B10R0.4 CSCCCNCCC(=O)C ba6ca44757cb501b77af5fad9f076f1f [0,1,0,0,0,0|2,0,0]=3 1996 B10R0.4 CSCCCNCCC(=O)N e135727b2665adc7ad4ec6a340cd1057 [0,1,0,0,0,0|2,0,0]=3 1997 B10R0.4 CSCCCNCCC(=O)O ebcd26378cbdddef3de03c919f85430a [0,1,0,0,0,0|1,0,0]=2 1998 B10R0.4 CSCCCNCCC(=S)N 9e6d9940466cd7b3dd3b940f2f48b729 [0,1,0,0,0,0|2,1,0]=4 1999 B10R0.4 CSCCCNCCC(C)O e3201444ee57c0b4141f28224d1732f4 [0,1,0,0,0,0|2,0,1]=4 2000 B10R0.4 CSCCCNCCS(=O)C 2a6958b54329339e1484fb6f7f704842 [0,1,0,0,0,0|3,0,0]=4 2001 B10R0.4 CSCCCNCCS(=O)O fff4b35609eb4a31d60a63e82c389db0 [0,1,0,0,0,0|2,0,0]=3 2002 B10R0.4 CSCCCNCC[C@@H](C)O 3da49fe17e20a5dbd8b15ff6577f809c [0,1,0,0,0,0|2,0,1]=4 2003 B10R0.4 CSCCCNCC[C@H](C)O 4ed8efed7ffad1175717c16b46fba25e [0,1,0,0,0,0|2,0,1]=4 2004 B10R0.4 CSCCCNCOC(=O)C 70a1c770ebdcc64647b0d3fa98de0ca9 [0,1,0,0,0,0|3,0,0]=4 2005 B10R0.4 CSCCCNCSC(=O)N 22b83e43b4c2d1413c788ed69684541a [0,1,0,0,0,0|3,0,0]=4 2006 B10R0.4 CSCCCOCCC(=O)C 3ba9f69b4dabe21dca9b0f34d43e0e87 [0,1,0,0,0,0|2,0,0]=3 2007 B10R0.4 CSCCCOCCC(=O)N 059f372458e61e0fdbc119c74b3a1e7a [0,1,0,0,0,0|2,0,0]=3 2008 B10R0.4 CSCCCOCCC(=O)O 6b3756b593022d7d702b5e676fa25b5e [0,1,0,0,0,0|1,0,0]=2 2009 B10R0.4 CSCCCOCCS(=O)C 16e1220a871b4f0ef3bdcabbb3115b96 [0,1,0,0,0,0|3,0,0]=4 2010 B10R0.4 CSCCCOCC[N+](=O)[O-] e569d3140984d2d26d6c03e6c458a98f [0,1,0,0,0,0|2,0,1]=4 2011 B10R0.4 CSCCCOCNC(=O)C 84bdb8fb42d138ceb15e4d46a890ecd4 [0,1,0,0,0,0|3,0,0]=4 2012 B10R0.4 CSCCCOCNC(=O)N 4392a20a6683861c456cf7e893f59e55 [0,1,0,0,0,0|3,0,0]=4 2013 B10R0.4 CSCCCOCOC(=O)C 65b51777e809d54d2dcc355dc9f9dcf9 [0,1,0,0,0,0|3,0,0]=4 2014 B10R0.4 CSCCCOCSC(=O)N dcede0def791170cd2ae25f87115498b [0,1,0,0,0,0|3,0,0]=4 2015 B10R0.4 CSCCNC/C=C/C(=O)O b1228173c26f88bf0095cbc45a5e21db [0,1,0,0,0,0|1,0,2]=4 2016 B10R0.4 CSCCNCC#CC(=O)O 9beba50b84dac3b96b5cab73e536e83f [0,1,0,0,0,0|1,0,2]=4 2017 B10R0.4 CSCCNCC=CC(=O)O 7f5fb377fe5377cc803de2553c28d287 [0,1,0,0,0,0|1,0,2]=4 2018 B10R0.4 CSCCNCCCC(=O)C b0f651d6cbd97ab9c605588c785a7c5a [0,1,0,0,0,0|2,0,0]=3 2019 B10R0.4 CSCCNCCCC(=O)N 27ccd8f61ba2aae2586ac16dceba42a9 [0,1,0,0,0,0|2,0,0]=3 2020 B10R0.4 CSCCNCCCC(=O)O 984273bed5ff75481a174286557b4f00 [0,1,0,0,0,0|1,0,0]=2 2021 B10R0.4 CSCCNCCCC(C)O ed0c63796a660f5427e2b8ffcf4436e9 [0,1,0,0,0,0|2,0,1]=4 2022 B10R0.4 CSCCNCCCS(=O)C 1162a145fcbbed3fc5a8933706357013 [0,1,0,0,0,0|3,0,0]=4 2023 B10R0.4 CSCCNCCC[N+](=O)[O-] a9b0e89e865a75ab167f5f2a8ff89c4b [0,1,0,0,0,0|2,0,1]=4 2024 B10R0.4 CSCCNCCNC(=O)C 68d104d50d6a0956067ec0623da356e1 [0,1,0,0,0,0|3,0,0]=4 2025 B10R0.4 CSCCNCCNC(=O)N 54c753791582ddfd04d1184a6e8d1b31 [0,1,0,0,0,0|3,0,0]=4 2026 B10R0.4 CSCCNCCOC(=O)C fdfa5293f98007b59c0f2c8b85f59757 [0,1,0,0,0,0|3,0,0]=4 2027 B10R0.4 CSCCNCCSC(=O)C 42e9c293e7b4aec4d412811395e0d7a1 [0,1,0,0,0,0|3,0,0]=4 2028 B10R0.4 CSCCOC/C=C/C(=O)O c6623daae1bdc6df0eea5b6cc80f5ef4 [0,1,0,0,0,0|1,0,2]=4 2029 B10R0.4 CSCCOCC#CC(=O)O bd0e1d032df32016637158c474154032 [0,1,0,0,0,0|1,0,2]=4 2030 B10R0.4 CSCCOCC=CC(=O)O 0fd583ba97df6e5e9337d21463221f93 [0,1,0,0,0,0|1,0,2]=4 2031 B10R0.4 CSCCOCCCC(=O)C 5d591b5d8c802d0c0b966c0d6518b21f [0,1,0,0,0,0|2,0,0]=3 2032 B10R0.4 CSCCOCCCC(=O)N ee1765b132a381372bb1ce4a23f31025 [0,1,0,0,0,0|2,0,0]=3 2033 B10R0.4 CSCCOCCCC(=O)O 2169ad430e54ba0fc625bece4160068c [0,1,0,0,0,0|1,0,0]=2 2034 B10R0.4 CSCCOCCC[N+](=O)[O-] 60c06e8e55b86ce0bb3aba2cfca5fab7 [0,1,0,0,0,0|2,0,1]=4 2035 B10R0.4 CSCCOCCNC(=O)C dc80902e9829a1b9a33535197e697168 [0,1,0,0,0,0|3,0,0]=4 2036 B10R0.4 CSCCOCCNC(=O)N 23f89d0d0dc7e40c36bf25c8783ed13d [0,1,0,0,0,0|3,0,0]=4 2037 B10R0.4 CSCCOCCOC(=O)C 03481bc89f21bf34d849ce457ccf8202 [0,1,0,0,0,0|3,0,0]=4 2038 B10R0.4 CSCCOCCSC(=O)C 5cd7fab404c77da6c6a350d38dc24762 [0,1,0,0,0,0|3,0,0]=4 2039 B10R0.4 CSCNCCCCC(=O)N 8c00d06979110a869b1d4265beb700c4 [0,1,0,0,0,0|2,0,0]=3 2040 B10R0.4 CSCNCCCCC(=O)O 5ded596d0e21db27702f9a71836c5d08 [0,1,0,0,0,0|1,0,0]=2 2041 B10R0.4 CSCNCCCNC(=O)C 7ea00c2298d4050ef10999051c52e571 [0,1,0,0,0,0|3,0,0]=4 2042 B10R0.4 CSCNCCOCC(=O)O 9dde45d19d97a6d2f21ba3253fd6431d [0,1,0,0,0,0|2,0,0]=3 2043 B10R0.4 CSCNCCSCC(=O)O 99b5c3e65296e6ad64480ff1c9b17a6c [0,1,0,0,0,0|2,0,0]=3 2044 B10R0.4 CSCOCCC#CC(=O)O 1fe9de62f34aaf3cfb22cb3fd40d84b7 [0,1,0,0,0,0|1,0,2]=4 2045 B10R0.4 CSCOCCCCC(=O)C ee5a6b63448e3c341dbf3ba139d160cd [0,1,0,0,0,0|2,0,0]=3 2046 B10R0.4 CSCOCCCCC(=O)N 0e831c89ec7a9470a1a6f979ef21ea30 [0,1,0,0,0,0|2,0,0]=3 2047 B10R0.4 CSCOCCCCC(=O)O 6c17dfeb22841c97ecacc91dd0ab17dc [0,1,0,0,0,0|1,0,0]=2 2048 B10R0.4 CSCOCCCC[N+](=O)[O-] c9e5653873db78330238c0d3f8a9b617 [0,1,0,0,0,0|2,0,1]=4 2049 B10R0.4 CSCOCCCNC(=O)C 71df8289174afb99692b3b0c914e0a0e [0,1,0,0,0,0|3,0,0]=4 2050 B10R0.4 CSCOCCCOC(=O)C b359a480b93e6e32f5359b45976d0dfc [0,1,0,0,0,0|3,0,0]=4 2051 B10R0.4 CSCOCCCSC(=O)C 7396c6e531e22f144d4d5dc8ce68e267 [0,1,0,0,0,0|3,0,0]=4 2052 B10R0.4 CSCOCCOCC(=O)O ea88c1837b26f67820b4a9f2fc3636a4 [0,1,0,0,0,0|2,0,0]=3 2053 B10R0.4 CSCOCCSCC(=O)N 9b7fcaf28588050d6cc65ee489a043ad [0,1,0,0,0,0|3,0,0]=4 2054 B10R0.4 C[C@@H](O)CCCCNCCBr 981b2613b1d2a9ec8022e5fbd1ac0ac6 [0,1,0,0,0,0|2,0,1]=4 2055 B10R0.4 C[C@@H](O)CCCCNCCF 06a9119e5b24f6981568b27055f41132 [0,1,0,0,0,0|2,0,1]=4 2056 B10R0.4 C[C@@H](O)CCCCNCCI ea5db5bac35363c35ebf7704a1e4d342 [0,1,0,0,0,0|2,0,1]=4 2057 B10R0.4 C[C@@H](O)CCCCNCCO 540e5a73a85915e91ef6c8e3fa7a09a6 [0,1,0,0,0,0|2,0,1]=4 2058 B10R0.4 C[C@@H](O)CCCCNCCS a1b90adda40c9f3c04ba903565d01986 [0,1,0,0,0,0|2,0,1]=4 2059 B10R0.4 C[C@@H](O)CCNCCCCF 3caf2d840c6d57b474b164dcdda33023 [0,1,0,0,0,0|2,0,1]=4 2060 B10R0.4 C[C@@H](O)CCNCCCCO 4fca7630c61cfc16c51e05a444529134 [0,1,0,0,0,0|2,0,1]=4 2061 B10R0.4 C[C@@H](O)CNCCCCCCl b866b2a61898bd18c8941edd75867d6d [0,1,0,0,0,0|2,0,1]=4 2062 B10R0.4 C[C@@H](O)CNCCCCCF 14e1b1914eded3e96ba2baf634482ca5 [0,1,0,0,0,0|2,0,1]=4 2063 B10R0.4 C[C@@H](O)CNCCCCCO f00e8cd379c6d1e2716557afd308f86c [0,1,0,0,0,0|2,0,1]=4 2064 B10R0.4 C[C@H](O)CCNCCCCF fe19ddf1c8881c1a1b567c54dedaff13 [0,1,0,0,0,0|2,0,1]=4 2065 B10R0.4 C[C@H](O)CCNCCCCO a9d5080b2c136f8d46ba5a35c2f2a159 [0,1,0,0,0,0|2,0,1]=4 2066 B10R0.4 C[C@H](O)CNCCCCCCl ae753e896411fff5d1fe9a7a75f1edf0 [0,1,0,0,0,0|2,0,1]=4 2067 B10R0.4 C[C@H](O)CNCCCCCF c1bc8eb7156b69b5cb7c7d38b7f46148 [0,1,0,0,0,0|2,0,1]=4 2068 B10R0.4 C[C@H](O)CNCCCCCO 96311f7e134db8c0395a1fe3b30b2a18 [0,1,0,0,0,0|2,0,1]=4 2069 B10R0.4 N#CCCCCNCC(=O)N 667d701ae5b58b81621245273c448e54 [0,1,0,0,0,0|2,0,1]=4 2070 B10R0.4 N#CCCCCNCC(=O)O 35d6d21b615d456356a1e3b53ec5c7fb [0,1,0,0,0,0|1,0,1]=3 2071 B10R0.4 N#CCCCCOCC(=O)N 567629ed0095ad0b67aeb21684b9b663 [0,1,0,0,0,0|2,0,1]=4 2072 B10R0.4 N#CCCCCOCC(=O)O 3198be191b9513c8b3d591086f6dd40d [0,1,0,0,0,0|1,0,1]=3 2073 B10R0.4 N#CCCCCOCS(=O)O 86ccfcbdc08070df3bc716bd290d8710 [0,1,0,0,0,0|2,0,1]=4 2074 B10R0.4 N#CCCCNCCC(=O)N d873b475c4573ceb56db740e3a0a8974 [0,1,0,0,0,0|2,0,1]=4 2075 B10R0.4 N#CCCCNCCC(=O)O 96c4849221d8ece5f9633beba5cda804 [0,1,0,0,0,0|1,0,1]=3 2076 B10R0.4 N#CCCCNCCS(=O)O b6a365c6e437011f66ae3710bf9baea6 [0,1,0,0,0,0|2,0,1]=4 2077 B10R0.4 N#CCCCOCCC(=O)N 0cd0d9c891cf220eb6c9ca24e5297353 [0,1,0,0,0,0|2,0,1]=4 2078 B10R0.4 N#CCCCOCCC(=O)O b9f13f1747e7c2c06328940072fcd095 [0,1,0,0,0,0|1,0,1]=3 2079 B10R0.4 N#CCCNCCCC(=O)N ce6ef6ee14bcd9fa60e582991bc60995 [0,1,0,0,0,0|2,0,1]=4 2080 B10R0.4 N#CCCNCCCC(=O)O 5e132e7a513138323d64283138c29b14 [0,1,0,0,0,0|1,0,1]=3 2081 B10R0.4 N#CCCOCCCC(=O)N 8302ba9531b21f392fe9e6cc6c05f5ee [0,1,0,0,0,0|2,0,1]=4 2082 B10R0.4 N#CCCOCCCC(=O)O 90ef89a682d420686cb1b578ace69e00 [0,1,0,0,0,0|1,0,1]=3 2083 B10R0.4 N#CCNCCCCC(=O)N 8e73737621601972de18f7f82ea79f03 [0,1,0,0,0,0|2,0,1]=4 2084 B10R0.4 N#CCNCCCCC(=O)O 96f5677770d74775f05b9aa85de7855d [0,1,0,0,0,0|1,0,1]=3 2085 B10R0.4 N#CCNCCOCC(=O)O 71a5dcabf41db7cfd0b42954139c7c53 [0,1,0,0,0,0|2,0,1]=4 2086 B10R0.4 N#CCNCCSCC(=O)O 37a0eebfc84cb3764e7a1b8c6b0ff4e6 [0,1,0,0,0,0|2,0,1]=4 2087 B10R0.4 N#CCOCCCCC(=O)N 649530b911a9a45712368185fc1958fa [0,1,0,0,0,0|2,0,1]=4 2088 B10R0.4 N#CCOCCCCC(=O)O 71c8ac6b7e619b724ff1a7cfa4142fb7 [0,1,0,0,0,0|1,0,1]=3 2089 B10R0.4 N#CCOCCNCC(=O)O 6e322afc9c9c0cc5be393640f1387730 [0,1,0,0,0,0|2,0,1]=4 2090 B10R0.4 N#CCOCCOCC(=O)O 19cee2e9fbb3b80b15283dd17f6c7be1 [0,1,0,0,0,0|2,0,1]=4 2091 B10R0.4 N#CNCCCCCC(=O)N bab9d75d0fede21348f7edefbe167914 [0,1,0,0,0,0|2,0,1]=4 2092 B10R0.4 N#CNCCCOCC(=O)O 0cf73b56a3010836c25f79627f8f9185 [0,1,0,0,0,0|2,0,1]=4 2093 B10R0.4 N#CNCCOCCC(=O)O bcc00b0706cc8b737899bbab4cc291bf [0,1,0,0,0,0|2,0,1]=4 2094 B10R0.4 NC(=O)CCCCCNC=O 4ea4a0809a4a98e1eb9258064294c5a1 [0,1,0,0,0,0|2,0,1]=4 2095 B10R0.4 NC(=O)CCCCCNCF 168835141376a98e5d3e17441231488d [0,1,0,0,0,0|2,0,0]=3 2096 B10R0.4 NC(=O)CCCCCNCO c8d62efe9ddd27feee6ab28f94464eb3 [0,1,0,0,0,0|2,0,0]=3 2097 B10R0.4 NC(=O)CCCCCOCF 2addd4a9eb63485547e699d34a2e3bda [0,1,0,0,0,0|2,0,0]=3 2098 B10R0.4 NC(=O)CCCCNCC=O 4915834623ef6082a97cfad912ece1a4 [0,1,0,0,0,0|2,0,1]=4 2099 B10R0.4 NC(=O)CCCCNCCBr 1be305104caab4a4daf4dcf67a7d3373 [0,1,0,0,0,0|2,0,0]=3 2100 B10R0.4 NC(=O)CCCCNCCF 72fd08895d0cfec42cf5f8ad9cc7194f [0,1,0,0,0,0|2,0,0]=3 2101 B10R0.4 NC(=O)CCCCNCCI 78e76279c3418a2f92c0ffbc11c0ef60 [0,1,0,0,0,0|2,0,0]=3 2102 B10R0.4 NC(=O)CCCCNCCO 65a3f0ae966d6c5849294c99bfca067f [0,1,0,0,0,0|2,0,0]=3 2103 B10R0.4 NC(=O)CCCCNCCS ea711f8552c320ab0830eb07fa9f8a8e [0,1,0,0,0,0|2,0,0]=3 2104 B10R0.4 NC(=O)CCCCOCC=O 6df2c8ad8ba3aa367aeb0d6fa246cc61 [0,1,0,0,0,0|2,0,1]=4 2105 B10R0.4 NC(=O)CCCCOCCF 1fa9ac85a773296f72491dce6168bff5 [0,1,0,0,0,0|2,0,0]=3 2106 B10R0.4 NC(=O)CCCCOCCS 5e773ef22e7ade0a618741541ea006e2 [0,1,0,0,0,0|2,0,0]=3 2107 B10R0.4 NC(=O)CCCNCCC=O e9bd135ce3e97d1b5811095608647ad4 [0,1,0,0,0,0|2,0,1]=4 2108 B10R0.4 NC(=O)CCCNCCCCl b7463b528e977373efeab5bccf8216e8 [0,1,0,0,0,0|2,0,0]=3 2109 B10R0.4 NC(=O)CCCNCCCF beb6d533f51a08fb33d14624b0e967c0 [0,1,0,0,0,0|2,0,0]=3 2110 B10R0.4 NC(=O)CCCNCCCO b5e570a09bf7ce0f6958f6cf24cea4bf [0,1,0,0,0,0|2,0,0]=3 2111 B10R0.4 NC(=O)CCCNCCCS c06946ab4df4cd892041c2dcfa32b5ce [0,1,0,0,0,0|2,0,0]=3 2112 B10R0.4 NC(=O)CCCOCCC=O 919f799cec73e37dbdf4cf7ba085466e [0,1,0,0,0,0|2,0,1]=4 2113 B10R0.4 NC(=O)CCCOCCCF 5dc0e0365cec6a86ae412df215c6ec75 [0,1,0,0,0,0|2,0,0]=3 2114 B10R0.4 NC(=O)CCCOCCCS da597ec925c094b7920b8d33c7a6d48b [0,1,0,0,0,0|2,0,0]=3 2115 B10R0.4 NC(=O)CCNCCCC=O 03cb2883b3b9787bbdb3997e6fb094c7 [0,1,0,0,0,0|2,0,1]=4 2116 B10R0.4 NC(=O)CCNCCCCCl 63105970c630efac409c486cadbffae8 [0,1,0,0,0,0|2,0,0]=3 2117 B10R0.4 NC(=O)CCNCCCCF f4d9a57afee09bbd8cf18840bf126164 [0,1,0,0,0,0|2,0,0]=3 2118 B10R0.4 NC(=O)CCNCCCCO db69f1b1124d2372ea58a136b572225b [0,1,0,0,0,0|2,0,0]=3 2119 B10R0.4 NC(=O)CCNCCCCS b6c83f4fb64e3ec4caa041b67ccc0077 [0,1,0,0,0,0|2,0,0]=3 2120 B10R0.4 NC(=O)CCOCCCC=O 89f3ee012053f5641a2206025135d45d [0,1,0,0,0,0|2,0,1]=4 2121 B10R0.4 NC(=O)CCOCCCCF b88b8093813004ba1f889bd23f7c96c9 [0,1,0,0,0,0|2,0,0]=3 2122 B10R0.4 NC(=O)CCOCCCCS 37caaf4852e726737cc27b3110550d16 [0,1,0,0,0,0|2,0,0]=3 2123 B10R0.4 NC(=O)CNCCCCC=O ce1506e0410275a160c5b5779bd374d6 [0,1,0,0,0,0|2,0,1]=4 2124 B10R0.4 NC(=O)CNCCCCCCl fd31e95bdf01f497eb7912a9a53f6494 [0,1,0,0,0,0|2,0,0]=3 2125 B10R0.4 NC(=O)CNCCCCCF f6c85c89a6d81f1c3ad25ca646ccff17 [0,1,0,0,0,0|2,0,0]=3 2126 B10R0.4 NC(=O)CNCCCCCO 7b34d60a58c145ac2efa7af0999699a8 [0,1,0,0,0,0|2,0,0]=3 2127 B10R0.4 NC(=O)CNCCOCCO 7835dff2d74aef53a47d6199eb252163 [0,1,0,0,0,0|3,0,0]=4 2128 B10R0.4 NC(=O)CNCCOCCS f2e1c52ae57e0b11718a4d2249293734 [0,1,0,0,0,0|3,0,0]=4 2129 B10R0.4 NC(=O)CNCCSCCO f919f8a19785ef6271d12b9b5f3da70f [0,1,0,0,0,0|3,0,0]=4 2130 B10R0.4 NC(=O)COCCCCC=O ed47e5afcbfee2789ca1c9fb776840c0 [0,1,0,0,0,0|2,0,1]=4 2131 B10R0.4 NC(=O)COCCCCCF 2490632b700a7ac5785deea7c0a8c40c [0,1,0,0,0,0|2,0,0]=3 2132 B10R0.4 NC(=O)COCCNCCBr 2f653997c3f2e825371fe23a57dd698c [0,1,0,0,0,0|3,0,0]=4 2133 B10R0.4 NC(=O)COCCNCCF ba515b30fa8a061cf765d7bfe60a69b4 [0,1,0,0,0,0|3,0,0]=4 2134 B10R0.4 NC(=O)COCCNCCI e4912389c79451faab2eb5fc8bef19a6 [0,1,0,0,0,0|3,0,0]=4 2135 B10R0.4 NC(=O)COCCNCCO 0cf9af2231fcd8f6f3c2b1718510ee55 [0,1,0,0,0,0|3,0,0]=4 2136 B10R0.4 NC(=O)COCCNCCS a0a5bb53e336921e908d5ea47376b64f [0,1,0,0,0,0|3,0,0]=4 2137 B10R0.4 NC(=O)COCCOCCF ef265a3475adedb73d8fa50eda558b4b [0,1,0,0,0,0|3,0,0]=4 2138 B10R0.4 NC(=O)COCCOCCS ccd489edd4ba7eee9f89f6779e47c7fd [0,1,0,0,0,0|3,0,0]=4 2139 B10R0.4 NC(=O)CSCCOCCF df9054342c65f42892113c69aea79b03 [0,1,0,0,0,0|3,0,0]=4 2140 B10R0.4 NC(=O)CSCCOCCS f64b42c41d5c94dc33bf45f0fbbb1146 [0,1,0,0,0,0|3,0,0]=4 2141 B10R0.4 NC(=O)NCCNCCCCl cfa69e886e15c8427e753f2912e573db [0,1,0,0,0,0|3,0,0]=4 2142 B10R0.4 NC(=O)NCCNCCCO 2978ba94522dde64bb2ef9a8bbb7fb33 [0,1,0,0,0,0|3,0,0]=4 2143 B10R0.4 NC(=O)NCCOCCCF 081e8e93b919a17e94dad0d4999ad5a5 [0,1,0,0,0,0|3,0,0]=4 2144 B10R0.4 NC(=O)NCCOCCCS 00e077efd1dedc28f658aee12d691c0e [0,1,0,0,0,0|3,0,0]=4 2145 B10R0.4 NC(=O)NCOCCCCF 57e215ea1bdfa22d38dc3c95ffc0e1f3 [0,1,0,0,0,0|3,0,0]=4 2146 B10R0.4 NC(=O)SCNCCCCCl d779538458b62420425f29bed3bc5f66 [0,1,0,0,0,0|3,0,0]=4 2147 B10R0.4 NC(=O)SCNCCCCO 022bad48d8ec2b5b56ae82c74a011d49 [0,1,0,0,0,0|3,0,0]=4 2148 B10R0.4 NC(=O)SCNCCCCS 8c4a14456470202ab8f9002e78f99292 [0,1,0,0,0,0|3,0,0]=4 2149 B10R0.4 NC(=O)SCOCCCCF 6b86a2fc3ae23b36e9c14b23650c6977 [0,1,0,0,0,0|3,0,0]=4 2150 B10R0.4 NC(=O)SCOCCCCS 8d772578c9079e170d1048093c5b180f [0,1,0,0,0,0|3,0,0]=4 2151 B10R0.4 NC(=S)CCNCCCCF 7b02562dd8bcea3df86e5117dc6d0a73 [0,1,0,0,0,0|2,1,0]=4 2152 B10R0.4 NC(=S)CCNCCCCO e8b46b45f2c3782934448e43cee3a959 [0,1,0,0,0,0|2,1,0]=4 2153 B10R0.4 NC(=S)COCCCCCF f6d71b83f93c6855eea644a5cc988458 [0,1,0,0,0,0|2,1,0]=4 2154 B10R0.4 NOCCCCNCC(=O)N 1d6e4f1fc9d8a6606dab306d83c5e844 [0,1,0,0,0,0|3,0,0]=4 2155 B10R0.4 NOCCCCNCC(=O)O 70dadd5c846e10f66795cc83cee65fc1 [0,1,0,0,0,0|2,0,0]=3 2156 B10R0.4 NOCCNCCCC(=O)N a3f151a3b66c8487fbafe305dec28961 [0,1,0,0,0,0|3,0,0]=4 2157 B10R0.4 O=C(O)/C=C/CNCCCCl 5d7b01cccad7f7aa9fa7f0406bab9e93 [0,1,0,0,0,0|1,0,2]=4 2158 B10R0.4 O=C(O)/C=C/CNCCCF d92460741b8dda97762a1d7a72ba3673 [0,1,0,0,0,0|1,0,2]=4 2159 B10R0.4 O=C(O)/C=C/CNCCCO d9e674b13507c040b7a7a8b90c96e7d6 [0,1,0,0,0,0|1,0,2]=4 2160 B10R0.4 O=C(O)/C=C/CNCCCS 35fcb2a0be1464b0b2be2b2c55fc6187 [0,1,0,0,0,0|1,0,2]=4 2161 B10R0.4 O=C(O)/C=C/COCCCF 138adf3e5a621d89d67231c17793e2e6 [0,1,0,0,0,0|1,0,2]=4 2162 B10R0.4 O=C(O)/C=C/COCCCS 5bd8e6a45493d9cc00eb46a146676303 [0,1,0,0,0,0|1,0,2]=4 2163 B10R0.4 O=C(O)C#CCCOCCF 978133a64cd0700bc635be5edbebc5c5 [0,1,0,0,0,0|1,0,2]=4 2164 B10R0.4 O=C(O)C#CCCOCCS c1d5b5482cd14b46e8ffc5d82f0d5513 [0,1,0,0,0,0|1,0,2]=4 2165 B10R0.4 O=C(O)C#CCNCCCF 9fcede68357c8b8a84d0eccf60d3608e [0,1,0,0,0,0|1,0,2]=4 2166 B10R0.4 O=C(O)C#CCNCCCO a954b150cfc828e11ea8ca9912a3c638 [0,1,0,0,0,0|1,0,2]=4 2167 B10R0.4 O=C(O)C#CCNCCCS f0d5b613e31cd7b0ef77e717544779be [0,1,0,0,0,0|1,0,2]=4 2168 B10R0.4 O=C(O)C#CCOCCCF d5c8dde9d08c586b5cdcff6c7664f6da [0,1,0,0,0,0|1,0,2]=4 2169 B10R0.4 O=C(O)C#CCOCCCS a05e4b1c0a363c745c35c8ef39d33cd7 [0,1,0,0,0,0|1,0,2]=4 2170 B10R0.4 O=C(O)C=CCNCCCCl 1e72e22dd52648dea2d4205cb25f9624 [0,1,0,0,0,0|1,0,2]=4 2171 B10R0.4 O=C(O)C=CCNCCCF e26a9782d7430c923fbcae00d797add2 [0,1,0,0,0,0|1,0,2]=4 2172 B10R0.4 O=C(O)C=CCNCCCO fcba38efbd09999c051c3dc2d8670641 [0,1,0,0,0,0|1,0,2]=4 2173 B10R0.4 O=C(O)C=CCNCCCS 48d055f95461678cbe308cd4c0a345e3 [0,1,0,0,0,0|1,0,2]=4 2174 B10R0.4 O=C(O)C=CCOCCCF 8899ee31fe53daf02a3aea8b5f0aced2 [0,1,0,0,0,0|1,0,2]=4 2175 B10R0.4 O=C(O)C=CCOCCCS 1ca378389e39abb72f78c4e13ec684a5 [0,1,0,0,0,0|1,0,2]=4 2176 B10R0.4 O=C(O)CCCCCNCF 5010e9049fecfa0377d660157cc67715 [0,1,0,0,0,0|1,0,0]=2 2177 B10R0.4 O=C(O)CCCCCNCO 9f006abe272dfebb9f21f85b4e25f481 [0,1,0,0,0,0|1,0,0]=2 2178 B10R0.4 O=C(O)CCCCCOCF 71f72a753ed44d8087f81d2f875fc41b [0,1,0,0,0,0|1,0,0]=2 2179 B10R0.4 O=C(O)CCCCNCCF aa510449750017f96f3f1d1804b3727d [0,1,0,0,0,0|1,0,0]=2 2180 B10R0.4 O=C(O)CCCCNCCI 0252ad0383162f9fa94cd74a1313364e [0,1,0,0,0,0|1,0,0]=2 2181 B10R0.4 O=C(O)CCCCNCCO 278650aa09a4063af47118a1fddf5afa [0,1,0,0,0,0|1,0,0]=2 2182 B10R0.4 O=C(O)CCCCNCCS b836a13534f967d6f1dddb4786cb91a3 [0,1,0,0,0,0|1,0,0]=2 2183 B10R0.4 O=C(O)CCCCOCCF e9c9bf004bced3e5d4d08ac016f5c678 [0,1,0,0,0,0|1,0,0]=2 2184 B10R0.4 O=C(O)CCCCOCCS e9bbc58a5b43da00330d5dac53c10e5b [0,1,0,0,0,0|1,0,0]=2 2185 B10R0.4 O=C(O)CCCNC/C=C/Cl d0b8c623bb462bdf13a8032e34a30c38 [0,1,0,0,0,0|1,0,2]=4 2186 B10R0.4 O=C(O)CCCNC/C=C\Cl 3bea552d4ebb8cccfe58e6c3a83c5c7c [0,1,0,0,0,0|1,0,2]=4 2187 B10R0.4 O=C(O)CCCNC/C=C\O 6613045f4ae1ec673d2c1e65be33939d [0,1,0,0,0,0|1,0,2]=4 2188 B10R0.4 O=C(O)CCCNCCCCl e7a82f437ef7ce7c511305c3bebf2ef2 [0,1,0,0,0,0|1,0,0]=2 2189 B10R0.4 O=C(O)CCCNCCCF 3c12d664e7366df0bac8121fcdb32907 [0,1,0,0,0,0|1,0,0]=2 2190 B10R0.4 O=C(O)CCCNCCCO 9a5e0cfff3cc3bd220fe4c019937f745 [0,1,0,0,0,0|1,0,0]=2 2191 B10R0.4 O=C(O)CCCOC/C=C/Cl 7f0996062cdf0ef60addb1706ca8d5f0 [0,1,0,0,0,0|1,0,2]=4 2192 B10R0.4 O=C(O)CCCOCC=CCl 32834694f66f2ee7ff3031b2bb110447 [0,1,0,0,0,0|1,0,2]=4 2193 B10R0.4 O=C(O)CCCOCCCF ef86cc67ffb85fea8a2e23ffd0be7146 [0,1,0,0,0,0|1,0,0]=2 2194 B10R0.4 O=C(O)CCNCC#CCO f1002daf42c3b6cf4a47ce17f2a05cc2 [0,1,0,0,0,0|1,0,2]=4 2195 B10R0.4 O=C(O)CCNCCCCCl 15c8dbba8e6f22b07523ac4d29cb0ac3 [0,1,0,0,0,0|1,0,0]=2 2196 B10R0.4 O=C(O)CCNCCCCF f5d00c625d661c736577c0dc3ba36014 [0,1,0,0,0,0|1,0,0]=2 2197 B10R0.4 O=C(O)CCNCCCCO 1717076d72b743c651a0c543e687abfd [0,1,0,0,0,0|1,0,0]=2 2198 B10R0.4 O=C(O)CCNCCCCS 49b25c5bdb84f91f3248e476108ccc79 [0,1,0,0,0,0|1,0,0]=2 2199 B10R0.4 O=C(O)CCOCCCCF f1aba4d0fec36c39af00cdd25995f36c [0,1,0,0,0,0|1,0,0]=2 2200 B10R0.4 O=C(O)CCOCCCCS f440f233d2be0718d562a00417942445 [0,1,0,0,0,0|1,0,0]=2 2201 B10R0.4 O=C(O)CCOCCNCF b10b5c45064cfa3b61462f03de721399 [0,1,0,0,0,0|2,0,0]=3 2202 B10R0.4 O=C(O)CCOCCNCO e209915a2f35feaa6536a9cab51db950 [0,1,0,0,0,0|2,0,0]=3 2203 B10R0.4 O=C(O)CCOCCOCF 794036639e850bf79b0e6c6bb818a4b5 [0,1,0,0,0,0|2,0,0]=3 2204 B10R0.4 O=C(O)CNCCCCCCl a83b6bb993dd65ffba33eb2586cdf494 [0,1,0,0,0,0|1,0,0]=2 2205 B10R0.4 O=C(O)CNCCCCCF 4dbeaa853a61d08f169520460ad25911 [0,1,0,0,0,0|1,0,0]=2 2206 B10R0.4 O=C(O)CNCCCCCO 95121d7be2e3a87e4e81ec26c166df24 [0,1,0,0,0,0|1,0,0]=2 2207 B10R0.4 O=C(O)CNCCOCCO 61358dfe4f762e3239860abf51eb55a2 [0,1,0,0,0,0|2,0,0]=3 2208 B10R0.4 O=C(O)CNCCOCCS 925322d012b8e92ba4e47f9a5625ac74 [0,1,0,0,0,0|2,0,0]=3 2209 B10R0.4 O=C(O)CNCCSCCO 277ca89a0a517963cae207967b457e7c [0,1,0,0,0,0|2,0,0]=3 2210 B10R0.4 O=C(O)COCCCCCF 8e4729e23febda2f8d2fd6c5de67d134 [0,1,0,0,0,0|1,0,0]=2 2211 B10R0.4 O=C(O)COCCNCCF 2e7d4e80e31c3481ef07788398a5dd6a [0,1,0,0,0,0|2,0,0]=3 2212 B10R0.4 O=C(O)COCCNCCI e3160e5e187ed431712741097b4ede2f [0,1,0,0,0,0|2,0,0]=3 2213 B10R0.4 O=C(O)COCCNCCO 1d28851cb10c60424a64961c961ad5e1 [0,1,0,0,0,0|2,0,0]=3 2214 B10R0.4 O=C(O)COCCNCCS 426b240fbe8b2d3c77fa7bc41add1fe2 [0,1,0,0,0,0|2,0,0]=3 2215 B10R0.4 O=C(O)COCCOCCF 98b6f4f719a60ef054da74892db23cca [0,1,0,0,0,0|2,0,0]=3 2216 B10R0.4 O=C(O)COCCOCCS 374d05928f0579f3109488a6dc4024e2 [0,1,0,0,0,0|2,0,0]=3 2217 B10R0.4 O=C(O)CSCCNCCF cb7168a71eceedaa9f2298994c7f8a7d [0,1,0,0,0,0|2,0,0]=3 2218 B10R0.4 O=C(O)CSCCNCCO f8149fa1464b0b22fccb9cf51e8861d6 [0,1,0,0,0,0|2,0,0]=3 2219 B10R0.4 O=C(O)CSCCNCCS 9c8f0db50c9a3907b8542969b9c22d43 [0,1,0,0,0,0|2,0,0]=3 2220 B10R0.4 O=CCCCCNCC(=O)O afa09eb7ad93095d62a13368a3c2af83 [0,1,0,0,0,0|1,0,1]=3 2221 B10R0.4 O=CCCCCOCC(=O)O bbd2ea09c7afe456618ef923b44a2447 [0,1,0,0,0,0|1,0,1]=3 2222 B10R0.4 O=CCCCCOCS(=O)O 42e20277f4ba659cd55585ab1357921a [0,1,0,0,0,0|2,0,1]=4 2223 B10R0.4 O=CCCCNCCC(=O)O 8cfdc6a24de021fcf9eedd1564d48e87 [0,1,0,0,0,0|1,0,1]=3 2224 B10R0.4 O=CCCCNCCS(=O)O 9563d9b55f79f6bd65cb3398bdcba35c [0,1,0,0,0,0|2,0,1]=4 2225 B10R0.4 O=CCCCOCCC(=O)O 6315c452ffa50a37c22ea75ed9b097ad [0,1,0,0,0,0|1,0,1]=3 2226 B10R0.4 O=CCCNCCCC(=O)O 4cf44d1235885a7352ee88704c953847 [0,1,0,0,0,0|1,0,1]=3 2227 B10R0.4 O=CCCOCCCC(=O)O eeaed839850eec036bbecf09fd02f04c [0,1,0,0,0,0|1,0,1]=3 2228 B10R0.4 O=CCNCCCCC(=O)O f97209a18d125e201a5732d6f0c937c4 [0,1,0,0,0,0|1,0,1]=3 2229 B10R0.4 O=CCNCCOCC(=O)O 362725fd556ced7151e5415e0a962f24 [0,1,0,0,0,0|2,0,1]=4 2230 B10R0.4 O=CCNCCSCC(=O)O d0be72958cae681a0bece97b24112e21 [0,1,0,0,0,0|2,0,1]=4 2231 B10R0.4 O=CCOCCCCC(=O)O 77808aab3bd2e939797466d1a102c859 [0,1,0,0,0,0|1,0,1]=3 2232 B10R0.4 O=CCOCCNCC(=O)O 3b67c17346f39dfe377ae4e4ceee3427 [0,1,0,0,0,0|2,0,1]=4 2233 B10R0.4 O=CCOCCOCC(=O)O 16d2dff1285ffe1451ee4280c5c17031 [0,1,0,0,0,0|2,0,1]=4 2234 B10R0.4 O=CNCCOCCC(=O)O 6a6dd9a67adea14e5c87dc1284a8d2c7 [0,1,0,0,0,0|2,0,1]=4 2235 B10R0.4 O=COCCOCCC(=O)O 4198af4e4c2a0c8f431f24b9dc75a6b1 [0,1,0,0,0,0|2,0,1]=4 2236 B10R0.4 O=S(O)CCNCCCCF a6ebb461e61fd8b9709d31e16a4963d8 [0,1,0,0,0,0|2,0,0]=3 2237 B10R0.4 O=S(O)CCNCCCCO 77eee8cda74a4dc486213a9365905d5d [0,1,0,0,0,0|2,0,0]=3 2238 B10R0.4 O=S(O)COCCCCCF 402ddc7a1da086e0d2bc9a9fc3ebe9c1 [0,1,0,0,0,0|2,0,0]=3 2239 B10R0.4 O=[N+]([O-])CCCCOCCF a07f194330b1f6b79294b6dd22b7ce4a [0,1,0,0,0,0|2,0,1]=4 2240 B10R0.4 O=[N+]([O-])CCCCOCCS c320365bff845b20125aa2a3d72445c2 [0,1,0,0,0,0|2,0,1]=4 2241 B10R0.4 O=[N+]([O-])CCCNCCCCl 84988e1037f01480e53bcc37378cca53 [0,1,0,0,0,0|2,0,1]=4 2242 B10R0.4 O=[N+]([O-])CCCNCCCO 29b9e0744bc99432688a811f0ee30b8c [0,1,0,0,0,0|2,0,1]=4 2243 B10R0.4 O=[N+]([O-])CCCOCCCF 07934f55ad8ef252d66d99950706167c [0,1,0,0,0,0|2,0,1]=4 2244 B10R0.4 O=[N+]([O-])CCCOCCCS 9549f44327b627c0eb8e234fa30b055f [0,1,0,0,0,0|2,0,1]=4 2245 B10R0.4 O=[N+]([O-])CCOCCCCF 37aa1cb0d3aafed8032d486c58393914 [0,1,0,0,0,0|2,0,1]=4 2246 B10R0.4 O=[N+]([O-])CNCCCCCCl c6a225552dfc5a7dbafe76291a4b4da0 [0,1,0,0,0,0|2,0,1]=4 2247 B10R0.4 O=[N+]([O-])CNCCCCCO 1bbd6f9f8e3619222bfbf5e728199398 [0,1,0,0,0,0|2,0,1]=4 2248 B10R0.6 C#CCCCN(C)CC(=O)O 79e86c8aed0f94c0ae2cde3d7a92190d [0,1,0,0,0,0|1,0,2]=4 2249 B10R0.6 C#CCCNC(C)CC(=O)O a609eaccf4fe36daf976fc74ce6725a8 [0,1,0,0,0,0|1,0,2]=4 2250 B10R0.6 C#CCCN[C@@H](C)CC(=O)O 21c20197862f020ed4fdd015fa609086 [0,1,0,0,0,0|1,0,2]=4 2251 B10R0.6 C#CCCN[C@H](C)CC(=O)O 2489bf051abc5a889aca1081b1c65c51 [0,1,0,0,0,0|1,0,2]=4 2252 B10R0.6 C#CCCOC(C)CC(=O)O 7933b8b2f7651949095cebd2f3168706 [0,1,0,0,0,0|1,0,2]=4 2253 B10R0.6 C#CCCO[C@@H](C)CC(=O)O 776777c2e8c75af9af8a5cd5f2b502d4 [0,1,0,0,0,0|1,0,2]=4 2254 B10R0.6 C#CCCO[C@H](C)CC(=O)O ea645368030d3f26a28a04a260d07c5b [0,1,0,0,0,0|1,0,2]=4 2255 B10R0.6 C#CCNCC(O)CC(=O)O 0b736dba65330e156ec3df2f217c456d [0,1,0,0,0,0|1,0,2]=4 2256 B10R0.6 C#CCNC[C@@H](O)CC(=O)O ed1b7993108bb29d04e9a63e5443324d [0,1,0,0,0,0|1,0,2]=4 2257 B10R0.6 C#CCNC[C@H](O)CC(=O)O 143edd8c3bbb83a4ef0d1b003f8e1688 [0,1,0,0,0,0|1,0,2]=4 2258 B10R0.6 C/C=C/CNC(C)CC(=O)O a8685f9e353a8ab5592d2eb3a3e25e39 [0,1,0,0,0,0|1,0,2]=4 2259 B10R0.6 C/C=C/CN[C@@H](C)CC(=O)O 5a00d22d8d1d5b7558e9708a816f5b79 [0,1,0,0,0,0|1,0,2]=4 2260 B10R0.6 C/C=C/CN[C@H](C)CC(=O)O c112986834d558ffbf4e7164b3431844 [0,1,0,0,0,0|1,0,2]=4 2261 B10R0.6 C/C=C/COC(C)CC(=O)O 378b8bd5f41e891f369d94b86c55f0ac [0,1,0,0,0,0|1,0,2]=4 2262 B10R0.6 C/C=C/CO[C@@H](C)CC(=O)O 0107fb3baf014aff351849844a9cacc7 [0,1,0,0,0,0|1,0,2]=4 2263 B10R0.6 C/C=C/CO[C@H](C)CC(=O)O ab2711b64e544a0dae6abcb85e3643fa [0,1,0,0,0,0|1,0,2]=4 2264 B10R0.6 C/C=C\CNC(C)CC(=O)O 5b0d3995eff33e72a2664ce41aee3048 [0,1,0,0,0,0|1,0,2]=4 2265 B10R0.6 C/C=C\CN[C@@H](C)CC(=O)O 64a340a11f84a2e54a31ac8a60474276 [0,1,0,0,0,0|1,0,2]=4 2266 B10R0.6 C/C=C\CN[C@H](C)CC(=O)O 3c9589b50c1b35ff304b9631acb829e6 [0,1,0,0,0,0|1,0,2]=4 2267 B10R0.6 C/C=C\COC(C)CC(=O)O 159f19b49c77f3c917afd54b1eca6a84 [0,1,0,0,0,0|1,0,2]=4 2268 B10R0.6 C/C=C\CO[C@@H](C)CC(=O)O 17975e08d74667781a79734edb960dcf [0,1,0,0,0,0|1,0,2]=4 2269 B10R0.6 C/C=C\CO[C@H](C)CC(=O)O 4466efa5c86ceb1ca45f38c2a9aff521 [0,1,0,0,0,0|1,0,2]=4 2270 B10R0.6 C=C(Br)CN(C)CCCCC 33fdbc694dd2907d148c9eda5e321c9c [0,1,0,0,0,0|3,0,0]=4 2271 B10R0.6 C=C(C)CN(C)CCCCC d99def202978daf97a9f20ca4956f0cd [0,1,0,0,0,0|3,0,0]=4 2272 B10R0.6 C=C(Cl)CN(C)CCCCC 7282545bbc1956e62a820a5c74cd9f87 [0,1,0,0,0,0|3,0,0]=4 2273 B10R0.6 C=CCCCN(C)CC(=O)O d2fe223ad417384f82c8160cc6d03b88 [0,1,0,0,0,0|1,0,2]=4 2274 B10R0.6 C=CCCNC(C)CC(=O)O 3462b723563a9c33444b9ccf63ec30d3 [0,1,0,0,0,0|1,0,2]=4 2275 B10R0.6 C=CCCN[C@@H](C)CC(=O)O 1779298be8abb8b92e976d2859b9037c [0,1,0,0,0,0|1,0,2]=4 2276 B10R0.6 C=CCCN[C@H](C)CC(=O)O f218325f7743dd87d57e7b59a343737f [0,1,0,0,0,0|1,0,2]=4 2277 B10R0.6 C=CCCOC(C)CC(=O)O fbb02c9c03cb7d62b2b5dd8137d636db [0,1,0,0,0,0|1,0,2]=4 2278 B10R0.6 C=CCCO[C@@H](C)CC(=O)O 3d048d08049cf41703f7c8e1587622d4 [0,1,0,0,0,0|1,0,2]=4 2279 B10R0.6 C=CCCO[C@H](C)CC(=O)O e8f10a2960ea1e2af6f137f5bfdbe2b1 [0,1,0,0,0,0|1,0,2]=4 2280 B10R0.6 C=CCNCC(O)CC(=O)O 7a7efd0e4b33dc99b159fa1abd1bd7ba [0,1,0,0,0,0|1,0,2]=4 2281 B10R0.6 C=CCNC[C@@H](O)CC(=O)O e20bc22e9057005168f2f26c747cfddf [0,1,0,0,0,0|1,0,2]=4 2282 B10R0.6 C=CCNC[C@H](O)CC(=O)O e7d222ed1b7dc2214a2f5c45c41bbe8d [0,1,0,0,0,0|1,0,2]=4 2283 B10R0.6 CC#CCNC(C)CC(=O)O a1d1b4d34f768271309cd82e33a06549 [0,1,0,0,0,0|1,0,2]=4 2284 B10R0.6 CC#CCOC(C)CC(=O)O fe127e83e8791868d8d2e66fc864f571 [0,1,0,0,0,0|1,0,2]=4 2285 B10R0.6 CC(CC(=O)N)OCCCF 22b6c40d636bb9bc9e24549566e6dd74 [0,1,0,0,0,0|3,0,0]=4 2286 B10R0.6 CC(CC(=O)N)OCCCS d7ae2ae3b12359281a14fc62d5193095 [0,1,0,0,0,0|3,0,0]=4 2287 B10R0.6 CC(CC(=O)O)NCCC#N 3fd68aa8e308f197fdc64b0775d8277b [0,1,0,0,0,0|2,0,1]=4 2288 B10R0.6 CC(CC(=O)O)NCCC=O d6428d9af9e9fe0d0ffa21f590e4ac3b [0,1,0,0,0,0|2,0,1]=4 2289 B10R0.6 CC(CC(=O)O)NCCCCl 48b7d690fad84a46d1547de314bbf1a4 [0,1,0,0,0,0|2,0,0]=3 2290 B10R0.6 CC(CC(=O)O)NCCCF 23fa635ecedd135c01d43b5902dd459f [0,1,0,0,0,0|2,0,0]=3 2291 B10R0.6 CC(CC(=O)O)NCCCO 4fbb8f4c2657a517b102801a572c5eec [0,1,0,0,0,0|2,0,0]=3 2292 B10R0.6 CC(CC(=O)O)NCCCS de169f9e46b450df4c2135ce269ede5c [0,1,0,0,0,0|2,0,0]=3 2293 B10R0.6 CC(CC(=O)O)NCCON a01e3e7653005c69d3d29caa45091eaf [0,1,0,0,0,0|3,0,0]=4 2294 B10R0.6 CC(CC(=O)O)OCCC#N 26503b23a3eef39c7282868961e8e0e9 [0,1,0,0,0,0|2,0,1]=4 2295 B10R0.6 CC(CC(=O)O)OCCC=O 0b600d6d8825fb47bf205b185a439458 [0,1,0,0,0,0|2,0,1]=4 2296 B10R0.6 CC(CC(=O)O)OCCCF 20a46841ce7a31e62f3e0b0db948cc8c [0,1,0,0,0,0|2,0,0]=3 2297 B10R0.6 CC(CCNC#N)CC(=O)O 11cd7314e51188839a6bec29ee3d1c36 [0,1,0,0,0,0|2,0,1]=4 2298 B10R0.6 CC/C=C/CN(C)CC(=O)O c7f746a7f0a641e6a819d88bada2045a [0,1,0,0,0,0|1,0,2]=4 2299 B10R0.6 CC=CCNC(C)CC(=O)O fadb8c1ea26b8db2f97f2ee54a5bed5c [0,1,0,0,0,0|1,0,2]=4 2300 B10R0.6 CCCCCC(C)NC(=O)C c171b2058cf01627dcbe5546a9adf771 [0,1,0,0,0,0|2,0,0]=3 2301 B10R0.6 CCCCCN(C)CC(=O)N 856176a9883c7f313669e596dfe6bc0d [0,1,0,0,0,0|2,0,0]=3 2302 B10R0.6 CCCCCN(C)CC(=O)O 4ab140d6aac6faac2393e297443e0dda [0,1,0,0,0,0|1,0,0]=2 2303 B10R0.6 CCCCCN(C)CC(C)O 901fef81c3595ff2c01b25c0d15a49c8 [0,1,0,0,0,0|2,0,1]=4 2304 B10R0.6 CCCCCN(C)C[C@@H](C)O afc2448e222a7091f88ee19e4f713057 [0,1,0,0,0,0|2,0,1]=4 2305 B10R0.6 CCCCCN(C)C[C@H](C)O d10accc63c31e841e5b492aed9733d0f [0,1,0,0,0,0|2,0,1]=4 2306 B10R0.6 CCCCCN(C)C[N+](=O)[O-] 880f03fe3235a8b68701435479b7c648 [0,1,0,0,0,0|2,0,1]=4 2307 B10R0.6 CCCCC[C@H](C)NC(=O)C 3ba852cb007a73bb1c521783cc9a5f9b [0,1,0,0,0,0|2,0,0]=3 2308 B10R0.6 CCCCNC(=O)CC(=O)C 00bd35636d398cf3ada227296de4129c [0,1,0,0,0,0|2,0,1]=4 2309 B10R0.6 CCCCNC(=O)CC(=O)N c3cfa9aada86eb19f4d2c35de5c07b64 [0,1,0,0,0,0|2,0,1]=4 2310 B10R0.6 CCCCNC(C)CC(=O)O c633822bdd37960050b77a4c542ea52f [0,1,0,0,0,0|1,0,0]=2 2311 B10R0.6 CCCCNC(C)CC(C)O 2aedcf4a2cf446830670aa55ed1888f8 [0,1,0,0,0,0|2,0,1]=4 2312 B10R0.6 CCCCNC(C)OC(=O)C ebbdec824087aa88b4b4bc6265d4cb38 [0,1,0,0,0,0|3,0,0]=4 2313 B10R0.6 CCCCN[C@@H](C)CC(=O)O fb7944b4d683d296fe4ee273d84f1842 [0,1,0,0,0,0|1,0,0]=2 2314 B10R0.6 CCCCN[C@H](C)CC(=O)O effa4168fb691284724307507367e076 [0,1,0,0,0,0|1,0,0]=2 2315 B10R0.6 CCCCOC(C)CC(=O)N c3a32793bdcb30080a8edc904272094b [0,1,0,0,0,0|2,0,0]=3 2316 B10R0.6 CCCCOC(C)CC(=O)O 7d385d82783db9ce90ee671d43dd6564 [0,1,0,0,0,0|1,0,0]=2 2317 B10R0.6 CCCCOC(C)C[N+](=O)[O-] 6595390abc014aa2fac1227a3dbc3eae [0,1,0,0,0,0|2,0,1]=4 2318 B10R0.6 CCCCOC(C)OC(=O)C 998d73eb0cc87695df1b206f00c15219 [0,1,0,0,0,0|3,0,0]=4 2319 B10R0.6 CCCCO[C@@H](C)CC(=O)O e0b1114df9792477e60a032af290ecc0 [0,1,0,0,0,0|1,0,0]=2 2320 B10R0.6 CCCCO[C@H](C)CC(=O)O 72d7a585b30718443ba3a12d0dc6335b [0,1,0,0,0,0|1,0,0]=2 2321 B10R0.6 CCCNCC(=O)CC(=O)O 647d084d70797a2ed0a267823351fd12 [0,1,0,0,0,0|1,0,1]=3 2322 B10R0.6 CCCNCC(O)CC(=O)O 16b23299f37a8d9496c6c0b6251c38a9 [0,1,0,0,0,0|1,0,0]=2 2323 B10R0.6 CCCNC[C@@H](O)CC(=O)O 291cb1436a6d09c088f19d633b5b0ffe [0,1,0,0,0,0|1,0,0]=2 2324 B10R0.6 CCCNC[C@H](O)CC(=O)O d3a494af08bc1bf4019a0efd791c0770 [0,1,0,0,0,0|1,0,0]=2 2325 B10R0.6 CCCOCC(=O)CC(=O)O cf9be1521053caf66870fd24a0372650 [0,1,0,0,0,0|1,0,1]=3 2326 B10R0.6 CCCOCC(C)NC(=O)C 256e16fb224ac5487826e7e602d7ecb5 [0,1,0,0,0,0|3,0,0]=4 2327 B10R0.6 CCCOC[C@@H](C)NC(=O)C 02b867d1dcada6257e27f40901d68736 [0,1,0,0,0,0|3,0,0]=4 2328 B10R0.6 CCOCCN(C)CC(=O)C f730d97c2963fe42b4e5bea843da382c [0,1,0,0,0,0|3,0,0]=4 2329 B10R0.6 CCOCCN(C)CC(=O)N 0a98e1d4c76dc5a4d3c3dacc72ded502 [0,1,0,0,0,0|3,0,0]=4 2330 B10R0.6 CCOCCN(C)CC(=O)O 446c9fb74019ee2196c63ade707c10c3 [0,1,0,0,0,0|2,0,0]=3 2331 B10R0.6 CCOCNC(C)CC(=O)O e232c1c2473f278b5dd6d8ffcff4cdb5 [0,1,0,0,0,0|2,0,0]=3 2332 B10R0.6 CCOCN[C@@H](C)CC(=O)O 53fc876a49cea24f5633a426e3c1dbbc [0,1,0,0,0,0|2,0,0]=3 2333 B10R0.6 CCOCN[C@H](C)CC(=O)O 39099b3d3785dee4739e3a647ac154fd [0,1,0,0,0,0|2,0,0]=3 2334 B10R0.6 CCSCCN(C)CC(=O)N 4cf3f2e80bd3aea4a9e32fb49dd47cc4 [0,1,0,0,0,0|3,0,0]=4 2335 B10R0.6 CCSCCN(C)CC(=O)O bf9cb6b97ff05d946ff937b1880a0d94 [0,1,0,0,0,0|2,0,0]=3 2336 B10R0.6 CN(CCCC#N)CC(=O)O 3a0d5b650d7974698054a54f19a2418a [0,1,0,0,0,0|2,0,1]=4 2337 B10R0.6 CN(CCCC=O)CC(=O)O f7843d5a03ef29b30b5c78ede4b68d59 [0,1,0,0,0,0|2,0,1]=4 2338 B10R0.6 CN(CCCCF)CC(=O)N 58daeaac5dc44ffe20b623407388950a [0,1,0,0,0,0|3,0,0]=4 2339 B10R0.6 CN(CCCCF)CC(=O)O 5b61e09434cdab4e8b2006d911810673 [0,1,0,0,0,0|2,0,0]=3 2340 B10R0.6 CN(CCCCO)CC(=O)N 6b79b261fd982e51f9213b3fbb0716d7 [0,1,0,0,0,0|3,0,0]=4 2341 B10R0.6 CN(CCCCO)CC(=O)O 3fccb24de06af31e6c74eb15833d5ef5 [0,1,0,0,0,0|2,0,0]=3 2342 B10R0.6 CN(CCOCF)CC(=O)O 57984b46ccc0e5b764a7c76b90903a56 [0,1,0,0,0,0|3,0,0]=4 2343 B10R0.6 COCCCN(C)CC(=O)N a7a7b9fb7078c30ba41fb246ad09323a [0,1,0,0,0,0|3,0,0]=4 2344 B10R0.6 COCCCN(C)CC(=O)O 570ce0e05954c4a488f48f559ecab73e [0,1,0,0,0,0|2,0,0]=3 2345 B10R0.6 COCCNC(C)CC(=O)O 866bf16b62e1dc773e32e16c0e9cd051 [0,1,0,0,0,0|2,0,0]=3 2346 B10R0.6 COCCN[C@@H](C)CC(=O)O ec4a659a240a6314aa96b92d2dff1eec [0,1,0,0,0,0|2,0,0]=3 2347 B10R0.6 COCCN[C@H](C)CC(=O)O 838f867351d83330c44dc0c28aec25bc [0,1,0,0,0,0|2,0,0]=3 2348 B10R0.6 COCCOC(C)CC(=O)N bb9f363a1c577e6a0b8d685c9236f8eb [0,1,0,0,0,0|3,0,0]=4 2349 B10R0.6 COCCOC(C)CC(=O)O d0e3d911dad40bab8f3555ffc7325db6 [0,1,0,0,0,0|2,0,0]=3 2350 B10R0.6 COCCO[C@@H](C)CC(=O)O 47f213839360a14b30232500a6e3a55c [0,1,0,0,0,0|2,0,0]=3 2351 B10R0.6 COCCO[C@H](C)CC(=O)O 595ef25f89eca27131e928b5b3eaded7 [0,1,0,0,0,0|2,0,0]=3 2352 B10R0.6 COCNCC(O)CC(=O)O 8d44744b4402d927adaa9c95cd9bc254 [0,1,0,0,0,0|2,0,0]=3 2353 B10R0.6 COCNC[C@@H](O)CC(=O)O b76f776dd7118b8425bf415bc2ed1004 [0,1,0,0,0,0|2,0,0]=3 2354 B10R0.6 COCNC[C@H](O)CC(=O)O 2908c5b804b30593d9e0b74ee60b265a [0,1,0,0,0,0|2,0,0]=3 2355 B10R0.6 COCOCC(=O)CC(=O)O a6946ca16359570801a3c76919cd71d1 [0,1,0,0,0,0|2,0,1]=4 2356 B10R0.6 CSCCCN(C)CC(=O)N ba8052140fe2854c0e0ba64be53676eb [0,1,0,0,0,0|3,0,0]=4 2357 B10R0.6 CSCCCN(C)CC(=O)O fa30553e74200a7f26d562b5c7e9478c [0,1,0,0,0,0|2,0,0]=3 2358 B10R0.6 CSCCNC(C)CC(=O)O 9da2962f33fb37a44ca64ede33ad8f52 [0,1,0,0,0,0|2,0,0]=3 2359 B10R0.6 CSCCN[C@@H](C)CC(=O)O 39385d46d0a84bc98fffdcad4c3bc192 [0,1,0,0,0,0|2,0,0]=3 2360 B10R0.6 CSCCN[C@H](C)CC(=O)O 1c67020f7e973da201e07f7e06f13cbe [0,1,0,0,0,0|2,0,0]=3 2361 B10R0.6 CSCCOC(C)CC(=O)N 04bf6638e4426c41b241958dc8f9838a [0,1,0,0,0,0|3,0,0]=4 2362 B10R0.6 CSCCOC(C)CC(=O)O 6911747b09b0e914783455dfa183174e [0,1,0,0,0,0|2,0,0]=3 2363 B10R0.6 CSCCO[C@@H](C)CC(=O)O 49c5c9a29588caf6c1e9c935784d524d [0,1,0,0,0,0|2,0,0]=3 2364 B10R0.6 CSCCO[C@H](C)CC(=O)O 9b88641f60cd511fa1cc0648b62c50b9 [0,1,0,0,0,0|2,0,0]=3 2365 B10R0.6 CSCNCC(O)CC(=O)O 02430295015252d5ce860cb307f4f8f9 [0,1,0,0,0,0|2,0,0]=3 2366 B10R0.6 CSCNC[C@@H](O)CC(=O)O 8a6322b9af45b16f1d1046e12b2ef258 [0,1,0,0,0,0|2,0,0]=3 2367 B10R0.6 CSCNC[C@H](O)CC(=O)O 07989b96aa7c9e9593b7783798d8142b [0,1,0,0,0,0|2,0,0]=3 2368 B10R0.6 C[C@@H](CC(=O)O)NCCC#N d7e99f047f23d977ff4f74c293397c67 [0,1,0,0,0,0|2,0,1]=4 2369 B10R0.6 C[C@@H](CC(=O)O)NCCC=O fe38538e0cded8bbd518e970d55ec9c1 [0,1,0,0,0,0|2,0,1]=4 2370 B10R0.6 C[C@@H](CC(=O)O)NCCCF 2ca098fb78cd2275fa7827d7cbdf3415 [0,1,0,0,0,0|2,0,0]=3 2371 B10R0.6 C[C@@H](CC(=O)O)NCCCO 4f7d2323e51c64e7b3da81c1325bd272 [0,1,0,0,0,0|2,0,0]=3 2372 B10R0.6 C[C@@H](CC(=O)O)NCCCS c0b7b18a9f2f6f4fb31696c0a9a0e6ad [0,1,0,0,0,0|2,0,0]=3 2373 B10R0.6 C[C@@H](CC(=O)O)OCCC#N 40666272cfd0cd40815cc413f23ac554 [0,1,0,0,0,0|2,0,1]=4 2374 B10R0.6 C[C@@H](CC(=O)O)OCCC=O f84c5dc5c9625a08f22c8f4e124b9a15 [0,1,0,0,0,0|2,0,1]=4 2375 B10R0.6 C[C@@H](CC(=O)O)OCCCF 297974c6df83de99f3f79860b8b4a3e1 [0,1,0,0,0,0|2,0,0]=3 2376 B10R0.6 C[C@H](CC(=O)O)NCCC#N fda01eccf1739da88590b89fbaf1a1f4 [0,1,0,0,0,0|2,0,1]=4 2377 B10R0.6 C[C@H](CC(=O)O)NCCC=O 0217a443ba0db62aa4954755ad76ffe9 [0,1,0,0,0,0|2,0,1]=4 2378 B10R0.6 C[C@H](CC(=O)O)NCCCF 3c8264645396c7dac6d62f574c537790 [0,1,0,0,0,0|2,0,0]=3 2379 B10R0.6 C[C@H](CC(=O)O)NCCCO d5235cc6cbd5c6266ff267f459ee7d56 [0,1,0,0,0,0|2,0,0]=3 2380 B10R0.6 C[C@H](CC(=O)O)NCCCS c1fa447b2542b4a01d1b7547d6ab83e2 [0,1,0,0,0,0|2,0,0]=3 2381 B10R0.6 C[C@H](CC(=O)O)OCCC#N 7146d27be0b1e2102eb1bc8f100f0802 [0,1,0,0,0,0|2,0,1]=4 2382 B10R0.6 C[C@H](CC(=O)O)OCCC=O 026cc32e3847adfbfcdfa98c51e3e588 [0,1,0,0,0,0|2,0,1]=4 2383 B10R0.6 C[C@H](CC(=O)O)OCCCF 0f9befde539df2dd0e50e0d7ee8de3ef [0,1,0,0,0,0|2,0,0]=3 2384 B10R0.6 N#CCNCC(O)CC(=O)O 9d6f0f11eb7cf4cc5b745671141cea1c [0,1,0,0,0,0|2,0,1]=4 2385 B10R0.6 N#CCNC[C@@H](O)CC(=O)O c03b1ffdfcda31fa82b7ceb07b2fe6d8 [0,1,0,0,0,0|2,0,1]=4 2386 B10R0.6 N#CCNC[C@H](O)CC(=O)O a3a45ee211c3f83108657d3509f19a64 [0,1,0,0,0,0|2,0,1]=4 2387 B10R0.6 O=C(O)CC(=O)CNCCBr 82e0e668c384b170aed0dbb4e34bd4ba [0,1,0,0,0,0|2,0,1]=4 2388 B10R0.6 O=C(O)CC(=O)CNCCF caa739aa966fcc3f52f858de553c04bd [0,1,0,0,0,0|2,0,1]=4 2389 B10R0.6 O=C(O)CC(=O)CNCCI cf7bae5a88ee79306dad6b77fc09e0f1 [0,1,0,0,0,0|2,0,1]=4 2390 B10R0.6 O=C(O)CC(=O)CNCCO 6ae5f72703702de5adde9546d1103b20 [0,1,0,0,0,0|2,0,1]=4 2391 B10R0.6 O=C(O)CC(=O)CNCCS e4245758e82e3340c8a8b2d9fb429ee2 [0,1,0,0,0,0|2,0,1]=4 2392 B10R0.6 O=C(O)CC(=O)COCCS aac2e300cf5e1a95070774a41d84a7f5 [0,1,0,0,0,0|2,0,1]=4 2393 B10R0.6 O=C(O)CC(O)CNCCF 235c7530a8bc54bb754c11b61ddcc9c9 [0,1,0,0,0,0|2,0,0]=3 2394 B10R0.6 O=C(O)CC(O)CNCCO 54a93ac68f41814121d48df912e6e308 [0,1,0,0,0,0|2,0,0]=3 2395 B10R0.6 O=C(O)CC(O)CNCCS b1f75523342b993ab533679a9f7f10b8 [0,1,0,0,0,0|2,0,0]=3 2396 B10R0.6 O=C(O)C[C@@H](O)CNCCF e1c514b36fac8d5549f3d3acfc581185 [0,1,0,0,0,0|2,0,0]=3 2397 B10R0.6 O=C(O)C[C@@H](O)CNCCO 5f96c5bff751fa3c7bab8d9e7fa0f59a [0,1,0,0,0,0|2,0,0]=3 2398 B10R0.6 O=C(O)C[C@@H](O)CNCCS 208b7a9b5aa60cc05fa44a5137166276 [0,1,0,0,0,0|2,0,0]=3 2399 B10R0.6 O=C(O)C[C@H](O)CNCCF fc75303fe8c7f28afc8eab3286c2ff69 [0,1,0,0,0,0|2,0,0]=3 2400 B10R0.6 O=C(O)C[C@H](O)CNCCO 508d545b7df3d13b4296823ffc196b15 [0,1,0,0,0,0|2,0,0]=3 2401 B10R0.6 O=C(O)C[C@H](O)CNCCS 005168e84f2f8fefcc51db8efa932c44 [0,1,0,0,0,0|2,0,0]=3 2402 B10R0.6 O=CCNCC(O)CC(=O)O 6070832e59ee18684b70841f45098cd3 [0,1,0,0,0,0|2,0,1]=4 2403 B10R0.6 O=CCNC[C@@H](O)CC(=O)O e3a83ec84e1a6fff2cd7a72a11a93bab [0,1,0,0,0,0|2,0,1]=4 2404 B10R0.6 O=CCNC[C@H](O)CC(=O)O d4ee3cf2c58dfa9825eb65ae01e726e4 [0,1,0,0,0,0|2,0,1]=4 2405 B10R0.22 CCCCCNCC(C)(C)O ae94554c022fd64cb28e25b38aad49ef [0,1,0,0,0,0|2,0,1]=4 2406 B10R0.22 CCCCCNCS(=O)(=O)C a58d1d8468fdec4c158a8f8db10d47d7 [0,1,0,0,0,0|2,0,1]=4 2407 B10R0.22 CCCCCNCS(=O)(=O)O c21120f6eb43d826bbb53ef10a2854ff [0,1,0,0,0,0|2,0,0]=3 2408 B10R0.22 CCCCCOCC(C)(C)O 956f995c6f1d387ad17dbba4b5f8e90e [0,1,0,0,0,0|2,0,1]=4 2409 B10R0.22 CCCCCOCS(=O)(=O)C 42e3f1de9aa47a4467af87ed7e197c21 [0,1,0,0,0,0|2,0,1]=4 2410 B10R0.22 CCCCNCCC(C)(C)O f6662fa2ef50877aaf425a71e1319028 [0,1,0,0,0,0|2,0,1]=4 2411 B10R0.22 CCCCNCCS(=O)(=O)C 46229fbaef8b7786db995aaff07fc9e4 [0,1,0,0,0,0|2,0,1]=4 2412 B10R0.22 CCCCNCCS(=O)(=O)N 911a1ebd1a4784ecbdd7bb2f05d0cc66 [0,1,0,0,0,0|2,0,1]=4 2413 B10R0.22 CCCCNCCS(=O)(=O)O 03e92a563b8f96b8167e6bb695222e66 [0,1,0,0,0,0|2,0,0]=3 2414 B10R0.22 CCCCOCCC(C)(C)O 8a996f4b5951e279667e40071f0a4e68 [0,1,0,0,0,0|2,0,1]=4 2415 B10R0.22 CCCCOCCS(=N)(=O)C 014cc0fd4592c531b51b853b936ef2e8 [0,1,0,0,0,0|3,0,0]=4 2416 B10R0.22 CCCCOCCS(=O)(=O)C 3d678b0b901e28dd272db304da1b5508 [0,1,0,0,0,0|2,0,1]=4 2417 B10R0.22 CCCCOCCS(=O)(=O)N 5f6d082481e4822caa665682d364c245 [0,1,0,0,0,0|2,0,1]=4 2418 B10R0.22 CCCCOCCS(=O)(=O)O bb963e223108a9df583b4d995a37e21a [0,1,0,0,0,0|2,0,0]=3 2419 B10R0.22 CCCNCCCC(C)(C)O 61651489957c568eec9c91fe7dc9a238 [0,1,0,0,0,0|2,0,1]=4 2420 B10R0.22 CCCNCCCS(=O)(=O)C 3407de644a39157ad4d93d54631ee100 [0,1,0,0,0,0|2,0,1]=4 2421 B10R0.22 CCCNCCCS(=O)(=O)N bd9bf261adb8163103575aef2e33007e [0,1,0,0,0,0|2,0,1]=4 2422 B10R0.22 CCCNCCCS(=O)(=O)O 24acc1a1a42d884d292692e7b07d99c3 [0,1,0,0,0,0|2,0,0]=3 2423 B10R0.22 CCCNCCOS(=O)(=O)O 8b1a6269afcb5dbe0d9d7df96d5a60ff [0,1,0,0,0,0|3,0,0]=4 2424 B10R0.22 CCCOCCCC(C)(C)O 2b98d0ef5702340b2a272ca19269d4f3 [0,1,0,0,0,0|2,0,1]=4 2425 B10R0.22 CCCOCCCS(=O)(=O)C d044a7e0cf5b0bc808770a1107b6dd88 [0,1,0,0,0,0|2,0,1]=4 2426 B10R0.22 CCCOCCCS(=O)(=O)N 3a90743973d0d2c37d91d0b9291dc557 [0,1,0,0,0,0|2,0,1]=4 2427 B10R0.22 CCCOCCCS(=O)(=O)O 095be99f10f30a88ffecce12bbf5edb4 [0,1,0,0,0,0|2,0,0]=3 2428 B10R0.22 CCOCCCCS(=O)(=O)C 73b845867ffbf38b0766b069305d8640 [0,1,0,0,0,0|2,0,1]=4 2429 B10R0.22 CCOCCCCS(=O)(=O)O d081480578c7921f135f6c14ee1e1e74 [0,1,0,0,0,0|2,0,0]=3 2430 B10R0.22 CCOCCCNS(=O)(=O)O d928f37010faa909f545db992d7c7263 [0,1,0,0,0,0|3,0,0]=4 2431 B10R0.22 CCOCCNCS(=O)(=O)O 3386ff3099f753e43d698bf5b3bb6e29 [0,1,0,0,0,0|3,0,0]=4 2432 B10R0.22 CCOCNCCS(=O)(=O)O 5190dafeaca770823c26f27aaa80e8a2 [0,1,0,0,0,0|3,0,0]=4 2433 B10R0.22 CCOCOCCS(=O)(=O)O 49e0fde5f666563acbf883887b2fa89a [0,1,0,0,0,0|3,0,0]=4 2434 B10R0.22 CCSCCNCS(=O)(=O)O 97a43c7a7e798cf9728a6f41d1becbab [0,1,0,0,0,0|3,0,0]=4 2435 B10R0.22 COCCCNCS(=O)(=O)O 81d4d4fcc2a4098486294c8e60193d08 [0,1,0,0,0,0|3,0,0]=4 2436 B10R0.22 COCCCOCS(=O)(=O)O 329168af34cde097a0fd34bf1607f465 [0,1,0,0,0,0|3,0,0]=4 2437 B10R0.22 COCCNCCS(=O)(=O)O 403e3490d0c9627d7eecdd9ba84fcd06 [0,1,0,0,0,0|3,0,0]=4 2438 B10R0.22 COCCOCCS(=O)(=O)O 9458fad41cf1deb0b94d8d14f3460988 [0,1,0,0,0,0|3,0,0]=4 2439 B10R0.22 COCNCCCS(=O)(=O)O a64f1c7edbb09ecd5961db82a9c79bd2 [0,1,0,0,0,0|3,0,0]=4 2440 B10R0.22 COCOCCCS(=O)(=O)O 79f4bffd875667b98ea5d02a74d1ef4d [0,1,0,0,0,0|3,0,0]=4 2441 B10R0.22 CSCCCNCS(=O)(=O)O 8d26828fe8c5a5762538fc911c714071 [0,1,0,0,0,0|3,0,0]=4 2442 B10R0.22 CSCCCOCS(=O)(=O)O d31b41b392fee65a786a188094389ead [0,1,0,0,0,0|3,0,0]=4 2443 B10R0.22 CSCCNCCS(=O)(=O)O beb933931caf67e4a7e6d9796d2ab4ed [0,1,0,0,0,0|3,0,0]=4 2444 B10R0.22 CSCCOCCS(=O)(=O)O 4e82dc572c431d23c695ce593c7f276a [0,1,0,0,0,0|3,0,0]=4 2445 B10R0.22 CSCNCCCS(=O)(=O)O 9f0b1d1dbd0ce1a8bec0eea7c6364413 [0,1,0,0,0,0|3,0,0]=4 2446 B10R0.22 CSCOCCCS(=O)(=O)O 9389be3a4343a6bc40c1eeae06fc920c [0,1,0,0,0,0|3,0,0]=4 2447 B10R0.22 O=S(=O)(O)CCCCOCF fa0f1dedcfaa79d96f1cc183c379e294 [0,1,0,0,0,0|3,0,0]=4 2448 B10R0.22 O=S(=O)(O)CCCNCCBr 0c87d5cc9b1ae41a1e4d018a3ece62d7 [0,1,0,0,0,0|3,0,0]=4 2449 B10R0.22 O=S(=O)(O)CCCNCCF 2acbdf4b3159aa91941c92ef26897686 [0,1,0,0,0,0|3,0,0]=4 2450 B10R0.22 O=S(=O)(O)CCCNCCI 9ef059d342919b03efa9aeb1d05fe129 [0,1,0,0,0,0|3,0,0]=4 2451 B10R0.22 O=S(=O)(O)CCCNCCO 6e64ff7979be9d29d0dd6135aa56ea6d [0,1,0,0,0,0|3,0,0]=4 2452 B10R0.22 O=S(=O)(O)CCCNCCS ab4401b52fc505d0000acaae5bf31149 [0,1,0,0,0,0|3,0,0]=4 2453 B10R0.22 O=S(=O)(O)CCCOCCF 0b51e1762a3ce9256d132484ec7e2ecb [0,1,0,0,0,0|3,0,0]=4 2454 B10R0.22 O=S(=O)(O)CCCOCCS 6e5536b2f0cd2927511442ba32dee784 [0,1,0,0,0,0|3,0,0]=4 2455 B10R0.22 O=S(=O)(O)CCNCCCCl f0ad126893208e8162258308956ab96c [0,1,0,0,0,0|3,0,0]=4 2456 B10R0.22 O=S(=O)(O)CCNCCCF 13229969401a363a21df930772da16aa [0,1,0,0,0,0|3,0,0]=4 2457 B10R0.22 O=S(=O)(O)CCNCCCO 80dbc118a61352e1d511cbcee7629790 [0,1,0,0,0,0|3,0,0]=4 2458 B10R0.22 O=S(=O)(O)CCNCCCS d1758021afc0ed0d72c0acebf6f3f2fa [0,1,0,0,0,0|3,0,0]=4 2459 B10R0.22 O=S(=O)(O)CCOCCCF 8334078279933bb74f8cda5b38f266e9 [0,1,0,0,0,0|3,0,0]=4 2460 B10R0.22 O=S(=O)(O)CCOCCCS eade5e9665712c5d6b4383842cbcca88 [0,1,0,0,0,0|3,0,0]=4 2461 B10R0.22 O=S(=O)(O)CNCCCCCl 9e1fe09db5c1c1c5d378ee3163b8d3cf [0,1,0,0,0,0|3,0,0]=4 2462 B10R0.22 O=S(=O)(O)CNCCCCF a9680bb56c58b84e099bf6f84920a5ab [0,1,0,0,0,0|3,0,0]=4 2463 B10R0.22 O=S(=O)(O)CNCCCCO 3d5863205bde3ca180455c427318d100 [0,1,0,0,0,0|3,0,0]=4 2464 B10R0.22 O=S(=O)(O)CNCCCCS d927a2304b622c8b65e59287248632e1 [0,1,0,0,0,0|3,0,0]=4 2465 B10R0.22 O=S(=O)(O)COCCCCF a4dce12f099c394ec5eeb19aca9c923b [0,1,0,0,0,0|3,0,0]=4 2466 B10R0.55 C#CC(C)NCCCC(=O)O 167ffa05deec1bb1fa794390ae9af139 [0,1,0,0,0,0|1,0,2]=4 2467 B10R0.55 C#C[C@@H](C)NCCCC(=O)O fdb6cc87b86c7b823356fbf7b095e92b [0,1,0,0,0,0|1,0,2]=4 2468 B10R0.55 C#C[C@H](C)NCCCC(=O)O 197a6c97bec9ee2482c4aca0cc2777eb [0,1,0,0,0,0|1,0,2]=4 2469 B10R0.55 C=C(Br)CCOCC(C)CC 13a381ac0f040fa33ac24f90d37cf04b [0,1,0,0,0,0|3,0,0]=4 2470 B10R0.55 C=C(Br)CCOC[C@@H](C)CC 47be077d8b18a2b09befe015416f5cf8 [0,1,0,0,0,0|3,0,0]=4 2471 B10R0.55 C=C(Br)CCOC[C@H](C)CC c4a7d146056be9a7589a00f44417a914 [0,1,0,0,0,0|3,0,0]=4 2472 B10R0.55 C=C(Br)CNCCC(C)CC 268f37880f760c94d8527f66bf8936a1 [0,1,0,0,0,0|3,0,0]=4 2473 B10R0.55 C=C(Br)COCCC(C)CC 79206851460d29914bcb4f32eb37c8b5 [0,1,0,0,0,0|3,0,0]=4 2474 B10R0.55 C=C(Br)COCCC(S)CC f53617d86d3c1cccf6d8d9f66c7cdefe [0,1,0,0,0,0|3,0,0]=4 2475 B10R0.55 C=C(Br)COCC[C@@H](C)CC 8d1e3436f8d8649ca2a94e16a14c4996 [0,1,0,0,0,0|3,0,0]=4 2476 B10R0.55 C=C(C)CCCNC(C)CC d2cf1fbf9a150b471468e5ac6d9bda4f [0,1,0,0,0,0|3,0,0]=4 2477 B10R0.55 C=C(C)CCCN[C@@H](C)CC 38cd2d1aaef2946b71b290bd628113b9 [0,1,0,0,0,0|3,0,0]=4 2478 B10R0.55 C=C(C)CCCN[C@H](C)CC f2c8904eb82b93c95f6d02b15a8c28b2 [0,1,0,0,0,0|3,0,0]=4 2479 B10R0.55 C=C(C)CCCOC(C)CC 7f4be0c3352b4483482cfad6306fe7ba [0,1,0,0,0,0|3,0,0]=4 2480 B10R0.55 C=C(C)CCCO[C@@H](C)CC a04a86085d89763e28d3528a2f3ee1f2 [0,1,0,0,0,0|3,0,0]=4 2481 B10R0.55 C=C(C)CCCO[C@H](C)CC f81b7d5dadd88320fc85eb916061c386 [0,1,0,0,0,0|3,0,0]=4 2482 B10R0.55 C=C(C)CCNCC(C)CC a7838dc4262e51c237273c0fccc5fdbb [0,1,0,0,0,0|3,0,0]=4 2483 B10R0.55 C=C(C)CCNCC(O)CC 5542e80acdf0c9997112eaecb1f6f065 [0,1,0,0,0,0|3,0,0]=4 2484 B10R0.55 C=C(C)CCNC[C@@H](C)CC e9840c0dc3de1969cd31ca3de12d8d51 [0,1,0,0,0,0|3,0,0]=4 2485 B10R0.55 C=C(C)CCNC[C@H](C)CC e229f4d286fe7624eca044e975afcbbb [0,1,0,0,0,0|3,0,0]=4 2486 B10R0.55 C=C(C)CCNC[C@H](O)CC 448977ae3fbfe570d0766463c3648bc6 [0,1,0,0,0,0|3,0,0]=4 2487 B10R0.55 C=C(C)CCOCC(C)CC e032c351af65786808f894807fc92d8a [0,1,0,0,0,0|3,0,0]=4 2488 B10R0.55 C=C(C)CCOC[C@@H](C)CC 4ab30b367c68db19f7861fd43857107e [0,1,0,0,0,0|3,0,0]=4 2489 B10R0.55 C=C(C)CCOC[C@H](C)CC bdc1b448e5535458ac0e6404b4af5519 [0,1,0,0,0,0|3,0,0]=4 2490 B10R0.55 C=C(C)CNCCC(C)CC 7ec6c7b918c334f1c606df014b2e5f1e [0,1,0,0,0,0|3,0,0]=4 2491 B10R0.55 C=C(C)COCCC(C)CC 889543ee475f0134dfb441cf0530d442 [0,1,0,0,0,0|3,0,0]=4 2492 B10R0.55 C=C(C)COCCC(S)CC c152980cd0987ecf3418b6defdb780e4 [0,1,0,0,0,0|3,0,0]=4 2493 B10R0.55 C=C(C)COCC[C@@H](C)CC 2efbec83099b7397b86ccf72cde1c1b6 [0,1,0,0,0,0|3,0,0]=4 2494 B10R0.55 C=C(CC)CNCCC(=O)N 725a4fa29c45f90b2d34f2cfd4b0f02b [0,1,0,0,0,0|2,0,1]=4 2495 B10R0.55 C=C(CC)CNCCC(=O)O 9bedd2930b2106d312bcc9649571a88f [0,1,0,0,0,0|1,0,1]=3 2496 B10R0.55 C=C(CC)CNCCS(=O)O f53de93ce60f2ac7dc6cb8b0dfa250d0 [0,1,0,0,0,0|2,0,1]=4 2497 B10R0.55 C=C(CC)COCCC(=O)C 46f20d1b170d3d2ab61ca48ff6bcbef9 [0,1,0,0,0,0|2,0,1]=4 2498 B10R0.55 C=C(CC)COCCC(=O)N 3634462004873747c6ecebe16d3d257c [0,1,0,0,0,0|2,0,1]=4 2499 B10R0.55 C=C(CC)COCCC(=O)O 675ce1c88ade5ae6200355b669fe1003 [0,1,0,0,0,0|1,0,1]=3 2500 B10R0.55 C=C(CNCCC(=O)O)OC f2083d22c8e4c89a13ea57ecdae0ead5 [0,1,0,0,0,0|2,0,1]=4 2501 B10R0.55 C=C(CO)CNCCC(=O)O aafd797161b7e6d91e9d759e8ce66ab9 [0,1,0,0,0,0|2,0,1]=4 2502 B10R0.55 C=C(COCCC(=O)O)OC 10bdea75df7376b7e566ff371eaa3729 [0,1,0,0,0,0|2,0,1]=4 2503 B10R0.55 C=C(Cl)CNCCC(C)CC b43e38dd8706f12b0b287c7521bfeee3 [0,1,0,0,0,0|3,0,0]=4 2504 B10R0.55 C=C(Cl)COCCC(C)CC c0894c8fea44db238530de6d1f8b30ab [0,1,0,0,0,0|3,0,0]=4 2505 B10R0.55 C=C(Cl)COCCC(S)CC 2eb386360b681c1c80278fd3b470d9f4 [0,1,0,0,0,0|3,0,0]=4 2506 B10R0.55 C=C(Cl)COCC[C@@H](C)CC b2ecb1df48fb27dddb57ab16227e6792 [0,1,0,0,0,0|3,0,0]=4 2507 B10R0.55 C=C(F)COCCC(C)CC 9311e543050d5cfa77a0bc4fad2b7161 [0,1,0,0,0,0|3,0,0]=4 2508 B10R0.55 C=C(F)COCCC(S)CC 78685bbb686a7956a03313e39ac317d2 [0,1,0,0,0,0|3,0,0]=4 2509 B10R0.55 C=C(F)COCC[C@@H](C)CC da8201d8fe195eca91ed08733cc59287 [0,1,0,0,0,0|3,0,0]=4 2510 B10R0.55 C=C(I)COCCC(C)CC 76d37142fb1a06b023fd5b3e713afc0e [0,1,0,0,0,0|3,0,0]=4 2511 B10R0.55 C=CC(C)COCCC(=O)O d46650cad160bd586654300d8048a2ce [0,1,0,0,0,0|1,0,2]=4 2512 B10R0.55 C=CC(C)NCCCC(=O)O b5c8616afa95eeb22d5f8744a0b345fe [0,1,0,0,0,0|1,0,2]=4 2513 B10R0.55 C=CC(C)OCCCC(=O)O 50e7c4c22786df186650c13d2dec5080 [0,1,0,0,0,0|1,0,2]=4 2514 B10R0.55 C=CC(O)CNCCC(=O)O 3a78963f4f5c92a47b436a0a0df20980 [0,1,0,0,0,0|1,0,2]=4 2515 B10R0.55 C=C[C@H](C)OCCCC(=O)O b6ba2c80bde765d226c9c5305595ef4d [0,1,0,0,0,0|1,0,2]=4 2516 B10R0.55 CC(=O)CCCNC(C)CO ea889046ee5a273d09d04d1364234b9e [0,1,0,0,0,0|3,0,0]=4 2517 B10R0.55 CC(=O)CCCN[C@@H](C)CO 8b758a4ca0c53217901538d70f8b2cb5 [0,1,0,0,0,0|3,0,0]=4 2518 B10R0.55 CC(=O)CCCN[C@H](C)CO b1a258654729a062031fad1d18dac4b9 [0,1,0,0,0,0|3,0,0]=4 2519 B10R0.55 CC(=O)CCCOC(C)CF eb7c4ba12912be78c6ea982aa307bc82 [0,1,0,0,0,0|3,0,0]=4 2520 B10R0.55 CC(=O)CCCOC(C)CS ffde26bebeb4c3ca2495c4edd3d3bd9c [0,1,0,0,0,0|3,0,0]=4 2521 B10R0.55 CC(=O)CCCO[C@H](C)CS 2d98709e7cdd01f033ca176c8f28ddc3 [0,1,0,0,0,0|3,0,0]=4 2522 B10R0.55 CC(=O)CCNCC(Br)CBr dbc91e38506cd8ba96ef512d87f20c46 [0,1,0,0,0,0|3,0,0]=4 2523 B10R0.55 CC(=O)CCNCC(C)CO c542186ac07bbd5358eaefc197c95197 [0,1,0,0,0,0|3,0,0]=4 2524 B10R0.55 CC(=O)CCNCC(F)CO 82c9ba6364a8f7e1e4ff1975c6a5635d [0,1,0,0,0,0|3,0,0]=4 2525 B10R0.55 CC(=O)CCNCC(O)CO 5717a359ebb70f0df3f18ebe5337a621 [0,1,0,0,0,0|3,0,0]=4 2526 B10R0.55 CC(=O)CCNC[C@@H](F)CO f78b4c0a136018711fa34d6d6ee7ac7a [0,1,0,0,0,0|3,0,0]=4 2527 B10R0.55 CC(=O)CCNC[C@@H](O)CO d15108db99c620031a44288a0c58b285 [0,1,0,0,0,0|3,0,0]=4 2528 B10R0.55 CC(=O)CCNC[C@H](C)CO 00b5e2120ecaf17d67d7f0e86a52e70e [0,1,0,0,0,0|3,0,0]=4 2529 B10R0.55 CC(=O)CCNC[C@H](F)CO df29f4fe56b7186fc8c1813418d4593c [0,1,0,0,0,0|3,0,0]=4 2530 B10R0.55 CC(=O)CCNC[C@H](O)CO 3ff6c59b72e05e13b2901c888ef7c6a4 [0,1,0,0,0,0|3,0,0]=4 2531 B10R0.55 CC(=O)CCOCC(Br)CBr 0930a095bcfb175b6fdc7ec417f6c346 [0,1,0,0,0,0|3,0,0]=4 2532 B10R0.55 CC(=O)CCOCC(Cl)CCl 80d6d2a05a11780542e3a8782684d2ff [0,1,0,0,0,0|3,0,0]=4 2533 B10R0.55 CC(=O)CCOCC(O)CO d1be95e895c7dc3316c70c421d155f6e [0,1,0,0,0,0|3,0,0]=4 2534 B10R0.55 CC(=O)CCOCC(S)CS dc10b927d17b2d259f6e77a43d7d3d66 [0,1,0,0,0,0|3,0,0]=4 2535 B10R0.55 CC(=O)CCOC[C@@H](O)CO c471d52ab50a761128d9cba42450fe09 [0,1,0,0,0,0|3,0,0]=4 2536 B10R0.55 CC(=O)CCOC[C@H](O)CO 4b323f560614c14ebca0c8dbe46b3825 [0,1,0,0,0,0|3,0,0]=4 2537 B10R0.55 CC(=O)CNCCC(C)CO a1f63052814825ed22abdb49d8efcee9 [0,1,0,0,0,0|3,0,0]=4 2538 B10R0.55 CC(=O)NCCCC(C)CO a0106834f1a67984389e9d8a0e2490c2 [0,1,0,0,0,0|3,0,0]=4 2539 B10R0.55 CC(C#N)CNCCC(=O)O 32dda1987ef25994ec1fc05d97f8d33d [0,1,0,0,0,0|2,0,1]=4 2540 B10R0.55 CC(C#N)COCCC(=O)O bd85a0de2a06b2f4835c0d78bdd0d9f8 [0,1,0,0,0,0|2,0,1]=4 2541 B10R0.55 CC(C#N)NCCCC(=O)O eb3c341416a24397435e444226f35ba6 [0,1,0,0,0,0|2,0,1]=4 2542 B10R0.55 CC(C=O)NCCCC(=O)O 550f679a871f09ec8d9b314af632f9a0 [0,1,0,0,0,0|2,0,1]=4 2543 B10R0.55 CC(C=O)OCCCC(=O)O 0e120f8f4df86f39d3edb73bad31e59a [0,1,0,0,0,0|2,0,1]=4 2544 B10R0.55 CC(CF)OCCCC(=O)N 97b584d2266b8da516da92ded2d515a9 [0,1,0,0,0,0|3,0,0]=4 2545 B10R0.55 CC(CO)CCNCC(=O)N bf4dce8f68a77bf7a441f15f165fe8f7 [0,1,0,0,0,0|3,0,0]=4 2546 B10R0.55 CC(CO)CCNCC(=O)O 76e53dc0e47802591bb76501244ac685 [0,1,0,0,0,0|2,0,0]=3 2547 B10R0.55 CC(CO)CNCCC(=O)N 99055932d04569d73f0e9823ff4ee9ef [0,1,0,0,0,0|3,0,0]=4 2548 B10R0.55 CC(CO)CNCCC(=O)O 5085cc4be8266e6fe5f0cb1a569ca82e [0,1,0,0,0,0|2,0,0]=3 2549 B10R0.55 CC(CO)CNCCS(=O)O 4381053dcbf7f5fca0b91660efa4f046 [0,1,0,0,0,0|3,0,0]=4 2550 B10R0.55 CC(CO)NCCCC(=O)N 7b1ef5794e4df9cc937b2267fffd0122 [0,1,0,0,0,0|3,0,0]=4 2551 B10R0.55 CC(CO)NCCCC(=O)O 7a30d88fa83254cfe874b379cac2e896 [0,1,0,0,0,0|2,0,0]=3 2552 B10R0.55 CC(CS)OCCCC(=O)N 3f2b3f8b998b95ff2c3c0abb66615a40 [0,1,0,0,0,0|3,0,0]=4 2553 B10R0.55 CCC(=O)CNCCC(=O)N 8ccd013a4089e6a6d9310aa7916ede5f [0,1,0,0,0,0|2,0,1]=4 2554 B10R0.55 CCC(=O)CNCCC(=O)O ea608513f4348342b13180a744b39911 [0,1,0,0,0,0|1,0,1]=3 2555 B10R0.55 CCC(=O)CNCCS(=O)O 7281cee117a83b705d62c41f8c714a0e [0,1,0,0,0,0|2,0,1]=4 2556 B10R0.55 CCC(=O)COCCC(=O)C e1b28ea3ec38b22bbc2f0f064441a402 [0,1,0,0,0,0|2,0,1]=4 2557 B10R0.55 CCC(=O)COCCC(=O)N 8d6d2ea7affdc676c07f2e72f1c7a723 [0,1,0,0,0,0|2,0,1]=4 2558 B10R0.55 CCC(=O)COCCC(=O)O bfd407ced0e0b48f6e4840b07141357b [0,1,0,0,0,0|1,0,1]=3 2559 B10R0.55 CCC(=O)NCCCC(=O)N 5cd48f928ba847178ea9114a7375a348 [0,1,0,0,0,0|2,0,1]=4 2560 B10R0.55 CCC(=O)OCOCC(=O)O fb832441c955612d9b0dc1e5d69715ae [0,1,0,0,0,0|2,0,1]=4 2561 B10R0.55 CCC(C)CCNCC(=O)C facdc2ba8c1df1c3d1ed979ce1e598a9 [0,1,0,0,0,0|2,0,0]=3 2562 B10R0.55 CCC(C)CCNCC(=O)N 5e171110451912bb3e00b784eb9b4a00 [0,1,0,0,0,0|2,0,0]=3 2563 B10R0.55 CCC(C)CCNCC(=O)O c0874586a90d929f810e9434f0871a82 [0,1,0,0,0,0|1,0,0]=2 2564 B10R0.55 CCC(C)CCNCC(C)O e24c854cb458b04c812ca158a773c41c [0,1,0,0,0,0|2,0,1]=4 2565 B10R0.55 CCC(C)CCNC[C@@H](C)O e80bb5d350541c1e7e384b7628b349bf [0,1,0,0,0,0|2,0,1]=4 2566 B10R0.55 CCC(C)CCNC[C@H](C)O 7efb6f5f481e0d75fda8e84ca7f53a97 [0,1,0,0,0,0|2,0,1]=4 2567 B10R0.55 CCC(C)CCNC[N+](=O)[O-] b4b052f1a16743308b8e2becf6f17172 [0,1,0,0,0,0|2,0,1]=4 2568 B10R0.55 CCC(C)CCOCC(=O)C 979c0077b343550b911854fe59bc8f4c [0,1,0,0,0,0|2,0,0]=3 2569 B10R0.55 CCC(C)CCOCC(=O)N 0d1a1fff7700b9c53ef8784518184cd4 [0,1,0,0,0,0|2,0,0]=3 2570 B10R0.55 CCC(C)CCOCC(=O)O 7117a92df12d1ec50f15d4a89cc4ac88 [0,1,0,0,0,0|1,0,0]=2 2571 B10R0.55 CCC(C)CCOCC(=S)N 4a803c815c02ad4eada959e565d51bfd [0,1,0,0,0,0|2,1,0]=4 2572 B10R0.55 CCC(C)CCOCS(=O)O 19d775bd40f1706177c144548df35ad5 [0,1,0,0,0,0|2,0,0]=3 2573 B10R0.55 CCC(C)CCOC[N+](=O)[O-] e0140b67e7d9ed6966d57dd39ed6b383 [0,1,0,0,0,0|2,0,1]=4 2574 B10R0.55 CCC(C)CNCCC(=O)C 43281913af07e8c622019089c1c6dc8b [0,1,0,0,0,0|2,0,0]=3 2575 B10R0.55 CCC(C)CNCCC(=O)N bb5f36b76069c16b2929bd393da10a15 [0,1,0,0,0,0|2,0,0]=3 2576 B10R0.55 CCC(C)CNCCC(=O)O 59b5d5020b32cc2e945dd8bd129e7849 [0,1,0,0,0,0|1,0,0]=2 2577 B10R0.55 CCC(C)CNCCC(=S)N 4f5d99a73a6743762f4ae90bae333856 [0,1,0,0,0,0|2,1,0]=4 2578 B10R0.55 CCC(C)CNCCC(C)O fd751d4c209fb7995cf70086727902ee [0,1,0,0,0,0|2,0,1]=4 2579 B10R0.55 CCC(C)CNCCS(=O)C a7d970d277d4d2e0fdf887b055bac793 [0,1,0,0,0,0|3,0,0]=4 2580 B10R0.55 CCC(C)CNCCS(=O)O e6ecbd4d90df74e7d6ffb0f469601469 [0,1,0,0,0,0|2,0,0]=3 2581 B10R0.55 CCC(C)CNCC[C@@H](C)O 365a7a64bbfd74038cea08e5358bf76e [0,1,0,0,0,0|2,0,1]=4 2582 B10R0.55 CCC(C)CNCC[C@H](C)O 3f4c9969c83839ab8f77f9498710cf32 [0,1,0,0,0,0|2,0,1]=4 2583 B10R0.55 CCC(C)CNCOC(=O)C 45b27ed1b3fa5773a89cd025069c928a [0,1,0,0,0,0|3,0,0]=4 2584 B10R0.55 CCC(C)CNCSC(=O)N 0a75d309aa0958cd8ad31fac7380653e [0,1,0,0,0,0|3,0,0]=4 2585 B10R0.55 CCC(C)COCCC(=O)C de9221c15942e708a23bb59d59581498 [0,1,0,0,0,0|2,0,0]=3 2586 B10R0.55 CCC(C)COCCC(=O)N f3f5c002ccebc7b19a107405ad09e155 [0,1,0,0,0,0|2,0,0]=3 2587 B10R0.55 CCC(C)COCCC(=O)O efb34b64423e58caf238b1d103aacee4 [0,1,0,0,0,0|1,0,0]=2 2588 B10R0.55 CCC(C)COCCS(=O)C c68ab732ebd738c6a155b3b078cb5164 [0,1,0,0,0,0|3,0,0]=4 2589 B10R0.55 CCC(C)COCC[N+](=O)[O-] 7ba429dadcd86f561ba80fce3709fe84 [0,1,0,0,0,0|2,0,1]=4 2590 B10R0.55 CCC(C)COCNC(=O)C 1c113be68ac9325e5bbedd7dcebd141d [0,1,0,0,0,0|3,0,0]=4 2591 B10R0.55 CCC(C)COCNC(=O)N 2f7027d5d4a17dec72914dfb1f5d5b37 [0,1,0,0,0,0|3,0,0]=4 2592 B10R0.55 CCC(C)COCOC(=O)C 3f0c9c3055dec418254e7f92060d6183 [0,1,0,0,0,0|3,0,0]=4 2593 B10R0.55 CCC(C)COCSC(=O)N 625fd312f7d5093626e4a7648c1bef39 [0,1,0,0,0,0|3,0,0]=4 2594 B10R0.55 CCC(C)NC/C=C/C(=O)O 3d945143c4cab75950c671275c114ce7 [0,1,0,0,0,0|1,0,2]=4 2595 B10R0.55 CCC(C)NCC#CC(=O)O 6454a18584ab4c1fdf30150251021a6f [0,1,0,0,0,0|1,0,2]=4 2596 B10R0.55 CCC(C)NCC=CC(=O)O 69b50bfc056170b04e8a5a2e45347e2a [0,1,0,0,0,0|1,0,2]=4 2597 B10R0.55 CCC(C)NCCCC(=O)C eb226980a2ae5298d86add78ffe5955b [0,1,0,0,0,0|2,0,0]=3 2598 B10R0.55 CCC(C)NCCCC(=O)N 7577bc2dd7012c7abc8f7e4eb8f28bee [0,1,0,0,0,0|2,0,0]=3 2599 B10R0.55 CCC(C)NCCCC(=O)O 64a52db70ffa28e8d94ac0fb7ba9bff0 [0,1,0,0,0,0|1,0,0]=2 2600 B10R0.55 CCC(C)NCCCC(C)O 003a39d9b5f58fa1434940174955506d [0,1,0,0,0,0|2,0,1]=4 2601 B10R0.55 CCC(C)NCCCS(=O)C abe0d86572177fbd30e2e12b49ece203 [0,1,0,0,0,0|3,0,0]=4 2602 B10R0.55 CCC(C)NCCC[N+](=O)[O-] 7a0b841daced696916a5f47faaa0b9cc [0,1,0,0,0,0|2,0,1]=4 2603 B10R0.55 CCC(C)NCCNC(=O)C 11b7c5b98a01e1f5f36028160259d742 [0,1,0,0,0,0|3,0,0]=4 2604 B10R0.55 CCC(C)NCCNC(=O)N b44d1d51721e15443ddb44569a723af6 [0,1,0,0,0,0|3,0,0]=4 2605 B10R0.55 CCC(C)NCCOC(=O)C f1a2686fea282499245bdc84dc2245d2 [0,1,0,0,0,0|3,0,0]=4 2606 B10R0.55 CCC(C)NCCSC(=O)C ff9dc3ba3727028259d899ae6074d0df [0,1,0,0,0,0|3,0,0]=4 2607 B10R0.55 CCC(C)OC/C=C/C(=O)O 2c6decb2bc694310f689f26106a87e9f [0,1,0,0,0,0|1,0,2]=4 2608 B10R0.55 CCC(C)OCC#CC(=O)O dcf8b23ccb13989fc5cf43562aa47fa9 [0,1,0,0,0,0|1,0,2]=4 2609 B10R0.55 CCC(C)OCC=CC(=O)O 681401e661bc18a6e94e20d0dfa8e2e5 [0,1,0,0,0,0|1,0,2]=4 2610 B10R0.55 CCC(C)OCCCC(=O)C ecf55f07267ddf03dbea6bfb35b1f5f4 [0,1,0,0,0,0|2,0,0]=3 2611 B10R0.55 CCC(C)OCCCC(=O)N c59395cc4b6c2ba927fda7a57a7597e7 [0,1,0,0,0,0|2,0,0]=3 2612 B10R0.55 CCC(C)OCCC[N+](=O)[O-] a4d5f83b1b277115688974b465f62e3d [0,1,0,0,0,0|2,0,1]=4 2613 B10R0.55 CCC(C)OCCNC(=O)C 0326038e2594c5c129309147bc96743b [0,1,0,0,0,0|3,0,0]=4 2614 B10R0.55 CCC(C)OCCNC(=O)N cb366405cecb1c1144bbbad9a8a0dc85 [0,1,0,0,0,0|3,0,0]=4 2615 B10R0.55 CCC(C)OCCOC(=O)C eea4969987d429e16dd91fccc6cfb054 [0,1,0,0,0,0|3,0,0]=4 2616 B10R0.55 CCC(C)OCCSC(=O)C a91d431c7886880583e04562914c5528 [0,1,0,0,0,0|3,0,0]=4 2617 B10R0.55 CCC(O)CNCCC(=O)C 552d4428a110d0d60aafe4dcfc05d567 [0,1,0,0,0,0|2,0,0]=3 2618 B10R0.55 CCC(O)CNCCC(=O)N d891d8ba89ff080bfd4dedd3cc2ddb52 [0,1,0,0,0,0|2,0,0]=3 2619 B10R0.55 CCC(O)CNCCC(=O)O f2e5f0523ee086cdc346a6a74ffc1f7a [0,1,0,0,0,0|1,0,0]=2 2620 B10R0.55 CCC(O)CNCCC(=S)N 80af0e5cfca565031415953ce3df291d [0,1,0,0,0,0|2,1,0]=4 2621 B10R0.55 CCC(O)CNCCC(C)O 1ac51659057bddb4870440e5d5146689 [0,1,0,0,0,0|2,0,1]=4 2622 B10R0.55 CCC(O)CNCCS(=O)C 2aab35a4885fe4a973e25f0570fd6580 [0,1,0,0,0,0|3,0,0]=4 2623 B10R0.55 CCC(O)CNCCS(=O)O 724b43e63dd6866712aac8df8d3dae5e [0,1,0,0,0,0|2,0,0]=3 2624 B10R0.55 CCC(O)CNCC[C@@H](C)O 2534867446c70d046ae66236e6b680f0 [0,1,0,0,0,0|2,0,1]=4 2625 B10R0.55 CCC(O)CNCC[C@H](C)O 4fa7e42ed8885f9c93351eef91ae52d6 [0,1,0,0,0,0|2,0,1]=4 2626 B10R0.55 CCC(O)CNCOC(=O)C 96c690296ad22add33e14456300a846a [0,1,0,0,0,0|3,0,0]=4 2627 B10R0.55 CCC(O)CNCSC(=O)N c0c05dbeb5019c5172bbb4c71bbd3d5e [0,1,0,0,0,0|3,0,0]=4 2628 B10R0.55 CCC(S)CCOCC(=O)N 1eb26bf8439923782011553c82ea1c55 [0,1,0,0,0,0|2,0,0]=3 2629 B10R0.55 CCC(S)CCOCC(=O)O 7c10a908924967e816777ee1692ae82c [0,1,0,0,0,0|1,0,0]=2 2630 B10R0.55 CCC(S)CCOC[N+](=O)[O-] de7ee73ef22e4804a67b1d98744c70cd [0,1,0,0,0,0|2,0,1]=4 2631 B10R0.55 CCN(C)CCCCC(=O)C 3b0c3d395d78dd58ea179375d3222622 [0,1,0,0,0,0|2,0,0]=3 2632 B10R0.55 CCN(C)CCCCC(=O)N 745e82c1221d9430363252217d733ad3 [0,1,0,0,0,0|2,0,0]=3 2633 B10R0.55 CCN(C)CCCCC(=O)O bb82b1e460f16fb8943314d08f43ab8d [0,1,0,0,0,0|1,0,0]=2 2634 B10R0.55 CCN(C)CCCCC(C)O 8df8cbcb68479e66bcb12b972388d86c [0,1,0,0,0,0|2,0,1]=4 2635 B10R0.55 CCN(C)CCCC[C@@H](C)O d76029adaa30b5a7e657644f15b16820 [0,1,0,0,0,0|2,0,1]=4 2636 B10R0.55 CCN(C)CCCNC(=O)C 7d62cef8c7e7d4119f393e9ef5c71b7b [0,1,0,0,0,0|3,0,0]=4 2637 B10R0.55 CCN(C)CCCOC(=O)C 8abf6aad97c9b60ba3fd45ae10c88037 [0,1,0,0,0,0|3,0,0]=4 2638 B10R0.55 CCN(C)CCCSC(=O)C b6ac70fc6eeee392c018d10c515bb6e3 [0,1,0,0,0,0|3,0,0]=4 2639 B10R0.55 CCN(C)CCOCC(=O)N a15866fdef978ede9f9bfb6e090c98ba [0,1,0,0,0,0|3,0,0]=4 2640 B10R0.55 CCN(C)CCOCC(=O)O 110ce6d851c215b8e4f88e1d7e18be42 [0,1,0,0,0,0|2,0,0]=3 2641 B10R0.55 CCS(=O)CCNCC(=O)C 0e96cf0ec841e557e4f2195eeb1463cd [0,1,0,0,0,0|3,0,0]=4 2642 B10R0.55 CCS(=O)CCNCC(=O)N 135ed91fa08128ec28cd3ae96f7ee22c [0,1,0,0,0,0|3,0,0]=4 2643 B10R0.55 CCS(=O)CCOCC(=O)C 36e590a467f8e7231c380197338e7a24 [0,1,0,0,0,0|3,0,0]=4 2644 B10R0.55 CCS(=O)CCOCC(=O)N 8c29d14f0e19989bb4aa1e3ad963cf58 [0,1,0,0,0,0|3,0,0]=4 2645 B10R0.55 CCS(=O)CCOCS(=O)O 3073a83fe6c77904def0a3dde219a2dd [0,1,0,0,0,0|3,0,0]=4 2646 B10R0.55 CC[C@@H](C)CNCCC(=O)N 7ce4217fc943d9dbdb4a354b1d6cac1e [0,1,0,0,0,0|2,0,0]=3 2647 B10R0.55 CC[C@@H](C)CNCCC(=O)O 82dcea8aa970a6c213be42262f949a4e [0,1,0,0,0,0|1,0,0]=2 2648 B10R0.55 CC[C@@H](C)CNCCC(=S)N 91fc69511effc75d44f863abfded4a59 [0,1,0,0,0,0|2,1,0]=4 2649 B10R0.55 CC[C@@H](C)CNCCC(C)O 690e5e5d7756939999eef8cb6e81c3d6 [0,1,0,0,0,0|2,0,1]=4 2650 B10R0.55 CC[C@@H](C)CNCCS(=O)C f0ce8fbfa2d47259e7839682a1861f86 [0,1,0,0,0,0|3,0,0]=4 2651 B10R0.55 CC[C@@H](C)CNCCS(=O)O 11cb726c7411a886f7e7ebf6f11d32f0 [0,1,0,0,0,0|2,0,0]=3 2652 B10R0.55 CC[C@@H](C)CNCC[C@@H](C)O 8d5b029c8b29036138f93bf2a65cadcf [0,1,0,0,0,0|2,0,1]=4 2653 B10R0.55 CC[C@@H](C)CNCC[C@H](C)O 155708a92474f975952f42f65e5d2681 [0,1,0,0,0,0|2,0,1]=4 2654 B10R0.55 CC[C@@H](C)COCCC(=O)C a1e872c2fbdcb933d689574a238e15d5 [0,1,0,0,0,0|2,0,0]=3 2655 B10R0.55 CC[C@@H](C)COCCC(=O)N bff990e088818a7cf3777c0f75818a91 [0,1,0,0,0,0|2,0,0]=3 2656 B10R0.55 CC[C@@H](C)COCCC(=O)O 629ee50c5237c26e522b779665a79820 [0,1,0,0,0,0|1,0,0]=2 2657 B10R0.55 CC[C@@H](C)COCCS(=O)C 0c6c04056bd5d37ce7e133167e092dc6 [0,1,0,0,0,0|3,0,0]=4 2658 B10R0.55 CC[C@@H](C)COCC[N+](=O)[O-] 87d8c0482671d7144dc9a93f995d9307 [0,1,0,0,0,0|2,0,1]=4 2659 B10R0.55 CC[C@@H](C)COCNC(=O)C 0cfa435480a0fe2c8f23ad7ce8585e19 [0,1,0,0,0,0|3,0,0]=4 2660 B10R0.55 CC[C@@H](C)COCNC(=O)N 582b62e08d71c946f35e1284834e9b57 [0,1,0,0,0,0|3,0,0]=4 2661 B10R0.55 CC[C@@H](C)COCOC(=O)C c07cfbbd7071cecb58c01d5f746ec554 [0,1,0,0,0,0|3,0,0]=4 2662 B10R0.55 CC[C@@H](C)COCSC(=O)N f626d39b13e129336b84b6cc738ac543 [0,1,0,0,0,0|3,0,0]=4 2663 B10R0.55 CC[C@@H](C)NC/C=C/C(=O)O 120d9b947983394f864ab3142af1741a [0,1,0,0,0,0|1,0,2]=4 2664 B10R0.55 CC[C@@H](C)NCC=CC(=O)O a76ea54b78d64bffceae8be888cd9aed [0,1,0,0,0,0|1,0,2]=4 2665 B10R0.55 CC[C@@H](C)NCCCC(=O)C 30110e0f99f26d75483b82d55438a792 [0,1,0,0,0,0|2,0,0]=3 2666 B10R0.55 CC[C@@H](C)NCCCC(=O)N 8f5bb8635e9b4161ac2d062d39da802e [0,1,0,0,0,0|2,0,0]=3 2667 B10R0.55 CC[C@@H](C)NCCCC(C)O a9d38372b8fc65eb2b1d2b47dc669b23 [0,1,0,0,0,0|2,0,1]=4 2668 B10R0.55 CC[C@@H](C)NCCC[N+](=O)[O-] 192d362e0a6d1f7a32400498fb292964 [0,1,0,0,0,0|2,0,1]=4 2669 B10R0.55 CC[C@@H](C)NCCNC(=O)C b1ceda04375735f0c45e75af3f85659d [0,1,0,0,0,0|3,0,0]=4 2670 B10R0.55 CC[C@@H](C)NCCNC(=O)N 6fe89be5675d642b9fb5746938550b51 [0,1,0,0,0,0|3,0,0]=4 2671 B10R0.55 CC[C@@H](C)NCCOC(=O)C 389b11be481b4128b3250089d920dbf0 [0,1,0,0,0,0|3,0,0]=4 2672 B10R0.55 CC[C@@H](C)NCCSC(=O)C 418cd085ee44ae4cd7c9c0901ac53f8b [0,1,0,0,0,0|3,0,0]=4 2673 B10R0.55 CC[C@@H](C)OC/C=C/C(=O)O cbe082339e3123d77186acaf9688d18c [0,1,0,0,0,0|1,0,2]=4 2674 B10R0.55 CC[C@@H](C)OCC=CC(=O)O 253540fa0bd12bf807e7239d85ee7269 [0,1,0,0,0,0|1,0,2]=4 2675 B10R0.55 CC[C@@H](C)OCCCC(=O)C 5daf20a2f195e7bf62ce130fd8a8e12d [0,1,0,0,0,0|2,0,0]=3 2676 B10R0.55 CC[C@@H](C)OCCCC(=O)N ff4972c1a911921dd377d4725d78d0b7 [0,1,0,0,0,0|2,0,0]=3 2677 B10R0.55 CC[C@@H](C)OCCC[N+](=O)[O-] d091d7cdaa4fceb7931b70cbd7a57770 [0,1,0,0,0,0|2,0,1]=4 2678 B10R0.55 CC[C@@H](C)OCCNC(=O)C d056abd5391852d2ed154fab1da18c6f [0,1,0,0,0,0|3,0,0]=4 2679 B10R0.55 CC[C@@H](C)OCCNC(=O)N 13b2859fc8bfbd126a4c1e71d0b5f1cc [0,1,0,0,0,0|3,0,0]=4 2680 B10R0.55 CC[C@@H](C)OCCOC(=O)C 88255690af41c8c6932375eb3cba49ed [0,1,0,0,0,0|3,0,0]=4 2681 B10R0.55 CC[C@@H](C)OCCSC(=O)C 618a59e26b841aa83ec5b8678d51b642 [0,1,0,0,0,0|3,0,0]=4 2682 B10R0.55 CC[C@@H](O)CNCCC(=O)C c9c05af0c9174c065a3e85a9ca6510a7 [0,1,0,0,0,0|2,0,0]=3 2683 B10R0.55 CC[C@@H](O)CNCCC(=O)N 4f7c8efce8a0ff90334c6bef070166ed [0,1,0,0,0,0|2,0,0]=3 2684 B10R0.55 CC[C@@H](O)CNCCC(=O)O 794f3282a52a6371036819fd43d83f09 [0,1,0,0,0,0|1,0,0]=2 2685 B10R0.55 CC[C@@H](O)CNCCC(C)O 108ea467a828c215911fdf319afc157c [0,1,0,0,0,0|2,0,1]=4 2686 B10R0.55 CC[C@@H](O)CNCCS(=O)C ec0b90f3149fe415f6ab91e77aa34530 [0,1,0,0,0,0|3,0,0]=4 2687 B10R0.55 CC[C@@H](O)CNCOC(=O)C b4ee9998fe97191fe9c2b61ba2f7cb08 [0,1,0,0,0,0|3,0,0]=4 2688 B10R0.55 CC[C@@H](O)CNCSC(=O)N 3094e2e4b34ce4d28504aa193a381237 [0,1,0,0,0,0|3,0,0]=4 2689 B10R0.55 CC[C@H](C)CCOCC(=O)N a51b2b4180151e1c2a5e55e083ac9521 [0,1,0,0,0,0|2,0,0]=3 2690 B10R0.55 CC[C@H](C)CCOCC(=O)O b546808bbdd613ca75fdde6febc8af06 [0,1,0,0,0,0|1,0,0]=2 2691 B10R0.55 CC[C@H](C)CCOC[N+](=O)[O-] 83bd58a317609e68bf3b3ca4454c8608 [0,1,0,0,0,0|2,0,1]=4 2692 B10R0.55 CC[C@H](C)CNCCC(=O)C 931a1bbcc5ae6dc538a287b50d656a45 [0,1,0,0,0,0|2,0,0]=3 2693 B10R0.55 CC[C@H](C)CNCCC(=O)N baa1967b8eaa4e6501cbeb48348d3976 [0,1,0,0,0,0|2,0,0]=3 2694 B10R0.55 CC[C@H](C)CNCCC(=O)O 3f0ee1f7c0bd3c6154f1e43c34026b88 [0,1,0,0,0,0|1,0,0]=2 2695 B10R0.55 CC[C@H](C)CNCCC(=S)N 226d05bf10d52ffb62f0841de1eaabff [0,1,0,0,0,0|2,1,0]=4 2696 B10R0.55 CC[C@H](C)CNCCC(C)O 3790b08d589bb07d88760db1faf51658 [0,1,0,0,0,0|2,0,1]=4 2697 B10R0.55 CC[C@H](C)CNCCS(=O)C bf5902a233741ad86f7fc3ca13520fcd [0,1,0,0,0,0|3,0,0]=4 2698 B10R0.55 CC[C@H](C)CNCCS(=O)O 775d76f1f443775f3361e9efe8cfcbc2 [0,1,0,0,0,0|2,0,0]=3 2699 B10R0.55 CC[C@H](C)CNCC[C@@H](C)O 846d3cbe10cfa694fb875def8604b486 [0,1,0,0,0,0|2,0,1]=4 2700 B10R0.55 CC[C@H](C)CNCC[C@H](C)O 5b126ecdcb5a6a57bb546aa6c956e1c4 [0,1,0,0,0,0|2,0,1]=4 2701 B10R0.55 CC[C@H](C)CNCOC(=O)C 40fc7b358a5d148f02fd1e2e897aa9dc [0,1,0,0,0,0|3,0,0]=4 2702 B10R0.55 CC[C@H](C)CNCSC(=O)N afe6d09911347829657495f4f53f7e55 [0,1,0,0,0,0|3,0,0]=4 2703 B10R0.55 CC[C@H](C)COCCC(=O)C 6e627978bede9d4ce40fadc41c9ece06 [0,1,0,0,0,0|2,0,0]=3 2704 B10R0.55 CC[C@H](C)COCCC(=O)N d8cf5512b31404cded6e7ce01ef6c47c [0,1,0,0,0,0|2,0,0]=3 2705 B10R0.55 CC[C@H](C)COCCC(=O)O a1e225dba7ca62fe9106f920f556fe63 [0,1,0,0,0,0|1,0,0]=2 2706 B10R0.55 CC[C@H](C)COCCS(=O)C 9f2d232e4131bd9922c7ecadf1877b7f [0,1,0,0,0,0|3,0,0]=4 2707 B10R0.55 CC[C@H](C)COCC[N+](=O)[O-] f5e4403c767dd589be0a32a15a84bf35 [0,1,0,0,0,0|2,0,1]=4 2708 B10R0.55 CC[C@H](C)COCNC(=O)C 05ca95b31b850936e5a72b09ce43d27a [0,1,0,0,0,0|3,0,0]=4 2709 B10R0.55 CC[C@H](C)COCNC(=O)N b14b6c1d914c464a8ae25bdae5fa245a [0,1,0,0,0,0|3,0,0]=4 2710 B10R0.55 CC[C@H](C)COCOC(=O)C fbc035d2b0796c1d7c502879823bbafa [0,1,0,0,0,0|3,0,0]=4 2711 B10R0.55 CC[C@H](C)COCSC(=O)N f52a6da42618b9c8b3f502e6f849aa81 [0,1,0,0,0,0|3,0,0]=4 2712 B10R0.55 CC[C@H](C)NC/C=C/C(=O)O 6b055e68af5b0ed8587bdafdebf6aed7 [0,1,0,0,0,0|1,0,2]=4 2713 B10R0.55 CC[C@H](C)NCC=CC(=O)O 6357733e580260f24b7fe602708fb5ed [0,1,0,0,0,0|1,0,2]=4 2714 B10R0.55 CC[C@H](C)NCCCC(=O)C d9deab0eaed225b2e9e6f68ff71044bd [0,1,0,0,0,0|2,0,0]=3 2715 B10R0.55 CC[C@H](C)NCCCC(=O)N 863a25109964a63a3c2a33f9597c06c7 [0,1,0,0,0,0|2,0,0]=3 2716 B10R0.55 CC[C@H](C)NCCCC(C)O c1478fa07d10fbedfa6e6b2e9a115cd3 [0,1,0,0,0,0|2,0,1]=4 2717 B10R0.55 CC[C@H](C)NCCC[N+](=O)[O-] 95f3cc5cfe4d3514470d5dcffe8e26e9 [0,1,0,0,0,0|2,0,1]=4 2718 B10R0.55 CC[C@H](C)NCCNC(=O)C 3f3688c2adad499e8a24b67beefeb141 [0,1,0,0,0,0|3,0,0]=4 2719 B10R0.55 CC[C@H](C)NCCNC(=O)N 02d5596296bedbcde4e16f91254c012f [0,1,0,0,0,0|3,0,0]=4 2720 B10R0.55 CC[C@H](C)NCCOC(=O)C ea4fe5ba78e411aabbe8ccb98999433a [0,1,0,0,0,0|3,0,0]=4 2721 B10R0.55 CC[C@H](C)NCCSC(=O)C 7cf4ba26288f450a102702513b36715b [0,1,0,0,0,0|3,0,0]=4 2722 B10R0.55 CC[C@H](C)OC/C=C/C(=O)O b9d94e44cfe67c77000ec7ed04b5505b [0,1,0,0,0,0|1,0,2]=4 2723 B10R0.55 CC[C@H](C)OCC=CC(=O)O 51f5516198ae5f2f401a6ce354288fc6 [0,1,0,0,0,0|1,0,2]=4 2724 B10R0.55 CC[C@H](C)OCCCC(=O)C f6708d1229265ab3f7060e9a86ab051b [0,1,0,0,0,0|2,0,0]=3 2725 B10R0.55 CC[C@H](C)OCCCC(=O)N aa60075d7579a9565c74497515d8e66e [0,1,0,0,0,0|2,0,0]=3 2726 B10R0.55 CC[C@H](C)OCCC[N+](=O)[O-] f0014d64bfdf5d431a8ecd105d846f28 [0,1,0,0,0,0|2,0,1]=4 2727 B10R0.55 CC[C@H](C)OCCNC(=O)C d7ad17541d9a209f9cd6161c23336079 [0,1,0,0,0,0|3,0,0]=4 2728 B10R0.55 CC[C@H](C)OCCNC(=O)N a6b006c54af6ed59411760ceb609898f [0,1,0,0,0,0|3,0,0]=4 2729 B10R0.55 CC[C@H](C)OCCOC(=O)C 6218a7eb503538aabba0da5628a9d829 [0,1,0,0,0,0|3,0,0]=4 2730 B10R0.55 CC[C@H](C)OCCSC(=O)C d3f04f1df7606841d3a9685e7519af8d [0,1,0,0,0,0|3,0,0]=4 2731 B10R0.55 CN(CF)CCCCC(=O)O e18b8114d2431d664040b0c8e62c638f [0,1,0,0,0,0|2,0,0]=3 2732 B10R0.55 CN(CO)CCCCC(=O)O b018a7be474a57aa43409c2e8f5d00b2 [0,1,0,0,0,0|2,0,0]=3 2733 B10R0.55 CNC(=O)CCNCC(=O)O 3370da234046a553513b10b235dd5f3f [0,1,0,0,0,0|2,0,1]=4 2734 B10R0.55 CNC(=O)CCOCC(=O)O 728f9fd0c573bf656c5cac3e068e8ff3 [0,1,0,0,0,0|2,0,1]=4 2735 B10R0.55 CNC(=O)CNCCC(=O)O bb341844f959b6181328ee6851fc2e00 [0,1,0,0,0,0|2,0,1]=4 2736 B10R0.55 CNC(=O)COCCC(=O)O 2bc44f43a14ed7b707170117cffeb9f3 [0,1,0,0,0,0|2,0,1]=4 2737 B10R0.55 COC(=O)CCNCC(=O)O 6d5ebec618e68708f68c24fced7e1b10 [0,1,0,0,0,0|2,0,1]=4 2738 B10R0.55 COC(=O)CCOCC(=O)O 8067ee91aa4a4f56b5d88d7678c46986 [0,1,0,0,0,0|2,0,1]=4 2739 B10R0.55 COC(=O)CNCCC(=O)O 1eeb588c4ea65eb432bd6ccabfac02d6 [0,1,0,0,0,0|2,0,1]=4 2740 B10R0.55 COC(=O)COCCC(=O)O a335617633e3a1dcf1d51ce902417d9d [0,1,0,0,0,0|2,0,1]=4 2741 B10R0.55 COC(C)CCOCC(=O)N cd2162e60c864255a813da73498e6fd0 [0,1,0,0,0,0|3,0,0]=4 2742 B10R0.55 COC(C)CCOCC(=O)O a2155429e5a25c44b3afa674ae166c89 [0,1,0,0,0,0|2,0,0]=3 2743 B10R0.55 COC(C)CNCCC(=O)N 1736d9b42150c1b3a4aa9a40c52d8d92 [0,1,0,0,0,0|3,0,0]=4 2744 B10R0.55 COC(C)CNCCC(=O)O ed615add18505d555ec05affa46e4626 [0,1,0,0,0,0|2,0,0]=3 2745 B10R0.55 COC(C)CNCCS(=O)O eee2f5e45d08e65e8e7c4854354b4260 [0,1,0,0,0,0|3,0,0]=4 2746 B10R0.55 COC(C)COCCC(=O)C 15737f7831f75b8c5c8937e571a33211 [0,1,0,0,0,0|3,0,0]=4 2747 B10R0.55 COC(C)COCCC(=O)N 8c3a566379f6fb33d11b27382ea757b7 [0,1,0,0,0,0|3,0,0]=4 2748 B10R0.55 COC(C)COCCC(=O)O 39ce88c06bb548c83ec1d40faeee95c5 [0,1,0,0,0,0|2,0,0]=3 2749 B10R0.55 CO[C@@H](C)CNCCC(=O)C 1bc7761dfd0bdc80df8d8286f3a6a64d [0,1,0,0,0,0|3,0,0]=4 2750 B10R0.55 CO[C@@H](C)CNCCC(=O)N 9f7cd69757d9c86770c9fe374b00eedb [0,1,0,0,0,0|3,0,0]=4 2751 B10R0.55 CO[C@@H](C)CNCCC(=O)O 65c1b770f176a2d81de3e5028e6c709d [0,1,0,0,0,0|2,0,0]=3 2752 B10R0.55 CO[C@@H](C)CNCCS(=O)O 957dbf0e56b54b1bccac9d55b8a5425f [0,1,0,0,0,0|3,0,0]=4 2753 B10R0.55 CO[C@@H](C)COCCC(=O)C 92e8045fc41b44ac83e2a536cb9c7350 [0,1,0,0,0,0|3,0,0]=4 2754 B10R0.55 CO[C@@H](C)COCCC(=O)N b4339cb4c43c59a4704c05f540c9a00d [0,1,0,0,0,0|3,0,0]=4 2755 B10R0.55 CO[C@@H](C)COCCC(=O)O 142306f3c65293ff5d63529d7e2be48f [0,1,0,0,0,0|2,0,0]=3 2756 B10R0.55 CO[C@H](C)CNCCC(=O)C 0a96c3b631c0ed2af1e66b320dfa9293 [0,1,0,0,0,0|3,0,0]=4 2757 B10R0.55 CO[C@H](C)CNCCC(=O)N 2b64c9dc7d584603825dd2954ba9b2dc [0,1,0,0,0,0|3,0,0]=4 2758 B10R0.55 CO[C@H](C)CNCCC(=O)O 24ee6c154acd62d1b0dbb0619bc43d67 [0,1,0,0,0,0|2,0,0]=3 2759 B10R0.55 CO[C@H](C)CNCCS(=O)O 33b282d0eb70ecdcf9fabfbe0042cb98 [0,1,0,0,0,0|3,0,0]=4 2760 B10R0.55 CO[C@H](C)COCCC(=O)C 1f5f1a6d7f0d02f2d362a9791356dff8 [0,1,0,0,0,0|3,0,0]=4 2761 B10R0.55 CO[C@H](C)COCCC(=O)N 2aeaa53c89c81b04696e9de916fba278 [0,1,0,0,0,0|3,0,0]=4 2762 B10R0.55 CO[C@H](C)COCCC(=O)O c920ef65d73b3f010094d83b80e02c74 [0,1,0,0,0,0|2,0,0]=3 2763 B10R0.55 C[C@@H](CO)CCNCC(=O)N d01d95999e6e8188751fe2d845a28582 [0,1,0,0,0,0|3,0,0]=4 2764 B10R0.55 C[C@@H](CO)CCNCC(=O)O 70c198e2423239414e886a5059898ac5 [0,1,0,0,0,0|2,0,0]=3 2765 B10R0.55 C[C@@H](CO)CNCCC(=O)N a086aa21f2b237de21a4de932b42c826 [0,1,0,0,0,0|3,0,0]=4 2766 B10R0.55 C[C@@H](CO)CNCCC(=O)O 3885f11350714e83ecb85ddc4012d891 [0,1,0,0,0,0|2,0,0]=3 2767 B10R0.55 C[C@@H](CO)CNCCS(=O)O b98cd98f832c809881ac748237f53dd2 [0,1,0,0,0,0|3,0,0]=4 2768 B10R0.55 C[C@@H](CO)NCCCC(=O)N ab4766c88d127ae7c2fa460e091961a0 [0,1,0,0,0,0|3,0,0]=4 2769 B10R0.55 C[C@@H](CO)NCCCC(=O)O f2fb01e497d8d1233c3f9759e4f5f0f7 [0,1,0,0,0,0|2,0,0]=3 2770 B10R0.55 C[C@H](C=O)NCCCC(=O)O 2d23f56addaa20c65e70451460a0caab [0,1,0,0,0,0|2,0,1]=4 2771 B10R0.55 C[C@H](CO)CNCCC(=O)N 2067288537ba3f35f868705de8d48fd2 [0,1,0,0,0,0|3,0,0]=4 2772 B10R0.55 C[C@H](CO)CNCCC(=O)O 0268186da7d292c04d0714c1a0915e7e [0,1,0,0,0,0|2,0,0]=3 2773 B10R0.55 C[C@H](CO)CNCCS(=O)O dfcd72dac56930e25f65183d6f76077a [0,1,0,0,0,0|3,0,0]=4 2774 B10R0.55 C[C@H](CO)NCCCC(=O)N 0fbb798c56e875a1603ed52d36fb9a4a [0,1,0,0,0,0|3,0,0]=4 2775 B10R0.55 C[C@H](CO)NCCCC(=O)O 18b1643b4d16f33489c5ff88ab1f0515 [0,1,0,0,0,0|2,0,0]=3 2776 B10R0.55 C[C@H](CS)OCCCC(=O)N 5d6b232df7a012bcf0a4d59fcda60166 [0,1,0,0,0,0|3,0,0]=4 2777 B10R0.55 NC(=O)CCNCC(Br)CBr 6c47fd2cc00dfaf762144b1feea0e1f9 [0,1,0,0,0,0|3,0,0]=4 2778 B10R0.55 NC(=O)CCNCC(F)CO 2c30bdbe6d5dac0f778bdd54ee5590cd [0,1,0,0,0,0|3,0,0]=4 2779 B10R0.55 NC(=O)CCNCC(O)CF 07fc790968b452413c0a9d1a24bca2ef [0,1,0,0,0,0|3,0,0]=4 2780 B10R0.55 NC(=O)CCNCC(O)CO 5ea2bdeae08133c9bdd0954741a4efde [0,1,0,0,0,0|3,0,0]=4 2781 B10R0.55 NC(=O)CCNC[C@@H](F)CO 009ba7c3acd9eb0e99fc794cbadc105a [0,1,0,0,0,0|3,0,0]=4 2782 B10R0.55 NC(=O)CCNC[C@@H](O)CO d411cc07e865b9767a1426c0147043b3 [0,1,0,0,0,0|3,0,0]=4 2783 B10R0.55 NC(=O)CCNC[C@H](F)CO 5d7d78e0bcc8e99087dc6afd31cc2f13 [0,1,0,0,0,0|3,0,0]=4 2784 B10R0.55 NC(=O)CCNC[C@H](O)CO 048e7b2339a479398eea59794f164461 [0,1,0,0,0,0|3,0,0]=4 2785 B10R0.55 NC(=O)CCOCC(Br)CBr 1400ee9977780a417b560fdcdd86614a [0,1,0,0,0,0|3,0,0]=4 2786 B10R0.55 NC(=O)CCOCC(Cl)CCl 89fd95cbd3162d45a98fdafc75413168 [0,1,0,0,0,0|3,0,0]=4 2787 B10R0.55 NC(=O)CCOCC(O)CO 9303f234dcbef5e8cca30bba9830de64 [0,1,0,0,0,0|3,0,0]=4 2788 B10R0.55 NC(=O)CCOCC(S)CS 85219ccd601b29b4d2745b6fede559ab [0,1,0,0,0,0|3,0,0]=4 2789 B10R0.55 NC(=O)CCOC[C@@H](O)CO 1bf67e6e83f452da3fd3c035d8bc6a5d [0,1,0,0,0,0|3,0,0]=4 2790 B10R0.55 NC(=O)CCOC[C@H](O)CO bfa79534bd9d0f74dd4a88ed3cec2fe1 [0,1,0,0,0,0|3,0,0]=4 2791 B10R0.55 NC(=O)CNCCC(O)CO 74dd4d476c25bff5af0dbc4994f7476e [0,1,0,0,0,0|3,0,0]=4 2792 B10R0.55 O=C(O)CCNCC(=O)CO 21c706e4a5b83f7c629e41b13adc88a8 [0,1,0,0,0,0|2,0,1]=4 2793 B10R0.55 O=C(O)CCNCC(Br)CBr 83a1b54388fac8eff31324a7f3055e46 [0,1,0,0,0,0|2,0,0]=3 2794 B10R0.55 O=C(O)CCNCC(F)CO 603af068938969ce170ac2128dfd3a96 [0,1,0,0,0,0|2,0,0]=3 2795 B10R0.55 O=C(O)CCNCC(O)CF cef274e96fd9a2218fcae01f40b1b30e [0,1,0,0,0,0|2,0,0]=3 2796 B10R0.55 O=C(O)CCNCC(O)CO 0efe0819c909d4fcf7804e2475cc59b6 [0,1,0,0,0,0|2,0,0]=3 2797 B10R0.55 O=C(O)CCNC[C@@H](F)CO 24764e4e2184273152d6327ecca0fc06 [0,1,0,0,0,0|2,0,0]=3 2798 B10R0.55 O=C(O)CCNC[C@@H](O)CO 81ac7a7d725a0d640f4d93e7366caa00 [0,1,0,0,0,0|2,0,0]=3 2799 B10R0.55 O=C(O)CCNC[C@H](F)CO 9eae2bde259067b97bbbc584dec43556 [0,1,0,0,0,0|2,0,0]=3 2800 B10R0.55 O=C(O)CCNC[C@H](O)CO 1153603a6501717c903e7a1d1bc8fa26 [0,1,0,0,0,0|2,0,0]=3 2801 B10R0.55 O=C(O)CCOCC(Cl)CCl 7f6ee25d89fec4f0fb79b1b43ba97708 [0,1,0,0,0,0|2,0,0]=3 2802 B10R0.55 O=C(O)CCOCC(O)CO c88c46b3a15d221ca12af48d1ded0e51 [0,1,0,0,0,0|2,0,0]=3 2803 B10R0.55 O=C(O)CCOCC(S)CS 69687f83e4e8d8b69a9db43f42d0bf6e [0,1,0,0,0,0|2,0,0]=3 2804 B10R0.55 O=C(O)CCOC[C@@H](O)CO 2a4fb6c0ea17548397d92b9915beea63 [0,1,0,0,0,0|2,0,0]=3 2805 B10R0.55 O=C(O)CCOC[C@H](O)CO e7214dd5fe429da83e7069eb8216e7d2 [0,1,0,0,0,0|2,0,0]=3 2806 B10R0.55 O=C(O)CNCCC(O)CO b51fb04be35adce87fe9e3371df0c242 [0,1,0,0,0,0|2,0,0]=3 2807 B10R0.55 O=S(O)CCNCC(O)CF 9f355b7e04063cd07c8bd3a5952da753 [0,1,0,0,0,0|3,0,0]=4 2808 B10R0.55 O=S(O)CCNCC(O)CO f5d64353ea8923c879b15ff978ec455b [0,1,0,0,0,0|3,0,0]=4 2809 B10R0.55 O=S(O)CCNC[C@@H](O)CO 022519b23e84cb365f7e0a012ecf3d5e [0,1,0,0,0,0|3,0,0]=4 2810 B10R0.55 O=S(O)CCNC[C@H](O)CO 0d2644798ffc4cc6e8c1eb78970ca17a [0,1,0,0,0,0|3,0,0]=4 2811 B10R0.74 C#CC(=O)NCCCCCC 9ce0dcb0417530c831957f5468426ec6 [0,1,0,0,0,0|2,0,0]=3 2812 B10R0.74 C#CC(=O)NCCCCCCl 4bd3b0401c6adc0b1504259ce5472034 [0,1,0,0,0,0|3,0,0]=4 2813 B10R0.74 C#CC(=O)NCCCCCO 78ae8ebf48e66c623f7ebe96afd1b089 [0,1,0,0,0,0|3,0,0]=4 2814 B10R0.74 C#CC(=O)NCCCCOC 66d4d6bff0ba4cb62d9b6f222760c57a [0,1,0,0,0,0|3,0,0]=4 2815 B10R0.74 C#CC(=O)NCCCCSC 818b3523d42deae665984e70e8c2f56b [0,1,0,0,0,0|3,0,0]=4 2816 B10R0.74 C#CC(=O)NCCCOCC 73672a16f1b86e20f6e9426a721f4718 [0,1,0,0,0,0|3,0,0]=4 2817 B10R0.74 C#CC(=O)NCCOCCC 9b3bdb9245cd962112137111d214f9c0 [0,1,0,0,0,0|3,0,0]=4 2818 B10R0.74 C#CCCCCNC(=O)CO ff516938cd03a3623296aa7a2ad29f83 [0,1,0,0,0,0|1,0,2]=4 2819 B10R0.74 C#CCCCNCC(=O)CO 9a123aedb33e909ce9508d855aea89ae [0,1,0,0,0,0|1,0,2]=4 2820 B10R0.74 C#CCCCNCC(=O)NO d33cf44f89bbdf0e661ca9b193ddbae3 [0,1,0,0,0,0|1,0,2]=4 2821 B10R0.74 C#CCCCNCC(=O)OC 3ee685146bb6eb18d3a526a1d6ad4d40 [0,1,0,0,0,0|1,0,2]=4 2822 B10R0.74 C#CCCCOCC(=O)OC d235707655216660c3c98711e0bfbbbb [0,1,0,0,0,0|1,0,2]=4 2823 B10R0.74 C#CCCNCCC(=O)NO edb822143d7f02c0b8f58834b1738834 [0,1,0,0,0,0|1,0,2]=4 2824 B10R0.74 C#CCCNCCC(=O)OC 7431d6cfe5b28328ec53460e2195a626 [0,1,0,0,0,0|1,0,2]=4 2825 B10R0.74 C#CCCOCCC(=O)OC 05705bbf8bdc53436a7506ec636964b6 [0,1,0,0,0,0|1,0,2]=4 2826 B10R0.74 C#CCNCCCC(=O)OC 35c54f743edd55a42e3af2c7dc8c84cb [0,1,0,0,0,0|1,0,2]=4 2827 B10R0.74 C#CCOCCCC(=O)OC b36cc09989a5f35a5ccecf4ccf790920 [0,1,0,0,0,0|1,0,2]=4 2828 B10R0.74 C/C=C/CCOCC(=O)OC 5cef2662e711e50b70e469aabdcf7229 [0,1,0,0,0,0|1,0,2]=4 2829 B10R0.74 C/C=C/CNCCC(=O)NO ac95bde8876e23b8189803be8f71514d [0,1,0,0,0,0|1,0,2]=4 2830 B10R0.74 C/C=C/CNCCC(=O)OC 7be7a46cafcd38f3d321224f29167a03 [0,1,0,0,0,0|1,0,2]=4 2831 B10R0.74 C/C=C/COCCC(=O)OC 21902d7a81ea7f51f8fcd1c729f7b9a0 [0,1,0,0,0,0|1,0,2]=4 2832 B10R0.74 C/C=C\CNCCC(=O)NO b45c44de9260514ce1f0387931d93dae [0,1,0,0,0,0|1,0,2]=4 2833 B10R0.74 C/C=C\CNCCC(=O)OC 7f70fdeed154ab2b7272e7f7961fa398 [0,1,0,0,0,0|1,0,2]=4 2834 B10R0.74 C/C=C\COCCC(=O)OC d5696b8018621cffa0a62e755f785eb9 [0,1,0,0,0,0|1,0,2]=4 2835 B10R0.74 C=C(C#N)CNCCCCC ecfaf25ad2c9bfecd6d2738d9e07bdb6 [0,1,0,0,0,0|3,0,0]=4 2836 B10R0.74 C=C(C#N)COCCCCC c060fe0ed714e19839f540409e1ccdcb [0,1,0,0,0,0|3,0,0]=4 2837 B10R0.74 C=C(C=O)OCCCCCC 940d42a6ab41c79281a642305f54c21a [0,1,0,0,0,0|2,0,0]=3 2838 B10R0.74 C=C(C=O)OCCCCCF 0c66c85650f9af14f1e10a384365549e [0,1,0,0,0,0|3,0,0]=4 2839 B10R0.74 C=C(C=O)OCCCCOC 2032bbd5fa16902caddad4f43c0aedf8 [0,1,0,0,0,0|3,0,0]=4 2840 B10R0.74 C=C(C=O)OCCCOCC f3b812ffdabce81419de4cf041999b58 [0,1,0,0,0,0|3,0,0]=4 2841 B10R0.74 C=C(C=O)OCCCSCC e2c4a160a78f37d35ac4f9e0dd3aa338 [0,1,0,0,0,0|3,0,0]=4 2842 B10R0.74 C=C(C=O)OCCOCCC 654023781d9a6da849a330900fdeef06 [0,1,0,0,0,0|3,0,0]=4 2843 B10R0.74 C=C(C=O)OCOCCCC 09e3a76ff1be164af5a4bb922f4fa340 [0,1,0,0,0,0|3,0,0]=4 2844 B10R0.74 C=C(CC)CNCCCCC 8ea0f8842832f35f75f80e057ba25f3c [0,1,0,0,0,0|3,0,0]=4 2845 B10R0.74 C=C(CC)COCCCCC 75a076fa5d2b53a201e5a9dd953cf8d1 [0,1,0,0,0,0|3,0,0]=4 2846 B10R0.74 C=C(CNCCCCC)OC 7ceed52b8862c2740fad9864ee680023 [0,1,0,0,0,0|2,0,0]=3 2847 B10R0.74 C=C(CNCCCCCl)OC 01d23e856a39112e8dd60657a75c99d9 [0,1,0,0,0,0|3,0,0]=4 2848 B10R0.74 C=C(CNCCCCO)OC 15a75b452c078fc660c1db6739273d37 [0,1,0,0,0,0|3,0,0]=4 2849 B10R0.74 C=C(CNCCCCS)OC e2d765e0cb62973dae27c9aa9e43a296 [0,1,0,0,0,0|3,0,0]=4 2850 B10R0.74 C=C(CNCCCOC)OC c29b40f8f60ffa78b814d4233e42cd48 [0,1,0,0,0,0|3,0,0]=4 2851 B10R0.74 C=C(CNCCCSC)OC 6763b9dd9d3e42683fe4470877832470 [0,1,0,0,0,0|3,0,0]=4 2852 B10R0.74 C=C(CNCCOCC)OC d9aaba76db8f8225e7187e5309c93622 [0,1,0,0,0,0|3,0,0]=4 2853 B10R0.74 C=C(CNCCSCC)OC 44cfb0a7f61c695ff76b6ad376449389 [0,1,0,0,0,0|3,0,0]=4 2854 B10R0.74 C=C(CO)CNCCCCC 47cc22d1e0bb02b8d80aa229030b73ad [0,1,0,0,0,0|2,0,0]=3 2855 B10R0.74 C=C(CO)CNCCCCCl 5a4ceef4a205ab6eb320f7597ff42796 [0,1,0,0,0,0|3,0,0]=4 2856 B10R0.74 C=C(CO)CNCCCCO c332aff6f85b5a4223aee3dbfec616f5 [0,1,0,0,0,0|3,0,0]=4 2857 B10R0.74 C=C(CO)CNCCCCS 8531c907fcb8c7ae1cf27ba7f3df6838 [0,1,0,0,0,0|3,0,0]=4 2858 B10R0.74 C=C(CO)CNCCCOC 725c0492941dfda8541db5893adb5743 [0,1,0,0,0,0|3,0,0]=4 2859 B10R0.74 C=C(CO)CNCCCSC 0ce379e733cfb4fcec4ea00d5a5fafea [0,1,0,0,0,0|3,0,0]=4 2860 B10R0.74 C=C(CO)CNCCOCC 2442f83b75dd9f922b290bcd76ace36e [0,1,0,0,0,0|3,0,0]=4 2861 B10R0.74 C=C(CO)CNCCSCC b6941b8ef3f9c7677c78fedc9a957126 [0,1,0,0,0,0|3,0,0]=4 2862 B10R0.74 C=C(COCCCCC)OC 1bd3146a306a9b176c071f317d4b189d [0,1,0,0,0,0|2,0,0]=3 2863 B10R0.74 C=C(COCCCCF)OC 9720fa56fbe1db00b6c9cee649a6b455 [0,1,0,0,0,0|3,0,0]=4 2864 B10R0.74 C=C(COCCCCS)OC d5f49692e3e2c3c7722899285520cf16 [0,1,0,0,0,0|3,0,0]=4 2865 B10R0.74 C=C(COCCCOC)OC 597a24aaedbe861c2a0015ff43383664 [0,1,0,0,0,0|3,0,0]=4 2866 B10R0.74 C=C(COCCCSC)OC 7ee113f30e6cfdeb6638af657701c00a [0,1,0,0,0,0|3,0,0]=4 2867 B10R0.74 C=C(COCCOCC)OC 3413996f41eb592370b1582878b672ef [0,1,0,0,0,0|3,0,0]=4 2868 B10R0.74 C=C(COCCSCC)OC db7457c27896d184d710335b227c3daf [0,1,0,0,0,0|3,0,0]=4 2869 B10R0.74 C=CC(=O)CCCNCCBr c4a11717c1a48d42c8ce736180caa246 [0,1,0,0,0,0|3,0,0]=4 2870 B10R0.74 C=CC(=O)CCCNCCC 6452811aa0f965a0bac588aba4cc7d75 [0,1,0,0,0,0|2,0,0]=3 2871 B10R0.74 C=CC(=O)CCCNCCF f09b1399de9c8795c368e14b38cbda57 [0,1,0,0,0,0|3,0,0]=4 2872 B10R0.74 C=CC(=O)CCCNCCI 5b121128ffec8c1dcaadf5f81008e86b [0,1,0,0,0,0|3,0,0]=4 2873 B10R0.74 C=CC(=O)CCCNCCO 8413a5ad27d0198a22c44e447107e93f [0,1,0,0,0,0|3,0,0]=4 2874 B10R0.74 C=CC(=O)CCCNCCS 9bcdfda2a7f64d0290d7670e25ae6a46 [0,1,0,0,0,0|3,0,0]=4 2875 B10R0.74 C=CC(=O)CCCOCCC 2f1f5ed625ae1d833f97ac1c8ad75a3e [0,1,0,0,0,0|2,0,0]=3 2876 B10R0.74 C=CC(=O)CCCOCCF 51cea3e5cd7e467a41ffa717300140e8 [0,1,0,0,0,0|3,0,0]=4 2877 B10R0.74 C=CC(=O)CCCOCCS 06f5106093257b304477a35f0a140d9f [0,1,0,0,0,0|3,0,0]=4 2878 B10R0.74 C=CC(=O)CCCOCOC b58ad31461c53bc8bfd54b0fb58436ae [0,1,0,0,0,0|3,0,0]=4 2879 B10R0.74 C=CC(=O)NCCCCCC 88ce4279cd9f4230d78384982723ab15 [0,1,0,0,0,0|2,0,0]=3 2880 B10R0.74 C=CC(=O)NCCCCCCl 5d35e702a0fe92550144e4f96ced98b6 [0,1,0,0,0,0|3,0,0]=4 2881 B10R0.74 C=CC(=O)NCCCCCO ce222738eaf189ce2ba47ad69dacec89 [0,1,0,0,0,0|3,0,0]=4 2882 B10R0.74 C=CC(=O)NCCCCOC 81797f8381e611c2a9b876a1ae808184 [0,1,0,0,0,0|3,0,0]=4 2883 B10R0.74 C=CC(=O)NCCCCSC ba9547773ce82542fa30b25bd56375ba [0,1,0,0,0,0|3,0,0]=4 2884 B10R0.74 C=CC(=O)NCCCOCC 3b384cdff3b1a9bdf6f568edaa8f72ef [0,1,0,0,0,0|3,0,0]=4 2885 B10R0.74 C=CC(=O)NCCNCCC 55130badaa16c3443a84ef96d50da361 [0,1,0,0,0,0|3,0,0]=4 2886 B10R0.74 C=CC(=O)NCCOCCC 66bf7ac7732e825d411a87372c0e16bf [0,1,0,0,0,0|3,0,0]=4 2887 B10R0.74 C=CC(=O)NCOCCCC 327e7e67c9f9e961c425796e607b435a [0,1,0,0,0,0|3,0,0]=4 2888 B10R0.74 C=CC(=O)OCCNCCC dc3d9fb28749e0db9da8f5b756c6273e [0,1,0,0,0,0|3,0,0]=4 2889 B10R0.74 C=CC(=O)OCCOCCC 58d9a252ddc93e7a4f2569b1795784b6 [0,1,0,0,0,0|3,0,0]=4 2890 B10R0.74 C=CC(O)CNCCCCC 5dc8e3acef25251d027aa047b7f73859 [0,1,0,0,0,0|2,0,1]=4 2891 B10R0.74 C=CCCCCNC(=O)CO 2905b68dae9a3566578a0fac8e07b802 [0,1,0,0,0,0|1,0,2]=4 2892 B10R0.74 C=CCCCNCC(=O)CO b687e816d4f46a49b56a5b6030c50dab [0,1,0,0,0,0|1,0,2]=4 2893 B10R0.74 C=CCCCNCC(=O)NO d86a052560792e76a3aea79f38b662ac [0,1,0,0,0,0|1,0,2]=4 2894 B10R0.74 C=CCCCNCC(=O)OC b990198261ac7da853622cda2db1e13f [0,1,0,0,0,0|1,0,2]=4 2895 B10R0.74 C=CCCCOCC(=O)OC 5614853b296b4387cb21dfe5bd4ed723 [0,1,0,0,0,0|1,0,2]=4 2896 B10R0.74 C=CCCNCCC(=O)NO acaedd968987372999082137d6781742 [0,1,0,0,0,0|1,0,2]=4 2897 B10R0.74 C=CCCNCCC(=O)OC 9515b25cc9aa639c47ed2c8df65ff076 [0,1,0,0,0,0|1,0,2]=4 2898 B10R0.74 C=CCCOCCC(=O)OC 605f11671d618badff32dc1a046f5de6 [0,1,0,0,0,0|1,0,2]=4 2899 B10R0.74 C=CCNCCCC(=O)OC c7530121a5d52d98706e094b83f48453 [0,1,0,0,0,0|1,0,2]=4 2900 B10R0.74 CC#CCCOCC(=O)OC bccf3e49d64aa126ac83eba4c0215c4c [0,1,0,0,0,0|1,0,2]=4 2901 B10R0.74 CC#CCNCCC(=O)OC b2bce661e24d3e71c6a47d83bea99616 [0,1,0,0,0,0|1,0,2]=4 2902 B10R0.74 CC#CCOCCC(=O)OC b09dc233a0c4c648af3373bf5cfea976 [0,1,0,0,0,0|1,0,2]=4 2903 B10R0.74 CC/C=C/CNCC(=O)NO bdcefd5d8991a4c6f68e1a98472a81c9 [0,1,0,0,0,0|1,0,2]=4 2904 B10R0.74 CC/C=C/CNCC(=O)OC 19854a993a13e81af2b3e81b0a9b52b8 [0,1,0,0,0,0|1,0,2]=4 2905 B10R0.74 CC/C=C/COCC(=O)OC df91b6626dbab8528a78f4a8549ba0f2 [0,1,0,0,0,0|1,0,2]=4 2906 B10R0.74 CC/C=C\COCC(=O)OC 14e106e074a4f78b35a827be1b81d218 [0,1,0,0,0,0|1,0,2]=4 2907 B10R0.74 CC=CCNCCC(=O)OC 367c1a7fc8289463c84a20eca95be8a4 [0,1,0,0,0,0|1,0,2]=4 2908 B10R0.74 CC=CCOCCC(=O)OC dd611678d04db410bfaf196bff3894b7 [0,1,0,0,0,0|1,0,2]=4 2909 B10R0.74 CCC#CCOCC(=O)OC 9869a0b1a08f272f6f7e87e1a7df5c50 [0,1,0,0,0,0|1,0,2]=4 2910 B10R0.74 CCC(=O)CNCCCCCl 58b326e56bd105b75957a3417ada4b94 [0,1,0,0,0,0|3,0,0]=4 2911 B10R0.74 CCC(=O)CNCCCCO afa336155d3d50267b56893fb4eea6a2 [0,1,0,0,0,0|3,0,0]=4 2912 B10R0.74 CCC(=O)CNCCCCS 89d3a8e0e76cf4458dea73594882c77e [0,1,0,0,0,0|3,0,0]=4 2913 B10R0.74 CCC(=O)CNCCCOC 796b52210881430f2b55b106f0eae362 [0,1,0,0,0,0|3,0,0]=4 2914 B10R0.74 CCC(=O)CNCCCSC 937029030da1b54e36436a66ae1644dc [0,1,0,0,0,0|3,0,0]=4 2915 B10R0.74 CCC(=O)COCCCCF 4256b82eb7b4015a55aaae3b4f33c831 [0,1,0,0,0,0|3,0,0]=4 2916 B10R0.74 CCC(=O)COCCCCS 6565f26a778339bd381373257b145382 [0,1,0,0,0,0|3,0,0]=4 2917 B10R0.74 CCC(=O)COCCCOC 1151fd7fb421340ad8cdf3f7159df49b [0,1,0,0,0,0|3,0,0]=4 2918 B10R0.74 CCC(=O)COCCCSC 1eae8353d4c4b23362968ab5d33e2b0f [0,1,0,0,0,0|3,0,0]=4 2919 B10R0.74 CCC(=O)NCCCCCCl 719912c2fc32999aaca586ce6a33a4fc [0,1,0,0,0,0|3,0,0]=4 2920 B10R0.74 CCC(=O)NCCCCCO 1c6fabc29010351852246ff1decd06a1 [0,1,0,0,0,0|3,0,0]=4 2921 B10R0.74 CCC(=O)NCCCCOC 304fb086e3dbdc4472ef768bd3e17d25 [0,1,0,0,0,0|3,0,0]=4 2922 B10R0.74 CCC(=O)NCCCCSC e2aaa2c9252a2834ce862f0cb7545c18 [0,1,0,0,0,0|3,0,0]=4 2923 B10R0.74 CCCCCCCN(C)C=O cabb5953e5f85ac4e59396bcaf0e43b7 [0,1,0,0,0,0|2,0,0]=3 2924 B10R0.74 CCCCCCCN(C)CC 47b76648ffaec1d683c10fbd55b8b760 [0,1,0,0,0,0|3,0,0]=4 2925 B10R0.74 CCCCCCCN(C)CF efc27d4909d8b5313adc8ac4275b32da [0,1,0,0,0,0|3,0,0]=4 2926 B10R0.74 CCCCCCCN(C)CO 573521cd3fbdacea8ebfd46803417275 [0,1,0,0,0,0|2,0,0]=3 2927 B10R0.74 CCCCCCNC(=O)C=O 77542971675e4c1be34f9cc380438664 [0,1,0,0,0,0|1,0,1]=3 2928 B10R0.74 CCCCCCNC(=O)CC f0032df3cc8c2000bc1576b718e1412f [0,1,0,0,0,0|2,0,0]=3 2929 B10R0.74 CCCCCCNC(=O)CF 738680f040b17c056aa0d8344a6ec8af [0,1,0,0,0,0|2,0,0]=3 2930 B10R0.74 CCCCCCNC(=O)CO e8cf9f23cdf04b79897a080a69f10636 [0,1,0,0,0,0|1,0,0]=2 2931 B10R0.74 CCCCCCNC(=O)CS 3e91e20700d92addaced40b0a6fc3a10 [0,1,0,0,0,0|1,1,0]=3 2932 B10R0.74 CCCCCCNC(C)C=O b976c3b07f1bcd7d7bf4ea0f7dda9d2e [0,1,0,0,0,0|2,0,1]=4 2933 B10R0.74 CCCCCCNC(C)CO 07ceb339611b1c528c6b5c7f6cc75c93 [0,1,0,0,0,0|2,0,1]=4 2934 B10R0.74 CCCCCCN[C@@H](C)CO 4743e3b17903aa1add096c5d6519b0c1 [0,1,0,0,0,0|2,0,1]=4 2935 B10R0.74 CCCCCCN[C@H](C)C=O c1f3002178c0951e2fc282654b4ab5ac [0,1,0,0,0,0|2,0,1]=4 2936 B10R0.74 CCCCCCN[C@H](C)CO 30ba1c8e11fd11e8a728d06f64037e6a [0,1,0,0,0,0|2,0,1]=4 2937 B10R0.74 CCCCCCOC(C)C=O 53cdcf5ad06947d7299adccaa193f0cc [0,1,0,0,0,0|2,0,1]=4 2938 B10R0.74 CCCCCCO[C@H](C)C=O 6de2ee791cd08619fd7f79912e5eccbb [0,1,0,0,0,0|2,0,1]=4 2939 B10R0.74 CCCCCNC/C(=C/Cl)/Cl 07f577724a35e6fc59a67f87da303756 [0,1,0,0,0,0|3,0,0]=4 2940 B10R0.74 CCCCCNCC(=O)CC 9dd2e224792ae6d66bce0b7cb1ae679b [0,1,0,0,0,0|2,0,0]=3 2941 B10R0.74 CCCCCNCC(=O)CO 6b2786aaa9795a5c5117cb363febeda7 [0,1,0,0,0,0|1,0,0]=2 2942 B10R0.74 CCCCCNCC(=O)NC 824806198187a2c8b60b648f0512f923 [0,1,0,0,0,0|2,0,0]=3 2943 B10R0.74 CCCCCNCC(=O)NO aea682c668d0435bfcc8e8bd09e49795 [0,1,0,0,0,0|1,0,0]=2 2944 B10R0.74 CCCCCNCC(=O)OC 648365248fe1587b1bbc2cd6174118d5 [0,1,0,0,0,0|1,0,0]=2 2945 B10R0.74 CCCCCNCC(C)CO ef7f03b77fd3afaa805373f90c3e56aa [0,1,0,0,0,0|2,0,1]=4 2946 B10R0.74 CCCCCNCC(C)OC e1a7290ebd35116e5dd33a73a4d62278 [0,1,0,0,0,0|2,0,1]=4 2947 B10R0.74 CCCCCNCC(F)CO 2ea7729e2c5077c95f45eb5327b66e01 [0,1,0,0,0,0|2,0,1]=4 2948 B10R0.74 CCCCCNCC(O)CC d6191ad3bd9358697a26014dd3c35d2e [0,1,0,0,0,0|2,0,1]=4 2949 B10R0.74 CCCCCNCC(O)CF 2294d811f3ddee0eb17dce26521c7bc6 [0,1,0,0,0,0|2,0,1]=4 2950 B10R0.74 CCCCCNCC(O)CO d3519d9a489173acf72b75770f9d71db [0,1,0,0,0,0|1,0,2]=4 2951 B10R0.74 CCCCCNC[C@@H](C)CO a665f6dd4dd9bac51b0be7828ee7dd2d [0,1,0,0,0,0|2,0,1]=4 2952 B10R0.74 CCCCCNC[C@@H](C)OC af6f9cd0a6a92dff3e8a066f619898a7 [0,1,0,0,0,0|2,0,1]=4 2953 B10R0.74 CCCCCNC[C@@H](F)CO 7a711a0395e408a042d54a5116e6b076 [0,1,0,0,0,0|2,0,1]=4 2954 B10R0.74 CCCCCNC[C@@H](O)CO 89026120ff28d3dbf2a83bce3cad26c0 [0,1,0,0,0,0|1,0,2]=4 2955 B10R0.74 CCCCCNC[C@H](C)CO 9d0f39d55298985b676bed1fd2f186e0 [0,1,0,0,0,0|2,0,1]=4 2956 B10R0.74 CCCCCNC[C@H](C)OC 28c8631af38e434585208ec75ceaa810 [0,1,0,0,0,0|2,0,1]=4 2957 B10R0.74 CCCCCNC[C@H](F)CO bb31d8090ca8e3abfa433e1f362f853a [0,1,0,0,0,0|2,0,1]=4 2958 B10R0.74 CCCCCNC[C@H](O)CC 141cc5eeaba79c4f9687c521abb8108f [0,1,0,0,0,0|2,0,1]=4 2959 B10R0.74 CCCCCNC[C@H](O)CO 015dca554ce841a00aec8917d717a402 [0,1,0,0,0,0|1,0,2]=4 2960 B10R0.74 CCCCCOC/C(=C/Cl)/Cl 9a7d4efabb9fc993d3d0b24cf5036e4f [0,1,0,0,0,0|3,0,0]=4 2961 B10R0.74 CCCCCOC/C(=C/I)/C c843c8568ed1236c0fce66b4b0a5eb1d [0,1,0,0,0,0|3,0,0]=4 2962 B10R0.74 CCCCCOCC(=CI)C caabb414f9557bfc8bfaf2823b6df5c7 [0,1,0,0,0,0|3,0,0]=4 2963 B10R0.74 CCCCCOCC(=O)CC dbc68622c1630e1162d4ac42bae10c20 [0,1,0,0,0,0|2,0,0]=3 2964 B10R0.74 CCCCCOCC(=O)NC 7963aeae3ec675f3acaacb8898855202 [0,1,0,0,0,0|2,0,0]=3 2965 B10R0.74 CCCCCOCC(=O)OC b7118d3515803bc38039c9851ac2a113 [0,1,0,0,0,0|1,0,0]=2 2966 B10R0.74 CCCCCOCC(C)OC 784d7bffd0552dcf06bcf9b89514c886 [0,1,0,0,0,0|2,0,1]=4 2967 B10R0.74 CCCCCOCC(O)CO a1b36fdc5e1bf46799aa0665344b2cd4 [0,1,0,0,0,0|1,0,2]=4 2968 B10R0.74 CCCCCOC[C@@H](C)OC a4877b9376583bb89200ebce31e15333 [0,1,0,0,0,0|2,0,1]=4 2969 B10R0.74 CCCCCOC[C@@H](O)CO dbec6fbfc37ac25dc27fe74f36f0fb6f [0,1,0,0,0,0|1,0,2]=4 2970 B10R0.74 CCCCCOC[C@H](C)OC 308df08929304a3a098581799a590a61 [0,1,0,0,0,0|2,0,1]=4 2971 B10R0.74 CCCCCOC[C@H](O)CO b973cba7b2684874077d1ef653495bea [0,1,0,0,0,0|1,0,2]=4 2972 B10R0.74 CCCCNCCC(=O)NC 9358a84b45aa382250269cc4a432e002 [0,1,0,0,0,0|2,0,0]=3 2973 B10R0.74 CCCCNCCC(=O)NO 939516755ac6ecba6fceb322e131b37b [0,1,0,0,0,0|1,0,0]=2 2974 B10R0.74 CCCCNCCC(=O)OC 09ad74908609854771fdcf0490c9897c [0,1,0,0,0,0|1,0,0]=2 2975 B10R0.74 CCCCNCCC(C)CO b4c09f84716ff041596d971974cd520f [0,1,0,0,0,0|2,0,1]=4 2976 B10R0.74 CCCCNCCC(O)CO eefcff15428a61b2cb99ab02c211b5b8 [0,1,0,0,0,0|1,0,2]=4 2977 B10R0.74 CCCCNCCS(=O)CC 4f7fd15358b9a857942c5bba78d45605 [0,1,0,0,0,0|3,0,0]=4 2978 B10R0.74 CCCCNCC[C@@H](C)CO 79c77af43a32e53f0b9406150011cecb [0,1,0,0,0,0|2,0,1]=4 2979 B10R0.74 CCCCNCOC(=O)CC e0b802cea9bb962c4bfe33b428a79424 [0,1,0,0,0,0|3,0,0]=4 2980 B10R0.74 CCCCNCOC(=O)OC b9862ebe4e8cf9ca635d6e2c0b6a69d3 [0,1,0,0,0,0|2,0,0]=3 2981 B10R0.74 CCCCOCCC(=O)NC 45b320f2a23c3fb98d60c20a9148826e [0,1,0,0,0,0|2,0,0]=3 2982 B10R0.74 CCCCOCCC(=O)OC e3be7e6d51b5d91e883aedbf1fdb6a9f [0,1,0,0,0,0|1,0,0]=2 2983 B10R0.74 CCCCOCCC(C)OC c8652128de7645f740690c6ee96dd945 [0,1,0,0,0,0|2,0,1]=4 2984 B10R0.74 CCCCOCCN(C)C=O 1c22f4c69f891be22902fa0967936897 [0,1,0,0,0,0|3,0,0]=4 2985 B10R0.74 CCCCOCCS(=O)CC a4f32aa190e55e60f786e86eb5a7eb42 [0,1,0,0,0,0|3,0,0]=4 2986 B10R0.74 CCCCOCOC(=O)CC 79f92447ebf68bdbe7c87af9f238ac09 [0,1,0,0,0,0|3,0,0]=4 2987 B10R0.74 CCCCOCOC(=O)OC f2b08abd9d6a5d7efd1cbb987a41251e [0,1,0,0,0,0|2,0,0]=3 2988 B10R0.74 CCCNC/C=C/C(=O)OC d187b40bc82130c5216e6dc2996aa46d [0,1,0,0,0,0|1,0,2]=4 2989 B10R0.74 CCCNC/C=C\C(=O)OC d531e3c68942266bed58d1eba3e9966a [0,1,0,0,0,0|1,0,2]=4 2990 B10R0.74 CCCNCC#CC(=O)OC fa9c5088cb0bba6fdab9fe49508304f7 [0,1,0,0,0,0|1,0,2]=4 2991 B10R0.74 CCCNCC=CC(=O)OC 350c6262148a20258506775102337b8b [0,1,0,0,0,0|1,0,2]=4 2992 B10R0.74 CCCNCCCC(=O)NC a3b31883785f33a03890cefb42b1d82a [0,1,0,0,0,0|2,0,0]=3 2993 B10R0.74 CCCNCCCC(=O)OC b16643f72059eae0ad94565e3f229a1f [0,1,0,0,0,0|1,0,0]=2 2994 B10R0.74 CCCNCCCC(C)CO 67fe566447d872b897b076ee88527f4f [0,1,0,0,0,0|2,0,1]=4 2995 B10R0.74 CCCNCCNC(=O)CC 654790e0c463f303ea5b5f1e104b3b23 [0,1,0,0,0,0|3,0,0]=4 2996 B10R0.74 CCCOC/C=C/C(=O)OC bfce11a355dc4f4a5487c0dbb8f55e6b [0,1,0,0,0,0|1,0,2]=4 2997 B10R0.74 CCCOC/C=C\C(=O)OC dcfa8ae3af300ec4f68156f25ffba366 [0,1,0,0,0,0|1,0,2]=4 2998 B10R0.74 CCCOCC#CC(=O)OC c1615b7f88b4176630c07fca414f7744 [0,1,0,0,0,0|1,0,2]=4 2999 B10R0.74 CCCOCC=CC(=O)OC 6c5e7ef1753396b9c64f09bd9c14ee05 [0,1,0,0,0,0|1,0,2]=4 3000 B10R0.74 CCCOCCCC(=O)NC 47cc15a6d3336cd77ff2e352f7e46945 [0,1,0,0,0,0|2,0,0]=3 3001 B10R0.74 CCCOCCCC(=O)OC 6777d826a7092669282f32ac583d5482 [0,1,0,0,0,0|1,0,0]=2 3002 B10R0.74 CCCOCCNC(=O)C=O b48a2b43e340f8d8431622a53eccba21 [0,1,0,0,0,0|2,0,1]=4 3003 B10R0.74 CCCOCCNC(=O)CC 37663f297721ace7d18f666f43feb975 [0,1,0,0,0,0|3,0,0]=4 3004 B10R0.74 CCCOCCNC(=O)CF 5013b76951d3f24534e4a2f4ef6f16d8 [0,1,0,0,0,0|3,0,0]=4 3005 B10R0.74 CCCOCCNC(=O)CO 2ce5430bc5513b3c98ba20d9c18070bf [0,1,0,0,0,0|2,0,0]=3 3006 B10R0.74 CCCOCCNC(=O)CS bc82f7eca67c7644035f9bc9a0838786 [0,1,0,0,0,0|2,1,0]=4 3007 B10R0.74 CCCOCCOC(=O)CC 0266b80a03c10e2cb61b113dd4b9130c [0,1,0,0,0,0|3,0,0]=4 3008 B10R0.74 CCCOCCOC(=O)OC 19df69bdbd15a1dd1020380f97d55a25 [0,1,0,0,0,0|2,0,0]=3 3009 B10R0.74 CCNCCCCC(=O)OC 2fc49225e902a66c0506ebb2378fe230 [0,1,0,0,0,0|1,0,0]=2 3010 B10R0.74 CCOCCCCC(=O)OC 26c440802f326860db2c18e76f91ac90 [0,1,0,0,0,0|1,0,0]=2 3011 B10R0.74 CCOCCCNC(=O)C=O e26629e3143069d085d1a92bd16f4eb5 [0,1,0,0,0,0|2,0,1]=4 3012 B10R0.74 CCOCCCNC(=O)CC 32ec07714ce8038f039e2cd922179ddc [0,1,0,0,0,0|3,0,0]=4 3013 B10R0.74 CCOCCCNC(=O)CF 582805b2461cea727120fee2c8152f5b [0,1,0,0,0,0|3,0,0]=4 3014 B10R0.74 CCOCCCNC(=O)CO de34d34d4a02261ee053fc87ff9ef871 [0,1,0,0,0,0|2,0,0]=3 3015 B10R0.74 CCOCCCNC(=O)CS 9aee97d749c5222418402473db97a090 [0,1,0,0,0,0|2,1,0]=4 3016 B10R0.74 CCOCCNCC(=O)CC d7706193ea63d1501ba50869205a2155 [0,1,0,0,0,0|3,0,0]=4 3017 B10R0.74 CCOCCNCC(=O)CO 1ea2cbfc198fa2591d39a771b8e1e70f [0,1,0,0,0,0|2,0,0]=3 3018 B10R0.74 CCOCCNCC(=O)NC a4d46dceae910736e1d8ece0285535cc [0,1,0,0,0,0|3,0,0]=4 3019 B10R0.74 CCOCCNCC(=O)NO 748a9fe806afccf2a109d95b53a47005 [0,1,0,0,0,0|2,0,0]=3 3020 B10R0.74 CCOCCNCC(=O)OC 4e8de05c8bba98d3809ba8d488720d7e [0,1,0,0,0,0|2,0,0]=3 3021 B10R0.74 CCOCCOCC(=O)CC f5ee646e9c774eb801506681a591586a [0,1,0,0,0,0|3,0,0]=4 3022 B10R0.74 CCOCCOCC(=O)NC 403ac419c87b63f3ab88a9e8e8198398 [0,1,0,0,0,0|3,0,0]=4 3023 B10R0.74 CCOCCOCC(=O)OC a85fffda64a094bd9fa34bf171e10958 [0,1,0,0,0,0|2,0,0]=3 3024 B10R0.74 CCOCNCCC(=O)NC 8726bb53147a199db2efd57673e2ff09 [0,1,0,0,0,0|3,0,0]=4 3025 B10R0.74 CCOCNCCC(=O)NO e87aeb25c57b530994778bbf252ee4a1 [0,1,0,0,0,0|2,0,0]=3 3026 B10R0.74 CCOCNCCC(=O)OC d1aa96682cb912ad175d4f3af69a7407 [0,1,0,0,0,0|2,0,0]=3 3027 B10R0.74 CCOCOCCC(=O)NC 8e4a46454820767ceb194bebfadcbfa0 [0,1,0,0,0,0|3,0,0]=4 3028 B10R0.74 CCOCOCCC(=O)OC a1011f85baa037966a10f0db7d9f71d6 [0,1,0,0,0,0|2,0,0]=3 3029 B10R0.74 CCSCCNCC(=O)CC ea42e9803fa591d5438d4ed46e472050 [0,1,0,0,0,0|3,0,0]=4 3030 B10R0.74 CCSCCNCC(=O)CO 4a5459b1f42cec65e48cf1e4b9606975 [0,1,0,0,0,0|2,0,0]=3 3031 B10R0.74 CCSCCNCC(=O)NC 387ff4d5af1f5c530e82ebd6d4452c5d [0,1,0,0,0,0|3,0,0]=4 3032 B10R0.74 CCSCCNCC(=O)NO 7f10bbdce3cb96363049e3b1f29984c9 [0,1,0,0,0,0|2,0,0]=3 3033 B10R0.74 CCSCCNCC(=O)OC 1ffb21202fa1cb9c1e862f710d175ea3 [0,1,0,0,0,0|2,0,0]=3 3034 B10R0.74 CCSCCOCC(=O)CC 82de2cead989ad44946e29a17907e2c4 [0,1,0,0,0,0|3,0,0]=4 3035 B10R0.74 CCSCCOCC(=O)NC dc4ea39a964dad3e0844aabb3720e833 [0,1,0,0,0,0|3,0,0]=4 3036 B10R0.74 CCSCCOCC(=O)OC 5721b0d191f483b2c5970b87ced2a450 [0,1,0,0,0,0|2,0,0]=3 3037 B10R0.74 CN(C=O)CCCCCCO fceebcab022774b9a914686cac752a97 [0,1,0,0,0,0|3,0,0]=4 3038 B10R0.74 CN(CO)CCCCCCO fef77a9b05242a3ef32caf219936c950 [0,1,0,0,0,0|3,0,0]=4 3039 B10R0.74 CNC(=O)CCCNCCBr d621ce1017dd8d58c3ab2c2dc78c1cf4 [0,1,0,0,0,0|3,0,0]=4 3040 B10R0.74 CNC(=O)CCCNCCF adbf6afb34238e81dc80681f9f5ad507 [0,1,0,0,0,0|3,0,0]=4 3041 B10R0.74 CNC(=O)CCCNCCI 34502bd426cbc6dd2b2777a4fafd09ee [0,1,0,0,0,0|3,0,0]=4 3042 B10R0.74 CNC(=O)CCCNCCO a86b9197033a953d5a019d019724da8f [0,1,0,0,0,0|3,0,0]=4 3043 B10R0.74 CNC(=O)CCCNCCS e948f4cfe7ca35e5bea28362aefacb19 [0,1,0,0,0,0|3,0,0]=4 3044 B10R0.74 CNC(=O)CCCOCCF 0db3ebb5f2cb21fdc582cf0e295e5c9c [0,1,0,0,0,0|3,0,0]=4 3045 B10R0.74 CNC(=O)CCCOCCS 507a06ed57ac68f0da280bf5fa21321e [0,1,0,0,0,0|3,0,0]=4 3046 B10R0.74 CNC(=O)CCCOCOC b97404eaddea3fd296603f6afce517f9 [0,1,0,0,0,0|3,0,0]=4 3047 B10R0.74 CNC(=O)CCCOCSC da9605829d888f8ef09324597b688ab0 [0,1,0,0,0,0|3,0,0]=4 3048 B10R0.74 CNC(=O)CCNCCCCl 0d6ceeb569360fce51a8b14520e2e2cd [0,1,0,0,0,0|3,0,0]=4 3049 B10R0.74 CNC(=O)CCNCCCF 7011f6c3b2fda239d970addee2951126 [0,1,0,0,0,0|3,0,0]=4 3050 B10R0.74 CNC(=O)CCNCCCO 2ac308ad2c10a6726746a34dc88a0836 [0,1,0,0,0,0|3,0,0]=4 3051 B10R0.74 CNC(=O)CCNCCCS efd5d849c04b3be11a4f803bda4e68e1 [0,1,0,0,0,0|3,0,0]=4 3052 B10R0.74 CNC(=O)CCNCCOC 9bc7712881127a70307ce9977ab1e2c6 [0,1,0,0,0,0|3,0,0]=4 3053 B10R0.74 CNC(=O)CCNCCSC e817e15d52c5742482368de6a39139eb [0,1,0,0,0,0|3,0,0]=4 3054 B10R0.74 CNC(=O)CCOCCCF 3bca7f4f198cad9d24ba307fbf8f76ee [0,1,0,0,0,0|3,0,0]=4 3055 B10R0.74 CNC(=O)CCOCCCS 5d9c11d8b0fa94717478c71f574f3259 [0,1,0,0,0,0|3,0,0]=4 3056 B10R0.74 CNC(=O)CCOCCOC 629412aabb318b29f10a8629f044ff87 [0,1,0,0,0,0|3,0,0]=4 3057 B10R0.74 CNC(=O)CCOCCSC d943354598e94d6d2e0f4823f550f7b5 [0,1,0,0,0,0|3,0,0]=4 3058 B10R0.74 CNC(=O)CNCCCCCl ad8469b53fd70faaa6d4f0f43d7abdbc [0,1,0,0,0,0|3,0,0]=4 3059 B10R0.74 CNC(=O)CNCCCCF aaabd6bd0631d3e3792c92d750723c46 [0,1,0,0,0,0|3,0,0]=4 3060 B10R0.74 CNC(=O)CNCCCCO 9fcc3c262abd92a26d930ee64b845fe6 [0,1,0,0,0,0|3,0,0]=4 3061 B10R0.74 CNC(=O)CNCCCCS 94548bef9fc92876ddb7e33d191b842a [0,1,0,0,0,0|3,0,0]=4 3062 B10R0.74 CNC(=O)CNCCCOC cefe65405c7e395fd4e5034393adc451 [0,1,0,0,0,0|3,0,0]=4 3063 B10R0.74 CNC(=O)CNCCCSC 7993536c9632ef8c9c47ae3ae46447a0 [0,1,0,0,0,0|3,0,0]=4 3064 B10R0.74 CNC(=O)COCCCCF e5cfbbc391ea62dab369734de7797662 [0,1,0,0,0,0|3,0,0]=4 3065 B10R0.74 CNC(=O)COCCCCS a075a14b0bcbcbfb6ce87ed6511d6ff4 [0,1,0,0,0,0|3,0,0]=4 3066 B10R0.74 CNC(=O)COCCCOC dc096f5fcc789a980ca069c01dbc106a [0,1,0,0,0,0|3,0,0]=4 3067 B10R0.74 CNC(=O)COCCCSC dc98b6786fe09456fa85c8c4306d9803 [0,1,0,0,0,0|3,0,0]=4 3068 B10R0.74 COC(=O)CCCCNC#N 1b8b1b122187395a606ad90b88f5959c [0,1,0,0,0,0|2,0,1]=4 3069 B10R0.74 COC(=O)CCCCNC=O 3b0149e079715ae53ff5de3a02b476ed [0,1,0,0,0,0|2,0,1]=4 3070 B10R0.74 COC(=O)CCCCNCF 24fe1f8ef5e7f92df15e23d781c2bda6 [0,1,0,0,0,0|2,0,0]=3 3071 B10R0.74 COC(=O)CCCCNCO f030f24f4426fe74e7d8ea04e70e74ca [0,1,0,0,0,0|2,0,0]=3 3072 B10R0.74 COC(=O)CCCCOCF 174910bab2d037713b18a265a8f3f46a [0,1,0,0,0,0|2,0,0]=3 3073 B10R0.74 COC(=O)CCCNCC#N 3922f1182d8d1edace48109f92bdd928 [0,1,0,0,0,0|2,0,1]=4 3074 B10R0.74 COC(=O)CCCNCC=O 9df69e8b11a22e50f3848dc60566a9b9 [0,1,0,0,0,0|2,0,1]=4 3075 B10R0.74 COC(=O)CCCNCCBr 9c51d334e0953320e19fea85b6b1fd6c [0,1,0,0,0,0|2,0,0]=3 3076 B10R0.74 COC(=O)CCCNCCF ab83e9b19a9d2139da2ebfe0bd5d3b37 [0,1,0,0,0,0|2,0,0]=3 3077 B10R0.74 COC(=O)CCCNCCI e868fd7399f288687e6a6c32f65774b5 [0,1,0,0,0,0|2,0,0]=3 3078 B10R0.74 COC(=O)CCCNCCO 8668c445b163b442f85ab895d00987c8 [0,1,0,0,0,0|2,0,0]=3 3079 B10R0.74 COC(=O)CCCNCCS d701e11e7ad693a35efd750085305a74 [0,1,0,0,0,0|2,0,0]=3 3080 B10R0.74 COC(=O)CCCNCSC faedf9d17f7f69f05e860d9f4c2eedac [0,1,0,0,0,0|2,0,0]=3 3081 B10R0.74 COC(=O)CCCOCC#N e74c2c7c28f1c40f6cccf99ad65df5de [0,1,0,0,0,0|2,0,1]=4 3082 B10R0.74 COC(=O)CCCOCCF 7a0d6361420304c7bd4ae6ecca548250 [0,1,0,0,0,0|2,0,0]=3 3083 B10R0.74 COC(=O)CCCOCCS c957c36687ac3de604796819e2d658fc [0,1,0,0,0,0|2,0,0]=3 3084 B10R0.74 COC(=O)CCNCCC#N cb9b3732262a6903e4fbb1edf85f3127 [0,1,0,0,0,0|2,0,1]=4 3085 B10R0.74 COC(=O)CCNCCC=O c2c940a6fd56496a7ff3c38d2302e2bf [0,1,0,0,0,0|2,0,1]=4 3086 B10R0.74 COC(=O)CCNCCCCl fcdabf0770998f9d46c59cfa4e7bc088 [0,1,0,0,0,0|2,0,0]=3 3087 B10R0.74 COC(=O)CCNCCCF 2069cb4a743aa178a680e4a0d2a4552a [0,1,0,0,0,0|2,0,0]=3 3088 B10R0.74 COC(=O)CCNCCCO e96655e5337f5162972d522187b13057 [0,1,0,0,0,0|2,0,0]=3 3089 B10R0.74 COC(=O)CCNCCCS 91305a6874847a37968800110fe7e78a [0,1,0,0,0,0|2,0,0]=3 3090 B10R0.74 COC(=O)CCNCCON dc6c9a681cce8477cb2e7b7e0ac73b45 [0,1,0,0,0,0|3,0,0]=4 3091 B10R0.74 COC(=O)CCNCCSC 9e4c27bedbde00d5252809e0aa58c89e [0,1,0,0,0,0|2,0,0]=3 3092 B10R0.74 COC(=O)CCOCCC#N 1bd15e9d93fe60d1596d2336d4d69f0c [0,1,0,0,0,0|2,0,1]=4 3093 B10R0.74 COC(=O)CCOCCC=O a434f9716b90990b60fdb2b5161bbdf4 [0,1,0,0,0,0|2,0,1]=4 3094 B10R0.74 COC(=O)CCOCCCF 0aefebceea2c1de4d61a01719abc4a0b [0,1,0,0,0,0|2,0,0]=3 3095 B10R0.74 COC(=O)CCOCCCS 5520c0b92e39a85c24dc627f637a0781 [0,1,0,0,0,0|2,0,0]=3 3096 B10R0.74 COC(=O)CCOCCSC fdd64bc9ba11e14400f289a9f49df6a4 [0,1,0,0,0,0|2,0,0]=3 3097 B10R0.74 COC(=O)CNCCCC#N 634c3ddab2ca166da70bfe996219e039 [0,1,0,0,0,0|2,0,1]=4 3098 B10R0.74 COC(=O)CNCCCC=O feb0224454c5ae2912d525acfdd54d72 [0,1,0,0,0,0|2,0,1]=4 3099 B10R0.74 COC(=O)CNCCCCCl 5e9c4c1e412ed1d57e7a65a24f3d16e9 [0,1,0,0,0,0|2,0,0]=3 3100 B10R0.74 COC(=O)CNCCCCF 9c6b6f9c58be9fe01b9d5c3b50313ca6 [0,1,0,0,0,0|2,0,0]=3 3101 B10R0.74 COC(=O)CNCCCCO ea42ac0b81f4922b97a1f7174639fed1 [0,1,0,0,0,0|2,0,0]=3 3102 B10R0.74 COC(=O)CNCCCCS 81de9b1e99aeb0dc4a838becc69c5385 [0,1,0,0,0,0|2,0,0]=3 3103 B10R0.74 COC(=O)CNCCCSC 5fac51759d1aaf12d9eb7dac1709d600 [0,1,0,0,0,0|2,0,0]=3 3104 B10R0.74 COC(=O)COCCCC#N 6d192d824377428750d46f595a56204c [0,1,0,0,0,0|2,0,1]=4 3105 B10R0.74 COC(=O)COCCCC=O 4dd7b1f2c695da3adcecd9c873c78236 [0,1,0,0,0,0|2,0,1]=4 3106 B10R0.74 COC(=O)COCCCCF 004fc87d8325e555e0ba69b8de39ce15 [0,1,0,0,0,0|2,0,0]=3 3107 B10R0.74 COC(=O)COCCCCS 66361017a5f0eedafd224c8fdcb3465c [0,1,0,0,0,0|2,0,0]=3 3108 B10R0.74 COC(=O)COCCCSC cccf2e9fa2ee0349c1d66b0bc4f29a76 [0,1,0,0,0,0|2,0,0]=3 3109 B10R0.74 COC(=O)COCCOCF 42ae6b861206092659c9379d5be339fd [0,1,0,0,0,0|3,0,0]=4 3110 B10R0.74 COC(=O)OCCOCCF 3e93e2da9fd5bb891a00a4d9e4ff966c [0,1,0,0,0,0|3,0,0]=4 3111 B10R0.74 COC(=O)OCCOCCS 4f916091a7653337bd8b08ea257c2679 [0,1,0,0,0,0|3,0,0]=4 3112 B10R0.74 COC(=O)OCCOCSC 26e45fce16a76890b8820ac852cfbbed [0,1,0,0,0,0|3,0,0]=4 3113 B10R0.74 COC(=O)OCNCCCCl d79540cf63b385e5a7bb99911ba947b9 [0,1,0,0,0,0|3,0,0]=4 3114 B10R0.74 COC(=O)OCNCCCO aa57fdea458b9cde3098f1b2b1cac60d [0,1,0,0,0,0|3,0,0]=4 3115 B10R0.74 COC(=O)OCNCCSC 5226cf2e698b7b2701cdb1ea5e1ff800 [0,1,0,0,0,0|3,0,0]=4 3116 B10R0.74 COC(=O)OCOCCCF 0bd11ef2421d394ee1fc14f2647065ad [0,1,0,0,0,0|3,0,0]=4 3117 B10R0.74 COC(=O)OCOCCCS e0aafe56f3d968247475b6fe1690b9c8 [0,1,0,0,0,0|3,0,0]=4 3118 B10R0.74 COC(=O)OCOCCSC d1a8d2ca5dd68b79bcb6ee0a01436975 [0,1,0,0,0,0|3,0,0]=4 3119 B10R0.74 COCCCCNC(=O)C=O dcfd456ef4c75eb838189d43dc84bcbe [0,1,0,0,0,0|2,0,1]=4 3120 B10R0.74 COCCCCNC(=O)CF cf76a8228453b7346d5cf8b259a2422f [0,1,0,0,0,0|3,0,0]=4 3121 B10R0.74 COCCCCNC(=O)CO d7d94f3a67430ea44e1c65949e7a69c7 [0,1,0,0,0,0|2,0,0]=3 3122 B10R0.74 COCCCCNC(=O)CS 8bc7a2fca7467e20f3b76c5ce8119b06 [0,1,0,0,0,0|2,1,0]=4 3123 B10R0.74 COCCCNCC(=O)CO 4d2e6eb26214709d3c0db011581cbd09 [0,1,0,0,0,0|2,0,0]=3 3124 B10R0.74 COCCCNCC(=O)NO 4dd5d90a34b287dc0f8454a4591e826e [0,1,0,0,0,0|2,0,0]=3 3125 B10R0.74 COCCCNCC(=O)OC 32312a1b3f85bb4e70f6e4e37ca6fef7 [0,1,0,0,0,0|2,0,0]=3 3126 B10R0.74 COCCCOCC(=O)OC d608caa140492e0b0fcb94dda1926cf5 [0,1,0,0,0,0|2,0,0]=3 3127 B10R0.74 COCCNCCC(=O)NO d6621e17238c9330bde4d58de6a6b08f [0,1,0,0,0,0|2,0,0]=3 3128 B10R0.74 COCCNCCC(=O)OC 7c1ddb99a5aa10e5cebf2f0a1943a5a1 [0,1,0,0,0,0|2,0,0]=3 3129 B10R0.74 COCCNCOC(=O)OC 6381be7280054d6355fce5e1cfbfa9ed [0,1,0,0,0,0|3,0,0]=4 3130 B10R0.74 COCCOCCC(=O)OC 9517e4d9c854e0a6d5b0b99ca928d942 [0,1,0,0,0,0|2,0,0]=3 3131 B10R0.74 COCCOCOC(=O)OC a5c2d2e6baaf0a1567c032e04db1bf65 [0,1,0,0,0,0|3,0,0]=4 3132 B10R0.74 COCNCCCC(=O)OC 085c0ab887f5e3d1ddfd29e981267fd3 [0,1,0,0,0,0|2,0,0]=3 3133 B10R0.74 COCOCCCC(=O)OC b68fbbe3b66cde135d1c1e599e84c93f [0,1,0,0,0,0|2,0,0]=3 3134 B10R0.74 COCOCCOC(=O)OC 40eecdd82c26596431406769198420fd [0,1,0,0,0,0|3,0,0]=4 3135 B10R0.74 CSCCCCNC(=O)C=O e4d05bea79935cb5cf5c96919012382a [0,1,0,0,0,0|2,0,1]=4 3136 B10R0.74 CSCCCCNC(=O)CF 6ea934a2fae8c21cd25cd60e33c07f97 [0,1,0,0,0,0|3,0,0]=4 3137 B10R0.74 CSCCCCNC(=O)CO 0897b4bc23cfc693fb313fd1e05b76d5 [0,1,0,0,0,0|2,0,0]=3 3138 B10R0.74 CSCCCCNC(=O)CS 51b70df598406bddcb3bcbea875612b0 [0,1,0,0,0,0|2,1,0]=4 3139 B10R0.74 CSCCCNCC(=O)CO 79cedfd00ec1fa793e7cf1eb627d5013 [0,1,0,0,0,0|2,0,0]=3 3140 B10R0.74 CSCCCNCC(=O)NO 2e5ee0abbfe1b2a36f903e46ace45ca2 [0,1,0,0,0,0|2,0,0]=3 3141 B10R0.74 CSCCNCCC(=O)NO d32fac13729997cd17638a00bdbfdf74 [0,1,0,0,0,0|2,0,0]=3 3142 B10R0.74 N#CCCCCNC(=O)CO 65a865b398b2d351af4edd38cd8a3352 [0,1,0,0,0,0|2,0,1]=4 3143 B10R0.74 N#CCCCNCC(=O)CO 89e4c87542df779987b1f9358ae0407d [0,1,0,0,0,0|2,0,1]=4 3144 B10R0.74 N#CCCCNCC(=O)NO c4607e2ca28ed169da3079927f43e8a1 [0,1,0,0,0,0|2,0,1]=4 3145 B10R0.74 N#CCCNCCC(=O)NO 2a3684315afd565b1be3ddb250153573 [0,1,0,0,0,0|2,0,1]=4 3146 B10R0.74 O=C(CCNCCCF)NO 6f33222dc9314ed71b92ce57ff8c3a24 [0,1,0,0,0,0|2,0,0]=3 3147 B10R0.74 O=C(CCNCCCO)NO 652623971027b1cb3b1e33201aeb0039 [0,1,0,0,0,0|2,0,0]=3 3148 B10R0.74 O=C(CCNCCCS)NO 946908aa9cf3c3a2ff68c3093a28e21a [0,1,0,0,0,0|2,0,0]=3 3149 B10R0.74 O=C(CF)NCCCCCCl 6b93aba3941c6d4a7ff32a8d7d29cb35 [0,1,0,0,0,0|3,0,0]=4 3150 B10R0.74 O=C(CF)NCCCCCO cc98c8ff260eb1512f4030c943faa4ab [0,1,0,0,0,0|3,0,0]=4 3151 B10R0.74 O=C(CNCCCCF)NO 375575db4b9624c405e5f14553c801d2 [0,1,0,0,0,0|2,0,0]=3 3152 B10R0.74 O=C(CNCCCCO)NO b6a072521c9247b905a9a160464cc7fe [0,1,0,0,0,0|2,0,0]=3 3153 B10R0.74 O=C(CO)CNCCCCCl 2c3140c0f55a72e71c8b41008de91832 [0,1,0,0,0,0|2,0,0]=3 3154 B10R0.74 O=C(CO)CNCCCCO 814979fe34337e9065f3333a43425939 [0,1,0,0,0,0|2,0,0]=3 3155 B10R0.74 O=C(CO)CNCCCCS ed26889d691546d8252a9fc71c0f594d [0,1,0,0,0,0|2,0,0]=3 3156 B10R0.74 O=C(CO)NCCCCCCl bb852b5e0473f7eaf3faafcb8f02cf64 [0,1,0,0,0,0|2,0,0]=3 3157 B10R0.74 O=C(CO)NCCCCCO 8ea79bd119a2d2f4afdd555f388978a6 [0,1,0,0,0,0|2,0,0]=3 3158 B10R0.74 O=C(CO)NCCOCCO a60d1514c3ec1001cb06ee0fb7350fe4 [0,1,0,0,0,0|3,0,0]=4 3159 B10R0.74 O=C(CO)NCCOCCS d1c07c44305f486ba9727cb76548192e [0,1,0,0,0,0|3,0,0]=4 3160 B10R0.74 O=C(CO)NCCSCCO 801fd1b3808ba931f3ac65e6d2d53fa4 [0,1,0,0,0,0|3,0,0]=4 3161 B10R0.74 O=C(CS)NCCCCCCl 5338d3b263c8353b8756bcc2bc2e3eb1 [0,1,0,0,0,0|2,1,0]=4 3162 B10R0.74 O=C(CS)NCCCCCO f99d02ad12fcfe5a585d335e2a21ea39 [0,1,0,0,0,0|2,1,0]=4 3163 B10R0.74 O=CC(=O)NCCCCCCl 971bc84cc956716152c275e954cf175a [0,1,0,0,0,0|2,0,1]=4 3164 B10R0.74 O=CC(=O)NCCCCCO 7a2388d74c1856698a8110420b0ac876 [0,1,0,0,0,0|2,0,1]=4 3165 B10R0.74 O=CCCCNCC(=O)NO f00b2a077879ea9967338cecb3462831 [0,1,0,0,0,0|2,0,1]=4 3166 B10R0.74 O=CCCNCCC(=O)NO d9a8e755f2899556d9f2c97bd55e50c4 [0,1,0,0,0,0|2,0,1]=4 3167 B10R0.75 C#CCCCNC(C)C(=O)O d46e183c06ee36e009f8fff94534c48c [0,1,0,0,0,0|1,0,2]=4 3168 B10R0.75 C#CCCCNC(O)C(=O)O c7adbc14785259b0a820e84f7a18ba8a [0,1,0,0,0,0|1,0,2]=4 3169 B10R0.75 C#CCCCN[C@@H](C)C(=O)O d3bf4b4551f0675c1d90feb45e863d22 [0,1,0,0,0,0|1,0,2]=4 3170 B10R0.75 C#CCCCN[C@H](C)C(=O)O 2bef987c5528c191ae35833640bd753f [0,1,0,0,0,0|1,0,2]=4 3171 B10R0.75 C#CCCCOC(C)C(=O)O 0f1d2267876a0dd3b36472595944daf6 [0,1,0,0,0,0|1,0,2]=4 3172 B10R0.75 C#CCCCO[C@@H](C)C(=O)O 53ed968823931b9ff21581bff6669db6 [0,1,0,0,0,0|1,0,2]=4 3173 B10R0.75 C#CCCCO[C@H](C)C(=O)O cae52306c2088cd11e6d081a279e7b83 [0,1,0,0,0,0|1,0,2]=4 3174 B10R0.75 C#CCCNCC(C)C(=O)O a8647c257841732a9dd7d585545a1dbf [0,1,0,0,0,0|1,0,2]=4 3175 B10R0.75 C#CCCNCC(F)C(=O)O be7ad2b6d40585f2a2ad0d199cac7dd7 [0,1,0,0,0,0|1,0,2]=4 3176 B10R0.75 C#CCCNCC(O)C(=O)O 5e3215297106e820d083f964e7adf38a [0,1,0,0,0,0|1,0,2]=4 3177 B10R0.75 C#CCCNC[C@@H](C)C(=O)O 85152040e19d820353293c401c9ab299 [0,1,0,0,0,0|1,0,2]=4 3178 B10R0.75 C#CCCNC[C@@H](O)C(=O)O 35b9c9707572121ecccf594cb84ab0ce [0,1,0,0,0,0|1,0,2]=4 3179 B10R0.75 C#CCCNC[C@H](C)C(=O)O fbc343388c586cc956daed4c97dd143a [0,1,0,0,0,0|1,0,2]=4 3180 B10R0.75 C#CCCNC[C@H](O)C(=O)O fb5b7460b7387502b4c69e2b60270e0a [0,1,0,0,0,0|1,0,2]=4 3181 B10R0.75 C#CCCOCC(C)C(=O)O 477d99adfc306e68ae8b52f752c340a8 [0,1,0,0,0,0|1,0,2]=4 3182 B10R0.75 C#CCCOC[C@@H](C)C(=O)O e924eeeb31e395cc9259e68f22cec134 [0,1,0,0,0,0|1,0,2]=4 3183 B10R0.75 C#CCCOC[C@H](C)C(=O)O 7ac9f38660bed1095bb1462bc498d4a5 [0,1,0,0,0,0|1,0,2]=4 3184 B10R0.75 C#CCNCCC(F)C(=O)O 27bbc1ea74758fb775d5265831cd4712 [0,1,0,0,0,0|1,0,2]=4 3185 B10R0.75 C#CCNCCC(O)C(=O)O 72ddf24a9c94f98fd7ecc972c12a4487 [0,1,0,0,0,0|1,0,2]=4 3186 B10R0.75 C#CCNCC[C@H](O)C(=O)O c7ef0d1e20d634ec0438aa3ffa15163a [0,1,0,0,0,0|1,0,2]=4 3187 B10R0.75 C/C=C/CNCC(C)C(=O)O 9b6e5d3f8689831e5d980490aaaee565 [0,1,0,0,0,0|1,0,2]=4 3188 B10R0.75 C/C=C/CNCC(F)C(=O)O f5ac822664a04159d0acd29af333ebb5 [0,1,0,0,0,0|1,0,2]=4 3189 B10R0.75 C/C=C/CNCC(O)C(=O)O 81a5cd467106a3dc74a4166223b5a7f7 [0,1,0,0,0,0|1,0,2]=4 3190 B10R0.75 C/C=C/CNC[C@@H](C)C(=O)O 7cead21caf76faff5c18b38001067b9d [0,1,0,0,0,0|1,0,2]=4 3191 B10R0.75 C/C=C/CNC[C@@H](O)C(=O)O 933e39be6b567942a29ce50c22dec874 [0,1,0,0,0,0|1,0,2]=4 3192 B10R0.75 C/C=C/CNC[C@H](C)C(=O)O 7c40ea8caae029d043f3f27b759e3b76 [0,1,0,0,0,0|1,0,2]=4 3193 B10R0.75 C/C=C/CNC[C@H](O)C(=O)O 2643aa9b5f1422258befebde8fee6ed0 [0,1,0,0,0,0|1,0,2]=4 3194 B10R0.75 C/C=C/COCC(C)C(=O)O 791efd0d2d3b7ba675c897c5aea33f2c [0,1,0,0,0,0|1,0,2]=4 3195 B10R0.75 C/C=C/COC[C@@H](C)C(=O)O ff13c0adbc344d4a9535665fbbb2ae47 [0,1,0,0,0,0|1,0,2]=4 3196 B10R0.75 C/C=C/COC[C@H](C)C(=O)O d7f06b87f711c5ed865d11cd761beeae [0,1,0,0,0,0|1,0,2]=4 3197 B10R0.75 C/C=C\CNCC(C)C(=O)O f884294ea8e18ac53432b582889c58fd [0,1,0,0,0,0|1,0,2]=4 3198 B10R0.75 C/C=C\CNCC(F)C(=O)O 69420df7820f940f56794aa927ec0696 [0,1,0,0,0,0|1,0,2]=4 3199 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[0,1,0,0,0,0|2,0,0]=3 3311 B10R0.75 CCCCCN[C@H](C)C(=O)O cf05f4ee4299fbdf1ec78d0468c5276e [0,1,0,0,0,0|1,0,0]=2 3312 B10R0.75 CCCCCOC(C)C(=O)C ef6c55e18179136cda5b21537b82a891 [0,1,0,0,0,0|2,0,0]=3 3313 B10R0.75 CCCCCOC(C)C(=O)N 2052566ee2e5a58bbcc69cffbc985a74 [0,1,0,0,0,0|2,0,0]=3 3314 B10R0.75 CCCCCOC(C)C(=O)O d9a0cb918530269c86b9f8f93a0b386e [0,1,0,0,0,0|1,0,0]=2 3315 B10R0.75 CCCCCOC(F)C(=O)N 27aecf7e27d511ba56dbadb469dd35a8 [0,1,0,0,0,0|2,0,0]=3 3316 B10R0.75 CCCCCOC(F)C(=O)O 2ec572c2e9f4242a425c59d79225beda [0,1,0,0,0,0|1,0,0]=2 3317 B10R0.75 CCCCCO[C@@H](C)C(=O)N e39c15bf8fe0533a164779a56832111d [0,1,0,0,0,0|2,0,0]=3 3318 B10R0.75 CCCCCO[C@@H](C)C(=O)O 699cec09f5a70bc50bc69a7af1564b33 [0,1,0,0,0,0|1,0,0]=2 3319 B10R0.75 CCCCCO[C@@H](F)C(=O)O 79f8f0368673871b87fc7c14e08ffcf9 [0,1,0,0,0,0|1,0,0]=2 3320 B10R0.75 CCCCCO[C@H](C)C(=O)N 7b6c5897aa3c2bbffd958cb2f9bf9014 [0,1,0,0,0,0|2,0,0]=3 3321 B10R0.75 CCCCCO[C@H](C)C(=O)O 1003b54a4dca2cab07f6967f17d22592 [0,1,0,0,0,0|1,0,0]=2 3322 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0cb21ad6866fea6ce1f1961d6979636b [0,1,0,0,0,0|2,0,0]=3 3447 B10R0.75 CSCCOC[C@@H](C)C(=O)O 7689e76c57b895fd005ec7f894b1fdbb [0,1,0,0,0,0|2,0,0]=3 3448 B10R0.75 CSCCOC[C@H](C)C(=O)O 4d854f17063dd57c616287689dfba709 [0,1,0,0,0,0|2,0,0]=3 3449 B10R0.75 CSCNCCC(F)C(=O)O 3c0ae72c3610a64e48da3157f3d13b58 [0,1,0,0,0,0|2,0,0]=3 3450 B10R0.75 CSCNCCC(O)C(=O)O 69a7fdd405172e4d5591c15359ec8228 [0,1,0,0,0,0|2,0,0]=3 3451 B10R0.75 CSCNCC[C@H](O)C(=O)O 743924326ec47e16033d94ae95e0cadb [0,1,0,0,0,0|2,0,0]=3 3452 B10R0.75 C[C@@H](CNCCC#N)C(=O)O 829bb84b8960c70293e398ce8f6f1503 [0,1,0,0,0,0|2,0,1]=4 3453 B10R0.75 C[C@@H](CNCCC=O)C(=O)O 02d5f6d49cfd0d6101136a94c9ae912a [0,1,0,0,0,0|2,0,1]=4 3454 B10R0.75 C[C@@H](CNCCCF)C(=O)O 1945bb11a227de8d514ef56a15c73c06 [0,1,0,0,0,0|2,0,0]=3 3455 B10R0.75 C[C@@H](CNCCCO)C(=O)O 0600dfa8d5ce99863097968e7b901e75 [0,1,0,0,0,0|2,0,0]=3 3456 B10R0.75 C[C@@H](CNCCCS)C(=O)O ed057e7c6d5b68d70c1d9bf1c59ed2c4 [0,1,0,0,0,0|2,0,0]=3 3457 B10R0.75 C[C@@H](COCCC#N)C(=O)O 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C[C@@H](NCCCCO)C(=O)O fc2960ab9447c61f7ee313406493816e [0,1,0,0,0,0|2,0,0]=3 3469 B10R0.75 C[C@@H](NCCCCS)C(=O)N 28c7df3d39a720f1a5b67ac64fc2d40a [0,1,0,0,0,0|3,0,0]=4 3470 B10R0.75 C[C@@H](NCCCCS)C(=O)O 47848dd0075af980a92096b0fb7dffe0 [0,1,0,0,0,0|2,0,0]=3 3471 B10R0.75 C[C@@H](OCCCC#N)C(=O)O 4581bb11078e76a415e2092715a6414c [0,1,0,0,0,0|2,0,1]=4 3472 B10R0.75 C[C@@H](OCCCC=O)C(=O)O 9e331559c9378addef08b1d70d0bc435 [0,1,0,0,0,0|2,0,1]=4 3473 B10R0.75 C[C@@H](OCCCCF)C(=O)N 97d5a52dc9b5aa673084a649ace747ba [0,1,0,0,0,0|3,0,0]=4 3474 B10R0.75 C[C@@H](OCCCCF)C(=O)O 7bf7c08cd456746ff9c5a1093290cc12 [0,1,0,0,0,0|2,0,0]=3 3475 B10R0.75 C[C@@H](OCCCCS)C(=O)N c34427f1428923f2d2afa74f73cc09f6 [0,1,0,0,0,0|3,0,0]=4 3476 B10R0.75 C[C@H](CNCCC#N)C(=O)O dda6b9ec377122cd9e50fe9b6ca261cc [0,1,0,0,0,0|2,0,1]=4 3477 B10R0.75 C[C@H](CNCCC=O)C(=O)O fa5997b5cdf0a2e2dbb38b97cfa011b5 [0,1,0,0,0,0|2,0,1]=4 3478 B10R0.75 C[C@H](CNCCCF)C(=O)O 17a102b54c5459c5476cb8f8a74d692c [0,1,0,0,0,0|2,0,0]=3 3479 B10R0.75 C[C@H](CNCCCO)C(=O)O af7a2c0a7f68894696358259f3b6617c [0,1,0,0,0,0|2,0,0]=3 3480 B10R0.75 C[C@H](CNCCCS)C(=O)O dfc2557c0615b0f77f17da932856b1c0 [0,1,0,0,0,0|2,0,0]=3 3481 B10R0.75 C[C@H](COCCC#N)C(=O)O 6bc435693768a4b4cca18f19a4c9f176 [0,1,0,0,0,0|2,0,1]=4 3482 B10R0.75 C[C@H](COCCC=O)C(=O)O 0c4f55e2e04e5b1b05c37a3b30897873 [0,1,0,0,0,0|2,0,1]=4 3483 B10R0.75 C[C@H](COCCCF)C(=O)O 33550bbb64f3c931bdd974414d3aaee6 [0,1,0,0,0,0|2,0,0]=3 3484 B10R0.75 C[C@H](COCCCS)C(=O)O bae2089bb8473bc491cd066708a4f551 [0,1,0,0,0,0|2,0,0]=3 3485 B10R0.75 C[C@H](NCCCC#N)C(=O)O 18224f7a71a7632e0624a032babf1cfb [0,1,0,0,0,0|2,0,1]=4 3486 B10R0.75 C[C@H](NCCCC=O)C(=O)O 1df4c97cba960d506124b87dcca0a436 [0,1,0,0,0,0|2,0,1]=4 3487 B10R0.75 C[C@H](NCCCCCl)C(=O)N 321bb377bf2712a1905baa29dcebc25a [0,1,0,0,0,0|3,0,0]=4 3488 B10R0.75 C[C@H](NCCCCCl)C(=O)O 122350c1c341412d0d43bd05ab68f9e0 [0,1,0,0,0,0|2,0,0]=3 3489 B10R0.75 C[C@H](NCCCCF)C(=O)N f2b097a16db3182cec2c9669792ccca4 [0,1,0,0,0,0|3,0,0]=4 3490 B10R0.75 C[C@H](NCCCCF)C(=O)O 675b37b8e4240ba1491fee21927eb746 [0,1,0,0,0,0|2,0,0]=3 3491 B10R0.75 C[C@H](NCCCCO)C(=O)N 78f3c10082399ed21de45a06b2c63e99 [0,1,0,0,0,0|3,0,0]=4 3492 B10R0.75 C[C@H](NCCCCO)C(=O)O c445a3e289904fa28e5ba8b7bd4aacc8 [0,1,0,0,0,0|2,0,0]=3 3493 B10R0.75 C[C@H](NCCCCS)C(=O)N 7d414c4b86de97a2e4feb0cb18f2e86e [0,1,0,0,0,0|3,0,0]=4 3494 B10R0.75 C[C@H](NCCCCS)C(=O)O bb4ebed3985048c148ce32657f9fd33f [0,1,0,0,0,0|2,0,0]=3 3495 B10R0.75 C[C@H](OCCCC#N)C(=O)O e94e7bf5ddfa91559a415352da78f1ec [0,1,0,0,0,0|2,0,1]=4 3496 B10R0.75 C[C@H](OCCCC=O)C(=O)O 4d4bb8ab5beb8a7e25e3d04d797c4585 [0,1,0,0,0,0|2,0,1]=4 3497 B10R0.75 C[C@H](OCCCCF)C(=O)N 7e906ce95b72e0b3429fa5b0d91f98ef [0,1,0,0,0,0|3,0,0]=4 3498 B10R0.75 C[C@H](OCCCCF)C(=O)O d2b1e0a5c7f8bd0102a1a298b58e5b2c [0,1,0,0,0,0|2,0,0]=3 3499 B10R0.75 C[C@H](OCCCCS)C(=O)N 72967ac3a3de7cdf7bb201981a7fc8bd [0,1,0,0,0,0|3,0,0]=4 3500 B10R0.75 N#CCCCNC(O)C(=O)O e2b2d2b81e6e62a5bdc378466ec07f0a [0,1,0,0,0,0|2,0,1]=4 3501 B10R0.75 N#CCCNCC(F)C(=O)O 7d03aa6494539cd9e7c9c1c758f6624d [0,1,0,0,0,0|2,0,1]=4 3502 B10R0.75 N#CCCNCC(O)C(=O)O 56d7d0c369fbc2ad677ec1c7edf6bb18 [0,1,0,0,0,0|2,0,1]=4 3503 B10R0.75 N#CCCNC[C@@H](O)C(=O)O d6d2597195a3d9631278d2e1523eb019 [0,1,0,0,0,0|2,0,1]=4 3504 B10R0.75 N#CCCNC[C@H](O)C(=O)O 8a8ea78a64d3c1aea42bb4d248d72980 [0,1,0,0,0,0|2,0,1]=4 3505 B10R0.75 N#CCNCCC(F)C(=O)O 9393a0347c870d0ac0ef10c3a50fabb8 [0,1,0,0,0,0|2,0,1]=4 3506 B10R0.75 N#CCNCCC(O)C(=O)O 43f1fa689604829a8a7e0df90ca64aa2 [0,1,0,0,0,0|2,0,1]=4 3507 B10R0.75 N#CCNCC[C@H](O)C(=O)O 472b824343ea871b59e3f116dd12ee9d [0,1,0,0,0,0|2,0,1]=4 3508 B10R0.75 NC(=O)C(F)NCCCCCl e65c05a61ee6956bdcce0eaf08f63acc [0,1,0,0,0,0|3,0,0]=4 3509 B10R0.75 NC(=O)C(F)NCCCCO 4ae12aebd832dca7c172b67f0fa514c9 [0,1,0,0,0,0|3,0,0]=4 3510 B10R0.75 NC(=O)C(F)NCCCCS b12885b7d0adcf46cc894dc1f01b3879 [0,1,0,0,0,0|3,0,0]=4 3511 B10R0.75 NC(=O)C(F)OCCCCF 55670fc27b5490039d4803939bd6f9f7 [0,1,0,0,0,0|3,0,0]=4 3512 B10R0.75 NC(=O)C(F)OCCCCS 2a9b73b9c286259e5ee851d73eedafd7 [0,1,0,0,0,0|3,0,0]=4 3513 B10R0.75 NOCCNCC(O)C(=O)O 765d57b6c6edf3f07cd9c17d7f0895c9 [0,1,0,0,0,0|3,0,0]=4 3514 B10R0.75 NOCCNC[C@H](O)C(=O)O 20e54ce2c5391c8bff575d00287d63a4 [0,1,0,0,0,0|3,0,0]=4 3515 B10R0.75 O=C(O)C(=O)CNCCCCl fe34166c3771efc0850048b6fad5aeb7 [0,1,0,0,0,0|2,0,1]=4 3516 B10R0.75 O=C(O)C(=O)CNCCCO 9f8349478c39d748124dc94c91d1ada4 [0,1,0,0,0,0|2,0,1]=4 3517 B10R0.75 O=C(O)C(=O)COCCCF c6b59be8f94572b5e14f121ab4f990c3 [0,1,0,0,0,0|2,0,1]=4 3518 B10R0.75 O=C(O)C(F)CCNCCF 4ccf6598a98a805d36ad248e4e66b97b [0,1,0,0,0,0|2,0,0]=3 3519 B10R0.75 O=C(O)C(F)CCNCCO 6284eef18fff078bdb29bdcabf6b8200 [0,1,0,0,0,0|2,0,0]=3 3520 B10R0.75 O=C(O)C(F)CCNCCS 5558b8f50ca34248e13f5e8583739b75 [0,1,0,0,0,0|2,0,0]=3 3521 B10R0.75 O=C(O)C(F)CNCCCF d05f494229698c5e2652e06b84e91376 [0,1,0,0,0,0|2,0,0]=3 3522 B10R0.75 O=C(O)C(F)CNCCCO 0f7c210c6b81e67050df7be2311e4e99 [0,1,0,0,0,0|2,0,0]=3 3523 B10R0.75 O=C(O)C(O)CCNCCF 4eb0444245ea8711907e9cdaf00db0c3 [0,1,0,0,0,0|2,0,0]=3 3524 B10R0.75 O=C(O)C(O)CCNCCO 0952715bb656ef532bbecdab0d049b07 [0,1,0,0,0,0|2,0,0]=3 3525 B10R0.75 O=C(O)C(O)CCNCCS 93c36a2dc59fa90922b20f7d6fbf0ea8 [0,1,0,0,0,0|2,0,0]=3 3526 B10R0.75 O=C(O)C(O)CNCCCCl 86d7e8d3961ebb1ffff2964d1772bd29 [0,1,0,0,0,0|2,0,0]=3 3527 B10R0.75 O=C(O)C(O)CNCCCF 1e58e7140990d6ee8017d30500a489fc [0,1,0,0,0,0|2,0,0]=3 3528 B10R0.75 O=C(O)C(O)CNCCCO 92b6e20acc84dc533dc1e855781bebab [0,1,0,0,0,0|2,0,0]=3 3529 B10R0.75 O=C(O)C(O)CNCCCS 97cbab7ccd7500f5a7839d1ba50310ea [0,1,0,0,0,0|2,0,0]=3 3530 B10R0.75 O=C(O)C(O)NCCCCF a0563fa24d766451d7c8fc60ccc8f954 [0,1,0,0,0,0|2,0,0]=3 3531 B10R0.75 O=C(O)C(O)NCCCCO 7110ba7b7e3eb0eb4f8d0bf7331edb9e [0,1,0,0,0,0|2,0,0]=3 3532 B10R0.75 O=C(O)[C@@H](O)CCNCCF e50bd41a53efd9c0ab24c17df2012f7f [0,1,0,0,0,0|2,0,0]=3 3533 B10R0.75 O=C(O)[C@@H](O)CCNCCO 10b541f576ed1c87d335faf8a6b596b0 [0,1,0,0,0,0|2,0,0]=3 3534 B10R0.75 O=C(O)[C@@H](O)CCNCCS 3c3c7040da611de8eafc6903b31a0bf3 [0,1,0,0,0,0|2,0,0]=3 3535 B10R0.75 O=C(O)[C@@H](O)CNCCCCl f128c0c5fa5a2be7a3ae81211c775d1f [0,1,0,0,0,0|2,0,0]=3 3536 B10R0.75 O=C(O)[C@@H](O)CNCCCF 2c7e1b555185bedc525cdbd0c21f229e [0,1,0,0,0,0|2,0,0]=3 3537 B10R0.75 O=C(O)[C@@H](O)CNCCCO 0909269fe45f5137d6876ff98e19d727 [0,1,0,0,0,0|2,0,0]=3 3538 B10R0.75 O=C(O)[C@@H](O)CNCCCS 1f4cf1497dfea99a4a0221cefee37a86 [0,1,0,0,0,0|2,0,0]=3 3539 B10R0.75 O=C(O)[C@H](O)CNCCCF bf00b75790ea63119fc32841cac21ae2 [0,1,0,0,0,0|2,0,0]=3 3540 B10R0.75 O=C(O)[C@H](O)CNCCCO 13b6a75e1d8201592c2b3cd65e45cd45 [0,1,0,0,0,0|2,0,0]=3 3541 B10R0.75 O=C(O)[C@H](O)CNCCCS 9a349ef4aaa19c39cd57ddd5f09fc89f [0,1,0,0,0,0|2,0,0]=3 3542 B10R0.75 O=CCCCNC(O)C(=O)O 33d830d829dc3c7fda5ec5a504c0f2c6 [0,1,0,0,0,0|2,0,1]=4 3543 B10R0.75 O=CCCNCC(F)C(=O)O b01d81b0f81f6850be708383029b52b7 [0,1,0,0,0,0|2,0,1]=4 3544 B10R0.75 O=CCCNCC(O)C(=O)O 06bff96ed5c3b46b001c639198bd36e3 [0,1,0,0,0,0|2,0,1]=4 3545 B10R0.75 O=CCCNC[C@@H](O)C(=O)O 9021a3d2bd65be463425f14784eaf2ea [0,1,0,0,0,0|2,0,1]=4 3546 B10R0.75 O=CCCNC[C@H](O)C(=O)O d6b94b72d60d5c651db23b58fb3b3c0d [0,1,0,0,0,0|2,0,1]=4 3547 B10R0.75 O=CCNCCC(F)C(=O)O ee7fbccd1dea8623de26b1624959e028 [0,1,0,0,0,0|2,0,1]=4 3548 B10R0.75 O=CCNCCC(O)C(=O)O 6d67b2ec2810e4b9ae66ac5ae4999b3c [0,1,0,0,0,0|2,0,1]=4 3549 B10R0.75 O=CCNCC[C@H](O)C(=O)O bf4b81d852a9d133443871fedd2323cc [0,1,0,0,0,0|2,0,1]=4 3550 B10R0.78 C#CCCN(C)CCC(=O)O 64dee399e6ee904095254907594948d2 [0,1,0,0,0,0|1,0,2]=4 3551 B10R0.78 C#CCNC(C)CCC(=O)O fe7d69cff316f9831eef85d908d61c8f [0,1,0,0,0,0|1,0,2]=4 3552 B10R0.78 C#CCOC(C)CCC(=O)O 5b471e5e79ed0df3293da1514b15e491 [0,1,0,0,0,0|1,0,2]=4 3553 B10R0.78 C/C=C/CN(C)CCC(=O)O d48cb237d4b6714f804abb11046cf491 [0,1,0,0,0,0|1,0,2]=4 3554 B10R0.78 C/C=C\CN(C)CCC(=O)O db7fde7e853325de4cb4fe46f70dee6f [0,1,0,0,0,0|1,0,2]=4 3555 B10R0.78 C=C(Br)CNC(C)CCCC 7f10c454906a4c4f8534f96fd7be39b2 [0,1,0,0,0,0|3,0,0]=4 3556 B10R0.78 C=C(Br)CN[C@H](C)CCCC 713080afffd201a3d9677e8a39fad485 [0,1,0,0,0,0|3,0,0]=4 3557 B10R0.78 C=C(Br)COC(C)CCCC 81811f3255ba4b136d81529ce094b973 [0,1,0,0,0,0|3,0,0]=4 3558 B10R0.78 C=C(Br)CO[C@@H](C)CCCC d7fd141b7b49af0fae1f375d397083e7 [0,1,0,0,0,0|3,0,0]=4 3559 B10R0.78 C=C(Br)CO[C@H](C)CCCC 4467be3057b0fc2d19c437a4552558f2 [0,1,0,0,0,0|3,0,0]=4 3560 B10R0.78 C=C(C)CCN(C)CCCC da3198aa0a01bb6280636029a79c3b8e [0,1,0,0,0,0|3,0,0]=4 3561 B10R0.78 C=C(C)CNC(C)CCCC 0ff01b94c78fedf0a6c5a2b7af01b351 [0,1,0,0,0,0|3,0,0]=4 3562 B10R0.78 C=C(C)CN[C@H](C)CCCC 40a6d8390020d9315a81c4e2bf34109d [0,1,0,0,0,0|3,0,0]=4 3563 B10R0.78 C=C(C)COC(C)CCCC 692c7a1b9bc750f50e82860bdeba4de0 [0,1,0,0,0,0|3,0,0]=4 3564 B10R0.78 C=C(C)CO[C@@H](C)CCCC c5fbd67f0437c11b4f610c50ed1faf17 [0,1,0,0,0,0|3,0,0]=4 3565 B10R0.78 C=C(C)CO[C@H](C)CCCC ddb31cd54f90e0a80d0801b61c2986ef [0,1,0,0,0,0|3,0,0]=4 3566 B10R0.78 C=C(Cl)CNC(C)CCCC 440850f1c6a604cab01a079fa378ac70 [0,1,0,0,0,0|3,0,0]=4 3567 B10R0.78 C=C(Cl)CN[C@H](C)CCCC 46df13b74077f86d7a0c20cbc1fb3351 [0,1,0,0,0,0|3,0,0]=4 3568 B10R0.78 C=C(Cl)COC(C)CCCC f2d8a798ba1f562cf949fc65a13d3776 [0,1,0,0,0,0|3,0,0]=4 3569 B10R0.78 C=C(Cl)CO[C@@H](C)CCCC 870cd522532a6f8a98563e02ac4eff93 [0,1,0,0,0,0|3,0,0]=4 3570 B10R0.78 C=C(Cl)CO[C@H](C)CCCC 1263c0b7e8aea0ae7251b73355e297f0 [0,1,0,0,0,0|3,0,0]=4 3571 B10R0.78 C=C(I)COC(C)CCCC cac87331bd48f3c30bf739058ea93ddd [0,1,0,0,0,0|3,0,0]=4 3572 B10R0.78 C=CCCC(C)NCC(=O)O 5d2eb87c1e173f0f955b593541eba429 [0,1,0,0,0,0|1,0,2]=4 3573 B10R0.78 C=CCCC(C)OCC(=O)O b7388377e1306c899a295165a4f296dc [0,1,0,0,0,0|1,0,2]=4 3574 B10R0.78 C=CCCN(C)CCC(=O)O c88d142c0153cd074bf94e770862deee [0,1,0,0,0,0|1,0,2]=4 3575 B10R0.78 C=CCC[C@@H](C)OCC(=O)O d7d1f7d6c842e2d2ca8cc4938a342291 [0,1,0,0,0,0|1,0,2]=4 3576 B10R0.78 C=CCNC(C)CCC(=O)O 1c641b10659277bf870f2435fb9cc772 [0,1,0,0,0,0|1,0,2]=4 3577 B10R0.78 C=CCN[C@@H](C)CCC(=O)O 41e02b8225891f68f4968faae15e221e [0,1,0,0,0,0|1,0,2]=4 3578 B10R0.78 C=CCOC(C)CCC(=O)O d3bbb7bd77e045d25348a075f12af676 [0,1,0,0,0,0|1,0,2]=4 3579 B10R0.78 CC(=O)CCN(C)CCCO 46e4adaf0611c78760c0cc79cb0004e0 [0,1,0,0,0,0|3,0,0]=4 3580 B10R0.78 CC(=O)CNC(C)CCCO 13ca43d9cc0a795fff4e7ab9b29c0675 [0,1,0,0,0,0|3,0,0]=4 3581 B10R0.78 CC(=O)NC[C@H](C)CCCO 52d3712900624e77f1483526418f6494 [0,1,0,0,0,0|3,0,0]=4 3582 B10R0.78 CC(CCC#N)NCC(=O)O e16174c05a7e13cb77107c75c24440b3 [0,1,0,0,0,0|2,0,1]=4 3583 B10R0.78 CC(CCC#N)OCC(=O)O 5e4c5054c4d176f5b4e12f3a6c0b1068 [0,1,0,0,0,0|2,0,1]=4 3584 B10R0.78 CC(CCC(=O)O)NCC#N b7b3fd4db5b47ce25d0c7cb0114d30d7 [0,1,0,0,0,0|2,0,1]=4 3585 B10R0.78 CC(CCC(=O)O)NCC=O f07da88c3240b0e8214fd1c7519e2c1c [0,1,0,0,0,0|2,0,1]=4 3586 B10R0.78 CC(CCC(=O)O)NCCF 8ff81164d2113f849a4e3eaca508944e [0,1,0,0,0,0|2,0,0]=3 3587 B10R0.78 CC(CCC(=O)O)NCCI b6599eb7b3f748e96cecaf7ce4a26dd8 [0,1,0,0,0,0|2,0,0]=3 3588 B10R0.78 CC(CCC(=O)O)NCCO 6282011c531d423c647c14e47771978c [0,1,0,0,0,0|2,0,0]=3 3589 B10R0.78 CC(CCC(=O)O)OCC#N 5d4a05055b7b92f526090a3236b74cc0 [0,1,0,0,0,0|2,0,1]=4 3590 B10R0.78 CC(CCC(=O)O)OCC=O 7a9c9b3f7f3a3956a0f818bd283bd0c2 [0,1,0,0,0,0|2,0,1]=4 3591 B10R0.78 CC(CCC(=O)O)OCCF 9fc3f6b2137030574e7cc92eedd91727 [0,1,0,0,0,0|2,0,0]=3 3592 B10R0.78 CC(CCC(=O)O)OCCS 91d832b778795afa207fabc9780e76fa [0,1,0,0,0,0|2,0,0]=3 3593 B10R0.78 CC(CCCO)NCC(=O)N e26518c92da177a5a129e6c608ab3ef2 [0,1,0,0,0,0|3,0,0]=4 3594 B10R0.78 CC(CCCO)NCC(=O)O 562c0ea74055a258028dfcc28ad084dc [0,1,0,0,0,0|2,0,0]=3 3595 B10R0.78 CCC#CC(C)OCC(=O)O 214fe7b116432601287a5f31da0ae033 [0,1,0,0,0,0|1,0,2]=4 3596 B10R0.78 CCCCC(=O)NCC(=O)C 9bab1a410a486ddb153f70cacac7f1be [0,1,0,0,0,0|2,0,1]=4 3597 B10R0.78 CCCCC(=O)NCC(=O)N 67f29b8df1f70e319eaf02b26d85dc4a [0,1,0,0,0,0|2,0,1]=4 3598 B10R0.78 CCCCC(C)NCC(=O)C aa0d7dc1e61d96887b1e23e6e9b1d801 [0,1,0,0,0,0|2,0,0]=3 3599 B10R0.78 CCCCC(C)NCC(=O)N 176470242cf4f5ef2e154a227705a141 [0,1,0,0,0,0|2,0,0]=3 3600 B10R0.78 CCCCC(C)NCC(=O)O ca8ad46e018df2faa99dbf908bd443e1 [0,1,0,0,0,0|1,0,0]=2 3601 B10R0.78 CCCCC(C)NCC(C)O daaef59c8c728262f7bec9551df73db8 [0,1,0,0,0,0|2,0,1]=4 3602 B10R0.78 CCCCC(C)NC[C@@H](C)O 111140a3ed4b98bf2d3f006b24db5770 [0,1,0,0,0,0|2,0,1]=4 3603 B10R0.78 CCCCC(C)NC[C@H](C)O 7f750cedced843726711185af6eda797 [0,1,0,0,0,0|2,0,1]=4 3604 B10R0.78 CCCCC(C)NC[N+](=O)[O-] c2291c714b89930466deafca28ff8287 [0,1,0,0,0,0|2,0,1]=4 3605 B10R0.78 CCCCC(C)OCC(=O)C 1853e26f374aa2da1da8ca98875b6081 [0,1,0,0,0,0|2,0,0]=3 3606 B10R0.78 CCCCC(C)OCC(=O)N ffd58cfd46c48f74e3a7daf65636db71 [0,1,0,0,0,0|2,0,0]=3 3607 B10R0.78 CCCCC(C)OCC(=O)O a9747b2dc6b524106d5700f387a2a510 [0,1,0,0,0,0|1,0,0]=2 3608 B10R0.78 CCCCC(C)OCC(=S)N b69d4fed531a903c622a2540995f06bc [0,1,0,0,0,0|2,1,0]=4 3609 B10R0.78 CCCCC(C)OCS(=O)O 93f7d7b5545c84594d88971bfad4d13f [0,1,0,0,0,0|2,0,0]=3 3610 B10R0.78 CCCCC(C)OC[N+](=O)[O-] 07d4e13153ad67b6d0353b212e3aa0f7 [0,1,0,0,0,0|2,0,1]=4 3611 B10R0.78 CCCCC(O)CNC(=O)C 3f59abebe6296b965d9d52498cad501b [0,1,0,0,0,0|2,0,0]=3 3612 B10R0.78 CCCCN(C)CCC(=O)C dfbf1e6a28f7cdc2c88a65422fe6adc9 [0,1,0,0,0,0|2,0,0]=3 3613 B10R0.78 CCCCN(C)CCC(=O)N 7b2169d478f2bfe00d6ebf0223349053 [0,1,0,0,0,0|2,0,0]=3 3614 B10R0.78 CCCCN(C)CCC(=O)O b806e1b2cd351dd886d8560ee659fbb1 [0,1,0,0,0,0|1,0,0]=2 3615 B10R0.78 CCCCN(C)CCC(C)O 611b91cf07d9ccbc0710226421f547db [0,1,0,0,0,0|2,0,1]=4 3616 B10R0.78 CCCCN(C)CCS(=O)C 6637de780258a2727ecda1ca4de9030a [0,1,0,0,0,0|3,0,0]=4 3617 B10R0.78 CCCCN(C)COC(=O)C 1d2ebf38414d0b74d7c72413956a5ba7 [0,1,0,0,0,0|3,0,0]=4 3618 B10R0.78 CCCCN(C)CSC(=O)N 4f2e1e63481909a7f5101521c2e6a6b2 [0,1,0,0,0,0|3,0,0]=4 3619 B10R0.78 CCCC[C@@H](C)NCC(=O)N f3619adc95ed56f1a5e04d3cfe0a5195 [0,1,0,0,0,0|2,0,0]=3 3620 B10R0.78 CCCC[C@@H](C)NCC(=O)O cdf353e5bc7239425db33062b64cab42 [0,1,0,0,0,0|1,0,0]=2 3621 B10R0.78 CCCC[C@@H](C)NCC(C)O 0e82a5e6f7e7bec4164fd9bfdbd7fe3b [0,1,0,0,0,0|2,0,1]=4 3622 B10R0.78 CCCC[C@@H](C)NC[C@@H](C)O 9aee46399f87e708a36b91ca94a42bbd [0,1,0,0,0,0|2,0,1]=4 3623 B10R0.78 CCCC[C@@H](C)NC[C@H](C)O 3bb605939f0e3ac2f736aa125a883d54 [0,1,0,0,0,0|2,0,1]=4 3624 B10R0.78 CCCC[C@@H](C)NC[N+](=O)[O-] 733b17737411da3025268071bf7cddbe [0,1,0,0,0,0|2,0,1]=4 3625 B10R0.78 CCCC[C@@H](C)OCC(=O)N 728c4bfc1859e8955976444b5005cc9f [0,1,0,0,0,0|2,0,0]=3 3626 B10R0.78 CCCC[C@@H](C)OCC(=O)O fcdde6a6446f16e594fd1de5903e1b1b [0,1,0,0,0,0|1,0,0]=2 3627 B10R0.78 CCCC[C@@H](C)OC[N+](=O)[O-] e1cd6a77ebadaa492706fdb7f9a7fa88 [0,1,0,0,0,0|2,0,1]=4 3628 B10R0.78 CCCC[C@H](C)OCC(=O)N 00a0583900b94345286d5c7c32f13dc6 [0,1,0,0,0,0|2,0,0]=3 3629 B10R0.78 CCCC[C@H](C)OCC(=O)O 7b88542caf2c6272fa28507597d32d4c [0,1,0,0,0,0|1,0,0]=2 3630 B10R0.78 CCCC[C@H](C)OC[N+](=O)[O-] 4e0bb04e98a65df8065b1eda4b062b8b [0,1,0,0,0,0|2,0,1]=4 3631 B10R0.78 CCCNC(=O)CCC(=O)C 3cf255f5f8f0e0f3ac79a021f8aeb248 [0,1,0,0,0,0|2,0,1]=4 3632 B10R0.78 CCCNC(=O)CCC(=O)N e6eea4b681779ea8b475ef85c52dacfb [0,1,0,0,0,0|2,0,1]=4 3633 B10R0.78 CCCNC(=O)NCC(=O)O 6cae390e1d500ee5dfc5ef15b4febba2 [0,1,0,0,0,0|2,0,1]=4 3634 B10R0.78 CCCNC(=S)NCC(=O)O 19aebddf35dea2857709523de1c12c22 [0,1,0,0,0,0|2,0,1]=4 3635 B10R0.78 CCCNC(C)CCC(=O)O 571f95f24765651c01fcc52fa38fd0a0 [0,1,0,0,0,0|1,0,0]=2 3636 B10R0.78 CCCN[C@@H](C)CCC(=O)O 1755318cfb49486d14d8459d7a0a94b5 [0,1,0,0,0,0|1,0,0]=2 3637 B10R0.78 CCCOC(C)CCC(=O)O d80031c9b64791b5bc796683ccc38ba3 [0,1,0,0,0,0|1,0,0]=2 3638 B10R0.78 CCCOC(C)CNC(=O)C cd13e403e9118e1b675e0d2e8c901fe4 [0,1,0,0,0,0|3,0,0]=4 3639 B10R0.78 CCCOC(C)COC(=O)C 607b1670d79801d88d687c38012c337b [0,1,0,0,0,0|3,0,0]=4 3640 B10R0.78 CCNCC(=O)CCC(=O)O f79578d0503e92301f45db6fc13c3380 [0,1,0,0,0,0|1,0,1]=3 3641 B10R0.78 CCNCC(=O)NCC(=O)O 448aededde6828a1da441c00fa5293b5 [0,1,0,0,0,0|2,0,1]=4 3642 B10R0.78 CCOCC(C)OCC(=O)N 78753113ac128fc7758306ac0df87fdf [0,1,0,0,0,0|3,0,0]=4 3643 B10R0.78 CCOCC(C)OCC(=O)O 4340885b9dc9f87664ce91ece35c53ed [0,1,0,0,0,0|2,0,0]=3 3644 B10R0.78 CCOCC(O)CNC(=O)C b25571daf27c8c00ab2daa64019f8b65 [0,1,0,0,0,0|3,0,0]=4 3645 B10R0.78 CCOCN(C)CCC(=O)N b20097e51a55f4acdaac1c23489dc7b1 [0,1,0,0,0,0|3,0,0]=4 3646 B10R0.78 CCOCN(C)CCC(=O)O 3fbadfb640e3509ff11e976df6bf596d [0,1,0,0,0,0|2,0,0]=3 3647 B10R0.78 CCOC[C@@H](C)COC(=O)C 18b7cbf1bad58efd0e2ead3bc6fbee16 [0,1,0,0,0,0|3,0,0]=4 3648 B10R0.78 CN(CCC#N)CCC(=O)O fdeb11b802673842c6300f548e5db838 [0,1,0,0,0,0|2,0,1]=4 3649 B10R0.78 CN(CCC=O)CCC(=O)O d2916ca83f249b531818b8a38ed1264a [0,1,0,0,0,0|2,0,1]=4 3650 B10R0.78 CN(CCCF)CCC(=O)N 7a7a18b1a258cd3f5abfd729637cd573 [0,1,0,0,0,0|3,0,0]=4 3651 B10R0.78 CN(CCCF)CCC(=O)O 2325ac66a10fabffa6be021e273e1c87 [0,1,0,0,0,0|2,0,0]=3 3652 B10R0.78 CN(CCCO)CCC(=O)N 15d7477e3ff1b96937bcb24a564b7dca [0,1,0,0,0,0|3,0,0]=4 3653 B10R0.78 CN(CCCO)CCC(=O)O d4280057abed8bcb34df33d567337a81 [0,1,0,0,0,0|2,0,0]=3 3654 B10R0.78 CN(CCCS)CCC(=O)N 7492fcec25cfaaf3ce21a445a25c1b3b [0,1,0,0,0,0|3,0,0]=4 3655 B10R0.78 CN(CCCS)CCC(=O)O 2f47dffa227dfa98eb1a2041ed632e45 [0,1,0,0,0,0|2,0,0]=3 3656 B10R0.78 CN(CCON)CCC(=O)O 6142724cdf9f1ceff2147e9fda5200cd [0,1,0,0,0,0|3,0,0]=4 3657 B10R0.78 COCCC(C)OCC(=O)N ff8eb675624df90b55370802f1930eac [0,1,0,0,0,0|3,0,0]=4 3658 B10R0.78 COCCC(C)OCC(=O)O 76ca78191cee40c1b9b8fb4f37b53d72 [0,1,0,0,0,0|2,0,0]=3 3659 B10R0.78 COCCN(C)CCC(=O)C 8e2af4885db50475e472358338c02c8f [0,1,0,0,0,0|3,0,0]=4 3660 B10R0.78 COCCN(C)CCC(=O)N 33fc7dccd367767e811a02dc65e4ae48 [0,1,0,0,0,0|3,0,0]=4 3661 B10R0.78 COCCN(C)CCC(=O)O edff487632f15a7ed07cbc94173bae56 [0,1,0,0,0,0|2,0,0]=3 3662 B10R0.78 COCNC(C)CCC(=O)O cd23ab7231cf0ccd8c90f3d73d5d07db [0,1,0,0,0,0|2,0,0]=3 3663 B10R0.78 COCN[C@@H](C)CCC(=O)O bdc9bb6296a1c7446cd8cab2459e70d1 [0,1,0,0,0,0|2,0,0]=3 3664 B10R0.78 COCOC(C)CCC(=O)O ecc641dc89a23cf5a66427a947d5cab5 [0,1,0,0,0,0|2,0,0]=3 3665 B10R0.78 CSCCC(C)OCC(=O)N 7cc5b7e9493c3c5f8c2bc7affe68a9fc [0,1,0,0,0,0|3,0,0]=4 3666 B10R0.78 CSCCC(C)OCC(=O)O 7e21c7b86c9c1278fd86356500849ab4 [0,1,0,0,0,0|2,0,0]=3 3667 B10R0.78 CSCCN(C)CCC(=O)C 53eff6cca6d1516e3ac355a47c4fd392 [0,1,0,0,0,0|3,0,0]=4 3668 B10R0.78 CSCCN(C)CCC(=O)N 9b80ea83a7b07ba634a90569279330bd [0,1,0,0,0,0|3,0,0]=4 3669 B10R0.78 CSCCN(C)CCC(=O)O 889a55ace19552a938331e6cdad3d926 [0,1,0,0,0,0|2,0,0]=3 3670 B10R0.78 CSCNC(C)CCC(=O)O bafdfaa63b84df8ddac61b1460c7ec48 [0,1,0,0,0,0|2,0,0]=3 3671 B10R0.78 CSCN[C@@H](C)CCC(=O)O c17c3a655fcf622becc77d31957d3e6d [0,1,0,0,0,0|2,0,0]=3 3672 B10R0.78 CSCOC(C)CCC(=O)O b274ba4e4e52658c4be3d129907ff4fb [0,1,0,0,0,0|2,0,0]=3 3673 B10R0.78 C[C@@H](CCC(=O)O)NCC#N 6a486d5aaee54a6e9a3240f01e8d8b8b [0,1,0,0,0,0|2,0,1]=4 3674 B10R0.78 C[C@@H](CCC(=O)O)NCC=O b839759f3cf70a57c740f12ad2bedf48 [0,1,0,0,0,0|2,0,1]=4 3675 B10R0.78 C[C@@H](CCC(=O)O)NCCF 5dce132d74d7543a87cde0bc3adc6057 [0,1,0,0,0,0|2,0,0]=3 3676 B10R0.78 C[C@@H](CCC(=O)O)NCCO a7abf83a15744ef547c7f9ec102c6f60 [0,1,0,0,0,0|2,0,0]=3 3677 B10R0.78 C[C@H](CCCO)NCC(=O)N 69eae0a63049a00f6ae3288e4cd80904 [0,1,0,0,0,0|3,0,0]=4 3678 B10R0.78 C[C@H](CCCO)NCC(=O)O d581d9ae34e42ef5e62c3abf7ca11bff [0,1,0,0,0,0|2,0,0]=3 3679 B10R0.78 O=C(O)CCC(=O)CNCF 2170380d07fee7c42c71ca6d54d77a96 [0,1,0,0,0,0|2,0,1]=4 3680 B10R0.78 O=C(O)CCC(=O)CNCO b2906b414596a727dbbe132ec96a2bd5 [0,1,0,0,0,0|2,0,1]=4 3681 B10R0.97 C/C(=C/CNCCC(=O)O)/I 13e615e2fdfb7ca6a20c1baf92edcd1e [0,1,0,0,0,0|1,0,2]=4 3682 B10R0.97 C/C(=C/COCCC(=O)O)/Cl 8cf68156bbf60e9d94a87db894ccdc5e [0,1,0,0,0,0|1,0,2]=4 3683 B10R0.97 C/C(=C/COCCC(=O)O)/I f733012bb617c4c55d50153e2397aac1 [0,1,0,0,0,0|1,0,2]=4 3684 B10R0.97 C/C(=C\CNCCC(=O)O)/Cl 923f50352e00584712b09d76a3785c3c [0,1,0,0,0,0|1,0,2]=4 3685 B10R0.97 C/C(=C\COCCC(=O)O)/Cl 980c28d49ba69d336fcf6a38ad4570ab [0,1,0,0,0,0|1,0,2]=4 3686 B10R0.97 C=C(Br)CCOCCC(=O)O 587be7176e1ef66537093d5d979a2810 [0,1,0,0,0,0|1,0,2]=4 3687 B10R0.97 C=C(Br)CCOCCC(C)C 3b8e25a7a9aa61eaa7b814e3f42be2ac [0,1,0,0,0,0|3,0,0]=4 3688 B10R0.97 C=C(Br)CNCCCC(C)C 130f32f3c071a0a794079bcce085e317 [0,1,0,0,0,0|3,0,0]=4 3689 B10R0.97 C=C(Br)CNCCCC(C)O d2d8d85c4d6d85b5a845bd37f2ab4bf3 [0,1,0,0,0,0|3,0,0]=4 3690 B10R0.97 C=C(Br)COCCCC(C)C 45dcc1de0415b822d53293a4af084dfa [0,1,0,0,0,0|3,0,0]=4 3691 B10R0.97 C=C(C)CCCNCC(=O)C d9be3fc8f7473946f79abb4bfbb32864 [0,1,0,0,0,0|2,0,1]=4 3692 B10R0.97 C=C(C)CCCNCC(=O)N 122f18c9a1d7d9a5431ec821d4960b74 [0,1,0,0,0,0|2,0,1]=4 3693 B10R0.97 C=C(C)CCCNCC(=O)O 42dfb928d8650901d17252a4471d9dc3 [0,1,0,0,0,0|1,0,1]=3 3694 B10R0.97 C=C(C)CCCNCC(C)C 8f511e952e438382e5b9a3c92dd41799 [0,1,0,0,0,0|3,0,0]=4 3695 B10R0.97 C=C(C)CCCNCC(C)O 5c9ae67d05af6784026fa8119da70071 [0,1,0,0,0,0|3,0,0]=4 3696 B10R0.97 C=C(C)CCCNC[C@@H](C)O dd9c3ea80664c92328e77d948fdc7032 [0,1,0,0,0,0|3,0,0]=4 3697 B10R0.97 C=C(C)CCCNC[C@H](C)O 043354f010799c6497160e40482176c0 [0,1,0,0,0,0|3,0,0]=4 3698 B10R0.97 C=C(C)CCCOCC(=O)C 1698e61d4dbf1b240e6d7df77fdab5db [0,1,0,0,0,0|2,0,1]=4 3699 B10R0.97 C=C(C)CCCOCC(=O)N 7c0e22cbc668afaaa6bef23c404cbfe4 [0,1,0,0,0,0|2,0,1]=4 3700 B10R0.97 C=C(C)CCCOCC(=O)O fa358228b12cd9fac1dbbf319cdffb52 [0,1,0,0,0,0|1,0,1]=3 3701 B10R0.97 C=C(C)CCCOCC(C)C 34112f183a178f8706d778d5c62631f6 [0,1,0,0,0,0|3,0,0]=4 3702 B10R0.97 C=C(C)CCCOCC(C)F a20251d58d01e5a2fbe26543c468cfd4 [0,1,0,0,0,0|3,0,0]=4 3703 B10R0.97 C=C(C)CCCOCC(C)S 958f731fff0e2c1ed08a5adb01de11d8 [0,1,0,0,0,0|3,0,0]=4 3704 B10R0.97 C=C(C)CCCOCS(=O)O 9602288e86981143d7b0cec231fdb280 [0,1,0,0,0,0|2,0,1]=4 3705 B10R0.97 C=C(C)CCCOC[C@@H](C)F e6bddcb0b5b3e5e8802401e4cec94019 [0,1,0,0,0,0|3,0,0]=4 3706 B10R0.97 C=C(C)CCCOC[C@H](C)F 404093b0e31d4bf2924174219666e0e1 [0,1,0,0,0,0|3,0,0]=4 3707 B10R0.97 C=C(C)CCNCCC(=O)C fbfcc0d267ad5e7b7d02ffd0ebd6dcf6 [0,1,0,0,0,0|2,0,1]=4 3708 B10R0.97 C=C(C)CCNCCC(=O)N 4cb1e46715e7b09af3675c5cc4c04694 [0,1,0,0,0,0|2,0,1]=4 3709 B10R0.97 C=C(C)CCNCCC(=O)O fc0fc38a15743f67c5be17f4500eace5 [0,1,0,0,0,0|1,0,1]=3 3710 B10R0.97 C=C(C)CCNCCC(C)C 2a68ee535fcbfd6d83b5c3b2616e476a [0,1,0,0,0,0|3,0,0]=4 3711 B10R0.97 C=C(C)CCNCCC(C)O 7600daf953fd8de9753c58f602ed4d29 [0,1,0,0,0,0|3,0,0]=4 3712 B10R0.97 C=C(C)CCNCCS(=O)O 9c47c4442a15e620115b9f4c4e0978af [0,1,0,0,0,0|2,0,1]=4 3713 B10R0.97 C=C(C)CCNCC[C@@H](C)O d60587cab1b13ea3d1371c16eb77f7f4 [0,1,0,0,0,0|3,0,0]=4 3714 B10R0.97 C=C(C)CCNCC[C@H](C)O 0402c030cad5a89c10701eb06b6737a3 [0,1,0,0,0,0|3,0,0]=4 3715 B10R0.97 C=C(C)CCOCCC(=O)C 4730213577adf5d3a965b0cc67d07e2a [0,1,0,0,0,0|2,0,1]=4 3716 B10R0.97 C=C(C)CCOCCC(=O)N beeffd98fc79db2b2551772830858c0f [0,1,0,0,0,0|2,0,1]=4 3717 B10R0.97 C=C(C)CCOCCC(=O)O 242a0c810aa55d9084beace476177eca [0,1,0,0,0,0|1,0,1]=3 3718 B10R0.97 C=C(C)CCOCCC(C)C 9ef848ff7c2adcfa89643ef9288d6722 [0,1,0,0,0,0|3,0,0]=4 3719 B10R0.97 C=C(C)CNCCCC(=O)C 2194adcc082744af3a6615560f100c61 [0,1,0,0,0,0|2,0,1]=4 3720 B10R0.97 C=C(C)CNCCCC(=O)N e27b454dd2f09e379d26d4c9da80361f [0,1,0,0,0,0|2,0,1]=4 3721 B10R0.97 C=C(C)CNCCCC(=O)O 4a71b47e20ac7cb8bf4e581982179c69 [0,1,0,0,0,0|1,0,1]=3 3722 B10R0.97 C=C(C)CNCCCC(C)C 867dec14b504240a191f73e1b2982f42 [0,1,0,0,0,0|3,0,0]=4 3723 B10R0.97 C=C(C)CNCCCC(C)O 1b693d49d69c73dcc9a06cd7e5eb1bd4 [0,1,0,0,0,0|3,0,0]=4 3724 B10R0.97 C=C(C)COCCCC(=O)C 5fb459fe19eae2701df01ef98a60040c [0,1,0,0,0,0|2,0,1]=4 3725 B10R0.97 C=C(C)COCCCC(=O)N 1aea5824263e2174f961af6dd135d355 [0,1,0,0,0,0|2,0,1]=4 3726 B10R0.97 C=C(C)COCCCC(C)C 8366a4175228b71b5156d0328a743521 [0,1,0,0,0,0|3,0,0]=4 3727 B10R0.97 C=C(Cl)CNCCCC(C)C b75cac9f888d47011ed7e50771f2127f [0,1,0,0,0,0|3,0,0]=4 3728 B10R0.97 C=C(Cl)COCCCC(C)C 052b31e5dc56b9ae6cb2e66df89d91bb [0,1,0,0,0,0|3,0,0]=4 3729 B10R0.97 C=C(F)COCCCC(C)C 8776bb5a07d689e5652dd9c353cd2bd3 [0,1,0,0,0,0|3,0,0]=4 3730 B10R0.97 C=C(I)COCCCC(C)C 9b2df7b1bca9ea25938d8272079b5d68 [0,1,0,0,0,0|3,0,0]=4 3731 B10R0.97 CC(=CCCNCC(=O)O)C 0d7b363e792be09b8942cfc5d1b5fa5c [0,1,0,0,0,0|1,0,2]=4 3732 B10R0.97 CC(=CCCOCC(=O)O)C 4233744b61e91c90b9bb5925cc77dae1 [0,1,0,0,0,0|1,0,2]=4 3733 B10R0.97 CC(=CCNCCC(=O)O)C 305012f17ed1cbe4d0a4c0e2e78d9fca [0,1,0,0,0,0|1,0,2]=4 3734 B10R0.97 CC(=CCNCCC(=O)O)Cl 0a7be9a1aaafc1e4de322431f6548adf [0,1,0,0,0,0|1,0,2]=4 3735 B10R0.97 CC(=CCNCCC(=O)O)I 3d1fd3628c08921e46f588770e13f894 [0,1,0,0,0,0|1,0,2]=4 3736 B10R0.97 CC(=CCOCCC(=O)O)C 7178b614f85b130c7497af829e03f8fd [0,1,0,0,0,0|1,0,2]=4 3737 B10R0.97 CC(=CCOCCC(=O)O)Cl 544141cc96e67d48ac88ad252f735114 [0,1,0,0,0,0|1,0,2]=4 3738 B10R0.97 CC(=CCOCCC(=O)O)I bf4f2d5699545d3319c69e163bbed9ba [0,1,0,0,0,0|1,0,2]=4 3739 B10R0.97 CC(=O)CCCCOC(C)C 700fadd41e3541c73c36d719d2d2480c [0,1,0,0,0,0|2,0,0]=3 3740 B10R0.97 CC(=O)CCCNCC(=O)C a409933801cd759c569fa08c611af33e [0,1,0,0,0,0|2,0,1]=4 3741 B10R0.97 CC(=O)CCCNCC(=O)N 51d75401188117b73152c7a73b1487bf [0,1,0,0,0,0|2,0,1]=4 3742 B10R0.97 CC(=O)CCCNCC(=O)O 918b6ee5a87e78cab8f9c47454468e74 [0,1,0,0,0,0|1,0,1]=3 3743 B10R0.97 CC(=O)CCCNCC(C)C c4221c351f859819b5e6cfd633a8a821 [0,1,0,0,0,0|2,0,0]=3 3744 B10R0.97 CC(=O)CCCNCC(C)O 7827ded47062577adccafb076e979e7f [0,1,0,0,0,0|2,0,0]=3 3745 B10R0.97 CC(=O)CCCNCC(F)F ceea3ea0366ec60cf0de5812af43a654 [0,1,0,0,0,0|3,0,0]=4 3746 B10R0.97 CC(=O)CCCNC[C@@H](C)O 4f3248c59a558d260643490ed8d6b0ec [0,1,0,0,0,0|2,0,0]=3 3747 B10R0.97 CC(=O)CCCNC[C@H](C)O a8c96c63cd81114a3df8ed3f66294f69 [0,1,0,0,0,0|2,0,0]=3 3748 B10R0.97 CC(=O)CCCOCC(=O)C 9ee355d6e058129449a09a55e1a01760 [0,1,0,0,0,0|2,0,1]=4 3749 B10R0.97 CC(=O)CCCOCC(=O)N 7265256c71b66635e2f75eb7aa320292 [0,1,0,0,0,0|2,0,1]=4 3750 B10R0.97 CC(=O)CCCOCC(=O)O 8a4a403788cd63620217d0d24efac923 [0,1,0,0,0,0|1,0,1]=3 3751 B10R0.97 CC(=O)CCCOCC(C)C b1009e81425a6696c191de687864c929 [0,1,0,0,0,0|2,0,0]=3 3752 B10R0.97 CC(=O)CCCOCC(C)F a04f1efd598969901bda18001e418bd6 [0,1,0,0,0,0|2,0,0]=3 3753 B10R0.97 CC(=O)CCCOCC(C)S 49650a3a3b43d29d9d0dffef63039060 [0,1,0,0,0,0|2,0,0]=3 3754 B10R0.97 CC(=O)CCCOCC(F)F 20205ddfbf16be895daf9058d4239315 [0,1,0,0,0,0|3,0,0]=4 3755 B10R0.97 CC(=O)CCCOCN(C)C cb34abd3eb581ce54656e1bc368352b4 [0,1,0,0,0,0|3,0,0]=4 3756 B10R0.97 CC(=O)CCCOCS(=O)O d4c1ba7042320e4d2ff241d263c1e8df [0,1,0,0,0,0|2,0,1]=4 3757 B10R0.97 CC(=O)CCCOC[C@@H](C)F 0f2f82193430abc5c21e3e1cebc8adbb [0,1,0,0,0,0|2,0,0]=3 3758 B10R0.97 CC(=O)CCCOC[C@H](C)F 7070d2984c29be86f487110f8fa6e6b7 [0,1,0,0,0,0|2,0,0]=3 3759 B10R0.97 CC(=O)CCNCCC(=O)N c35125a8093768fa3a86fa3826a773ed [0,1,0,0,0,0|2,0,1]=4 3760 B10R0.97 CC(=O)CCNCCC(=O)O f6404f16113724251676710b77e6f73f [0,1,0,0,0,0|1,0,1]=3 3761 B10R0.97 CC(=O)CCNCCC(C)C faa052e18edf917b301219686b0404a4 [0,1,0,0,0,0|2,0,0]=3 3762 B10R0.97 CC(=O)CCNCCC(C)O d41dd1b382e0d229d77dac4517403a7f [0,1,0,0,0,0|2,0,0]=3 3763 B10R0.97 CC(=O)CCNCCC(F)F ff8d627008388372d22115802f81a436 [0,1,0,0,0,0|3,0,0]=4 3764 B10R0.97 CC(=O)CCNCCN(C)C 9af085468b22120e960a858ccd02f5eb [0,1,0,0,0,0|3,0,0]=4 3765 B10R0.97 CC(=O)CCNCCS(=O)C f664abfc76d7a79f97e104be0480b4f5 [0,1,0,0,0,0|3,0,0]=4 3766 B10R0.97 CC(=O)CCNCCS(=O)O 2a215cadaa85dc727e15ec7c4ce705bc [0,1,0,0,0,0|2,0,1]=4 3767 B10R0.97 CC(=O)CCNCC[C@@H](C)O 1c815573c9e5b60fa003bed245c05f2c [0,1,0,0,0,0|2,0,0]=3 3768 B10R0.97 CC(=O)CCNCC[C@H](C)O 88f95818f5c006753a98293dfc71cce2 [0,1,0,0,0,0|2,0,0]=3 3769 B10R0.97 CC(=O)CCOCCC(=O)C 342f59ad2b5c5cb1a268b6a5dc6b8411 [0,1,0,0,0,0|2,0,1]=4 3770 B10R0.97 CC(=O)CCOCCC(=O)N f356511520b91005e846540d53da4ee3 [0,1,0,0,0,0|2,0,1]=4 3771 B10R0.97 CC(=O)CCOCCC(=O)O 620c3207fd5e54c297c9fe5455b7b9e5 [0,1,0,0,0,0|1,0,1]=3 3772 B10R0.97 CC(=O)CCOCCC(C)C c9c39e705ea35ecfc05987554ddc1dcf [0,1,0,0,0,0|2,0,0]=3 3773 B10R0.97 CC(=O)CCOCCC(F)F cb097e3a5a4f4c15207736ff0013874b [0,1,0,0,0,0|3,0,0]=4 3774 B10R0.97 CC(=O)CCOCCN(C)C fc57446a5c7e15b5fa761dd146005fee [0,1,0,0,0,0|3,0,0]=4 3775 B10R0.97 CC(=O)CCOCCS(=O)C bbb754fffb147015bd370f8efbbecf1e [0,1,0,0,0,0|3,0,0]=4 3776 B10R0.97 CC(=O)CCOCOC(C)C 5daca7792f17370401d5796f5b177af2 [0,1,0,0,0,0|3,0,0]=4 3777 B10R0.97 CC(=O)CNCCCC(=O)N 7b33f06e9bec02ba46bd1e82bf7225db [0,1,0,0,0,0|2,0,1]=4 3778 B10R0.97 CC(=O)CNCCCC(C)C 1fa04713272b1c98b03053df68f246e6 [0,1,0,0,0,0|2,0,0]=3 3779 B10R0.97 CC(=O)CNCCCC(C)O 5bed14fc9c7a9f12933f39db4b26ee7c [0,1,0,0,0,0|2,0,0]=3 3780 B10R0.97 CC(=O)CNCCCN(C)C 8ddcd4cdb9e3a08e2e5ccb01ca946d87 [0,1,0,0,0,0|3,0,0]=4 3781 B10R0.97 CC(=O)CNCCOC(C)C ec5e851e1c602886dd96ff72a3dba67c [0,1,0,0,0,0|3,0,0]=4 3782 B10R0.97 CC(=O)CNCCSC(C)C 882b0bc1749f70855bb2311cfaae603f [0,1,0,0,0,0|3,0,0]=4 3783 B10R0.97 CC(=O)COCCCC(=O)N 67d72e3cf5d3b14706736e66323ccb70 [0,1,0,0,0,0|2,0,1]=4 3784 B10R0.97 CC(=O)COCCCC(C)C beb7c1e583ddc432986e64bf98ccd874 [0,1,0,0,0,0|2,0,0]=3 3785 B10R0.97 CC(=O)COCCCN(C)C 3585c3d9cdbea5ad2af815d2ba92792f [0,1,0,0,0,0|3,0,0]=4 3786 B10R0.97 CC(=O)COCCOC(C)C d4b97aecb1ccfeddac04b1723714102e [0,1,0,0,0,0|3,0,0]=4 3787 B10R0.97 CC(=O)COCCSC(C)C 7eadece400629dcaed465d32da5796b3 [0,1,0,0,0,0|3,0,0]=4 3788 B10R0.97 CC(=O)NCCCCC(=O)N f0b49d5713f49cbe84c3014215dd812a [0,1,0,0,0,0|2,0,1]=4 3789 B10R0.97 CC(=O)NCCCCC(F)F 0fda25ddece41f9a09e52579c0cf96e2 [0,1,0,0,0,0|3,0,0]=4 3790 B10R0.97 CC(=O)NCCCCN(C)C 0062ab02ea9badd3406faa927615ba6c [0,1,0,0,0,0|3,0,0]=4 3791 B10R0.97 CC(=O)NCCCNC(C)C 7a988676cdb4dd170a080d15aae419c3 [0,1,0,0,0,0|3,0,0]=4 3792 B10R0.97 CC(=O)NCCCOC(C)C 9de6e020660a7c77bd33a7015ae29ca5 [0,1,0,0,0,0|3,0,0]=4 3793 B10R0.97 CC(=O)NCCCSC(C)C c9bc4609c77837c2982f65228065d46f [0,1,0,0,0,0|3,0,0]=4 3794 B10R0.97 CC(=O)NCCNCC(=O)O 6e5d75202d0baca9a5055b6bdbaf0499 [0,1,0,0,0,0|2,0,1]=4 3795 B10R0.97 CC(=O)NCCNCC(C)C e4e52d8ff491c3f08d2ba4c7a42dcf7c [0,1,0,0,0,0|3,0,0]=4 3796 B10R0.97 CC(=O)NCCNCC(C)O e0b0f96f57ddef57000edc60bbb05d8f [0,1,0,0,0,0|3,0,0]=4 3797 B10R0.97 CC(=O)NCCNC[C@@H](C)O d0118e6c763eb5fd5e09f450be2b8923 [0,1,0,0,0,0|3,0,0]=4 3798 B10R0.97 CC(=O)NCCNC[C@H](C)O 3e10258e9ca6e8d5695f6de9533f01b6 [0,1,0,0,0,0|3,0,0]=4 3799 B10R0.97 CC(=O)NCCOCC(=O)O e8f4fcda0abddeb81c1abe4d71b3d705 [0,1,0,0,0,0|2,0,1]=4 3800 B10R0.97 CC(=O)NCCOCC(C)C 8859fe9d634771b389301d8a9f3df674 [0,1,0,0,0,0|3,0,0]=4 3801 B10R0.97 CC(=O)NCCOCC(C)F eeb7abf97c2845460027165d52679a2e [0,1,0,0,0,0|3,0,0]=4 3802 B10R0.97 CC(=O)NCCOCC(C)S 3d642db6450785caf0536d5b14420a1f [0,1,0,0,0,0|3,0,0]=4 3803 B10R0.97 CC(=O)NCCOC[C@@H](C)F 64deb5f2c1e615ab6dafe1cf458f0511 [0,1,0,0,0,0|3,0,0]=4 3804 B10R0.97 CC(=O)NCCOC[C@H](C)F aad6fda8e201b0d444bc232b1c2010ac [0,1,0,0,0,0|3,0,0]=4 3805 B10R0.97 CC(=O)NCOCCC(=O)O 1956da499b74a783ec3c32e1a5e7dffd [0,1,0,0,0,0|2,0,1]=4 3806 B10R0.97 CC(=O)NCOCCC(C)C 09aa1f3cb62e561137bcb2a5e510d8bc [0,1,0,0,0,0|3,0,0]=4 3807 B10R0.97 CC(=O)OCCCOC(C)C 2dadfbcff321fa5dc5b58052413ca706 [0,1,0,0,0,0|3,0,0]=4 3808 B10R0.97 CC(=O)OCCNCC(=O)O d6fbe71143d070c0a82dcc5aa20dd457 [0,1,0,0,0,0|2,0,1]=4 3809 B10R0.97 CC(=O)OCCNCC(C)C ceea8777460fc296a6a0f10659e59b7c [0,1,0,0,0,0|3,0,0]=4 3810 B10R0.97 CC(=O)OCCNCC(C)O 2ccdac4b82992206fcced7f0200889f5 [0,1,0,0,0,0|3,0,0]=4 3811 B10R0.97 CC(=O)OCCNC[C@@H](C)O 6156f16dc4b52d2b157e4f566e318b73 [0,1,0,0,0,0|3,0,0]=4 3812 B10R0.97 CC(=O)OCCNC[C@H](C)O 9ca0444f9e0ce203ee9b8f07ad1fef29 [0,1,0,0,0,0|3,0,0]=4 3813 B10R0.97 CC(=O)OCCOCC(=O)O d6af6ce9f695ce8f47b94a48098e7d01 [0,1,0,0,0,0|2,0,1]=4 3814 B10R0.97 CC(=O)OCCOCC(C)C 6cd76efc740ca1a7b98636fb933d6536 [0,1,0,0,0,0|3,0,0]=4 3815 B10R0.97 CC(=O)OCCOCC(C)F 7fd1cefec405c06f3332663a7329e344 [0,1,0,0,0,0|3,0,0]=4 3816 B10R0.97 CC(=O)OCCOCC(C)S af2751768c9469cbb07e1315f42870cf [0,1,0,0,0,0|3,0,0]=4 3817 B10R0.97 CC(=O)OCCOC[C@@H](C)F 34a0754129cbeaddd892b513ff5deb61 [0,1,0,0,0,0|3,0,0]=4 3818 B10R0.97 CC(=O)OCCOC[C@H](C)F b7d026d673b739f662449ec658b2b76f [0,1,0,0,0,0|3,0,0]=4 3819 B10R0.97 CC(=O)OCNCCC(=O)O 73164cae61b692d1f9e97ba3d7b6aa53 [0,1,0,0,0,0|2,0,1]=4 3820 B10R0.97 CC(=O)OCNCCC(C)C a9bb23822077d559e84b0913369f8554 [0,1,0,0,0,0|3,0,0]=4 3821 B10R0.97 CC(=O)OCNCCC(C)O 9fe41b99755d9ff2653c03b7fe7fd715 [0,1,0,0,0,0|3,0,0]=4 3822 B10R0.97 CC(=O)OCNCC[C@@H](C)O adca9644c820966cca840cae23464cdd [0,1,0,0,0,0|3,0,0]=4 3823 B10R0.97 CC(=O)OCNCC[C@H](C)O faa29511bd8875e5271fdc3eceaa5e17 [0,1,0,0,0,0|3,0,0]=4 3824 B10R0.97 CC(=O)OCOCCC(=O)O 5103d3f534841104db3f7f2246da652b [0,1,0,0,0,0|2,0,1]=4 3825 B10R0.97 CC(=O)OCOCCC(C)C 9297b1e3b71c1cac31130af506839c44 [0,1,0,0,0,0|3,0,0]=4 3826 B10R0.97 CC(=O)SCCCOC(C)C 1213911d80c5f6c39d6295be9c4f43ad [0,1,0,0,0,0|3,0,0]=4 3827 B10R0.97 CC(=O)SCCNCC(=O)O c6b51fb02ef5c70b7b5e73f902d572bd [0,1,0,0,0,0|2,0,1]=4 3828 B10R0.97 CC(=O)SCCNCC(C)C ae42ba8fa10ec68ac62a21d34355da30 [0,1,0,0,0,0|3,0,0]=4 3829 B10R0.97 CC(=O)SCCNCC(C)O e798977bc52d3452954264bdaa1b29bf [0,1,0,0,0,0|3,0,0]=4 3830 B10R0.97 CC(=O)SCCNC[C@@H](C)O 8d3b4bba29c3d527ecadaaa0332ed324 [0,1,0,0,0,0|3,0,0]=4 3831 B10R0.97 CC(=O)SCCNC[C@H](C)O 4370aa6884d11ceb401781f362f496e8 [0,1,0,0,0,0|3,0,0]=4 3832 B10R0.97 CC(=O)SCCOCC(=O)O d9d32a5bc21181df72f7cd4764b4a484 [0,1,0,0,0,0|2,0,1]=4 3833 B10R0.97 CC(=O)SCCOCC(C)C b478a0714849d4b2070e2d9fa8cf2be7 [0,1,0,0,0,0|3,0,0]=4 3834 B10R0.97 CC(=O)SCCOCC(C)F 78ff37df22dac485b036f11a34d74828 [0,1,0,0,0,0|3,0,0]=4 3835 B10R0.97 CC(=O)SCCOCC(C)S 735f006b6ef7f5b5fb83b86af5af4875 [0,1,0,0,0,0|3,0,0]=4 3836 B10R0.97 CC(=O)SCCOC[C@@H](C)F a4c62c1c45ae6fb2a50225b52d2a1e6d [0,1,0,0,0,0|3,0,0]=4 3837 B10R0.97 CC(=O)SCCOC[C@H](C)F befc543b1b5139a79848c8add8e2fe80 [0,1,0,0,0,0|3,0,0]=4 3838 B10R0.97 CC(C)/C=C/CNCC(=O)O 5c82e9b7f3a51e880e53089d3f330fee [0,1,0,0,0,0|1,0,2]=4 3839 B10R0.97 CC(C)/C=C/COCC(=O)O c97e7e326cdfbf4ba3af84c0b167bd13 [0,1,0,0,0,0|1,0,2]=4 3840 B10R0.97 CC(C)CCCNCC(=O)N d0a6930d5b59cb935bdb596cc82b62e5 [0,1,0,0,0,0|2,0,0]=3 3841 B10R0.97 CC(C)CCCNCC(=O)O 7b5eb9dbf8040a2662aff8c8cae111a2 [0,1,0,0,0,0|1,0,0]=2 3842 B10R0.97 CC(C)CCCNCC(C)O 47cb7766edcd2c5facf77914d8239a22 [0,1,0,0,0,0|2,0,1]=4 3843 B10R0.97 CC(C)CCCNC[C@@H](C)O 7acacdcdf0d4ef0b6b82fae22c2ae397 [0,1,0,0,0,0|2,0,1]=4 3844 B10R0.97 CC(C)CCCNC[C@H](C)O 99485c59b33b30f340da075aaea6f401 [0,1,0,0,0,0|2,0,1]=4 3845 B10R0.97 CC(C)CCCNC[N+](=O)[O-] 2a620ab65dced2909e1d53f2495872d1 [0,1,0,0,0,0|2,0,1]=4 3846 B10R0.97 CC(C)CCCOCC(=O)N 54e2d90a34c6a5f3c0b7e192e34d6af0 [0,1,0,0,0,0|2,0,0]=3 3847 B10R0.97 CC(C)CCCOCC(=O)O 946e4036f4ad307d3c3712db7f7590d3 [0,1,0,0,0,0|1,0,0]=2 3848 B10R0.97 CC(C)CCCOCC(=S)N 2acf3acdf08678c5efa0f02656c03e49 [0,1,0,0,0,0|2,1,0]=4 3849 B10R0.97 CC(C)CCCOCS(=O)O 7352a701aea74ff5f0bd1e37bc147f98 [0,1,0,0,0,0|2,0,0]=3 3850 B10R0.97 CC(C)CCCOC[N+](=O)[O-] 9a689b9bf0c9735ca5befb8797fed561 [0,1,0,0,0,0|2,0,1]=4 3851 B10R0.97 CC(C)CCNCCC(=O)N 45a592638c415a1f9252d022d3a65c1a [0,1,0,0,0,0|2,0,0]=3 3852 B10R0.97 CC(C)CCNCCC(=O)O 29e05adcace821b712e2551c82554863 [0,1,0,0,0,0|1,0,0]=2 3853 B10R0.97 CC(C)CCNCCC(=S)N a22d72c25c7436ac25a86d4d66bd51f6 [0,1,0,0,0,0|2,1,0]=4 3854 B10R0.97 CC(C)CCNCCC(C)O 34fcec0ca110cc0e84744342fd4628b3 [0,1,0,0,0,0|2,0,1]=4 3855 B10R0.97 CC(C)CCNCCS(=O)C 6b8feb0d0ee861d47581b3ecc5eb037d [0,1,0,0,0,0|3,0,0]=4 3856 B10R0.97 CC(C)CCNCCS(=O)O 31b252b6fa4834ae4b8cef42a52f948a [0,1,0,0,0,0|2,0,0]=3 3857 B10R0.97 CC(C)CCNCC[C@@H](C)O b602b9ffb5960c19b4e3f32687c1c8ff [0,1,0,0,0,0|2,0,1]=4 3858 B10R0.97 CC(C)CCNCC[C@H](C)O ccfe2f8c8facf2433ba466b9ecd28169 [0,1,0,0,0,0|2,0,1]=4 3859 B10R0.97 CC(C)CCNCSC(=O)N 3b09c46c99484f7e87b632beaf8030ae [0,1,0,0,0,0|3,0,0]=4 3860 B10R0.97 CC(C)CCOCCC(=O)N d774eae3d450426c6a0c5cbac71ff3f4 [0,1,0,0,0,0|2,0,0]=3 3861 B10R0.97 CC(C)CCOCCC(=O)O e0795bebe5219e64bad949096de2aa71 [0,1,0,0,0,0|1,0,0]=2 3862 B10R0.97 CC(C)CCOCCS(=O)C 131b27d446716b2e45b9860b1de4db16 [0,1,0,0,0,0|3,0,0]=4 3863 B10R0.97 CC(C)CCOCC[N+](=O)[O-] eafc1feb99124a8073454ecce2943e20 [0,1,0,0,0,0|2,0,1]=4 3864 B10R0.97 CC(C)CCOCNC(=O)N 186c6fb152cedc66023c0e292dbacedf [0,1,0,0,0,0|3,0,0]=4 3865 B10R0.97 CC(C)CCOCSC(=O)N bdd793b84796e5df93874a7a51268010 [0,1,0,0,0,0|3,0,0]=4 3866 B10R0.97 CC(C)CNC/C=C/C(=O)O 5739b3fbf12b13bcc6280ec87ca72acb [0,1,0,0,0,0|1,0,2]=4 3867 B10R0.97 CC(C)CNCC#CC(=O)O 6096fac8a74f5d99ed0b8dd39e7677ab [0,1,0,0,0,0|1,0,2]=4 3868 B10R0.97 CC(C)CNCC=CC(=O)O 6043100451ffb1ae48fcf115d0c03a84 [0,1,0,0,0,0|1,0,2]=4 3869 B10R0.97 CC(C)CNCCCC(=O)N 0f0ea70316a29cf4c8b917050bc9c4d4 [0,1,0,0,0,0|2,0,0]=3 3870 B10R0.97 CC(C)CNCCCC(=O)O 26ee06db53a69b8e2393eec9461819e8 [0,1,0,0,0,0|1,0,0]=2 3871 B10R0.97 CC(C)CNCCCC(C)O 0ead346042b4fc90a0b631892b62ff8a [0,1,0,0,0,0|2,0,1]=4 3872 B10R0.97 CC(C)CNCCCS(=O)C 6e152acb904f23c461583902a8888a78 [0,1,0,0,0,0|3,0,0]=4 3873 B10R0.97 CC(C)CNCCC[N+](=O)[O-] 9aaed3737430d38448e57b16fcda077e [0,1,0,0,0,0|2,0,1]=4 3874 B10R0.97 CC(C)CNCCNC(=O)N 2aae13134d2eb264f546d5443c6c0410 [0,1,0,0,0,0|3,0,0]=4 3875 B10R0.97 CC(C)COC/C=C/C(=O)O cb2fcfbaf77949a784c256e2b3c7751e [0,1,0,0,0,0|1,0,2]=4 3876 B10R0.97 CC(C)COCC#CC(=O)O fb6e535c4faa8120589282c0967e7993 [0,1,0,0,0,0|1,0,2]=4 3877 B10R0.97 CC(C)COCC=CC(=O)O a7305551f564720db4b3f6e889c4accb [0,1,0,0,0,0|1,0,2]=4 3878 B10R0.97 CC(C)COCCCC(=O)N e1ef5382714346abd933db6c4714f8ee [0,1,0,0,0,0|2,0,0]=3 3879 B10R0.97 CC(C)COCCC[N+](=O)[O-] 35d3376b6478494352a1b9cb51b522c7 [0,1,0,0,0,0|2,0,1]=4 3880 B10R0.97 CC(C)COCCNC(=O)N 8fe9e8175f6a1c9600e98d6174fb4537 [0,1,0,0,0,0|3,0,0]=4 3881 B10R0.97 CC(C)NCCCCC(=O)N 38b067db0007fa6e5c8101d29c440bbb [0,1,0,0,0,0|2,0,0]=3 3882 B10R0.97 CC(C)NCCCCC(=O)O 8ca7ad1722d6df81b0afcb0267dc9593 [0,1,0,0,0,0|1,0,0]=2 3883 B10R0.97 CC(C)NCCOCC(=O)O 8f596033ae90bed52692346183e35aa2 [0,1,0,0,0,0|2,0,0]=3 3884 B10R0.97 CC(C)NCCSCC(=O)O f4f0b1259d1d3e976682f92ba469551e [0,1,0,0,0,0|2,0,0]=3 3885 B10R0.97 CC(C)OCCC#CC(=O)O 968677221d0bc27c21b89427757253af [0,1,0,0,0,0|1,0,2]=4 3886 B10R0.97 CC(C)OCCCCC(=O)N 845ce5cee30744a4000807cc7c9c80f8 [0,1,0,0,0,0|2,0,0]=3 3887 B10R0.97 CC(C)OCCCCC(=O)O 080d97a0ede59999c48dbc5986ec4e9f [0,1,0,0,0,0|1,0,0]=2 3888 B10R0.97 CC(C)OCCCC[N+](=O)[O-] eaa2cbac8280f8a4296368b7681c88f4 [0,1,0,0,0,0|2,0,1]=4 3889 B10R0.97 CC(C)OCCNCC(=O)N 4623f66b0d6d2b78374a021666a50b93 [0,1,0,0,0,0|3,0,0]=4 3890 B10R0.97 CC(C)OCCNCC(=O)O d9233d6f5a2abb63d094bd87c8b4b4d9 [0,1,0,0,0,0|2,0,0]=3 3891 B10R0.97 CC(C)OCCOCC(=O)N 9e173618204bfada12fa486cf621c111 [0,1,0,0,0,0|3,0,0]=4 3892 B10R0.97 CC(C)OCCOCC(=O)O ca126d53a6e1dd30f108e2c5d3635f3e [0,1,0,0,0,0|2,0,0]=3 3893 B10R0.97 CC(C)OCCOCS(=O)O 16510aec4b2e2f9367abc1df0821aec4 [0,1,0,0,0,0|3,0,0]=4 3894 B10R0.97 CC(C)OCCSCC(=O)N a1ab29d43aa24cb701b549a8914357cf [0,1,0,0,0,0|3,0,0]=4 3895 B10R0.97 CC(C)OCNCCC(=O)N add7f340c8a33e4ee232037b4e88d240 [0,1,0,0,0,0|3,0,0]=4 3896 B10R0.97 CC(C)OCNCCC(=O)O 471c403e23ef1455eefb255b97f252b1 [0,1,0,0,0,0|2,0,0]=3 3897 B10R0.97 CC(C)OCNCCS(=O)O 46c664f627885133be11c204b7d1f73d [0,1,0,0,0,0|3,0,0]=4 3898 B10R0.97 CC(C)OCOCCC(=O)N bac3725b85fb38fd3bfabc0a5f7074ac [0,1,0,0,0,0|3,0,0]=4 3899 B10R0.97 CC(C)OCOCCC(=O)O e7da7510ec07e2d816f2631dbcc4fc29 [0,1,0,0,0,0|2,0,0]=3 3900 B10R0.97 CC(C)SCCNCC(=O)N b4377f98352b8dc623bc536be475a21b [0,1,0,0,0,0|3,0,0]=4 3901 B10R0.97 CC(C)SCCNCC(=O)O c91a2f6904497100466c5d082ad912ae [0,1,0,0,0,0|2,0,0]=3 3902 B10R0.97 CC(C)SCCOCC(=O)N 2ed3c5bac6316e73a5c3d34add28eabb [0,1,0,0,0,0|3,0,0]=4 3903 B10R0.97 CC(C)SCCOCC(=O)O 08b0602bb90386df3f18be9d28ab2311 [0,1,0,0,0,0|2,0,0]=3 3904 B10R0.97 CC(C)SCCOCS(=O)O df6c0b1a4767aebafc981cf13fec5662 [0,1,0,0,0,0|3,0,0]=4 3905 B10R0.97 CC(F)COC/C=C/C(=O)O ca0145e9b48baad89df4634e060e4766 [0,1,0,0,0,0|1,0,2]=4 3906 B10R0.97 CC(F)COCC=CC(=O)O d36a7037b6fb9c8eff156caeb1f362df [0,1,0,0,0,0|1,0,2]=4 3907 B10R0.97 CC(F)COCCCC(=O)N e140b7d76850f60d891e3da9ea7657ec [0,1,0,0,0,0|2,0,0]=3 3908 B10R0.97 CC(F)COCCC[N+](=O)[O-] c11d25a74ed8e3fd2d1588941c4cb155 [0,1,0,0,0,0|2,0,1]=4 3909 B10R0.97 CC(F)COCCNC(=O)N 8312b2747372207e641e8aba5fb788f2 [0,1,0,0,0,0|3,0,0]=4 3910 B10R0.97 CC(O)CCCNCC(=O)N 39fb65e87f0298671245faa925118ac4 [0,1,0,0,0,0|2,0,0]=3 3911 B10R0.97 CC(O)CCCNCC(=O)O bccb9d805e09a648643e850da2fcab8c [0,1,0,0,0,0|1,0,0]=2 3912 B10R0.97 CC(O)CCCNCC(C)O 11d6199de225a655b4c5d8b0de0c86f2 [0,1,0,0,0,0|2,0,1]=4 3913 B10R0.97 CC(O)CCCNC[C@@H](C)O 079374ef56d2f58696c66336c075202c [0,1,0,0,0,0|2,0,1]=4 3914 B10R0.97 CC(O)CCCNC[C@H](C)O 955a0111582b4a59fbef6bf73615108b [0,1,0,0,0,0|2,0,1]=4 3915 B10R0.97 CC(O)CCNCCC(=O)N e05cbfaa91d7d32ec171dc8fd5348abd [0,1,0,0,0,0|2,0,0]=3 3916 B10R0.97 CC(O)CCNCCC(=O)O 5cb6ca88c78ab71b45fe05defd351d6b [0,1,0,0,0,0|1,0,0]=2 3917 B10R0.97 CC(O)CCNCCC(=S)N 6f18591439debc23c98ea1b286a635a5 [0,1,0,0,0,0|2,1,0]=4 3918 B10R0.97 CC(O)CCNCCC(C)O 1b672ea211c2fbece63609827af3b5bf [0,1,0,0,0,0|2,0,1]=4 3919 B10R0.97 CC(O)CCNCCS(=O)C a110fb25c9ee96329959898518df71eb [0,1,0,0,0,0|3,0,0]=4 3920 B10R0.97 CC(O)CCNCCS(=O)O 32e047590389f7c73d383251e6e37212 [0,1,0,0,0,0|2,0,0]=3 3921 B10R0.97 CC(O)CCNCC[C@@H](C)O e153c5926d210190a61da0b0b1cc0b1c [0,1,0,0,0,0|2,0,1]=4 3922 B10R0.97 CC(O)CCNCC[C@H](C)O 72ba64c6f675fc0b7cc6e1ac74e2d769 [0,1,0,0,0,0|2,0,1]=4 3923 B10R0.97 CC(O)CCNCSC(=O)N 026fdc1d2b10c7716f838a0ae870c23f [0,1,0,0,0,0|3,0,0]=4 3924 B10R0.97 CC(O)CNC/C=C/C(=O)O 5901a30aac7aec25e8c54b71317ceda6 [0,1,0,0,0,0|1,0,2]=4 3925 B10R0.97 CC(O)CNCC#CC(=O)O feed19e37a45dea8b9f2cc5ba32ef815 [0,1,0,0,0,0|1,0,2]=4 3926 B10R0.97 CC(O)CNCC=CC(=O)O 502e473965995f46d4cbc728dcfabd5f [0,1,0,0,0,0|1,0,2]=4 3927 B10R0.97 CC(O)CNCCCC(=O)N 95d414d8913288bac6fc8e8beee28c47 [0,1,0,0,0,0|2,0,0]=3 3928 B10R0.97 CC(O)CNCCCC(=O)O 803531ff04b8ba4f1800dccdadb7502b [0,1,0,0,0,0|1,0,0]=2 3929 B10R0.97 CC(O)CNCCCS(=O)C 35f9b1d5508dc3377e52d26eb48a28bb [0,1,0,0,0,0|3,0,0]=4 3930 B10R0.97 CC(O)CNCCC[N+](=O)[O-] 021e5701fabbf713fe624706f29525d8 [0,1,0,0,0,0|2,0,1]=4 3931 B10R0.97 CC(O)CNCCNC(=O)N 1d9865985b952f1d6928a83a61de677c [0,1,0,0,0,0|3,0,0]=4 3932 B10R0.97 CC(S)COC/C=C/C(=O)O 2c62a0d63b836b0a15ef51bdd8bd6d69 [0,1,0,0,0,0|1,0,2]=4 3933 B10R0.97 CC(S)COCC=CC(=O)O 575bf131174d6aa8de4070ee1300770a [0,1,0,0,0,0|1,0,2]=4 3934 B10R0.97 CC(S)COCCCC(=O)N 5bbf7e562e45b8ce11d47b2543a4dc52 [0,1,0,0,0,0|2,0,0]=3 3935 B10R0.97 CC(S)COCCC[N+](=O)[O-] def625999d6c46a9367b058ae2f6fa27 [0,1,0,0,0,0|2,0,1]=4 3936 B10R0.97 CC(S)COCCNC(=O)N bc6eba7ed94923e8cbb5f312e8745998 [0,1,0,0,0,0|3,0,0]=4 3937 B10R0.97 CN(C)CCCNCC(=O)N 32baf241b5679db31ee123212261380d [0,1,0,0,0,0|3,0,0]=4 3938 B10R0.97 CN(C)CCCNCC(=O)O f36d6ac8916669e62c0924b9cda2e0f5 [0,1,0,0,0,0|2,0,0]=3 3939 B10R0.97 CN(C)CCCOCC(=O)N fc8af38b19d0bc01e0f8389b4414d7bd [0,1,0,0,0,0|3,0,0]=4 3940 B10R0.97 CN(C)CCCOCC(=O)O e65f1d54ee3a61b813d739823c5d0031 [0,1,0,0,0,0|2,0,0]=3 3941 B10R0.97 CN(C)CCCOCS(=O)O ffd514a987d42fb0dc718dbe78f88ece [0,1,0,0,0,0|3,0,0]=4 3942 B10R0.97 CN(C)CCNCCC(=O)N 061d835cfe794d000fdc2ddd759ba948 [0,1,0,0,0,0|3,0,0]=4 3943 B10R0.97 CN(C)CCNCCC(=O)O a0f4d30b8014303b0638054b4c8b13b2 [0,1,0,0,0,0|2,0,0]=3 3944 B10R0.97 CN(C)CCNCCS(=O)O e20c39d501e27e7f6accea2a70ae08b6 [0,1,0,0,0,0|3,0,0]=4 3945 B10R0.97 CN(C)CCOCCC(=O)N 58b4f7cd0af1148d44c204781fa30920 [0,1,0,0,0,0|3,0,0]=4 3946 B10R0.97 CN(C)CCOCCC(=O)O 8145e0353380ba7d77138194a3a7d8f4 [0,1,0,0,0,0|2,0,0]=3 3947 B10R0.97 CN(C)CNCCCC(=O)N a906eaf53a8ab11aa39e2e6930a1a764 [0,1,0,0,0,0|3,0,0]=4 3948 B10R0.97 CN(C)CNCCCC(=O)O 3a727bb28b9020a0f00630449137b7dc [0,1,0,0,0,0|2,0,0]=3 3949 B10R0.97 CN(C)COCCCC(=O)N de287ddca3ce0a8dcd108f00ded5434e [0,1,0,0,0,0|3,0,0]=4 3950 B10R0.97 CS(=O)CCCNCC(=O)N 27a1fb66f787312731cc7c651d07e6d2 [0,1,0,0,0,0|3,0,0]=4 3951 B10R0.97 CS(=O)CCCNCC(=O)O 090a24d96f0e27e511623262a3a90cb5 [0,1,0,0,0,0|2,0,0]=3 3952 B10R0.97 CS(=O)CCNCCC(=O)N f900e1eab9fa5b2a7d07194d956a6cf7 [0,1,0,0,0,0|3,0,0]=4 3953 B10R0.97 CS(=O)CCNCCC(=O)O e6da491bbfef9e99031b7f519bdaf264 [0,1,0,0,0,0|2,0,0]=3 3954 B10R0.97 CS(=O)CCNCCS(=O)O 73a7f76b3c8c89d74acf1742e977eeed [0,1,0,0,0,0|3,0,0]=4 3955 B10R0.97 CS(=O)CCOCCC(=O)N 612275feda378a258fd41746c4e84223 [0,1,0,0,0,0|3,0,0]=4 3956 B10R0.97 CS(=O)CCOCCC(=O)O 64e1ef5b421ed90d01d9a6955f8bbddd [0,1,0,0,0,0|2,0,0]=3 3957 B10R0.97 C[C@@H](F)COC/C=C/C(=O)O 860410dad056048b0b31498cc4f72fd9 [0,1,0,0,0,0|1,0,2]=4 3958 B10R0.97 C[C@@H](F)COCC=CC(=O)O d376d02445d6e5acb7378547780e8d18 [0,1,0,0,0,0|1,0,2]=4 3959 B10R0.97 C[C@@H](F)COCCCC(=O)N fd1ab2965c52c1c24b40243ebd4469d4 [0,1,0,0,0,0|2,0,0]=3 3960 B10R0.97 C[C@@H](F)COCCC[N+](=O)[O-] 669393fde2aef4b52ccec264365c3ce9 [0,1,0,0,0,0|2,0,1]=4 3961 B10R0.97 C[C@@H](F)COCCNC(=O)N 965681ccd4067bcb16d75ab391b7ef3a [0,1,0,0,0,0|3,0,0]=4 3962 B10R0.97 C[C@@H](O)CCNCCC(=O)N 045a4f7d6dcfde8b83481c9a6fc64061 [0,1,0,0,0,0|2,0,0]=3 3963 B10R0.97 C[C@@H](O)CCNCCC(=O)O 5a67dcdd3503103dc4fc520d76b18570 [0,1,0,0,0,0|1,0,0]=2 3964 B10R0.97 C[C@@H](O)CCNCCS(=O)C 52db58a3e32bc841f027dc60f518861a [0,1,0,0,0,0|3,0,0]=4 3965 B10R0.97 C[C@@H](O)CCNCSC(=O)N 00f307dc1b98d83f9cbd8aebba2679f0 [0,1,0,0,0,0|3,0,0]=4 3966 B10R0.97 C[C@@H](O)CNC/C=C/C(=O)O 5486ff52a0faefb0ce3a87a4aaaf2624 [0,1,0,0,0,0|1,0,2]=4 3967 B10R0.97 C[C@@H](O)CNCC#CC(=O)O a119cb13877a13251c72536023b8bd0d [0,1,0,0,0,0|1,0,2]=4 3968 B10R0.97 C[C@@H](O)CNCC=CC(=O)O 3cf8834c46be6db0d56fc59045ee94d0 [0,1,0,0,0,0|1,0,2]=4 3969 B10R0.97 C[C@@H](O)CNCCCC(=O)N 0c7644f8df2427c0eda8a73923a2515f [0,1,0,0,0,0|2,0,0]=3 3970 B10R0.97 C[C@@H](O)CNCCCC(=O)O b76c49cbc84d63ae631f619c0916d501 [0,1,0,0,0,0|1,0,0]=2 3971 B10R0.97 C[C@@H](O)CNCCCS(=O)C bf2f1d0f1b4ed8cc2b209466b8593067 [0,1,0,0,0,0|3,0,0]=4 3972 B10R0.97 C[C@@H](O)CNCCC[N+](=O)[O-] d1f6fe67eea8192a96062fa3cfe7ea76 [0,1,0,0,0,0|2,0,1]=4 3973 B10R0.97 C[C@@H](O)CNCCNC(=O)N 1f76a6d090317c936b5d1b62a377c51c [0,1,0,0,0,0|3,0,0]=4 3974 B10R0.97 C[C@H](F)COC/C=C/C(=O)O 14c8d7f69556138dfe128aebe4935294 [0,1,0,0,0,0|1,0,2]=4 3975 B10R0.97 C[C@H](F)COCC=CC(=O)O c5a4bd7982d258e941a0e93bb17ef89e [0,1,0,0,0,0|1,0,2]=4 3976 B10R0.97 C[C@H](F)COCCCC(=O)N 989336502a9b386a3f0e8555beb9ce07 [0,1,0,0,0,0|2,0,0]=3 3977 B10R0.97 C[C@H](F)COCCC[N+](=O)[O-] 222dc61c9492f2e2aa16bf5dfbd1a7d7 [0,1,0,0,0,0|2,0,1]=4 3978 B10R0.97 C[C@H](F)COCCNC(=O)N 0c5be855b37345eb4eafd5b7c31c29af [0,1,0,0,0,0|3,0,0]=4 3979 B10R0.97 C[C@H](O)CCNCCC(=O)N 26cc977be0b96a43566d14751467fd19 [0,1,0,0,0,0|2,0,0]=3 3980 B10R0.97 C[C@H](O)CCNCCC(=O)O 926fa517551eec126edfee46a62debd5 [0,1,0,0,0,0|1,0,0]=2 3981 B10R0.97 C[C@H](O)CCNCCS(=O)C ddda327eee1457c26ded0ef4ea3ae138 [0,1,0,0,0,0|3,0,0]=4 3982 B10R0.97 C[C@H](O)CCNCSC(=O)N 26a5ca3140cb08188144ba3a2e6d1599 [0,1,0,0,0,0|3,0,0]=4 3983 B10R0.97 C[C@H](O)CNC/C=C/C(=O)O 546e6dc14b75acba1f7ef4c4943ed4dc [0,1,0,0,0,0|1,0,2]=4 3984 B10R0.97 C[C@H](O)CNCC#CC(=O)O 166cf81e4496c87a6e5d56642fd786f5 [0,1,0,0,0,0|1,0,2]=4 3985 B10R0.97 C[C@H](O)CNCC=CC(=O)O d5d31ab2c4551a3b84f2b48e40dc459e [0,1,0,0,0,0|1,0,2]=4 3986 B10R0.97 C[C@H](O)CNCCCC(=O)N 37d5c40120bb8c4977d50a543ac3d7ed [0,1,0,0,0,0|2,0,0]=3 3987 B10R0.97 C[C@H](O)CNCCCC(=O)O 6df3ccef4c5ef1407b3cb64e292e3e26 [0,1,0,0,0,0|1,0,0]=2 3988 B10R0.97 C[C@H](O)CNCCCS(=O)C 34fe7f215022269a0f480db669e73aa8 [0,1,0,0,0,0|3,0,0]=4 3989 B10R0.97 C[C@H](O)CNCCC[N+](=O)[O-] 28e0c68b5367b09069f5d93fb080e249 [0,1,0,0,0,0|2,0,1]=4 3990 B10R0.97 C[C@H](O)CNCCNC(=O)N a542f3f9843dd2c574cdc2b376eab29c [0,1,0,0,0,0|3,0,0]=4 3991 B10R0.97 NC(=O)CCCNCC(=O)O 681bf9a49b09fb244d4b0544aa0f0c1e [0,1,0,0,0,0|2,0,1]=4 3992 B10R0.97 NC(=O)CCCNCC(F)F 375a5cf0d0bd38eef48f6db32b759f01 [0,1,0,0,0,0|3,0,0]=4 3993 B10R0.97 NC(=O)CCCOCC(=O)O 207f450c773475b77861c937f6eed1e1 [0,1,0,0,0,0|2,0,1]=4 3994 B10R0.97 NC(=O)CCCOCC(F)F b376a950ffb70ddb705f5ecd857cd013 [0,1,0,0,0,0|3,0,0]=4 3995 B10R0.97 NC(=O)CCNCCC(=O)O cf28330a5f9bcc81c85b658b861b0da9 [0,1,0,0,0,0|2,0,1]=4 3996 B10R0.97 NC(=O)CCNCCC(F)F 0440b16e45aa1564765d86ec9df14f34 [0,1,0,0,0,0|3,0,0]=4 3997 B10R0.97 NC(=O)CCOCCC(=O)O d9e11414f18c6adac56d3b07d655eb83 [0,1,0,0,0,0|2,0,1]=4 3998 B10R0.97 NC(=O)CCOCCC(F)F d59d206d3289abff6a7c0dfff5885130 [0,1,0,0,0,0|3,0,0]=4 3999 B10R0.97 NC(=O)CNCCCC(=O)O ede9e5c830fd5b952593217e06e3fc67 [0,1,0,0,0,0|2,0,1]=4 4000 B10R0.97 NC(=S)CCNCCC(=O)O a5ef06ff91c580cd4dd7c08c301d9bf6 [0,1,0,0,0,0|2,0,1]=4 4001 B10R0.97 O=C(O)CCCNCC(=O)O c1fb1d26f4369b6b15840f4bd05aad4a [0,1,0,0,0,0|2,0,1]=4 4002 B10R0.97 O=C(O)CCCNCC(F)F 5d730fcdd21ad43f97eda848d677407d [0,1,0,0,0,0|2,0,0]=3 4003 B10R0.97 O=C(O)CCNCCC(=O)O f720177bb6e681193c4a522b8b1a2ab3 [0,1,0,0,0,0|2,0,1]=4 4004 B10R0.97 O=C(O)CCNCCC(F)F 62620ca2169ccaefd72dfd56e46c7e59 [0,1,0,0,0,0|2,0,0]=3 4005 B10R0.97 O=C(O)CCNCCS(=O)O 797ed0a2ff1accd75f2fe5bbb8efd767 [0,1,0,0,0,0|3,0,0]=4 4006 B10R0.97 O=C(O)CCOCCC(=O)O 6d0eaea7af8fca9cf172539dcc2cc4eb [0,1,0,0,0,0|2,0,1]=4 4007 B10R0.97 O=C(O)CCOCCC(F)F 8827639f7f04063cfe435c3fc128b5cb [0,1,0,0,0,0|2,0,0]=3 4008 B10R0.97 O=C(O)CCOCC[N+](=O)[O-] b99b270b9c9192b6372c6020178ec52d [0,1,0,0,0,0|3,0,0]=4 4009 B10R0.97 O=C(O)CNCCOC(F)F e7ccec0b37a39c4f43cde86381c955c3 [0,1,0,0,0,0|3,0,0]=4 4010 B10R0.97 O=C(O)COCCC[N+](=O)[O-] b10909682f36de971af0fb9e3c3fe6f2 [0,1,0,0,0,0|3,0,0]=4 4011 B10R0.97 O=C(O)COCCOC(F)F 8d75a3d8283a6f957f295af2c9d64915 [0,1,0,0,0,0|3,0,0]=4 4012 B10R1.10 CCCN1CCCC(=O)C1 7297bca07aecf137a110922d2e01ce93 [0,0,0,1,0,0|2,0,0]=3 4013 B10R1.10 CCCN1CCCC(C1)O 4b5e31bc75a412042a98cda95cb657d2 [0,0,0,1,0,0|2,0,1]=4 4014 B10R1.10 CCCN1CCC[C@@H](C1)O b4f8b28199658b903bd200d0f10150d0 [0,0,0,1,0,0|2,0,1]=4 4015 B10R1.10 CCCN1CCC[C@H](C1)O dd2f52a0ca3a05a39c7e198c74003e98 [0,0,0,1,0,0|2,0,1]=4 4016 B10R1.10 CCCN1CCNC(=O)C1 d8e989a714f7948a3d5167ce4cee8b3b [0,0,0,1,0,0|3,0,0]=4 4017 B10R1.10 CCCN1CCOC(=O)C1 32566a616273931864f84b8dc9e1db89 [0,0,0,1,0,0|3,0,0]=4 4018 B10R1.10 CCNC1CCCC(C1)O 113e722fc1e449e3e54ccf67b4ce78a7 [0,0,0,1,0,0|2,0,1]=4 4019 B10R1.10 CCNC1CCNC(=O)C1 479099502481b0bb9404cd03f14296cc [0,0,0,1,0,0|3,0,0]=4 4020 B10R1.10 CCN[C@@H]1CCC[C@@H](C1)O 7f9bb0b6d56b12bb66d83f760d316ab1 [0,0,0,1,0,0|2,0,1]=4 4021 B10R1.10 CCN[C@@H]1CCC[C@H](C1)O 396290b6b5db7e9cb63a3fcf9b0c183b [0,0,0,1,0,0|2,0,1]=4 4022 B10R1.10 CCN[C@@H]1CCNC(=O)C1 9e0e4a482e7d76c713bd53a977e4018c [0,0,0,1,0,0|3,0,0]=4 4023 B10R1.10 CCN[C@H]1CCC[C@@H](C1)O 79d8666b7770f893e752839182a97ad1 [0,0,0,1,0,0|2,0,1]=4 4024 B10R1.10 CCN[C@H]1CCC[C@H](C1)O 5b66beda661cb9accdacd389931ec98f [0,0,0,1,0,0|2,0,1]=4 4025 B10R1.10 CCN[C@H]1CCNC(=O)C1 8a31d87f498d620fd6d53bbabeec5703 [0,0,0,1,0,0|3,0,0]=4 4026 B10R1.10 CCOC1C=C(CCC1)C d9eb6c6cd48b33da0c9d05cf485ca643 [0,0,0,1,0,0|3,0,0]=4 4027 B10R1.10 CCOC1CCCC(=O)C1 7694e8ef5c808ba4dfd648fc2fdd5673 [0,0,0,1,0,0|2,0,0]=3 4028 B10R1.10 CCOC1CCNC(=O)C1 d6924d66bc2960427a5aa83c3b834b70 [0,0,0,1,0,0|3,0,0]=4 4029 B10R1.10 CCO[C@@H]1CCNC(=O)C1 2becd24c03a17e28797b47c03861b891 [0,0,0,1,0,0|3,0,0]=4 4030 B10R1.10 CCO[C@H]1CCNC(=O)C1 0c306295dc6c1bac8cf8e49e072469f8 [0,0,0,1,0,0|3,0,0]=4 4031 B10R1.10 COCN1CCCC(=O)C1 317af02d006d13a065b06a81b628f169 [0,0,0,1,0,0|3,0,0]=4 4032 B10R1.10 CSCN1CCCC(=O)C1 b21514babe8d2894f6c60bd55dd61e0c [0,0,0,1,0,0|3,0,0]=4 4033 B10R1.10 O=C1CCCC(C1)OCF 3ef4074d9d8cde512776f61233cdd122 [0,0,0,1,0,0|3,0,0]=4 4034 B10R1.10 O=C1CCCN(C1)CCF df6897b009456e691cbb1a32e848f708 [0,0,0,1,0,0|3,0,0]=4 4035 B10R1.10 O=C1CCCN(C1)CCO 6865bbc1bbed842c379aefac569dc87d [0,0,0,1,0,0|3,0,0]=4 4036 B10R1.10 O=C1CCCN(C1)CCS d9f8fccd11178e50e7151700008525ca [0,0,0,1,0,0|3,0,0]=4 4037 B10R1.16 CCCCN1CCC(C1)O 584db9ab75df990a992c8592cd74cb04 [0,0,0,1,0,0|2,0,1]=4 4038 B10R1.16 CCCCN1CC[C@@H](C1)O b5851d6be3a4e1fb5c92f6bf54ffb635 [0,0,0,1,0,0|2,0,1]=4 4039 B10R1.16 CCCCN1CC[C@H](C1)O e5dbb9cf9ec2abf54bbd5a4dcb2f08ad [0,0,0,1,0,0|2,0,1]=4 4040 B10R1.16 CCCCN1CNC(=O)C1 0624f2a7ee39baaad7c43ea60cd55ffb [0,0,0,1,0,0|3,0,0]=4 4041 B10R1.16 CCCNC1CCC(C1)O f1b335e63d27b53f1a1b6a1c3d09f7f2 [0,0,0,1,0,0|2,0,1]=4 4042 B10R1.16 CCCNC1CNC(=O)C1 35d5e3b097849aab566cce8890869260 [0,0,0,1,0,0|3,0,0]=4 4043 B10R1.16 CCCN[C@@H]1CC[C@@H](C1)O 2205b6593b5f673891de8852dfa6826b [0,0,0,1,0,0|2,0,1]=4 4044 B10R1.16 CCCN[C@@H]1CC[C@H](C1)O d9fd8f02ee8da6c0ca51876478c2a65b [0,0,0,1,0,0|2,0,1]=4 4045 B10R1.16 CCCN[C@@H]1CNC(=O)C1 051cf0147f8a99fbc0924cefcf322cca [0,0,0,1,0,0|3,0,0]=4 4046 B10R1.16 CCCN[C@H]1CC[C@@H](C1)O 9e176b3a99876099d4ac464218d7b1a2 [0,0,0,1,0,0|2,0,1]=4 4047 B10R1.16 CCCN[C@H]1CC[C@H](C1)O 2723f1f883a3f877474673609328126f [0,0,0,1,0,0|2,0,1]=4 4048 B10R1.16 CCCN[C@H]1CNC(=O)C1 7cea076bfed9e270d22e944eec1d557a [0,0,0,1,0,0|3,0,0]=4 4049 B10R1.16 CCCOC1=CC(=O)CC1 a2353883a2bd2b42e0a88c8646a1e90b [0,0,0,1,0,0|2,0,1]=4 4050 B10R1.16 CCCOC1C=CC(=O)O1 ec85feedde51258c7e7f449139265d27 [0,0,0,1,0,0|1,0,2]=4 4051 B10R1.16 CCCOC1CCC(=O)C1 0118665d271ddbcc63e9ba5f111fa1f6 [0,0,0,1,0,0|2,0,0]=3 4052 B10R1.16 CCCOC1CNC(=O)C1 0f15cee0a2759025c047bc54ce0080e3 [0,0,0,1,0,0|3,0,0]=4 4053 B10R1.16 CCCOC1COC(=O)C1 ca0ac5731bd984eaa0698f1cba3edf6a [0,0,0,1,0,0|3,0,0]=4 4054 B10R1.16 CCCO[C@@H]1CNC(=O)C1 61a5ac0fba08becf910c02802fbd53bf [0,0,0,1,0,0|3,0,0]=4 4055 B10R1.16 CCCO[C@@H]1COC(=O)C1 e7d18da29ffe80b08db4c6cd7cf2389d [0,0,0,1,0,0|3,0,0]=4 4056 B10R1.16 CCCO[C@H]1CNC(=O)C1 1aec5b2052828c55ce00f017788b3401 [0,0,0,1,0,0|3,0,0]=4 4057 B10R1.16 CCCO[C@H]1COC(=O)C1 52385ae9526d9d0546f0e633bba5aca7 [0,0,0,1,0,0|3,0,0]=4 4058 B10R1.16 CCNCC1CCC(=O)N1 b2d4e2d5e4524f1edb7bc0ead8723922 [0,0,0,1,0,0|2,0,0]=3 4059 B10R1.16 CCNCC1CCC(C1)O 2a62b49b03dc9bd9c9667922aa8236db [0,0,0,1,0,0|2,0,1]=4 4060 B10R1.16 CCNCC1CNC(=O)C1 94246a3528a078628d4d42a9d48429d0 [0,0,0,1,0,0|3,0,0]=4 4061 B10R1.16 CCNC[C@@H]1CCC(=O)N1 0c12878ef047aa579a235990ce95252d [0,0,0,1,0,0|2,0,0]=3 4062 B10R1.16 CCNC[C@@H]1CNC(=O)C1 ccee0d8d0ac64bde793ef5dab31e197e [0,0,0,1,0,0|3,0,0]=4 4063 B10R1.16 CCNC[C@H]1CCC(=O)N1 7bf56d86ba2fc8887a82e9543391075b [0,0,0,1,0,0|2,0,0]=3 4064 B10R1.16 CCOCC1C=CC(=O)O1 3d114fda6fc7a21d274206eff0482ba4 [0,0,0,1,0,0|1,0,2]=4 4065 B10R1.16 CCOCC1CCC(=O)C1 b2309fa8aecb08cd924e47f5abc4efec [0,0,0,1,0,0|2,0,0]=3 4066 B10R1.16 CCOCC1CCC(=O)N1 284faa06f6b7af7d2360d6923bd2c548 [0,0,0,1,0,0|2,0,0]=3 4067 B10R1.16 CCOCC1CCC(=O)O1 68878c40f0d88997c0eac48c9395a889 [0,0,0,1,0,0|1,0,0]=2 4068 B10R1.16 CCOCC1CCC(O1)C 8e264e7c24328ed86afa8787e8a69f5c [0,0,0,1,0,0|2,0,1]=4 4069 B10R1.16 CCOCC1CNC(=O)C1 86e912d738a20b3bce8d2d023b32843b [0,0,0,1,0,0|3,0,0]=4 4070 B10R1.16 CCOCC1CNC(=O)N1 78abd0b3bc190fd57610ab2d11b44a0d [0,0,0,1,0,0|3,0,0]=4 4071 B10R1.16 CCOCC1COC(=O)C1 fc8d2c528c0ba949e1ac94feca85512f [0,0,0,1,0,0|3,0,0]=4 4072 B10R1.16 CCOC[C@@H]1C=CC(=O)O1 4a5383ca9bc98f8e8a857df0bb6a3aea [0,0,0,1,0,0|1,0,2]=4 4073 B10R1.16 CCOC[C@@H]1CCC(=O)C1 886f2aa7068de127dafbb03846e349d5 [0,0,0,1,0,0|2,0,0]=3 4074 B10R1.16 CCOC[C@@H]1CCC(=O)N1 8fb17a976e393d6121213afd4ad838e4 [0,0,0,1,0,0|2,0,0]=3 4075 B10R1.16 CCOC[C@@H]1CCC(=O)O1 fa116338e507c856f655864f1fa338d4 [0,0,0,1,0,0|1,0,0]=2 4076 B10R1.16 CCOC[C@@H]1CC[C@@H](O1)C 4f0c512b610bf512c3ea8df23193a17f [0,0,0,1,0,0|2,0,1]=4 4077 B10R1.16 CCOC[C@@H]1CNC(=O)C1 ec267f7bf97fe9b9e67f9dfc5e47932b [0,0,0,1,0,0|3,0,0]=4 4078 B10R1.16 CCOC[C@H]1CCC(=O)N1 c8b2e4099128fd5dbf4dcb633abb5f4e [0,0,0,1,0,0|2,0,0]=3 4079 B10R1.16 CCOC[C@H]1CCC(=O)O1 5ea62a9b88a47b06d381abba60ed3ed7 [0,0,0,1,0,0|1,0,0]=2 4080 B10R1.16 CCOC[C@H]1CNC(=O)C1 832dffb8e86308c043973940695a735b [0,0,0,1,0,0|3,0,0]=4 4081 B10R1.16 COCOC1CCC(=O)C1 3f0670be66776efa2650c7f8f8ff9f23 [0,0,0,1,0,0|3,0,0]=4 4082 B10R1.16 N#CNCC1CCC(=O)O1 d1feb09aa3de614ae65e7a42fe595b79 [0,0,0,1,0,0|2,0,1]=4 4083 B10R1.16 O=C1CCC(C1)COCF a3dd5848b7cd8d2e813c35574505a53a [0,0,0,1,0,0|3,0,0]=4 4084 B10R1.16 O=C1CCC(C1)OCCF e098d997eb3d51fa873532d5a2a734d6 [0,0,0,1,0,0|3,0,0]=4 4085 B10R1.16 O=C1CCC(C1)OCCS b56ae300686fa3e56f2ba4ba430ca7d0 [0,0,0,1,0,0|3,0,0]=4 4086 B10R1.16 O=C1CCC(N1)CNCF e60601c5e6ec7596e84a4441da6e09ea [0,0,0,1,0,0|3,0,0]=4 4087 B10R1.16 O=C1CCC(N1)CNCO faa9c744205a27a4c011051a4253940b [0,0,0,1,0,0|3,0,0]=4 4088 B10R1.16 O=C1CCC(N1)COCF 4ea4fbca5a03a5bb3ecd580fa707a8d0 [0,0,0,1,0,0|3,0,0]=4 4089 B10R1.16 O=C1CCC(O1)COCF 2ce7db809de6e3f2be92a0e8ec92a43d [0,0,0,1,0,0|2,0,0]=3 4090 B10R1.16 O=C1CC[C@@H](N1)CNCF b2f43891f00ade8c0b7c9a72903b5365 [0,0,0,1,0,0|3,0,0]=4 4091 B10R1.16 O=C1CC[C@@H](N1)CNCO 8f73d44f5c46f24c4baded87399cce0a [0,0,0,1,0,0|3,0,0]=4 4092 B10R1.16 O=C1CC[C@@H](N1)COCF c6324f99881b3a0cb2a429668edd4aee [0,0,0,1,0,0|3,0,0]=4 4093 B10R1.16 O=C1CC[C@@H](O1)COCF 0c61b9a9b2fe5d2d9f7492156617b941 [0,0,0,1,0,0|2,0,0]=3 4094 B10R1.16 O=C1CC[C@H](C1)COCF 0205222befcb6358d1d47dbbf040f905 [0,0,0,1,0,0|3,0,0]=4 4095 B10R1.16 O=C1CC[C@H](N1)CNCF 7d685b8f0afb5f48d49a76b0b312761c [0,0,0,1,0,0|3,0,0]=4 4096 B10R1.16 O=C1CC[C@H](N1)CNCO 35b329c0f2d6b9aaaa63084f592c856b [0,0,0,1,0,0|3,0,0]=4 4097 B10R1.16 O=C1CC[C@H](N1)COCF c4ab441f4787a728634e3ebdaeb313de [0,0,0,1,0,0|3,0,0]=4 4098 B10R1.16 O=C1CC[C@H](O1)COCF 4144576c77ad59c81af5e2139c27ef0f [0,0,0,1,0,0|2,0,0]=3 4099 B10R1.18 CC(=O)NC1CCCOC1 4f95e852cc2bfb0219aae46495afcede [0,0,0,1,0,0|3,0,0]=4 4100 B10R1.18 CC(=O)NC1CCOCC1 b8a9513c5c3615ab522c7c4bba9e7be0 [0,0,0,1,0,0|3,0,0]=4 4101 B10R1.18 CC(=O)NC1CCSCC1 532c6db35a0b9f3a89303777aedbda02 [0,0,0,1,0,0|3,0,0]=4 4102 B10R1.18 CC(=O)N[C@@H]1CCCOC1 52485d58eafbf3c79fc267d807120eb6 [0,0,0,1,0,0|3,0,0]=4 4103 B10R1.18 CC(=O)N[C@H]1CCCOC1 e380151c69e874f737c0bf1b7124947f [0,0,0,1,0,0|3,0,0]=4 4104 B10R1.18 NC(=O)CN1CCCOC1 94387a83bd4cae31e3f14782a40647e9 [0,0,0,1,0,0|3,0,0]=4 4105 B10R1.18 NC(=O)CN1CCCSC1 b68231ec8070fb183d2e67e07bffdf5f [0,0,0,1,0,0|3,0,0]=4 4106 B10R1.18 NC(=O)CN1CCOCC1 c410094cbb204aafa2a00a06ff1200a7 [0,0,0,1,0,0|3,0,0]=4 4107 B10R1.18 NC(=O)CN1CCSCC1 e1433af854a61ebc2cf2a21d5e077032 [0,0,0,1,0,0|3,0,0]=4 4108 B10R1.18 O=C(O)CN1CC=CCC1 2ec65e7b8b50a2d37f2f7faf07e4bb0e [0,0,0,1,0,0|1,0,2]=4 4109 B10R1.18 O=C(O)CN1CCCOC1 276c9e6db5c50efdf0013ee255981aea [0,0,0,1,0,0|2,0,0]=3 4110 B10R1.18 O=C(O)CN1CCCSC1 969c23a84a85279fbc953810ec4f4635 [0,0,0,1,0,0|2,0,0]=3 4111 B10R1.18 O=C(O)CN1CCOCC1 71b10415ca7d674c1df6add3bdabacae [0,0,0,1,0,0|2,0,0]=3 4112 B10R1.18 O=C(O)CN1CCSCC1 71c83e558b9a1fa155bf6e87dce077b1 [0,0,0,1,0,0|2,0,0]=3 4113 B10R1.24 C#CCNCC1CC(=O)O1 34238da23f2771a081e156837b1179e7 [0,0,0,1,0,0|1,0,2]=4 4114 B10R1.24 C#CCOCC1CC(=O)O1 1daf5fad3d6252dd930dc96c41c8b6d5 [0,0,0,1,0,0|1,0,2]=4 4115 B10R1.24 C=C1CC(C1)CNCCC d2df9a1a3444d3bbb71131eda8cae42a [0,0,0,1,0,0|3,0,0]=4 4116 B10R1.24 C=C1CC(C1)COCCC c4738b1d34fdccc68f381f8fd9489731 [0,0,0,1,0,0|3,0,0]=4 4117 B10R1.24 CCCCCN1CC(C1)O 03eefc394e5b33e5b229a7010d3392ea [0,0,0,1,0,0|2,0,1]=4 4118 B10R1.24 CCCCNC1CC(C1)O 5de3a0fd4173595211531deeaa94ddf0 [0,0,0,1,0,0|2,0,1]=4 4119 B10R1.24 CCCCN[C@H]1C[C@@H](C1)O 702a5fcff4bb1c86029920e74f1beb43 [0,0,0,1,0,0|2,0,1]=4 4120 B10R1.24 CCCCN[C@H]1C[C@H](C1)O 010982ec829ea6b9165163d2f0ba5622 [0,0,0,1,0,0|2,0,1]=4 4121 B10R1.24 CCCCOC1CC(=O)C1 43b0c4e9c07f019289d4808f2589a0f4 [0,0,0,1,0,0|2,0,0]=3 4122 B10R1.24 CCCNCC1CC(=O)C1 69d0656586039c9a3f29e223cb7e102c [0,0,0,1,0,0|2,0,0]=3 4123 B10R1.24 CCCNCC1CC(=O)N1 91949a9791988ee6b03a2cc9aa02034c [0,0,0,1,0,0|2,0,0]=3 4124 B10R1.24 CCCNCC1CC(=O)O1 e6188be948b9442c83f4afcd8259e636 [0,0,0,1,0,0|1,0,0]=2 4125 B10R1.24 CCCNCC1CC(C1)O daeee638446258ac3f4937fead314869 [0,0,0,1,0,0|2,0,1]=4 4126 B10R1.24 CCCNC[C@H]1C[C@@H](C1)O 4097dcbdfaaddd09739b99a729f30622 [0,0,0,1,0,0|2,0,1]=4 4127 B10R1.24 CCCNC[C@H]1C[C@H](C1)O 35042c873eed1530d818e5ea4dc52b49 [0,0,0,1,0,0|2,0,1]=4 4128 B10R1.24 CCCOCC1CC(=O)C1 a1cbdd7bcf1e991eeb69ed53fa2d5fe5 [0,0,0,1,0,0|2,0,0]=3 4129 B10R1.24 CCCOCC1CC(=O)N1 f12a865c3d4e20fd9c0cc8bf1dc053ab [0,0,0,1,0,0|2,0,0]=3 4130 B10R1.24 CCCOCC1CC(=O)O1 98deb66a78aedaf4cee6d6522de3a253 [0,0,0,1,0,0|1,0,0]=2 4131 B10R1.24 CCCOC[C@@H]1CC(=O)N1 e71eb4334a39698bd2d109adc70a70ab [0,0,0,1,0,0|2,0,0]=3 4132 B10R1.24 CCCOC[C@H]1CC(=O)N1 5bc849df37602b2a716ac985f9970e6b [0,0,0,1,0,0|2,0,0]=3 4133 B10R1.24 COCCNC1CC(=O)C1 91a4d0d2f136d6b727a1a4f1793287fc [0,0,0,1,0,0|3,0,0]=4 4134 B10R1.24 COCCOC1CC(=O)C1 368b0c9b447b9046591e851fd3fcb1b0 [0,0,0,1,0,0|3,0,0]=4 4135 B10R1.24 COCOCC1CC(=O)C1 490e3fbc49ba85919ba1dfc50f6a3195 [0,0,0,1,0,0|3,0,0]=4 4136 B10R1.24 COCOCC1CC(=O)N1 255320cc62062dbb4e32414c847cb92f [0,0,0,1,0,0|3,0,0]=4 4137 B10R1.24 COCOCC1CC(=O)O1 136c5c10a95675b6f7738f0ed6687602 [0,0,0,1,0,0|2,0,0]=3 4138 B10R1.24 COCOC[C@@H]1CC(=O)N1 6d700fba3834c0cbf31f5fba260cf86a [0,0,0,1,0,0|3,0,0]=4 4139 B10R1.24 COCOC[C@H]1CC(=O)N1 f75070c0bf458716833f409bccf914e8 [0,0,0,1,0,0|3,0,0]=4 4140 B10R1.24 CSCCNC1CC(=O)C1 68bf6544e559b1ee200b1d6e6bf72659 [0,0,0,1,0,0|3,0,0]=4 4141 B10R1.24 CSCCOC1CC(=O)C1 6cce7b4c4e6cb15ed650ee1d0bb3b7a9 [0,0,0,1,0,0|3,0,0]=4 4142 B10R1.24 CSCOCC1CC(=O)C1 8e5a2cb7cedafa293b8bf416850fc883 [0,0,0,1,0,0|3,0,0]=4 4143 B10R1.24 CSCOCC1CC(=O)N1 da66054cc76f6b70512c9933044baba6 [0,0,0,1,0,0|3,0,0]=4 4144 B10R1.24 CSCOC[C@@H]1CC(=O)N1 1fe70c55dfabb09cf56cd7097f2a44d9 [0,0,0,1,0,0|3,0,0]=4 4145 B10R1.24 CSCOC[C@H]1CC(=O)N1 368f2b4b7b50cccd3a538b5328b7e2f5 [0,0,0,1,0,0|3,0,0]=4 4146 B10R1.24 N#CCNCC1CC(=O)O1 8aad1d47a31e8e7e827da4021eeb473d [0,0,0,1,0,0|2,0,1]=4 4147 B10R1.24 N#CCOCC1CC(=O)O1 3dcc76dea199a3a4157cd0ecd2a2cdc3 [0,0,0,1,0,0|2,0,1]=4 4148 B10R1.24 O=C1CC(C1)CNCCBr 2c798d2a7945b388238350e7072b48f9 [0,0,0,1,0,0|3,0,0]=4 4149 B10R1.24 O=C1CC(C1)CNCCF 00b3fd8c9f15f0bff705dffa1f8dbc1d [0,0,0,1,0,0|3,0,0]=4 4150 B10R1.24 O=C1CC(C1)CNCCI 65ca46d76ddbeb5532a0b729b25e0b9f [0,0,0,1,0,0|3,0,0]=4 4151 B10R1.24 O=C1CC(C1)CNCCO 0ca39d9acd8463523b123b3f8aac7b11 [0,0,0,1,0,0|3,0,0]=4 4152 B10R1.24 O=C1CC(C1)CNCCS 9c6bccb4c24605eed297808ae5a384cc [0,0,0,1,0,0|3,0,0]=4 4153 B10R1.24 O=C1CC(C1)COCCF a066dc711bab27ed863d02430948d041 [0,0,0,1,0,0|3,0,0]=4 4154 B10R1.24 O=C1CC(C1)COCCS b5d3202a3aaf8dd31c06d423717fbdea [0,0,0,1,0,0|3,0,0]=4 4155 B10R1.24 O=C1CC(C1)NCCCCl fa7ea5283d7bc6091fb9e8cae382d2f7 [0,0,0,1,0,0|3,0,0]=4 4156 B10R1.24 O=C1CC(C1)NCCCO ce620265f001693c022d682a443d74ab [0,0,0,1,0,0|3,0,0]=4 4157 B10R1.24 O=C1CC(C1)OCCCF 33fd479bd33f13752a6a06598a7bd8bc [0,0,0,1,0,0|3,0,0]=4 4158 B10R1.24 O=C1CC(C1)OCCCS 9fe371220a9e89d14909889362cea73d [0,0,0,1,0,0|3,0,0]=4 4159 B10R1.24 O=C1CC(N1)CNCCBr a2037f50b9bb5f61494753f1f9b1fe6b [0,0,0,1,0,0|3,0,0]=4 4160 B10R1.24 O=C1CC(N1)CNCCF 4042187456f16b0a61fa8e3312c1e2b4 [0,0,0,1,0,0|3,0,0]=4 4161 B10R1.24 O=C1CC(N1)CNCCI bc7b049bc9fdabcd9162a75071ec5e1d [0,0,0,1,0,0|3,0,0]=4 4162 B10R1.24 O=C1CC(N1)CNCCO dc4c2fa2d8e1e72367f65669bfa8f3e1 [0,0,0,1,0,0|3,0,0]=4 4163 B10R1.24 O=C1CC(N1)CNCCS 98f2d89c384458d264f088be0078c116 [0,0,0,1,0,0|3,0,0]=4 4164 B10R1.24 O=C1CC(N1)COCCF cf4a40a2b41e83d60f5d2354a8548074 [0,0,0,1,0,0|3,0,0]=4 4165 B10R1.24 O=C1CC(N1)COCCS 115c1cf38a51a55c738409f962b00d79 [0,0,0,1,0,0|3,0,0]=4 4166 B10R1.24 O=C1CC(O1)CNCCBr fb075682211b5e34d372b9a3782780e8 [0,0,0,1,0,0|2,0,0]=3 4167 B10R1.24 O=C1CC(O1)CNCCF d10f07095dbb519fc8dd151941992524 [0,0,0,1,0,0|2,0,0]=3 4168 B10R1.24 O=C1CC(O1)CNCCI 9fc8c7c7652a6f092d3b5e16249b5056 [0,0,0,1,0,0|2,0,0]=3 4169 B10R1.24 O=C1CC(O1)CNCCO 82df5165eb76785f682a4d2d525d68b5 [0,0,0,1,0,0|2,0,0]=3 4170 B10R1.24 O=C1CC(O1)CNCCS 9a812677641d0575e358d9c777b1d45c [0,0,0,1,0,0|2,0,0]=3 4171 B10R1.24 O=C1CC(O1)COCCF 51877d1ffbce2d1102f92ec0c95994b5 [0,0,0,1,0,0|2,0,0]=3 4172 B10R1.24 O=C1CC(O1)COCCS 5af6cd8953fa5b9cccb81a415e8efe0e [0,0,0,1,0,0|2,0,0]=3 4173 B10R1.24 O=C1C[C@@H](N1)COCCF eb24a8ef82a60920ac1d0dce36d4ffdf [0,0,0,1,0,0|3,0,0]=4 4174 B10R1.24 O=C1C[C@@H](N1)COCCS af2167439e866ceb0deae27ad12672fa [0,0,0,1,0,0|3,0,0]=4 4175 B10R1.24 O=C1C[C@H](N1)COCCF 6da06e1b42047a0b1b7891bbafc7ce47 [0,0,0,1,0,0|3,0,0]=4 4176 B10R1.24 O=C1C[C@H](N1)COCCS 85e3e28a49c02659476909acb5b76800 [0,0,0,1,0,0|3,0,0]=4 4177 B10R1.39 CC(=O)N1CCCC1CO 3663634b7abd18cbb84622ae336fba13 [0,0,0,1,0,0|3,0,0]=4 4178 B10R1.39 CC(=O)N1CCC[C@@H]1CF ab1f1a9f7b90c6246d4807fce03f01b9 [0,0,0,1,0,0|3,0,0]=4 4179 B10R1.39 CC(=O)N1CCC[C@@H]1CO c30953bbf0b814708ca046a841e82ee1 [0,0,0,1,0,0|3,0,0]=4 4180 B10R1.39 CC(=O)N1CCC[C@H]1CF 974fcba5c623f0b18c298ca4cec034a9 [0,0,0,1,0,0|3,0,0]=4 4181 B10R1.39 CC(=O)N1CCC[C@H]1CO 01de1a97629848b07160f2d0111b2996 [0,0,0,1,0,0|3,0,0]=4 4182 B10R1.39 CCC1CCCN1C(=O)C af5184853a2fc139326aceb69f54587c [0,0,0,1,0,0|2,0,0]=3 4183 B10R1.39 CCN1CC=CC1C(=O)O 89bda72f1795ce7a5213b1771e1a2eff [0,0,0,1,0,0|1,0,2]=4 4184 B10R1.39 CCN1CC=C[C@H]1C(=O)O 1bffb48288adbee6e99329e108e2b55e [0,0,0,1,0,0|1,0,2]=4 4185 B10R1.39 CCN1CCCC1C(=O)N e3638aebd20ecc50fb364eeffd06aad6 [0,0,0,1,0,0|2,0,0]=3 4186 B10R1.39 CCN1CCCC1C(=O)O c3983076958b8fb46558aab447120d49 [0,0,0,1,0,0|1,0,0]=2 4187 B10R1.39 CCN1CCCC1C(C)O 2fe3ff32d123d261dc32a6b4f6dd875a [0,0,0,1,0,0|2,0,1]=4 4188 B10R1.39 CCN1CCC[C@@H]1C(=O)N c904ceb8698f14197bc2e2ed45042711 [0,0,0,1,0,0|2,0,0]=3 4189 B10R1.39 CCN1CCC[C@@H]1C(=O)O 349d3c609c75982b622124f07b341c44 [0,0,0,1,0,0|1,0,0]=2 4190 B10R1.39 CCN1CCC[C@@H]1C(C)O 2fcc2db5a9ea947bbbe3b9ddb7004abd [0,0,0,1,0,0|2,0,1]=4 4191 B10R1.39 CCN1CCC[C@H]1C(=O)N 5dfa8ecf2b36963e9bcf6d81738e87bd [0,0,0,1,0,0|2,0,0]=3 4192 B10R1.39 CCN1CCC[C@H]1C(=O)O cf8e675da710a8a6e34bef600c46b98f [0,0,0,1,0,0|1,0,0]=2 4193 B10R1.39 CCN1CCC[C@H]1[C@H](C)O d149234dfbaffe72611b5ed16adf7902 [0,0,0,1,0,0|2,0,1]=4 4194 B10R1.39 CCN1CCSC1C(=O)O 23a71743abd51412d8c2f2a54d122163 [0,0,0,1,0,0|2,0,0]=3 4195 B10R1.39 CCN1CSCC1C(=O)O 9d58ce7de7d6dc337784b1a458991004 [0,0,0,1,0,0|2,0,0]=3 4196 B10R1.39 CCN1CSC[C@@H]1C(=O)O 62a29e6620e574cccad9193dfa1f259a [0,0,0,1,0,0|2,0,0]=3 4197 B10R1.39 CCN1CSC[C@H]1C(=O)O c44babec2d6380179adcb6ad018902f6 [0,0,0,1,0,0|2,0,0]=3 4198 B10R1.39 CC[C@@H]1CCCN1C(=O)C c75eb2201906f8faab97d30a9bca11c4 [0,0,0,1,0,0|2,0,0]=3 4199 B10R1.39 COC1CCCN1C(=O)C 34fe16e8654158db2f38d068503fb822 [0,0,0,1,0,0|3,0,0]=4 4200 B10R1.39 NC(=O)C1CCCN1CF 42364bf3efa4f733bbeea2eac179e186 [0,0,0,1,0,0|3,0,0]=4 4201 B10R1.39 NC(=O)C1CCCN1CO 798b53a860086bd46413e83881150d01 [0,0,0,1,0,0|3,0,0]=4 4202 B10R1.39 NC(=O)[C@@H]1CCCN1CF 5b6e560b5ed03c2cc3ba75bcf9aafe65 [0,0,0,1,0,0|3,0,0]=4 4203 B10R1.39 NC(=O)[C@@H]1CCCN1CO ff51148b59c35835bbeab3b8f5088f9f [0,0,0,1,0,0|3,0,0]=4 4204 B10R1.39 NC(=O)[C@H]1CCCN1CF 7b625afccb6ca0677b1ebd9c8280efe2 [0,0,0,1,0,0|3,0,0]=4 4205 B10R1.39 NC(=O)[C@H]1CCCN1CO 883914c0be6a7acbf4e6e7118ba7a0fc [0,0,0,1,0,0|3,0,0]=4 4206 B10R1.39 O=C(O)C1CCCN1CF 2df1b628c3ddddb71f4d9897e6b47849 [0,0,0,1,0,0|2,0,0]=3 4207 B10R1.39 O=C(O)C1CCCN1CO 7f02135e9c4c82c9ed8efa6b28dba1a4 [0,0,0,1,0,0|2,0,0]=3 4208 B10R1.39 O=C(O)C1CSCN1CF e280dce981ae51d0065753b840b39952 [0,0,0,1,0,0|3,0,0]=4 4209 B10R1.39 O=C(O)C1CSCN1CO 2106acef386e3a50e95413bdf5d796ef [0,0,0,1,0,0|3,0,0]=4 4210 B10R1.39 O=C(O)C1SCCN1CF d857bdccd90e1a451a9ff359b0359df7 [0,0,0,1,0,0|3,0,0]=4 4211 B10R1.39 O=C(O)C1SCCN1CO 6660fe84f679d9f0e1c6807e92c798fa [0,0,0,1,0,0|3,0,0]=4 4212 B10R1.39 O=C(O)[C@@H]1CCCN1CF a758da829a884a388b4dac859185ee61 [0,0,0,1,0,0|2,0,0]=3 4213 B10R1.39 O=C(O)[C@@H]1CCCN1CO ab593d24831e51749594a3241b86071f [0,0,0,1,0,0|2,0,0]=3 4214 B10R1.39 O=C(O)[C@@H]1CSCN1CF 9197deef9b38df9dfc6ff97e22793010 [0,0,0,1,0,0|3,0,0]=4 4215 B10R1.39 O=C(O)[C@@H]1CSCN1CO 9e15b3f0ca59bb5648e96edeed1ab489 [0,0,0,1,0,0|3,0,0]=4 4216 B10R1.39 O=C(O)[C@H]1CCCN1CF b1270dfad6d1aac80c0fd1f1ac2f6f0d [0,0,0,1,0,0|2,0,0]=3 4217 B10R1.39 O=C(O)[C@H]1CCCN1CO cbdfa18e1cbf673fbc79c7d3904d4492 [0,0,0,1,0,0|2,0,0]=3 4218 B10R1.39 O=C(O)[C@H]1CSCN1CF e74629e6ec47004dabdb153ad5f5dd02 [0,0,0,1,0,0|3,0,0]=4 4219 B10R1.39 O=C(O)[C@H]1CSCN1CO e89e2cd6d57a419293f0a445a727e832 [0,0,0,1,0,0|3,0,0]=4 4220 B10R1.56 C=C1CC1COCCCC d20632b89e5942cadf8e892a110a30e7 [0,0,0,1,0,0|3,0,0]=4 4221 B10R1.61 CC(=O)N1CCCCC1C 4f5cacb6e20ae65458b172f21fa4c03b [0,0,0,1,0,0|2,0,0]=3 4222 B10R1.61 CC(=O)N1CCCC[C@@H]1C 88289ec06bdb4324567eee30991d3abe [0,0,0,1,0,0|2,0,0]=3 4223 B10R1.61 CC(=O)N1CCCC[C@H]1C 3deac15cb8095a5a8513253ec4f9434f [0,0,0,1,0,0|2,0,0]=3 4224 B10R1.61 CC(=O)N1CCOCC1C 186802ab521b2d6bdab8784d8f406fe3 [0,0,0,1,0,0|3,0,0]=4 4225 B10R1.61 CC(=O)N1CCOC[C@@H]1C 2c2d5f38fe3af4873afc2922231f8b52 [0,0,0,1,0,0|3,0,0]=4 4226 B10R1.61 CC(=O)N1CCOC[C@H]1C 6ff78af7b260256006e8c4ee0f740fd8 [0,0,0,1,0,0|3,0,0]=4 4227 B10R1.64 C=C(Br)CN1CCCC1C 4eeb29cce58d03a7de96a89b22a99374 [0,0,0,1,0,0|3,0,0]=4 4228 B10R1.64 C=C(Br)CN1CCC[C@@H]1C 9b0602fe9ee8d6a891b5e1b4ae0ef58b [0,0,0,1,0,0|3,0,0]=4 4229 B10R1.64 C=C(Br)CN1CCC[C@H]1C 020957d1a491f836689ee7e8d2729d7e [0,0,0,1,0,0|3,0,0]=4 4230 B10R1.64 C=C(C)CN1CCCC1C 19cc55a5b8c94020d8f11a2465d37746 [0,0,0,1,0,0|3,0,0]=4 4231 B10R1.64 C=C(C)CN1CCC[C@@H]1C d2fcb26891716ca4cf07accbb6129aee [0,0,0,1,0,0|3,0,0]=4 4232 B10R1.64 C=C(C)CN1CCC[C@H]1C 86c2f23a0bae605b6f4dd12410e5bb37 [0,0,0,1,0,0|3,0,0]=4 4233 B10R1.64 C=C(Cl)CN1CCCC1C be5c1d9b965ce48223c916b8b047a98b [0,0,0,1,0,0|3,0,0]=4 4234 B10R1.64 C=C(Cl)CN1CCC[C@@H]1C 7f3bc1ad5185614caed5c314d1ccb5a6 [0,0,0,1,0,0|3,0,0]=4 4235 B10R1.64 C=C(Cl)CN1CCC[C@H]1C 6699962afbdfdbe771b8f4f3a165bd26 [0,0,0,1,0,0|3,0,0]=4 4236 B10R1.64 C=C(F)CN1CCCC1C 009de90f41a3d6d52009bf0f82779be7 [0,0,0,1,0,0|3,0,0]=4 4237 B10R1.64 C=C(F)CN1CCC[C@@H]1C ff2e863eb33e6982371a7066b8765b6b [0,0,0,1,0,0|3,0,0]=4 4238 B10R1.64 C=C(F)CN1CCC[C@H]1C 3bf3b17485954219b166659d4933f4eb [0,0,0,1,0,0|3,0,0]=4 4239 B10R1.64 CC(=O)NC1CCCC1O 59e0220d30c5d89a7bc774bdd7119d12 [0,0,0,1,0,0|3,0,0]=4 4240 B10R1.64 CC(=O)N[C@@H]1CCC[C@@H]1O 8cb67225b4b66d60c05cf19cee1f81da [0,0,0,1,0,0|3,0,0]=4 4241 B10R1.64 CC(=O)N[C@@H]1CCC[C@H]1O b09f4c2f2b9433d14ce51c1d506ae9e8 [0,0,0,1,0,0|3,0,0]=4 4242 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O e6a6e3adb2cb556e3a04e433a4ca013c [0,0,0,1,0,0|3,0,0]=4 4243 B10R1.64 CC(=O)N[C@H]1CCC[C@H]1O d54340e665e803c30264a16ad0e57d91 [0,0,0,1,0,0|3,0,0]=4 4244 B10R1.64 CC(O)CN1CCCC1C e0904d829f5ae1c1c8a37132bedc03cf [0,0,0,1,0,0|2,0,1]=4 4245 B10R1.64 CC(O)CN1CCC[C@@H]1C f3fddac415c701aba279fa805a60bb73 [0,0,0,1,0,0|2,0,1]=4 4246 B10R1.64 CC(O)CN1CCC[C@H]1C c7ac7ab3a542d2cd9a20f0dba81b14eb [0,0,0,1,0,0|2,0,1]=4 4247 B10R1.64 CC1CCCN1CC(=O)N 7c4eed599ade99e581d74786c61ffec8 [0,0,0,1,0,0|2,0,0]=3 4248 B10R1.64 CC1CCCN1CC(=O)O 71eb304a1d401775d27fc0753a674b0b [0,0,0,1,0,0|1,0,0]=2 4249 B10R1.64 CC1CCCN1C[C@@H](C)O f1f17ac41a002841ac45bb23af6e0df5 [0,0,0,1,0,0|2,0,1]=4 4250 B10R1.64 CC1CCCN1C[C@H](C)O a3da1c3aea429311222a7a938a16da96 [0,0,0,1,0,0|2,0,1]=4 4251 B10R1.64 CC1CCCN1C[N+](=O)[O-] e9c728dd28730a1edc9e49a777e57b34 [0,0,0,1,0,0|2,0,1]=4 4252 B10R1.64 CC1SCCN1CC(=O)N 1473d91980fc11b99d9e32239095121e [0,0,0,1,0,0|3,0,0]=4 4253 B10R1.64 CC1SCCN1CC(=O)O 6d80821f03b8a4633c94af3df2f09299 [0,0,0,1,0,0|2,0,0]=3 4254 B10R1.64 C[C@@H](O)CN1CCC[C@@H]1C 0579b9a2a5b55601012c227a7861c31c [0,0,0,1,0,0|2,0,1]=4 4255 B10R1.64 C[C@@H]1CCCN1CC(=O)N 7e2e467301747d64b336071a85a55428 [0,0,0,1,0,0|2,0,0]=3 4256 B10R1.64 C[C@@H]1CCCN1CC(=O)O 9b818000ca3132ec26b67b1ab81d55f9 [0,0,0,1,0,0|1,0,0]=2 4257 B10R1.64 C[C@@H]1CCCN1C[C@@H](C)O a1953599126d2e73c5f90858ff3b40b1 [0,0,0,1,0,0|2,0,1]=4 4258 B10R1.64 C[C@@H]1CCCN1C[N+](=O)[O-] c509d686a543f03582d8b8f078e71834 [0,0,0,1,0,0|2,0,1]=4 4259 B10R1.64 C[C@H](O)CN1CCC[C@@H]1C 4608bd25dbd968977e4f5c880f16efeb [0,0,0,1,0,0|2,0,1]=4 4260 B10R1.64 C[C@H](O)CN1CCC[C@H]1C 899d37e3d1971f3ab5ca4ff9471ee0b8 [0,0,0,1,0,0|2,0,1]=4 4261 B10R1.64 C[C@H]1CCCN1CC(=O)N 0f4d0309fef2162a5c669336bc8fe418 [0,0,0,1,0,0|2,0,0]=3 4262 B10R1.64 C[C@H]1CCCN1CC(=O)O 64061d78ea2e51d3ac2a9c61feca08be [0,0,0,1,0,0|1,0,0]=2 4263 B10R1.64 C[C@H]1CCCN1C[N+](=O)[O-] 40faf351ad53245bb67ef5d8ac8cce96 [0,0,0,1,0,0|2,0,1]=4 4264 B10R1.64 NC(=O)CN1CCCC1O d6d9a68ee6dec65cbeb5ff06f0992ed6 [0,0,0,1,0,0|3,0,0]=4 4265 B10R1.64 O=C(O)CN1CCCC1O ec57a92bef094a920e205f26c4cd66bf [0,0,0,1,0,0|2,0,0]=3 4266 B10R1.66 C=C(Br)CNC1CCCC1 c5e9051df98005196a453f2784271550 [0,0,0,1,0,0|3,0,0]=4 4267 B10R1.66 C=C(Br)COC1CCCC1 42f364e9c405b1c3cd20d787d52eeaf8 [0,0,0,1,0,0|3,0,0]=4 4268 B10R1.66 C=C(C)CNC1CCCC1 fb1e6e408319966a1409197fb48466fc [0,0,0,1,0,0|3,0,0]=4 4269 B10R1.66 C=C(C)COC1CCCC1 0baa029340c07e195631e67a7476458f [0,0,0,1,0,0|3,0,0]=4 4270 B10R1.66 C=C(Cl)CNC1CCCC1 f764cf753bf0255cec1e5a149d42e409 [0,0,0,1,0,0|3,0,0]=4 4271 B10R1.66 C=C(Cl)COC1CCCC1 4c4fcc9ab448f17967600088248dce4a [0,0,0,1,0,0|3,0,0]=4 4272 B10R1.66 C=C(F)CNC1CCCC1 3cdd4edf824f04c03fb938a120db01f0 [0,0,0,1,0,0|3,0,0]=4 4273 B10R1.66 C=C(F)COC1CCCC1 5b359480c47f5b5bd9cd002dde4b0236 [0,0,0,1,0,0|3,0,0]=4 4274 B10R1.66 C=C(I)COC1CCCC1 ea9ca49f291809da3cd71a458dbf4cc6 [0,0,0,1,0,0|3,0,0]=4 4275 B10R1.66 CC(=O)CCN1CCSC1 1d04fc7ba7176e69109ec5abc8934570 [0,0,0,1,0,0|3,0,0]=4 4276 B10R1.66 CC(=O)CNC1CCCC1 982a895596cb411344b5d5d1059736c0 [0,0,0,1,0,0|2,0,0]=3 4277 B10R1.66 CC(=O)CNC1CCOC1 facc3e35abff70f3a7061d48c15880f3 [0,0,0,1,0,0|3,0,0]=4 4278 B10R1.66 CC(=O)CN[C@@H]1CCOC1 ab40d28b9d8845580cfa8b91e38570fb [0,0,0,1,0,0|3,0,0]=4 4279 B10R1.66 CC(=O)CN[C@H]1CCOC1 ba7409f423d67894a4e5dbcc5a78b7bd [0,0,0,1,0,0|3,0,0]=4 4280 B10R1.66 CC(=O)COC1CCCC1 b4a4ed405f24170df2e680b9b91276af [0,0,0,1,0,0|2,0,0]=3 4281 B10R1.66 CC(=O)NCC1CCCC1 4b033df2d5e9c8dc815e6cf1e844965d [0,0,0,1,0,0|2,0,0]=3 4282 B10R1.66 CC(=O)NCC1CCCO1 d796e1bcbe3ecee47a944fbd2b1407c2 [0,0,0,1,0,0|3,0,0]=4 4283 B10R1.66 CC(=O)NCC1CCOC1 bce87e20d96a11e99377f7808ef9095b [0,0,0,1,0,0|3,0,0]=4 4284 B10R1.66 CC(=O)NC[C@@H]1CCCO1 10aff43ea33a655572bc7f4810244226 [0,0,0,1,0,0|3,0,0]=4 4285 B10R1.66 CC(=O)NC[C@@H]1CCOC1 ec1b203015848b3faf316ffb2ea83643 [0,0,0,1,0,0|3,0,0]=4 4286 B10R1.66 CC(=O)NC[C@H]1CCCO1 c97b710d0be598ef27ac8c5431018722 [0,0,0,1,0,0|3,0,0]=4 4287 B10R1.66 CC(=O)NC[C@H]1CCOC1 6ae094c27ca10209607a242335b1813d [0,0,0,1,0,0|3,0,0]=4 4288 B10R1.66 CC(O)CNC1CCCC1 b820e3d9afe93564c0983427a73810f3 [0,0,0,1,0,0|2,0,1]=4 4289 B10R1.66 C[C@@H](O)CNC1CCCC1 8a1f8985e621a80e06a328246e1e3448 [0,0,0,1,0,0|2,0,1]=4 4290 B10R1.66 C[C@H](O)CNC1CCCC1 2befe5661cba4e9f3d3cf9fc34bfd20d [0,0,0,1,0,0|2,0,1]=4 4291 B10R1.66 NC(=O)CCN1CCSC1 291dbb47d218456c5f4156fedca60868 [0,0,0,1,0,0|3,0,0]=4 4292 B10R1.66 NC(=O)CNC1CCCC1 9c36273e943c132bbefd74db949ab45f [0,0,0,1,0,0|2,0,0]=3 4293 B10R1.66 NC(=O)CNC1CCOC1 812f29f7b3576c6e4f3e53e8ad46851f [0,0,0,1,0,0|3,0,0]=4 4294 B10R1.66 NC(=O)CNC1CCSC1 428b8a4c978ae724b02c5c926207cd3e [0,0,0,1,0,0|3,0,0]=4 4295 B10R1.66 NC(=O)CN[C@@H]1CCOC1 375d535a3daf4c72db98cfc35e777485 [0,0,0,1,0,0|3,0,0]=4 4296 B10R1.66 NC(=O)CN[C@H]1CCOC1 c430ed6472892a62b82603c18cf4105a [0,0,0,1,0,0|3,0,0]=4 4297 B10R1.66 NC(=O)COC1CCCC1 d7b7d33efe873067a8b31f32069e40fe [0,0,0,1,0,0|2,0,0]=3 4298 B10R1.66 NC(=O)COC1CCCO1 572c264c8f8acc8112572869238c174e [0,0,0,1,0,0|3,0,0]=4 4299 B10R1.66 NC(=O)COC1CCOC1 d5148e9740dbc69bdb853893f2b3d12a [0,0,0,1,0,0|3,0,0]=4 4300 B10R1.66 NC(=O)COC1CCSC1 cec0eb4f7a499b81222c1a27b0cb34d2 [0,0,0,1,0,0|3,0,0]=4 4301 B10R1.66 NC(=O)CO[C@@H]1CCOC1 49dc32b1f1506522c89aa7ce5c91d3bf [0,0,0,1,0,0|3,0,0]=4 4302 B10R1.66 NC(=O)CO[C@@H]1CCSC1 b9e767100dada703c8b3a7f8badd30b1 [0,0,0,1,0,0|3,0,0]=4 4303 B10R1.66 NC(=O)CO[C@H]1CCOC1 a2f89afc0802b6ee16d361e3a6fe70ac [0,0,0,1,0,0|3,0,0]=4 4304 B10R1.66 NC(=O)CO[C@H]1CCSC1 e1cec98f3b5aad705c54173689397c82 [0,0,0,1,0,0|3,0,0]=4 4305 B10R1.66 NC(=S)COC1CCCC1 54af9f8df6a2f1e34b309e014e24e7d1 [0,0,0,1,0,0|2,1,0]=4 4306 B10R1.66 O=C(O)CCN1CC=CC1 c65ba50af520c1ae6b0360bbe16ef8eb [0,0,0,1,0,0|1,0,2]=4 4307 B10R1.66 O=C(O)CCN1CCSC1 865036530d19a20c3ef17a0aa8d37ac2 [0,0,0,1,0,0|2,0,0]=3 4308 B10R1.66 O=C(O)CNC1CC=CC1 b8e47b529e5fc837552042e04bc94d72 [0,0,0,1,0,0|1,0,2]=4 4309 B10R1.66 O=C(O)CNC1CCCC1 fb567dda9f1fcebaac0043a4fd3325ce [0,0,0,1,0,0|1,0,0]=2 4310 B10R1.66 O=C(O)CNC1CCOC1 4ccadd048e05caef0aa0224309a71ab9 [0,0,0,1,0,0|2,0,0]=3 4311 B10R1.66 O=C(O)CNC1CCSC1 cc711451681d5deb60a93f003c75abe6 [0,0,0,1,0,0|2,0,0]=3 4312 B10R1.66 O=C(O)CN[C@@H]1CCOC1 409924f0dc5c5a1e485257d0c382bb7d [0,0,0,1,0,0|2,0,0]=3 4313 B10R1.66 O=C(O)CN[C@H]1CCOC1 bb7abf04bc34989947c2e061f8225296 [0,0,0,1,0,0|2,0,0]=3 4314 B10R1.66 O=C(O)COC1C=CCC1 516af6899b9a378445553ab94f04bd0f [0,0,0,1,0,0|1,0,2]=4 4315 B10R1.66 O=C(O)COC1CC=CC1 8b8788a3c0effe6f4d1b782421ac330f [0,0,0,1,0,0|1,0,2]=4 4316 B10R1.66 O=C(O)COC1CCCC1 5d3de03f73830ac26dc91c46fa3d4104 [0,0,0,1,0,0|1,0,0]=2 4317 B10R1.66 O=C(O)COC1CCCO1 9af41fcd5b2bf45f089ffbb228468f59 [0,0,0,1,0,0|2,0,0]=3 4318 B10R1.66 O=C(O)COC1CCOC1 c00a0816f6af3a6b09957548ac53c261 [0,0,0,1,0,0|2,0,0]=3 4319 B10R1.66 O=C(O)COC1CCSC1 caf5157f4ef4575a7421435e1146be8d [0,0,0,1,0,0|2,0,0]=3 4320 B10R1.66 O=C(O)CO[C@@H]1CCOC1 40244ec714f8851edd84a85a39a537dc [0,0,0,1,0,0|2,0,0]=3 4321 B10R1.66 O=C(O)CO[C@@H]1CCSC1 3f3ccc7956dc20f5c5ac4f02583eda03 [0,0,0,1,0,0|2,0,0]=3 4322 B10R1.66 O=C(O)CO[C@H]1CCOC1 c198688958ecea1c8118006934dbb8ea [0,0,0,1,0,0|2,0,0]=3 4323 B10R1.66 O=C(O)CO[C@H]1CCSC1 d5d79b4e4ea2912843ea0f8d16269f5b [0,0,0,1,0,0|2,0,0]=3 4324 B10R1.66 O=S(O)COC1CCCC1 08b1908d1b79fff78a0acfd6877e8468 [0,0,0,1,0,0|2,0,0]=3 4325 B10R1.66 O=[N+]([O-])CNC1CCCC1 4309020587eb8b84de682b42ca96363d [0,0,0,1,0,0|2,0,1]=4 4326 B10R1.66 O=[N+]([O-])COC1CCCC1 f6363365f6fad184c0e1fff1accfe856 [0,0,0,1,0,0|2,0,1]=4 4327 B10R1.73 C=C(Br)COCC1CC1C acf77d1236ad39c9913216ba4c00a553 [0,0,0,1,0,0|3,0,0]=4 4328 B10R1.73 C=C(Br)COC[C@@H]1C[C@@H]1C d35fdfa4b0897f69e4d37a596644acc4 [0,0,0,1,0,0|3,0,0]=4 4329 B10R1.73 C=C(Br)COC[C@@H]1C[C@H]1C 90c65fe7ba783c5a312bb2aeada4eaf4 [0,0,0,1,0,0|3,0,0]=4 4330 B10R1.73 C=C(Br)COC[C@H]1C[C@@H]1C d40d05ff76144659ccc547319258c6b7 [0,0,0,1,0,0|3,0,0]=4 4331 B10R1.73 C=C(C)CCNC1CC1C 55dc59a32b6aa2d0288e08f9c028d2e1 [0,0,0,1,0,0|3,0,0]=4 4332 B10R1.73 C=C(C)COCC1CC1C 0a20ad9d41b9d861f2a5ba71d4715711 [0,0,0,1,0,0|3,0,0]=4 4333 B10R1.73 C=C(C)COC[C@@H]1C[C@@H]1C b10528463b2f921e21cea2dcd92674a3 [0,0,0,1,0,0|3,0,0]=4 4334 B10R1.73 C=C(C)COC[C@@H]1C[C@H]1C 729b8c92a46a1cb562f15e627b33d522 [0,0,0,1,0,0|3,0,0]=4 4335 B10R1.73 C=C(C)COC[C@H]1C[C@@H]1C 393c6e198814bd694d053125f3e319aa [0,0,0,1,0,0|3,0,0]=4 4336 B10R1.73 C=C(Cl)COCC1CC1C 80a94a7b1524ca648cbe70da7ffbda26 [0,0,0,1,0,0|3,0,0]=4 4337 B10R1.73 C=C(Cl)COC[C@@H]1C[C@@H]1C 513a7f8fefbce48889a783f2746c15d2 [0,0,0,1,0,0|3,0,0]=4 4338 B10R1.73 C=C(Cl)COC[C@@H]1C[C@H]1C f523050865ebcce73413ae3e8294183a [0,0,0,1,0,0|3,0,0]=4 4339 B10R1.73 C=C(Cl)COC[C@H]1C[C@@H]1C bb77eb7365aa1989d8f07dfb4a4bd5fa [0,0,0,1,0,0|3,0,0]=4 4340 B10R1.73 C=C(F)COCC1CC1C 117f3a5183c6d948b875458925eb32de [0,0,0,1,0,0|3,0,0]=4 4341 B10R1.73 C=C(F)COC[C@@H]1C[C@@H]1C c8af6287fcdf0ab2e91e037b2db5c41a [0,0,0,1,0,0|3,0,0]=4 4342 B10R1.73 C=C(F)COC[C@@H]1C[C@H]1C f0c46857942319fef37542f530cc059d [0,0,0,1,0,0|3,0,0]=4 4343 B10R1.73 C=C(F)COC[C@H]1C[C@@H]1C be700106e6bbe4c4b73de4a5ab1dcbeb [0,0,0,1,0,0|3,0,0]=4 4344 B10R1.73 C=C1CC1COCC(=O)O f3e3c7d903ad268a8abbdd04b75516e3 [0,0,0,1,0,0|1,0,2]=4 4345 B10R1.73 CC(=O)CCNC1CC1C a0f261b651c9ed776bbd9ae7f003bf8a [0,0,0,1,0,0|2,0,0]=3 4346 B10R1.73 CC(=O)CCN[C@@H]1C[C@H]1F 33248c02a442f28c4648d3093a739c7e [0,0,0,1,0,0|3,0,0]=4 4347 B10R1.73 CC(=O)CCN[C@H]1C[C@@H]1F 58f0b62aaee94a7aaf6ef2805b1f7034 [0,0,0,1,0,0|3,0,0]=4 4348 B10R1.73 CC(=O)CCN[C@H]1C[C@H]1F fe6db6da9562b0875088eb496adaf03f [0,0,0,1,0,0|3,0,0]=4 4349 B10R1.73 CC(=O)OCNC1CC1C 2cbd266e24269da7df58cb98d6a2fa19 [0,0,0,1,0,0|3,0,0]=4 4350 B10R1.73 CC(O)CCNC1CC1C 056feab47faf9acccef8e077a9fbb41a [0,0,0,1,0,0|2,0,1]=4 4351 B10R1.73 CC1CC1COCC(=O)N a51c0cf1f3552614ebd6d18360a6dab8 [0,0,0,1,0,0|2,0,0]=3 4352 B10R1.73 CC1CC1COCC(=O)O 48c21a72e06119c87256212f209582f7 [0,0,0,1,0,0|1,0,0]=2 4353 B10R1.73 CC1CC1COC[N+](=O)[O-] 7c30b0d898de53870a2248fbe68c6338 [0,0,0,1,0,0|2,0,1]=4 4354 B10R1.73 CC1CC1NCCC(=O)N 01dedfa60e20b4370aefe1b6cf10bcff [0,0,0,1,0,0|2,0,0]=3 4355 B10R1.73 CC1CC1NCCC(=O)O dafd5a694641c8e1f7b7903df829e138 [0,0,0,1,0,0|1,0,0]=2 4356 B10R1.73 CC1CC1NCCS(=O)C a8b6d92bd41c0812b9599bcd3bade0cb [0,0,0,1,0,0|3,0,0]=4 4357 B10R1.73 CC1CC1NCSC(=O)N cbf9f47dec3de54d4cd87a0295e1bd37 [0,0,0,1,0,0|3,0,0]=4 4358 B10R1.73 C[C@@H]1C[C@H]1COCC(=O)N 8f7e2d574bf3b982efd9db52c7d9e857 [0,0,0,1,0,0|2,0,0]=3 4359 B10R1.73 C[C@@H]1C[C@H]1COCC(=O)O 9d211c6c60226597f723447cbc214271 [0,0,0,1,0,0|1,0,0]=2 4360 B10R1.73 C[C@@H]1C[C@H]1COC[N+](=O)[O-] a7bd82f87e1a13daa142fea84b708bf4 [0,0,0,1,0,0|2,0,1]=4 4361 B10R1.73 C[C@H]1C[C@@H]1COCC(=O)N e4f551a7cfe66cab6e182199916f32f2 [0,0,0,1,0,0|2,0,0]=3 4362 B10R1.73 C[C@H]1C[C@@H]1COCC(=O)O a5336ce467034ad207eac9bf5dc6a620 [0,0,0,1,0,0|1,0,0]=2 4363 B10R1.73 C[C@H]1C[C@@H]1COC[N+](=O)[O-] 723be8af05885a4f9ad1a140c54a7ab0 [0,0,0,1,0,0|2,0,1]=4 4364 B10R1.73 C[C@H]1C[C@H]1COCC(=O)N c5944cfe0de9948c73b520ac0bc7c096 [0,0,0,1,0,0|2,0,0]=3 4365 B10R1.73 C[C@H]1C[C@H]1COCC(=O)O c45bab8411e01116d664faac83c6d766 [0,0,0,1,0,0|1,0,0]=2 4366 B10R1.73 C[C@H]1C[C@H]1COC[N+](=O)[O-] 272097079379bbf92ffe74ed291ee6fa [0,0,0,1,0,0|2,0,1]=4 4367 B10R1.73 NC(=O)CCN[C@@H]1C[C@H]1F 2182f1b3b9c923c36138af89861787a4 [0,0,0,1,0,0|3,0,0]=4 4368 B10R1.73 NC(=O)CCN[C@H]1C[C@@H]1F 2b587596081a02e75444960387fe9e53 [0,0,0,1,0,0|3,0,0]=4 4369 B10R1.73 NC(=O)CCN[C@H]1C[C@H]1F 72dcc3a157738f376a8046b380723ecb [0,0,0,1,0,0|3,0,0]=4 4370 B10R1.73 NC(=O)COC[C@@H]1C[C@@H]1F b347de852c946bdaadb369a6f59908bd [0,0,0,1,0,0|3,0,0]=4 4371 B10R1.73 NC(=O)COC[C@@H]1C[C@H]1F acb11d92e4c2c0c5e44ad9e7941dc5fe [0,0,0,1,0,0|3,0,0]=4 4372 B10R1.73 NC(=O)COC[C@H]1C[C@@H]1F ad3bbfe2db7e5cd80d44e9ab0a89f52e [0,0,0,1,0,0|3,0,0]=4 4373 B10R1.73 NC(=O)COC[C@H]1C[C@H]1F 189c2d64b1983645ebcd8646ab3b22cb [0,0,0,1,0,0|3,0,0]=4 4374 B10R1.73 O=C(O)CCN[C@@H]1C[C@H]1F b185a702ddd7568777289a3133d5fa61 [0,0,0,1,0,0|2,0,0]=3 4375 B10R1.73 O=C(O)CCN[C@H]1C[C@@H]1F 271d5cbb104d920eeb569499d233d5e7 [0,0,0,1,0,0|2,0,0]=3 4376 B10R1.73 O=C(O)CCN[C@H]1C[C@H]1F 787fba67e8311a3e89a9175cefd8bb40 [0,0,0,1,0,0|2,0,0]=3 4377 B10R1.73 O=C(O)COC[C@@H]1C[C@@H]1F 7e4c09a33f8613c33e3bb780dd16ac99 [0,0,0,1,0,0|2,0,0]=3 4378 B10R1.73 O=C(O)COC[C@@H]1C[C@H]1F 18f900f8cc4fa76172f41d6791923192 [0,0,0,1,0,0|2,0,0]=3 4379 B10R1.73 O=C(O)COC[C@H]1C[C@@H]1F a03662c885e4fb56fd2e9330b57d6e5c [0,0,0,1,0,0|2,0,0]=3 4380 B10R1.73 O=C(O)COC[C@H]1C[C@H]1F a578eda4363d7a91e8a903e4d9a45941 [0,0,0,1,0,0|2,0,0]=3 4381 B10R1.86 C#CCN1CCC1C(=O)O 0a1b0656b0f9abdb7a249b1183680a99 [0,0,0,1,0,0|1,0,2]=4 4382 B10R1.86 C#CCN1CC[C@@H]1C(=O)O a7ed6970b71872c93fc2c42dd71fa0f4 [0,0,0,1,0,0|1,0,2]=4 4383 B10R1.86 C#CCN1CC[C@H]1C(=O)O 4334aca8c3dbaee08ade63ebe8617c35 [0,0,0,1,0,0|1,0,2]=4 4384 B10R1.86 C=CCN1CCC1C(=O)O 5aa9822b6d013d305550f77ed908ce20 [0,0,0,1,0,0|1,0,2]=4 4385 B10R1.86 C=CCN1CC[C@@H]1C(=O)O 2b11763329b4ee89ac482074c508e369 [0,0,0,1,0,0|1,0,2]=4 4386 B10R1.86 C=CCN1CC[C@H]1C(=O)O 86e7a64607ab41bdc3006f1b156912c1 [0,0,0,1,0,0|1,0,2]=4 4387 B10R1.86 CC(=O)N1CCC1CCO 09e9cf8c5fafefb9ccd221a7a0914eb0 [0,0,0,1,0,0|3,0,0]=4 4388 B10R1.86 CCCN1CCC1C(=O)N 35d1b93e33c2b266d54f8780ed2b7ffa [0,0,0,1,0,0|2,0,0]=3 4389 B10R1.86 CCCN1CCC1C(=O)O 4b455e0294207b1a2bf667cca1518823 [0,0,0,1,0,0|1,0,0]=2 4390 B10R1.86 CCCN1CC[C@@H]1C(=O)N 2816a3560ebdcb13b04668ba0a938ba7 [0,0,0,1,0,0|2,0,0]=3 4391 B10R1.86 CCCN1CC[C@@H]1C(=O)O d13b2957294e68e46c0da3b6d0fff09d [0,0,0,1,0,0|1,0,0]=2 4392 B10R1.86 CCCN1CC[C@H]1C(=O)N 80639e7c53f8b8293ed9f7dceaa5030b [0,0,0,1,0,0|2,0,0]=3 4393 B10R1.86 CCCN1CC[C@H]1C(=O)O db973ca0f7546753e639c1a516b768cc [0,0,0,1,0,0|1,0,0]=2 4394 B10R1.86 CCN[C@H]1CC[C@H]1C(=O)O 89c0dfdc99ab72737959c668e1a06333 [0,0,0,1,0,0|1,0,0]=2 4395 B10R1.86 CCOC1CCC1C(=O)O 24e9d7678dd5393f5b6092a46418ac5a [0,0,0,1,0,0|1,0,0]=2 4396 B10R1.86 CCO[C@H]1CC[C@@H]1C(=O)O 225858fcf1b537db229804c5703f595a [0,0,0,1,0,0|1,0,0]=2 4397 B10R1.86 COCC1CCN1C(=O)C 319bbac40814be107506e6e3247dbb7d [0,0,0,1,0,0|3,0,0]=4 4398 B10R1.86 COCN1CCC1C(=O)N a14f1c8b5b149cf911a8226c7cfe8c1c [0,0,0,1,0,0|3,0,0]=4 4399 B10R1.86 COCN1CCC1C(=O)O 3204f98a1589884ef4919069312d5439 [0,0,0,1,0,0|2,0,0]=3 4400 B10R1.86 COCN1CC[C@@H]1C(=O)N 3fa72226c67dc1163e469e64dc18820e [0,0,0,1,0,0|3,0,0]=4 4401 B10R1.86 COCN1CC[C@@H]1C(=O)O 678f3401d65dab1541a8ea717354c365 [0,0,0,1,0,0|2,0,0]=3 4402 B10R1.86 COCN1CC[C@H]1C(=O)N 5100b0def75a0d67692df393dea80602 [0,0,0,1,0,0|3,0,0]=4 4403 B10R1.86 COCN1CC[C@H]1C(=O)O 2a21aceeafdeef8f6d6f8b5d0fe9e526 [0,0,0,1,0,0|2,0,0]=3 4404 B10R1.86 COC[C@@H]1CCN1C(=O)C 2ac5516e0ab46ed4d6ab8c17f4ff6cbb [0,0,0,1,0,0|3,0,0]=4 4405 B10R1.86 COC[C@H]1CCN1C(=O)C 864902a6d6d9f4a7d5095df0b6ad2460 [0,0,0,1,0,0|3,0,0]=4 4406 B10R1.86 CSCN1CCC1C(=O)N ca6031ea072c20b28e018e271956f9f4 [0,0,0,1,0,0|3,0,0]=4 4407 B10R1.86 CSCN1CCC1C(=O)O 06b3a26ab590f56c6c04e8f4851d2737 [0,0,0,1,0,0|2,0,0]=3 4408 B10R1.86 CSCN1CC[C@@H]1C(=O)N 250650462f92493ed27e8976919efc12 [0,0,0,1,0,0|3,0,0]=4 4409 B10R1.86 CSCN1CC[C@@H]1C(=O)O 78d7ed147126e3a49f5a824faa209a2c [0,0,0,1,0,0|2,0,0]=3 4410 B10R1.86 CSCN1CC[C@H]1C(=O)N 14872a5d4e7f36fb5e59189e9230f23e [0,0,0,1,0,0|3,0,0]=4 4411 B10R1.86 CSCN1CC[C@H]1C(=O)O 03066c57d20cc6511320a42980afb9f1 [0,0,0,1,0,0|2,0,0]=3 4412 B10R1.86 N#CCN1CCC1C(=O)O c3523b927da677136e56cb3b55ade3a8 [0,0,0,1,0,0|2,0,1]=4 4413 B10R1.86 N#CCN1CC[C@@H]1C(=O)O 779f8b7130f2c520ddac56403f5f5843 [0,0,0,1,0,0|2,0,1]=4 4414 B10R1.86 N#CCN1CC[C@H]1C(=O)O 327d19037cb154d02de85a7e52583c4b [0,0,0,1,0,0|2,0,1]=4 4415 B10R1.86 NC(=O)C1CCN1CCF 1b8a8602ce793f661f05d665ceef3e5e [0,0,0,1,0,0|3,0,0]=4 4416 B10R1.86 NC(=O)C1CCN1CCO 86b8ba8f027853ec8df80a0c9f3f6765 [0,0,0,1,0,0|3,0,0]=4 4417 B10R1.86 NC(=O)C1CCN1CCS bbd0fb7d23b533f1091f8a7b4fe378e5 [0,0,0,1,0,0|3,0,0]=4 4418 B10R1.86 NC(=O)[C@@H]1CCN1CCF 66bf66a76eca3609fc1a4cd9ae7913da [0,0,0,1,0,0|3,0,0]=4 4419 B10R1.86 NC(=O)[C@@H]1CCN1CCO ff35af6bd70ce602443c3610b7b6a45a [0,0,0,1,0,0|3,0,0]=4 4420 B10R1.86 NC(=O)[C@@H]1CCN1CCS 612a791a79a884d4dd563ec9d6a118c6 [0,0,0,1,0,0|3,0,0]=4 4421 B10R1.86 NC(=O)[C@H]1CCN1CCF dd1781e577d8d3d2df41c2310935ca74 [0,0,0,1,0,0|3,0,0]=4 4422 B10R1.86 NC(=O)[C@H]1CCN1CCO 4cfcde91de0f71235313725613cc1e56 [0,0,0,1,0,0|3,0,0]=4 4423 B10R1.86 NC(=O)[C@H]1CCN1CCS 83352736b55b893bdccd05801fd61278 [0,0,0,1,0,0|3,0,0]=4 4424 B10R1.86 O=C(O)C1CCC1OCF 2f3d0806af511dc3faa8f276acf37014 [0,0,0,1,0,0|2,0,0]=3 4425 B10R1.86 O=C(O)C1CCN1CCF 05cfa42e24b7dce2b6038a22b0e7b4fe [0,0,0,1,0,0|2,0,0]=3 4426 B10R1.86 O=C(O)C1CCN1CCO 5e9f8d63cba1346be944dc9207f7b6a3 [0,0,0,1,0,0|2,0,0]=3 4427 B10R1.86 O=C(O)C1CCN1CCS 1baa29c98878247171f5e8eb80d19c98 [0,0,0,1,0,0|2,0,0]=3 4428 B10R1.86 O=C(O)[C@@H]1CCN1CCF 0cc7903d956de86eb486b927d2d40f7d [0,0,0,1,0,0|2,0,0]=3 4429 B10R1.86 O=C(O)[C@@H]1CCN1CCO 7b8d82e4be67ae9c9f601bf99eca2156 [0,0,0,1,0,0|2,0,0]=3 4430 B10R1.86 O=C(O)[C@@H]1CCN1CCS 974cdca7a75dea667e823ac5a13a3935 [0,0,0,1,0,0|2,0,0]=3 4431 B10R1.86 O=C(O)[C@@H]1CC[C@@H]1NCF 9682f230e4c9a80194b8b5454b3ffc56 [0,0,0,1,0,0|2,0,0]=3 4432 B10R1.86 O=C(O)[C@@H]1CC[C@@H]1NCO e7a586bfcb83edc0c1bd4e90f3bc6bf5 [0,0,0,1,0,0|2,0,0]=3 4433 B10R1.86 O=C(O)[C@H]1CCN1CCF a09d4e8d71af1e53f6be98cf98b954a7 [0,0,0,1,0,0|2,0,0]=3 4434 B10R1.86 O=C(O)[C@H]1CCN1CCO c90376d55b9d739e0d2bfc0719c9e760 [0,0,0,1,0,0|2,0,0]=3 4435 B10R1.86 O=C(O)[C@H]1CCN1CCS 257b1529f281cd366033afd679782596 [0,0,0,1,0,0|2,0,0]=3 4436 B10R1.86 O=C(O)[C@H]1CC[C@@H]1OCF ed3e0d6942e54a8039d52cf620bc9113 [0,0,0,1,0,0|2,0,0]=3 4437 B10R1.86 O=CCN1CCC1C(=O)O 7387d5e06c3ff564f40403010c3a5980 [0,0,0,1,0,0|2,0,1]=4 4438 B10R1.86 O=CCN1CC[C@@H]1C(=O)O 2aca071cd64e89ac40a94d36ceb212a3 [0,0,0,1,0,0|2,0,1]=4 4439 B10R1.86 O=CCN1CC[C@H]1C(=O)O dd7a33ff7f110145c0a82bbcdfe5d32e [0,0,0,1,0,0|2,0,1]=4 4440 B10R1.97 COC[C@@H]1C[C@@H]1NC(=O)C 6d893d1ab09ade19f7c5272183f8b14a [0,0,0,1,0,0|3,0,0]=4 4441 B10R1.97 COC[C@H]1C[C@@H]1NC(=O)C b332de0aa12bf2572f8c1577cbef991c [0,0,0,1,0,0|3,0,0]=4 4442 B10R1.117 C=C(Br)CN[C@@H]1CC[C@H]1C eb4e35c9f82268ed9636e350c478c6ab [0,0,0,1,0,0|3,0,0]=4 4443 B10R1.117 C=C(Br)CN[C@H]1CC[C@H]1C ff9ec38e7ca0f28e0f189541ca6af004 [0,0,0,1,0,0|3,0,0]=4 4444 B10R1.117 C=C(C)CN[C@@H]1CC[C@H]1C c9752bbd06cbd0ff917ddc543844a1eb [0,0,0,1,0,0|3,0,0]=4 4445 B10R1.117 C=C(C)CN[C@H]1CC[C@H]1C 489337e71ac2f76019a5c6a134f6929e [0,0,0,1,0,0|3,0,0]=4 4446 B10R1.117 C=C(Cl)CN[C@@H]1CC[C@H]1C e404f1ff9209380b3114acd00ae532c0 [0,0,0,1,0,0|3,0,0]=4 4447 B10R1.117 C=C(Cl)CN[C@H]1CC[C@H]1C 1ef42b1308b5230e5b28a233c81f6c0a [0,0,0,1,0,0|3,0,0]=4 4448 B10R1.117 C=C(F)CN[C@@H]1CC[C@H]1C 4dba475743b221c23caa4a3cb21f7bcc [0,0,0,1,0,0|3,0,0]=4 4449 B10R1.117 C=C(F)CN[C@H]1CC[C@H]1C 48fa9ee17d9fbd616b045c1d08aa00a7 [0,0,0,1,0,0|3,0,0]=4 4450 B10R1.117 CC(=O)NCC1CCN1C 5ea63e401aae2e71c0de4dba7958eaca [0,0,0,1,0,0|3,0,0]=4 4451 B10R1.117 CC(O)CN[C@@H]1CC[C@H]1C 1ab39c686b99c237d47858aad7367f88 [0,0,0,1,0,0|2,0,1]=4 4452 B10R1.117 CC(O)CN[C@H]1CC[C@H]1C 5b1013d68987e5b9569e4eff2438a4d7 [0,0,0,1,0,0|2,0,1]=4 4453 B10R1.117 CC1OCC1NCC(=O)N e342b70e5ba6441a5914b8f450fb9530 [0,0,0,1,0,0|3,0,0]=4 4454 B10R1.117 CC1OCC1NCC(=O)O 0a9e06db81a31fbd331d9b464d752af8 [0,0,0,1,0,0|2,0,0]=3 4455 B10R1.117 CC1OCC1OCC(=O)N 7bc173ea317e17e069c41193a4eb40c2 [0,0,0,1,0,0|3,0,0]=4 4456 B10R1.117 CC1OCC1OCC(=O)O 95296052ae9aaf9bd7e91c97369913b5 [0,0,0,1,0,0|2,0,0]=3 4457 B10R1.117 C[C@@H]1CC[C@@H]1NCC(=O)N dfda55b0c58816777cf480c85f215f97 [0,0,0,1,0,0|2,0,0]=3 4458 B10R1.117 C[C@@H]1CC[C@@H]1NCC(=O)O 37b5abd01a4fe8a9b4b4d9b49be884b1 [0,0,0,1,0,0|1,0,0]=2 4459 B10R1.117 C[C@@H]1CC[C@@H]1NC[C@@H](C)O fbfba557988086732ec9f092968e2e30 [0,0,0,1,0,0|2,0,1]=4 4460 B10R1.117 C[C@@H]1CC[C@@H]1NC[N+](=O)[O-] 5604a1237c536370ab2f919e1d7a0d3d [0,0,0,1,0,0|2,0,1]=4 4461 B10R1.117 C[C@@H]1CC[C@H]1NCC(=O)N a93980f8790e5e6e0e7a7da4e634e897 [0,0,0,1,0,0|2,0,0]=3 4462 B10R1.117 C[C@@H]1CC[C@H]1NCC(=O)O c187d5877fa6362810a96d12cc185c98 [0,0,0,1,0,0|1,0,0]=2 4463 B10R1.117 C[C@@H]1CC[C@H]1NC[C@@H](C)O 337826c1d1084d285f5035cb1be0cc61 [0,0,0,1,0,0|2,0,1]=4 4464 B10R1.117 C[C@@H]1CC[C@H]1NC[N+](=O)[O-] 283d7294b0672c9b630058d9fa8af1fa [0,0,0,1,0,0|2,0,1]=4 4465 B10R1.117 C[C@H](O)CN[C@@H]1CC[C@H]1C f9fb6d880e0638f6ac3f120b8fd9e139 [0,0,0,1,0,0|2,0,1]=4 4466 B10R1.117 C[C@H](O)CN[C@H]1CC[C@H]1C a0ee5801b2c05cd8e6c87493a8813fac [0,0,0,1,0,0|2,0,1]=4 4467 B10R1.117 NC(=O)CNC1CCC1F 0ba89f3e4c30ca43fa892798c29e207d [0,0,0,1,0,0|3,0,0]=4 4468 B10R1.117 NC(=O)CNC1CCC1O f4bdc711c5a2b1650b094a037a8fce3e [0,0,0,1,0,0|3,0,0]=4 4469 B10R1.117 NC(=O)CN[C@@H]1CC[C@@H]1O 73221ffe0719e9995c6839ec29b16f29 [0,0,0,1,0,0|3,0,0]=4 4470 B10R1.117 NC(=O)CN[C@@H]1CC[C@H]1O cd59e1dfb0a954fd554eb4f229e165ce [0,0,0,1,0,0|3,0,0]=4 4471 B10R1.117 NC(=O)CN[C@H]1CC[C@@H]1O 0117149131b0be78aa8b27b11cd8d263 [0,0,0,1,0,0|3,0,0]=4 4472 B10R1.117 NC(=O)CN[C@H]1CC[C@H]1O 98fc4c54dae124e722af034bc8847ea0 [0,0,0,1,0,0|3,0,0]=4 4473 B10R1.117 O=C(O)CNC1CCC1F e2f149cc08a33576821bebe94cf9b048 [0,0,0,1,0,0|2,0,0]=3 4474 B10R1.117 O=C(O)CNC1CCC1O 20b6fb5b647452fbb90cd62d71003220 [0,0,0,1,0,0|2,0,0]=3 4475 B10R1.117 O=C(O)CN[C@@H]1CC[C@@H]1O b8115a2ef8cacd8835aa382136b8ee2b [0,0,0,1,0,0|2,0,0]=3 4476 B10R1.117 O=C(O)CN[C@@H]1CC[C@H]1O 5fd8485fd741a81390845f0682fad8a9 [0,0,0,1,0,0|2,0,0]=3 4477 B10R1.117 O=C(O)CN[C@H]1CC[C@@H]1O 506dfdbbed8e63bb0a98cda77b4d5cf1 [0,0,0,1,0,0|2,0,0]=3 4478 B10R1.117 O=C(O)CN[C@H]1CC[C@H]1O bf67585518bece29e195449f75f82798 [0,0,0,1,0,0|2,0,0]=3 4479 B10R1.117 O=C(O)COC1CCC1=O f85507f7cfd76c6c2e069cde33eeed2c [0,0,0,1,0,0|2,0,1]=4 4480 B10R1.126 C=C(Br)CCOCC1CC1 180ac72315270d9c63fcc5acd08b262a [0,0,0,1,0,0|3,0,0]=4 4481 B10R1.126 C=C(Br)CNCCC1CC1 c4f19d80483cae81086b449273047ded [0,0,0,1,0,0|3,0,0]=4 4482 B10R1.126 C=C(Br)COCCC1CC1 2c79b6f5dfd13d395712d10b6e1f3de8 [0,0,0,1,0,0|3,0,0]=4 4483 B10R1.126 C=C(C)CCCNC1CC1 341d40b0cbe40a51bb3ccec1c4d6d4b1 [0,0,0,1,0,0|3,0,0]=4 4484 B10R1.126 C=C(C)CCCOC1CC1 ddcd1c3fd3cd4ce6d14a939c53bc1ab2 [0,0,0,1,0,0|3,0,0]=4 4485 B10R1.126 C=C(C)CCNCC1CC1 86c81e0b1eff708d2de80316fec2d922 [0,0,0,1,0,0|3,0,0]=4 4486 B10R1.126 C=C(C)CCOCC1CC1 776a298db72183dd9542f4766754503d [0,0,0,1,0,0|3,0,0]=4 4487 B10R1.126 C=C(C)CNCCC1CC1 8eb788e2a252f62eada33b31ef82ff21 [0,0,0,1,0,0|3,0,0]=4 4488 B10R1.126 C=C(C)COCCC1CC1 7a726596bc15eef3a380d7cac717a065 [0,0,0,1,0,0|3,0,0]=4 4489 B10R1.126 C=C(Cl)CNCCC1CC1 ad8e7be55e92f13bb2a091bd73b9047d [0,0,0,1,0,0|3,0,0]=4 4490 B10R1.126 C=C(Cl)COCCC1CC1 61126c7e45413c143377992334ce9571 [0,0,0,1,0,0|3,0,0]=4 4491 B10R1.126 C=C(F)CNCCC1CC1 9d2f9541c7207119e8acfb57d7b14177 [0,0,0,1,0,0|3,0,0]=4 4492 B10R1.126 C=C(F)COCCC1CC1 08e885cfa3cf54f28c8557e5c0c4d84d [0,0,0,1,0,0|3,0,0]=4 4493 B10R1.126 C=C(I)COCCC1CC1 746948874454710546962fa653b993c9 [0,0,0,1,0,0|3,0,0]=4 4494 B10R1.126 CC(=O)CCCNC1CC1 aeee14142a81454606c7ce924dca3586 [0,0,0,1,0,0|2,0,0]=3 4495 B10R1.126 CC(=O)CCCOC1CC1 590bef78d96b3b4478190aec6f290839 [0,0,0,1,0,0|2,0,0]=3 4496 B10R1.126 CC(=O)CCNCC1CC1 bca27719374241061927d7b83ad5e0a7 [0,0,0,1,0,0|2,0,0]=3 4497 B10R1.126 CC(=O)CCOCC1CC1 e4c85eaab9f54c5f1c30c4a6f8da893e [0,0,0,1,0,0|2,0,0]=3 4498 B10R1.126 CC(=O)CNCCC1CC1 344f642538f9883f20377bf6d62fbc05 [0,0,0,1,0,0|2,0,0]=3 4499 B10R1.126 CC(=O)COCCC1CC1 5db2b90ba11a0fb9fcfb36b968b93eba [0,0,0,1,0,0|2,0,0]=3 4500 B10R1.126 CC(=O)NCCNC1CC1 d7e67de82703b5c432e7905a9212f502 [0,0,0,1,0,0|3,0,0]=4 4501 B10R1.126 CC(=O)NCCOC1CC1 751a83589129fc058729bddfba86504b [0,0,0,1,0,0|3,0,0]=4 4502 B10R1.126 CC(=O)NCOCC1CC1 f6f8e11a3129641ffaa41fad52b62b24 [0,0,0,1,0,0|3,0,0]=4 4503 B10R1.126 CC(=O)OCCNC1CC1 e7393563964eae44460d17048d50844b [0,0,0,1,0,0|3,0,0]=4 4504 B10R1.126 CC(=O)OCCOC1CC1 8181877d26885747f028e5b481568bf5 [0,0,0,1,0,0|3,0,0]=4 4505 B10R1.126 CC(=O)OCNCC1CC1 cfc076dc9b69f7a91c287c46fb53258c [0,0,0,1,0,0|3,0,0]=4 4506 B10R1.126 CC(=O)OCOCC1CC1 3bd8958ecee1854fce2ee28bba8e49b2 [0,0,0,1,0,0|3,0,0]=4 4507 B10R1.126 CC(=O)SCCNC1CC1 992a661881a796906a7dae9bbae7566d [0,0,0,1,0,0|3,0,0]=4 4508 B10R1.126 CC(=O)SCCOC1CC1 c0bd07d45172e2121bd3114a95af499b [0,0,0,1,0,0|3,0,0]=4 4509 B10R1.126 CC(O)CCCNC1CC1 07141c4272835cdc9288750f4d0471ad [0,0,0,1,0,0|2,0,1]=4 4510 B10R1.126 CC(O)CCNCC1CC1 1086c0b81671dca7ea8e060b54727cec [0,0,0,1,0,0|2,0,1]=4 4511 B10R1.126 CC(O)CNCCC1CC1 e937d2b04d12b9ccc409b90cd909f16d [0,0,0,1,0,0|2,0,1]=4 4512 B10R1.126 CS(=O)CCCNC1CC1 acf40768b6a7bb9085577c064ae17e55 [0,0,0,1,0,0|3,0,0]=4 4513 B10R1.126 CS(=O)CCNCC1CC1 192b0587b91812d0be48c32a87023989 [0,0,0,1,0,0|3,0,0]=4 4514 B10R1.126 CS(=O)CCOCC1CC1 e3bdcba80c6490b9c5851013f9e6ef96 [0,0,0,1,0,0|3,0,0]=4 4515 B10R1.126 C[C@@H](O)CCNCC1CC1 00327d6018143d8c57f5955de8e50cc8 [0,0,0,1,0,0|2,0,1]=4 4516 B10R1.126 C[C@@H](O)CNCCC1CC1 b170124a3f42c781387c7e2f80cfa627 [0,0,0,1,0,0|2,0,1]=4 4517 B10R1.126 C[C@H](O)CCNCC1CC1 5dc4c15749eac80af842864a3fb0c4a0 [0,0,0,1,0,0|2,0,1]=4 4518 B10R1.126 C[C@H](O)CNCCC1CC1 623d9fe657c1a19bdc6729cb883a9696 [0,0,0,1,0,0|2,0,1]=4 4519 B10R1.126 NC(=O)CCCNC1CC1 0a9b71f54bfc3f675a16d5847e3c5203 [0,0,0,1,0,0|2,0,0]=3 4520 B10R1.126 NC(=O)CCCOC1CC1 a20915f72580e1e8e3ce2018eef0fbc9 [0,0,0,1,0,0|2,0,0]=3 4521 B10R1.126 NC(=O)CCNCC1CC1 f5236dfc8e7900d72c63a28f06b39e9e [0,0,0,1,0,0|2,0,0]=3 4522 B10R1.126 NC(=O)CCOCC1CC1 9e1c4e9a1b93d48c25808f8d98ae7fe1 [0,0,0,1,0,0|2,0,0]=3 4523 B10R1.126 NC(=O)CNCCC1CC1 4a08391f2032735529f47a41f54011c9 [0,0,0,1,0,0|2,0,0]=3 4524 B10R1.126 NC(=O)CNCCN1CC1 5d70c55df38115144f7375ab68dc4bd2 [0,0,0,1,0,0|3,0,0]=4 4525 B10R1.126 NC(=O)COCCC1CC1 6442ecc3fae6ef4b7275078a3e5c99aa [0,0,0,1,0,0|2,0,0]=3 4526 B10R1.126 NC(=O)COCCN1CC1 4a3bcefe8be9da2f80108db2d945ae79 [0,0,0,1,0,0|3,0,0]=4 4527 B10R1.126 NC(=O)NCCNC1CC1 860ac3cc2427704eef793a8eaf9016fc [0,0,0,1,0,0|3,0,0]=4 4528 B10R1.126 NC(=O)NCCOC1CC1 697a51e63486290b88762f553ba75d38 [0,0,0,1,0,0|3,0,0]=4 4529 B10R1.126 NC(=O)NCOCC1CC1 cd65a74f60413f1a74044768c45d8497 [0,0,0,1,0,0|3,0,0]=4 4530 B10R1.126 NC(=O)SCNCC1CC1 005f6b3fb8ccdec6c7d6a183b2e7c27c [0,0,0,1,0,0|3,0,0]=4 4531 B10R1.126 NC(=O)SCOCC1CC1 5bf993292a2bf22c05dacb42da12dd60 [0,0,0,1,0,0|3,0,0]=4 4532 B10R1.126 NC(=S)CCNCC1CC1 1b21dc945dbdd270f2e8a1d081329ee6 [0,0,0,1,0,0|2,1,0]=4 4533 B10R1.126 NC(=S)COCCC1CC1 3284c3b00d9e3453aff11142b432ea93 [0,0,0,1,0,0|2,1,0]=4 4534 B10R1.126 O=C(O)/C=C/CNC1CC1 90acf7440c94ed618132190fca77c2c4 [0,0,0,1,0,0|1,0,2]=4 4535 B10R1.126 O=C(O)/C=C/COC1CC1 153906564429509cfb4e14d7e03a746b [0,0,0,1,0,0|1,0,2]=4 4536 B10R1.126 O=C(O)C#CCNC1CC1 471ec9b7f42a891794eeb73cd487b943 [0,0,0,1,0,0|1,0,2]=4 4537 B10R1.126 O=C(O)C#CCOC1CC1 4f4047ed741582ed737e6fb75c162854 [0,0,0,1,0,0|1,0,2]=4 4538 B10R1.126 O=C(O)C=CCNC1CC1 582652095f8dfccc346fb540d3d5382c [0,0,0,1,0,0|1,0,2]=4 4539 B10R1.126 O=C(O)C=CCOC1CC1 3176eb7cf374fdc36591f97b54227c2a [0,0,0,1,0,0|1,0,2]=4 4540 B10R1.126 O=C(O)CCCNC1CC1 dd468d360b917f47f682ee50a287e9d8 [0,0,0,1,0,0|1,0,0]=2 4541 B10R1.126 O=C(O)CCCOC1CC1 b7be63e0bba517180e4df0722213e005 [0,0,0,1,0,0|1,0,0]=2 4542 B10R1.126 O=C(O)CCNCC1CC1 09210a961eb6bc883a8b63442218357b [0,0,0,1,0,0|1,0,0]=2 4543 B10R1.126 O=C(O)CCOCC1CC1 eafe891a8012d500ee7e15eeb8328f36 [0,0,0,1,0,0|1,0,0]=2 4544 B10R1.126 O=C(O)CNCCC1CC1 61119269f81a6f03295c0747c64c1b37 [0,0,0,1,0,0|1,0,0]=2 4545 B10R1.126 O=C(O)CNCCN1CC1 62187a28c5608b91177f314f3be06453 [0,0,0,1,0,0|2,0,0]=3 4546 B10R1.126 O=C(O)COCCC1CC1 fb38b8ef197ca0863d4f81dc1489f3f0 [0,0,0,1,0,0|1,0,0]=2 4547 B10R1.126 O=C(O)COCCN1CC1 efda77991229b512e05a9e392dbabd7c [0,0,0,1,0,0|2,0,0]=3 4548 B10R1.126 O=S(O)CCNCC1CC1 384067583f824b614e3292f5aab74826 [0,0,0,1,0,0|2,0,0]=3 4549 B10R1.126 O=S(O)COCCC1CC1 e10cd751c66ceaeed40184298d33e5db [0,0,0,1,0,0|2,0,0]=3 4550 B10R1.126 O=[N+]([O-])CCCNC1CC1 fb101689739f2e4ff927c5e8b7e3d049 [0,0,0,1,0,0|2,0,1]=4 4551 B10R1.126 O=[N+]([O-])CCCOC1CC1 6d8fa3abef29ca325d37430d271d9dcc [0,0,0,1,0,0|2,0,1]=4 4552 B10R1.126 O=[N+]([O-])CCOCC1CC1 4980624ee45e623c5aab42cc7b3e7faa [0,0,0,1,0,0|2,0,1]=4 4553 B10R1.126 O=[N+]([O-])CNCCC1CC1 0da2cda612634048d49a113901a5b99c [0,0,0,1,0,0|2,0,1]=4 4554 B10R1.126 O=[N+]([O-])COCCC1CC1 4ab78cf39765c815229b822cfaba41e7 [0,0,0,1,0,0|2,0,1]=4 4555 B10R1.127 C=C(Br)CCOC1CCC1 4aac270ba592d74b188a855a91932f53 [0,0,0,1,0,0|3,0,0]=4 4556 B10R1.127 C=C(Br)CNCC1CCC1 1ca478c16c52c6fa4a329c588a6a8c81 [0,0,0,1,0,0|3,0,0]=4 4557 B10R1.127 C=C(Br)COCC1CCC1 684c2358f5f9f29336691968485ccb30 [0,0,0,1,0,0|3,0,0]=4 4558 B10R1.127 C=C(C)CCCN1CCC1 4809f945b79fa5d30be0f0e422606c80 [0,0,0,1,0,0|3,0,0]=4 4559 B10R1.127 C=C(C)CCNC1CCC1 28ccad926fc28e6fe0bea3c4b0efa65e [0,0,0,1,0,0|3,0,0]=4 4560 B10R1.127 C=C(C)CCOC1CCC1 5ceffb4a5f3cda2f793ce689ba21878e [0,0,0,1,0,0|3,0,0]=4 4561 B10R1.127 C=C(C)CNCC1CCC1 b8993a545f6d9fa8c2f626cdd696fd79 [0,0,0,1,0,0|3,0,0]=4 4562 B10R1.127 C=C(C)COCC1CCC1 dbfba38ac2f22ae7a6a83ce9c64e9d96 [0,0,0,1,0,0|3,0,0]=4 4563 B10R1.127 C=C(Cl)CNCC1CCC1 6fb62f6e0ff345d14b0977f4442b4abb [0,0,0,1,0,0|3,0,0]=4 4564 B10R1.127 C=C(Cl)COCC1CCC1 6bcac86d63f01a6cc8a966290f99f6fa [0,0,0,1,0,0|3,0,0]=4 4565 B10R1.127 C=C(F)CNCC1CCC1 47aef52c932d81a70a6db156216eb5ad [0,0,0,1,0,0|3,0,0]=4 4566 B10R1.127 C=C(F)COCC1CCC1 e3d8549c79984c9fc83c872624b2ccef [0,0,0,1,0,0|3,0,0]=4 4567 B10R1.127 C=C(I)COCC1CCC1 b6da99f9539352d96418ccabddd067d3 [0,0,0,1,0,0|3,0,0]=4 4568 B10R1.127 CC(=O)CCCN1CCC1 2fb5cde180707e5a212ddace39d26806 [0,0,0,1,0,0|2,0,0]=3 4569 B10R1.127 CC(=O)CCNC1CCC1 999a7ffc1a3f5ce6b66cfa8f5f9a6d0f [0,0,0,1,0,0|2,0,0]=3 4570 B10R1.127 CC(=O)CCNC1COC1 3f09409ee184fd4d062c8de2e8d7bea3 [0,0,0,1,0,0|3,0,0]=4 4571 B10R1.127 CC(=O)CCOC1CCC1 203124ee8579861e62b6b3ee00e4e01e [0,0,0,1,0,0|2,0,0]=3 4572 B10R1.127 CC(=O)CCOC1COC1 c94b6ccbaa1c326666656b23632ed495 [0,0,0,1,0,0|3,0,0]=4 4573 B10R1.127 CC(=O)CCOC1CSC1 2f9aa7391379fb31d2212d88ff5dd2b5 [0,0,0,1,0,0|3,0,0]=4 4574 B10R1.127 CC(=O)CNCC1CCC1 db7a20e92411b8eec31700ba102d9d58 [0,0,0,1,0,0|2,0,0]=3 4575 B10R1.127 CC(=O)CNCC1CCO1 11ac9ccd72c03650343bc5b14bec7b23 [0,0,0,1,0,0|3,0,0]=4 4576 B10R1.127 CC(=O)CNCC1COC1 55d8eb5059ad3b07594fb88b8a0cfd22 [0,0,0,1,0,0|3,0,0]=4 4577 B10R1.127 CC(=O)CNC[C@@H]1CCO1 ae8f1ab00f49c56ca48b67e0cb0cb394 [0,0,0,1,0,0|3,0,0]=4 4578 B10R1.127 CC(=O)CNC[C@H]1CCO1 2648e763248de853d103a2c36b44736d [0,0,0,1,0,0|3,0,0]=4 4579 B10R1.127 CC(=O)COCC1CCC1 8fd68570ac5a590b26f61b50e831d8eb [0,0,0,1,0,0|2,0,0]=3 4580 B10R1.127 CC(=O)COCC1CCO1 1a86f57adaa4d15f8477305cef5f7322 [0,0,0,1,0,0|3,0,0]=4 4581 B10R1.127 CC(=O)COCC1COC1 0adef0c2e4fa5272af6d4747e3441a25 [0,0,0,1,0,0|3,0,0]=4 4582 B10R1.127 CC(=O)COC[C@@H]1CCO1 e835cd73d0682e14d2132023c0efca5c [0,0,0,1,0,0|3,0,0]=4 4583 B10R1.127 CC(=O)COC[C@H]1CCO1 33d6a0604999988ad66207c80ad34b66 [0,0,0,1,0,0|3,0,0]=4 4584 B10R1.127 CC(=O)NCCC1CCC1 3190e402a675f8afeaa5825a170e0c31 [0,0,0,1,0,0|2,0,0]=3 4585 B10R1.127 CC(=O)NCCC1CCO1 04230957e9bf84f9b057cf566bf62412 [0,0,0,1,0,0|3,0,0]=4 4586 B10R1.127 CC(=O)NCCC1COC1 10aeefb3f3629e2e3e03b9e1c6331931 [0,0,0,1,0,0|3,0,0]=4 4587 B10R1.127 CC(=O)NCCN1CCC1 f87103f75ba5695982d253de823c90a9 [0,0,0,1,0,0|3,0,0]=4 4588 B10R1.127 CC(=O)NCC[C@@H]1CCO1 d38459e42399e38cd4786058c7cbcea8 [0,0,0,1,0,0|3,0,0]=4 4589 B10R1.127 CC(=O)NCOC1CCC1 68747d3c55215c7a49e0e89dbde30061 [0,0,0,1,0,0|3,0,0]=4 4590 B10R1.127 CC(=O)OCCN1CCC1 72c3a138347a104f636a4fcf06f333e7 [0,0,0,1,0,0|3,0,0]=4 4591 B10R1.127 CC(=O)OCNC1CCC1 aeeb0c95153dc603162df6a7812120ec [0,0,0,1,0,0|3,0,0]=4 4592 B10R1.127 CC(=O)OCOC1CCC1 289ae414f77a88378bfc645b19030fcf [0,0,0,1,0,0|3,0,0]=4 4593 B10R1.127 CC(=O)SCCN1CCC1 a32846b21a4168b147a2d5a75ccd5e0e [0,0,0,1,0,0|3,0,0]=4 4594 B10R1.127 CC(O)CCCN1CCC1 b5bb30983577542891102e78d9845966 [0,0,0,1,0,0|2,0,1]=4 4595 B10R1.127 CC(O)CCNC1CCC1 0263b847e854d291762fe7dbbf858b5c [0,0,0,1,0,0|2,0,1]=4 4596 B10R1.127 CC(O)CNCC1CCC1 e906540e3fafc1f3220306932b267d1e [0,0,0,1,0,0|2,0,1]=4 4597 B10R1.127 CS(=O)CCNC1CCC1 530142edcecb08a403c5f19832d02b72 [0,0,0,1,0,0|3,0,0]=4 4598 B10R1.127 CS(=O)CCOC1CCC1 621cc5794aef15b19a21b705380013a2 [0,0,0,1,0,0|3,0,0]=4 4599 B10R1.127 C[C@@H](O)CCNC1CCC1 19bb1cf6b904a3bd1d99e3dbc3cbef47 [0,0,0,1,0,0|2,0,1]=4 4600 B10R1.127 C[C@@H](O)CNCC1CCC1 6526a39af214ca2e624ce59cc3a37c91 [0,0,0,1,0,0|2,0,1]=4 4601 B10R1.127 C[C@H](O)CCNC1CCC1 d556d74ebd738333ce01eabf6896c505 [0,0,0,1,0,0|2,0,1]=4 4602 B10R1.127 C[C@H](O)CNCC1CCC1 e8da21263fbd999b8d5a002427b052bf [0,0,0,1,0,0|2,0,1]=4 4603 B10R1.127 NC(=O)CCCN1CCC1 e9dab82e43a82dd0078a32d64b655bff [0,0,0,1,0,0|2,0,0]=3 4604 B10R1.127 NC(=O)CCNC1CCC1 e5f4f8d042c545b323078feb3c85744a [0,0,0,1,0,0|2,0,0]=3 4605 B10R1.127 NC(=O)CCNC1COC1 793d188d6f1bf65fa6bdc274420914fe [0,0,0,1,0,0|3,0,0]=4 4606 B10R1.127 NC(=O)CCOC1CCC1 f004a8e160aab4f0381a2285b5620e32 [0,0,0,1,0,0|2,0,0]=3 4607 B10R1.127 NC(=O)CCOC1COC1 8a6a82ae1a2d0e63d77a0bb16483cc98 [0,0,0,1,0,0|3,0,0]=4 4608 B10R1.127 NC(=O)CCOC1CSC1 8947a159745aeac3a5a91beae1e5261d [0,0,0,1,0,0|3,0,0]=4 4609 B10R1.127 NC(=O)CNCC1CCC1 9380aed3728fe3d254c584a53cfa3d40 [0,0,0,1,0,0|2,0,0]=3 4610 B10R1.127 NC(=O)CNCC1CCO1 1746504623ac94838bb295582498ab64 [0,0,0,1,0,0|3,0,0]=4 4611 B10R1.127 NC(=O)CNCC1COC1 2bf9e3802ed8c71c4560c614531b01a4 [0,0,0,1,0,0|3,0,0]=4 4612 B10R1.127 NC(=O)CNC[C@@H]1CCO1 f396f80b604789b4ac14ad64fc288714 [0,0,0,1,0,0|3,0,0]=4 4613 B10R1.127 NC(=O)CNC[C@H]1CCO1 812bf642de19284c7ff4235eda5a3995 [0,0,0,1,0,0|3,0,0]=4 4614 B10R1.127 NC(=O)COCC1CCC1 f72897710ae03109d3506fccb1ca535c [0,0,0,1,0,0|2,0,0]=3 4615 B10R1.127 NC(=O)COCC1CCO1 dcc159975abc4679c997de47a260570d [0,0,0,1,0,0|3,0,0]=4 4616 B10R1.127 NC(=O)COCC1COC1 d7d7bb53d804c08758960b09a3fe45d0 [0,0,0,1,0,0|3,0,0]=4 4617 B10R1.127 NC(=O)COCC1CSC1 a8f8656ea39aca92fd7a52e83eb2ac4a [0,0,0,1,0,0|3,0,0]=4 4618 B10R1.127 NC(=O)COC[C@@H]1CCO1 5e10704a35e96b7a7572d3c34b10b363 [0,0,0,1,0,0|3,0,0]=4 4619 B10R1.127 NC(=O)COC[C@H]1CCO1 3661b16f02354905fce68f9b7a51fc6c [0,0,0,1,0,0|3,0,0]=4 4620 B10R1.127 NC(=O)NCCN1CCC1 43aa514b46560bd0ec7c4c3ecaca2389 [0,0,0,1,0,0|3,0,0]=4 4621 B10R1.127 NC(=O)NCOC1CCC1 bfd29fca39888f7a56f906c84acd428b [0,0,0,1,0,0|3,0,0]=4 4622 B10R1.127 NC(=O)SCNC1CCC1 0ae9b70fcd87f6fddca12ea7afbcc09c [0,0,0,1,0,0|3,0,0]=4 4623 B10R1.127 NC(=O)SCOC1CCC1 5cccf3e2165a0b775b72261fc15bd2f3 [0,0,0,1,0,0|3,0,0]=4 4624 B10R1.127 NC(=S)CCNC1CCC1 def5479506d6ff17b3a0c41d367fbdbb [0,0,0,1,0,0|2,1,0]=4 4625 B10R1.127 NC(=S)COCC1CCC1 61e38e85328e5c2b7a8cf7de68e58201 [0,0,0,1,0,0|2,1,0]=4 4626 B10R1.127 O=C(O)/C=C/CN1CCC1 97ae46aa601c3f500ce36e62c778b8fd [0,0,0,1,0,0|1,0,2]=4 4627 B10R1.127 O=C(O)C=CCN1CCC1 cbee3e461fef8097a8e2f1e363bfab3a [0,0,0,1,0,0|1,0,2]=4 4628 B10R1.127 O=C(O)CCNC1CCC1 160170e3580b9165aea6acb99da89a8a [0,0,0,1,0,0|1,0,0]=2 4629 B10R1.127 O=C(O)CCNC1COC1 76441b82defd111817e3af59cd984a25 [0,0,0,1,0,0|2,0,0]=3 4630 B10R1.127 O=C(O)CCOC1CCC1 2ac2445ef790d6f82b52145b8a697859 [0,0,0,1,0,0|1,0,0]=2 4631 B10R1.127 O=C(O)CCOC1COC1 a96a84add0bd770821b57bab3ab070ad [0,0,0,1,0,0|2,0,0]=3 4632 B10R1.127 O=C(O)CCOC1CSC1 b1b4a73af978a9a05bf5f8460bd1358b [0,0,0,1,0,0|2,0,0]=3 4633 B10R1.127 O=C(O)CNCC1CCC1 8df0d476c349f97069051ff8cbb4bd78 [0,0,0,1,0,0|1,0,0]=2 4634 B10R1.127 O=C(O)CNCC1CCO1 ad0efd582fc3203b814dee0af06665fb [0,0,0,1,0,0|2,0,0]=3 4635 B10R1.127 O=C(O)CNCC1COC1 71f7e19eb6ab169b826a4609eb458b18 [0,0,0,1,0,0|2,0,0]=3 4636 B10R1.127 O=C(O)CNC[C@@H]1CCO1 bc300dd63ecec6f4acba13764847f9a9 [0,0,0,1,0,0|2,0,0]=3 4637 B10R1.127 O=C(O)CNC[C@H]1CCO1 72e93d2e4ab4d72b5812156d3358ac04 [0,0,0,1,0,0|2,0,0]=3 4638 B10R1.127 O=C(O)COCC1CCC1 b4343aeb53fdf7b10eb7fc6469f57b31 [0,0,0,1,0,0|1,0,0]=2 4639 B10R1.127 O=C(O)COCC1CCO1 477e82e14e4e6c63dc5465a2a5dccb6e [0,0,0,1,0,0|2,0,0]=3 4640 B10R1.127 O=C(O)COCC1COC1 68b189e73df81fcf00c066add52114dd [0,0,0,1,0,0|2,0,0]=3 4641 B10R1.127 O=C(O)COCC1CSC1 1fea7afff9ea9d842bc2d64e80a5fdf8 [0,0,0,1,0,0|2,0,0]=3 4642 B10R1.127 O=C(O)COC[C@@H]1CCO1 dfb1f99b6b05b1261728a068b921198a [0,0,0,1,0,0|2,0,0]=3 4643 B10R1.127 O=C(O)COC[C@H]1CCO1 d3a15cc792bfa2d1801e2814900dd2ed [0,0,0,1,0,0|2,0,0]=3 4644 B10R1.127 O=S(O)CCNC1CCC1 0cce8cbeb5d86a358d73d67cdf6d03fe [0,0,0,1,0,0|2,0,0]=3 4645 B10R1.127 O=S(O)CCNC1COC1 cc5d028e508e73dd11ba46a0ee9ef91c [0,0,0,1,0,0|3,0,0]=4 4646 B10R1.127 O=S(O)COCC1CCC1 0e5e565a2a456e011886b0d82ff48ebe [0,0,0,1,0,0|2,0,0]=3 4647 B10R1.127 O=S(O)COCC1CCO1 ab3e2f963c276034ce82dbc8006717e4 [0,0,0,1,0,0|3,0,0]=4 4648 B10R1.127 O=S(O)COCC1COC1 5ed1a0fd2cc8aef28b1d9725da733f27 [0,0,0,1,0,0|3,0,0]=4 4649 B10R1.127 O=S(O)COC[C@@H]1CCO1 53cbca48f171f82d0b3a73226955ba01 [0,0,0,1,0,0|3,0,0]=4 4650 B10R1.127 O=S(O)COC[C@H]1CCO1 fa74ad5dce3c88ec921e1b07d1a86a6c [0,0,0,1,0,0|3,0,0]=4 4651 B10R1.127 O=[N+]([O-])CCCN1CCC1 ab35eff3c92565df97975b0a0e5dde1c [0,0,0,1,0,0|2,0,1]=4 4652 B10R1.127 O=[N+]([O-])CCOC1CCC1 9e5f716e0ca9bc28de9681618adb003c [0,0,0,1,0,0|2,0,1]=4 4653 B10R1.127 O=[N+]([O-])CNCC1CCC1 86fa75acba23f639646ce5ed83e81c45 [0,0,0,1,0,0|2,0,1]=4 4654 B10R1.127 O=[N+]([O-])COCC1CCC1 7bf7e27f0817303f3d21e70b55545add [0,0,0,1,0,0|2,0,1]=4 4655 B10R1.133 CCNC1CCCC1(C)O cef76a298faa75cf20392298d986d951 [0,0,0,1,0,0|2,0,1]=4 4656 B10R1.133 CCN[C@@H]1CCC[C@@]1(C)O bb030e6801f2bac0e3f3a29bdda6709a [0,0,0,1,0,0|2,0,1]=4 4657 B10R1.133 CCN[C@H]1CCC[C@]1(C)O aa09fdd71ee71868360caa9a438eac03 [0,0,0,1,0,0|2,0,1]=4 4658 B10R1.141 CCNCC1CCS1(=O)=O dcde52ef44aa0f222ac2f6fa38bec443 [0,0,0,1,0,0|2,0,1]=4 4659 B10R1.141 CCOCC1CCS1(=O)=O 234e2ce5e0539ac2ad7471c741345743 [0,0,0,1,0,0|2,0,1]=4 4660 B10R1.144 C#CCN[C@@H]1C[C@@H]1C(=O)O c326990567a2175d8e61e8296ba768a7 [0,0,0,1,0,0|1,0,2]=4 4661 B10R1.144 C#CCN[C@H]1C[C@@H]1C(=O)O bb6a2a502d4694806c7eccd6fadaa600 [0,0,0,1,0,0|1,0,2]=4 4662 B10R1.144 C#CCN[C@H]1C[C@H]1C(=O)O 6f93f75dce385545b29633e13cc170bc [0,0,0,1,0,0|1,0,2]=4 4663 B10R1.144 C#CCO[C@@H]1C[C@@H]1C(=O)O 059287d597c77c54c1002db4f49a1f82 [0,0,0,1,0,0|1,0,2]=4 4664 B10R1.144 C#CCO[C@H]1C[C@@H]1C(=O)O 94d8aaca24a2937de61627c7fdf94a39 [0,0,0,1,0,0|1,0,2]=4 4665 B10R1.144 C#CCO[C@H]1C[C@H]1C(=O)O f24df5433a5d476550a3743fc18178be [0,0,0,1,0,0|1,0,2]=4 4666 B10R1.144 CCCN[C@@H]1C[C@@H]1C(=O)O 8b6065ccda35b6e121bb4d84d7ca2d15 [0,0,0,1,0,0|1,0,0]=2 4667 B10R1.144 CCCN[C@H]1C[C@@H]1C(=O)O bb67236d635930b21a9033bd54b3e699 [0,0,0,1,0,0|1,0,0]=2 4668 B10R1.144 CCCN[C@H]1C[C@H]1C(=O)O 45cf0adca91604d7378db84601dc99ca [0,0,0,1,0,0|1,0,0]=2 4669 B10R1.144 CCCO[C@@H]1C[C@@H]1C(=O)O ef58b5a901157975cfbdf2de9eac2112 [0,0,0,1,0,0|1,0,0]=2 4670 B10R1.144 CCCO[C@H]1C[C@@H]1C(=O)O d8df1b33d4d58c6045aafeb6d556b5f8 [0,0,0,1,0,0|1,0,0]=2 4671 B10R1.144 CCCO[C@H]1C[C@H]1C(=O)O 2172e9900e42913e81a79e12722cb587 [0,0,0,1,0,0|1,0,0]=2 4672 B10R1.144 CCNC[C@@H]1C[C@H]1C(=O)O 1645dfed96f1a35e7d2a7e317b4a85c8 [0,0,0,1,0,0|1,0,0]=2 4673 B10R1.144 CCOCC1CC1C(=O)O f47208bff69eca6292bec5ee4aeb1480 [0,0,0,1,0,0|1,0,0]=2 4674 B10R1.144 CCOC[C@@H]1C[C@H]1C(=O)O 29824500bda68368f83156b674cdb103 [0,0,0,1,0,0|1,0,0]=2 4675 B10R1.144 CCOC[C@H]1C[C@@H]1C(=O)O 236a8aa51e1ac2e3d16cdd4c7a14d1de [0,0,0,1,0,0|1,0,0]=2 4676 B10R1.144 CCOC[C@H]1C[C@H]1C(=O)O 883fcab2883008e1f5b20391ca8afa39 [0,0,0,1,0,0|1,0,0]=2 4677 B10R1.144 COCO[C@@H]1C[C@@H]1C(=O)O d7334245a1ed608e4918e9f26d1921e7 [0,0,0,1,0,0|2,0,0]=3 4678 B10R1.144 COCO[C@H]1C[C@@H]1C(=O)O acca60373f4f8022b94b5101407acb01 [0,0,0,1,0,0|2,0,0]=3 4679 B10R1.144 COCO[C@H]1C[C@H]1C(=O)O be3e72c0e16e4acb5ddcd2e707e9a791 [0,0,0,1,0,0|2,0,0]=3 4680 B10R1.144 N#CCN[C@@H]1C[C@@H]1C(=O)O 7a2ccdbe0f2b6ea0ade894d8d6cd91e6 [0,0,0,1,0,0|2,0,1]=4 4681 B10R1.144 N#CCN[C@H]1C[C@@H]1C(=O)O a1cc845282cc624d4f4c13065f507e5c [0,0,0,1,0,0|2,0,1]=4 4682 B10R1.144 N#CCN[C@H]1C[C@H]1C(=O)O 663769b80292f312008c3b2303f6f43f [0,0,0,1,0,0|2,0,1]=4 4683 B10R1.144 N#CCO[C@@H]1C[C@@H]1C(=O)O bdc22a885341a7b820143ce894a611ba [0,0,0,1,0,0|2,0,1]=4 4684 B10R1.144 N#CCO[C@H]1C[C@@H]1C(=O)O 2a89186d9b9ebcf212390f1a69678f8f [0,0,0,1,0,0|2,0,1]=4 4685 B10R1.144 N#CCO[C@H]1C[C@H]1C(=O)O cbf2f3eb32c3a735875ffcbe6aabfe7a [0,0,0,1,0,0|2,0,1]=4 4686 B10R1.144 N#CNCC1CC1C(=O)O 7061146ccdab148690f39cc49b7a81dd [0,0,0,1,0,0|2,0,1]=4 4687 B10R1.144 N#CNC[C@@H]1C[C@H]1C(=O)O a9b71b707ecc741cd6d8de824315cb70 [0,0,0,1,0,0|2,0,1]=4 4688 B10R1.144 O=C(O)C1CC1COCF 0e1a062c524b407de5ed5d23bc6d0108 [0,0,0,1,0,0|2,0,0]=3 4689 B10R1.144 O=C(O)[C@@H]1C[C@@H]1COCF 9de151d9e6c87533b41e515b63fc5a6e [0,0,0,1,0,0|2,0,0]=3 4690 B10R1.144 O=C(O)[C@@H]1C[C@@H]1NCCBr 5edc7c0d2c036a5e951f5fa0c038a6fe [0,0,0,1,0,0|2,0,0]=3 4691 B10R1.144 O=C(O)[C@@H]1C[C@@H]1NCCF 417a48b1a121fdd0f578256451703a0b [0,0,0,1,0,0|2,0,0]=3 4692 B10R1.144 O=C(O)[C@@H]1C[C@@H]1NCCI d369dc2261be6136bd66474c108390f6 [0,0,0,1,0,0|2,0,0]=3 4693 B10R1.144 O=C(O)[C@@H]1C[C@@H]1NCCO 7a8e3a02265c3aff4138908cc9481abe [0,0,0,1,0,0|2,0,0]=3 4694 B10R1.144 O=C(O)[C@@H]1C[C@@H]1NCCS 02c393c8f1cbb6ed203e80847146681a [0,0,0,1,0,0|2,0,0]=3 4695 B10R1.144 O=C(O)[C@@H]1C[C@@H]1OCCF b4e6457b0e1fbc29135dd41774f5ea18 [0,0,0,1,0,0|2,0,0]=3 4696 B10R1.144 O=C(O)[C@@H]1C[C@@H]1OCCS 70848310f1646844a01535bafec04114 [0,0,0,1,0,0|2,0,0]=3 4697 B10R1.144 O=C(O)[C@@H]1C[C@H]1CNCF 5050cda9308655b88dfb40c2fd458503 [0,0,0,1,0,0|2,0,0]=3 4698 B10R1.144 O=C(O)[C@@H]1C[C@H]1CNCO 8d8db038512c60e3f0ca3ec0bc493091 [0,0,0,1,0,0|2,0,0]=3 4699 B10R1.144 O=C(O)[C@@H]1C[C@H]1COCF 41250d4516ff2edffd37e90dbe209f55 [0,0,0,1,0,0|2,0,0]=3 4700 B10R1.144 O=C(O)[C@H]1C[C@@H]1COCF fa601c00cfb581cbc4352d74f63436c3 [0,0,0,1,0,0|2,0,0]=3 4701 B10R1.144 O=C(O)[C@H]1C[C@@H]1NCCBr 03082419d9c842a214f2634ce0135a0a [0,0,0,1,0,0|2,0,0]=3 4702 B10R1.144 O=C(O)[C@H]1C[C@@H]1NCCF 2f2a8cd30867dc7a1ef3b2e1bd5b5a4f [0,0,0,1,0,0|2,0,0]=3 4703 B10R1.144 O=C(O)[C@H]1C[C@@H]1NCCI 93577a5a216655fde6fddc49a8710db2 [0,0,0,1,0,0|2,0,0]=3 4704 B10R1.144 O=C(O)[C@H]1C[C@@H]1NCCO b8bd649e6e460995a8fec562321e9ce2 [0,0,0,1,0,0|2,0,0]=3 4705 B10R1.144 O=C(O)[C@H]1C[C@@H]1NCCS df40da07103a8da072f566ae864cd520 [0,0,0,1,0,0|2,0,0]=3 4706 B10R1.144 O=C(O)[C@H]1C[C@@H]1OCCF 4548a288b07b0cab33493a5234916fbb [0,0,0,1,0,0|2,0,0]=3 4707 B10R1.144 O=C(O)[C@H]1C[C@@H]1OCCS 8018f3db92eef002f38c6d3fa34c34b9 [0,0,0,1,0,0|2,0,0]=3 4708 B10R1.144 O=C(O)[C@H]1C[C@H]1NCCBr a64b935b22d715fa6c814958f6cc58a6 [0,0,0,1,0,0|2,0,0]=3 4709 B10R1.144 O=C(O)[C@H]1C[C@H]1NCCF 9c22c3f76d73902ff8debb99b8508c0c [0,0,0,1,0,0|2,0,0]=3 4710 B10R1.144 O=C(O)[C@H]1C[C@H]1NCCI 53fe564946a853d09e1c274befd18613 [0,0,0,1,0,0|2,0,0]=3 4711 B10R1.144 O=C(O)[C@H]1C[C@H]1NCCO 0e7fe26b277acc1b9427b0d3820114b1 [0,0,0,1,0,0|2,0,0]=3 4712 B10R1.144 O=C(O)[C@H]1C[C@H]1NCCS 3355d7dc1cb641115278d000d2774f58 [0,0,0,1,0,0|2,0,0]=3 4713 B10R1.144 O=C(O)[C@H]1C[C@H]1OCCF ff3b2abde015831a09df10091c5f8627 [0,0,0,1,0,0|2,0,0]=3 4714 B10R1.144 O=C(O)[C@H]1C[C@H]1OCCS a8a1aa559a5d991e9e372be1fbe6d106 [0,0,0,1,0,0|2,0,0]=3 4715 B10R1.156 CC(=O)NCC1CC1CO 97df77cada213e0344698cda3c268c55 [0,0,0,1,0,0|3,0,0]=4 4716 B10R1.156 CO[C@H]1C[C@H]1NCC(=O)N bfcb17f4eae78d5d295231234e8e0f12 [0,0,0,1,0,0|3,0,0]=4 4717 B10R1.156 CO[C@H]1C[C@H]1NCC(=O)O e3d1d6a0e98f5a977626488a4b628dc4 [0,0,0,1,0,0|2,0,0]=3 4718 B10R1.156 NC(=O)CN[C@@H]1C[C@H]1CO cf5705afaf30980f610debd42f986c92 [0,0,0,1,0,0|3,0,0]=4 4719 B10R1.156 NC(=O)CN[C@H]1C[C@@H]1CO e850276753f3f6fe6a00eb4afa6f5b1a [0,0,0,1,0,0|3,0,0]=4 4720 B10R1.156 NC(=O)CN[C@H]1C[C@H]1CO c893ddd54d7f5508fbccc5923ac37880 [0,0,0,1,0,0|3,0,0]=4 4721 B10R1.156 O=C(O)CN[C@@H]1C[C@H]1CO f251d9006116e74a72ee0df8966552c6 [0,0,0,1,0,0|2,0,0]=3 4722 B10R1.156 O=C(O)CN[C@H]1C[C@@H]1CO 0df478b5219c8b6824692a7c653c82f3 [0,0,0,1,0,0|2,0,0]=3 4723 B10R1.156 O=C(O)CN[C@H]1C[C@H]1CO c48f082185e9402a5c620d386e5264ee [0,0,0,1,0,0|2,0,0]=3 4724 B10R1.156 O=CC1CC1NCC(=O)O 65e015782a4b5f2911edf8d938c4a676 [0,0,0,1,0,0|2,0,1]=4 4725 B10R1.156 O=CC1CC1OCC(=O)O 7d5cc370f7fa3a9ac30787034ddc7630 [0,0,0,1,0,0|2,0,1]=4 4726 B10R1.162 CCN1CCCCC(C1)O aed5146c8170f842a5a4089ca94727a5 [0,0,0,1,0,0|2,0,1]=4 4727 B10R1.162 CCN1CCCC[C@H](C1)O 14e3c1b433f6e1d1b711e6cb5c7b6de1 [0,0,0,1,0,0|2,0,1]=4 4728 B10R1.162 CCN1CCCNC(=O)C1 7f847c2e24a9fed6454900cb01e9e0cc [0,0,0,1,0,0|3,0,0]=4 4729 B10R1.173 C=C(Br)CN1CCC1CC 57b11f623c4cd08bfca53396e1a76143 [0,0,0,1,0,0|3,0,0]=4 4730 B10R1.173 C=C(C)CN1CCC1CC 99a4fabf54bdf8ddffdf73dbb793c515 [0,0,0,1,0,0|3,0,0]=4 4731 B10R1.173 C=C(Cl)CN1CCC1CC ddabbe8d7ff868a1066f4c636970ff70 [0,0,0,1,0,0|3,0,0]=4 4732 B10R1.173 C=C(F)CN1CCC1CC 0d7a63ec6ebcd08ce6d4d0b3219b5875 [0,0,0,1,0,0|3,0,0]=4 4733 B10R1.173 CCC1CCN1CC(=O)N ff9b881f847dbcc4bdf0d8ab4e9ed6e4 [0,0,0,1,0,0|2,0,0]=3 4734 B10R1.173 CCC1CCN1CC(=O)O 5837e591b7e88e7d687f320a675ea6ac [0,0,0,1,0,0|1,0,0]=2 4735 B10R1.173 CCC1CCN1CC(C)O 1d8cc6cc5d1f0fd7b3f27e8c4806458a [0,0,0,1,0,0|2,0,1]=4 4736 B10R1.173 CCC1CCN1C[C@@H](C)O 55efcaaee268a2051e1e6827e3f949ec [0,0,0,1,0,0|2,0,1]=4 4737 B10R1.173 CCC1CCN1C[C@H](C)O dcbeb1bc6c821ac6cb3e14ac96b51a68 [0,0,0,1,0,0|2,0,1]=4 4738 B10R1.173 CCC1CCN1C[N+](=O)[O-] bb88a3759523e3f8f8fa20626105ab3d [0,0,0,1,0,0|2,0,1]=4 4739 B10R1.173 CCN1CCC1CC(=O)O b55343875421912ce9629f1d4c69a858 [0,0,0,1,0,0|1,0,0]=2 4740 B10R1.173 COC1CCC1NC(=O)C 25dc329934ae20ae647eaff3b135d675 [0,0,0,1,0,0|3,0,0]=4 4741 B10R1.173 CO[C@@H]1CC[C@@H]1NC(=O)C 2b4e06bf131c36a80072f2d2eccd1b93 [0,0,0,1,0,0|3,0,0]=4 4742 B10R1.173 CO[C@@H]1CC[C@H]1NC(=O)C 069f4e563cd051c1cf85671b13400397 [0,0,0,1,0,0|3,0,0]=4 4743 B10R1.173 CO[C@H]1CC[C@@H]1NC(=O)C 3077d1a2a6baf5f56b22f38c0c0f7be2 [0,0,0,1,0,0|3,0,0]=4 4744 B10R1.173 CO[C@H]1CC[C@H]1NC(=O)C e1be9e7d1b31a3193da27f5a69aa2f49 [0,0,0,1,0,0|3,0,0]=4 4745 B10R1.173 NC(=O)CN1CCC1CO 27d8c3c16beb89e0e656abc54ff79865 [0,0,0,1,0,0|3,0,0]=4 4746 B10R1.173 NC(=O)CN1CC[C@@H]1CO 79206dd8f931b501d7e0ee1a4efd9a1c [0,0,0,1,0,0|3,0,0]=4 4747 B10R1.173 NC(=O)CN1CC[C@H]1CO 292ccf83f6aa96d529ffe79fd10e2f6d [0,0,0,1,0,0|3,0,0]=4 4748 B10R1.173 O=C(O)CC1CCN1CF 74c3291221725fc93b310625c6639da0 [0,0,0,1,0,0|2,0,0]=3 4749 B10R1.173 O=C(O)CC1CCN1CO cbfb90782529411f5c5311f9a016067f [0,0,0,1,0,0|2,0,0]=3 4750 B10R1.173 O=C(O)CN1CCC1CO 53e5c3dfbbb7f9b51b3e3b77430911c9 [0,0,0,1,0,0|2,0,0]=3 4751 B10R1.173 O=C(O)CN1CC[C@@H]1CO 79ebf1cae39369a1ac772125d96f78ae [0,0,0,1,0,0|2,0,0]=3 4752 B10R1.173 O=C(O)CN1CC[C@H]1CO 672f7679f7ebd53c3e51bd9e451db016 [0,0,0,1,0,0|2,0,0]=3 4753 B10R1.348 CC(=O)N1CCCCCC1 bd008ed1d89241423499eab40b9ddd3a [0,0,0,1,0,0|2,0,0]=3 4754 B10R1.348 CC(=O)N1CCCOCC1 a2dffbfa21961387a7917a6b3f119be9 [0,0,0,1,0,0|3,0,0]=4 4755 B7R0.1 C=CCCCNCC d6a027a0701e414181b831a715c54cb6 [2,0,0,0,0,0|1,0,1]=4 4756 B7R0.1 C=CCCCOCC 44cf1a7a597e160be341d31404acdfaa [2,0,0,0,0,0|1,0,1]=4 4757 B7R0.1 C=CCCNCCC c633813bb9d3717e891210de7cc1e8d5 [2,0,0,0,0,0|1,0,1]=4 4758 B7R0.1 C=CCCOCCC b938a9e5fd3f24fa3adf9ccf635a9e5b [2,0,0,0,0,0|1,0,1]=4 4759 B7R0.1 C=CCNCCCC 3d8f05f7ed31cff346091b529993046e [2,0,0,0,0,0|1,0,1]=4 4760 B7R0.1 C=CCOCCCC 01358a2b7449cb631c1f1da5323f5dd1 [2,0,0,0,0,0|1,0,1]=4 4761 B7R0.1 CCCCCNC=O a8a22095c4bcd5b43c5b29c77fc7eedb [2,0,0,0,0,0|1,0,0]=3 4762 B7R0.1 CCCCCNCC e4fc231c21797e6191f546ff9bcbf191 [2,0,0,0,0,0|1,0,1]=4 4763 B7R0.1 CCCCCNCF ac90ce28f099294c590373d3f9f6da79 [2,0,0,0,0,0|2,0,0]=4 4764 B7R0.1 CCCCCNCO ec5ba66caaffe66e13002eeb0f8fbef0 [2,0,0,0,0,0|1,0,0]=3 4765 B7R0.1 CCCCCOCC bc8c76b482c8637477570a20a92424f9 [2,0,0,0,0,0|1,0,1]=4 4766 B7R0.1 CCCCCOCF 12202160b083613b3fc9b1e5cca026a2 [2,0,0,0,0,0|2,0,0]=4 4767 B7R0.1 CCCCNCC=O 2e37d7006381e9687c17149af03971de [2,0,0,0,0,0|1,0,0]=3 4768 B7R0.1 CCCCNCCBr 6994c0f761f70c79e3636f87821a4da7 [2,0,0,0,0,0|2,0,0]=4 4769 B7R0.1 CCCCNCCC a3b3a945f6f1baa84f39f99cc86c2768 [2,0,0,0,0,0|1,0,1]=4 4770 B7R0.1 CCCCNCCF a4a379fc89c7098446dbe8e70a8f3629 [2,0,0,0,0,0|2,0,0]=4 4771 B7R0.1 CCCCNCCI 9d533ae71c7c61157641b188cb16d262 [2,0,0,0,0,0|2,0,0]=4 4772 B7R0.1 CCCCNCCO 45e09e0eaf8e70243153c679742c268d [2,0,0,0,0,0|1,0,0]=3 4773 B7R0.1 CCCCNCCS e10b263df14eb689519a5b45c170340c [2,0,0,0,0,0|1,1,0]=4 4774 B7R0.1 CCCCOCC=O 059f1387d1800516c5888740482db589 [2,0,0,0,0,0|1,0,0]=3 4775 B7R0.1 CCCCOCCC e85630c69ee3c8e8f032efaf949c778a [2,0,0,0,0,0|1,0,1]=4 4776 B7R0.1 CCCCOCCF 174e59bdf2395ea80ece65db27934915 [2,0,0,0,0,0|2,0,0]=4 4777 B7R0.1 CCCCOCCS 74c4cbde8803965399df836274456678 [2,0,0,0,0,0|1,1,0]=4 4778 B7R0.1 CCCNC/C=C\O 37fdbeb5b418269df5882cb49905fc66 [2,0,0,0,0,0|1,0,1]=4 4779 B7R0.1 CCCNCCC=O 6175371dd27625c7d44a4a376a810e9d [2,0,0,0,0,0|1,0,0]=3 4780 B7R0.1 CCCNCCCCl 05aad0ada33ce1df42fe1d1576685bfa [2,0,0,0,0,0|2,0,0]=4 4781 B7R0.1 CCCNCCCF 5d767cf9963f4f908c6ad9d2f041592c [2,0,0,0,0,0|2,0,0]=4 4782 B7R0.1 CCCNCCCO 600eb878efec79e60bf3b2a8b60d23ae [2,0,0,0,0,0|1,0,0]=3 4783 B7R0.1 CCCNCCCS fc06966689a479decefc05eb0a8ab32b [2,0,0,0,0,0|1,1,0]=4 4784 B7R0.1 CCCOCCC=O 066ce9d71bb9cb79ed95a965d8418289 [2,0,0,0,0,0|1,0,0]=3 4785 B7R0.1 CCCOCCCF 522fb4722b6639ce9c12cb71accf1c57 [2,0,0,0,0,0|2,0,0]=4 4786 B7R0.1 CCCOCCCS c6a4adfcc507637ade07069cbc203677 [2,0,0,0,0,0|1,1,0]=4 4787 B7R0.1 CCNCCCCCl 4d7dec7a70ffb7caf22f71709e83606c [2,0,0,0,0,0|2,0,0]=4 4788 B7R0.1 CCNCCCCO 8314b38fc58537828c26adc5093ed491 [2,0,0,0,0,0|1,0,0]=3 4789 B7R0.1 CCNCCCCS 4d91597b38f1a9587a1a3a986f181250 [2,0,0,0,0,0|1,1,0]=4 4790 B7R0.1 CCOCCCC=O 8252684f63a0fadbbbc733c07d72d862 [2,0,0,0,0,0|1,0,0]=3 4791 B7R0.1 CCOCCCCF a309ddf8ba0f9055832bde37214b59d2 [2,0,0,0,0,0|2,0,0]=4 4792 B7R0.1 CCOCCCCS 29d95ab249579051b9ba4b50c383360a [2,0,0,0,0,0|1,1,0]=4 4793 B7R0.1 CCOCCNC=O 5ff8b0f631a008d336c5b5d059941e52 [2,0,0,0,0,0|2,0,0]=4 4794 B7R0.1 CCOCCNCO e2eefbd861380598dec880b760814d85 [2,0,0,0,0,0|2,0,0]=4 4795 B7R0.1 CCOCCOC=O 13c874dc60dfb3d1f6f6a29b0d060101 [2,0,0,0,0,0|2,0,0]=4 4796 B7R0.1 CCOCNCCO f221c34d35f484f7601137254b505360 [2,0,0,0,0,0|2,0,0]=4 4797 B7R0.1 CCSCCNC=O 385ec0536f2dafb781a8f3aea079d78c [2,0,0,0,0,0|2,0,0]=4 4798 B7R0.1 CCSCCNCO d46776a8ac8e806badbf181dbecaf11f [2,0,0,0,0,0|2,0,0]=4 4799 B7R0.1 COCCCNC=O 8b809f06a028927c1bb77d4ce795b6c6 [2,0,0,0,0,0|2,0,0]=4 4800 B7R0.1 COCCCNCO 7f15d3e78e16ebdbf4dea7c28747923f [2,0,0,0,0,0|2,0,0]=4 4801 B7R0.1 COCCNCC=O 30a27f931dd328052d03310080bbede9 [2,0,0,0,0,0|2,0,0]=4 4802 B7R0.1 COCCNCCO fc530150283f0a9894550a64892a4dcb [2,0,0,0,0,0|2,0,0]=4 4803 B7R0.1 COCCOCC=O 7bf0866abc6521aca0a006639887e6db [2,0,0,0,0,0|2,0,0]=4 4804 B7R0.1 COCNCCCO 514e51520c1fb8a1d3be4a389b10ee42 [2,0,0,0,0,0|2,0,0]=4 4805 B7R0.1 COCOCCC=O 867162fff7db4dfba86a4f93622307d6 [2,0,0,0,0,0|2,0,0]=4 4806 B7R0.1 CSCCCNC=O 7314f13ceee46dd5e864578ae6458630 [2,0,0,0,0,0|2,0,0]=4 4807 B7R0.1 CSCCCNCO 0e35ff7cab5ce9b5f1fe3019d22ea16e [2,0,0,0,0,0|2,0,0]=4 4808 B7R0.1 CSCCNCC=O 8de69eeee638d27e11ca8a7f5e17ae95 [2,0,0,0,0,0|2,0,0]=4 4809 B7R0.1 CSCCNCCO 98ea2c21875828fd22fee65d8b2ac707 [2,0,0,0,0,0|2,0,0]=4 4810 B7R0.1 CSCCOCC=O 7ceb38e7eb56bc23c985da3b919bcd85 [2,0,0,0,0,0|2,0,0]=4 4811 B7R0.1 CSCNCCCO f55eebe3b8375230b40b6450474c6b2b [2,0,0,0,0,0|2,0,0]=4 4812 B7R0.1 CSCOCCC=O eca7e28d98d26bea86d16bbabb7f8fbd [2,0,0,0,0,0|2,0,0]=4 4813 B7R0.1 O=CCCCOCF 78f6a2560292de5460d17953e3976f02 [2,0,0,0,0,0|2,0,0]=4 4814 B7R0.1 O=CCCNCCBr 291f019ce3bf899c9d2e33793b2b93f1 [2,0,0,0,0,0|2,0,0]=4 4815 B7R0.1 O=CCCNCCF 03b16d128f405ac3e0d050695aad18fa [2,0,0,0,0,0|2,0,0]=4 4816 B7R0.1 O=CCCNCCI 98b4f0ed1ee425ed4236063d3f41c320 [2,0,0,0,0,0|2,0,0]=4 4817 B7R0.1 O=CCCNCCO 624a8e88bd3627d1f4811c83acb74cb8 [2,0,0,0,0,0|2,0,0]=4 4818 B7R0.1 O=CCCNCCS 2c7d16d16b489acd0898d35ca2ec1288 [2,0,0,0,0,0|2,0,0]=4 4819 B7R0.1 O=CCCOCCF 799d4b07b5e7a35b60f3a0c45dcb8147 [2,0,0,0,0,0|2,0,0]=4 4820 B7R0.1 O=CCCOCCS 5ca5a4b308c3272ba99d0c42e8ac625b [2,0,0,0,0,0|2,0,0]=4 4821 B7R0.1 O=CCNCCCCl b1d3b8faf2fb5ab605f4c9413bd0ce31 [2,0,0,0,0,0|2,0,0]=4 4822 B7R0.1 O=CCNCCCO 68540a99f30371e028542cb2d30d539a [2,0,0,0,0,0|2,0,0]=4 4823 B7R0.1 O=CCOCCCF 30c212e5e5e6bba647ac0be6ae41e232 [2,0,0,0,0,0|2,0,0]=4 4824 B7R0.1 O=CCOCCCS cee0da51fe633a0479c401372ce33e5f [2,0,0,0,0,0|2,0,0]=4 4825 B7R0.1 O=CNCCCCCl f92f31577db7c76752d74048c9613e26 [2,0,0,0,0,0|2,0,0]=4 4826 B7R0.1 O=CNCCCCO 2b728fba12236cded175996b460e95da [2,0,0,0,0,0|2,0,0]=4 4827 B7R0.1 O=CNCCCCS 8f7648f8a23508fcd6d57892fa9ccef7 [2,0,0,0,0,0|2,0,0]=4 4828 B7R0.1 OCCCCNCF 7e26da81cb202e81f9fa6935013ff164 [2,0,0,0,0,0|2,0,0]=4 4829 B7R0.1 OCCCCNCO 3308a62177334006d69e4e812a481bb1 [2,0,0,0,0,0|2,0,0]=4 4830 B7R0.1 OCCCNCCBr 298f76d93b4a56118785c24aabe36d03 [2,0,0,0,0,0|2,0,0]=4 4831 B7R0.1 OCCCNCCF 160ffea2dd40155e84c24124da4d3bb5 [2,0,0,0,0,0|2,0,0]=4 4832 B7R0.1 OCCCNCCI b0caa3b33126ba633de191e5b27be25d [2,0,0,0,0,0|2,0,0]=4 4833 B7R0.1 OCCCNCCO b7e543e706324c7668084e51d2ac83f2 [2,0,0,0,0,0|2,0,0]=4 4834 B7R0.1 OCCCNCCS a78d7d11eead19ac41bdcdfaa23aa4c3 [2,0,0,0,0,0|2,0,0]=4 4835 B7R0.1 OCCNCCCCl 10a4c88cfa54a10eeb2391e86b7e00e5 [2,0,0,0,0,0|2,0,0]=4 4836 B7R0.1 OCCNCCCF 91fb92031bfde2e9db842bc4e4a8eee4 [2,0,0,0,0,0|2,0,0]=4 4837 B7R0.1 OCCNCCCS c5d3e46e0ec074044c852191bd32ce81 [2,0,0,0,0,0|2,0,0]=4 4838 B7R0.1 OCNCCCCCl ca8e2c827cdc1f4b61ee0f17daccc9f0 [2,0,0,0,0,0|2,0,0]=4 4839 B7R0.1 OCNCCCCS 703d007b8ef355c907943572af1839f8 [2,0,0,0,0,0|2,0,0]=4 4840 B7R0.4 CCCCNC(=O)C 0949c76abd7904d01e0aead7cd919e16 [2,0,0,0,0,0|2,0,0]=4 4841 B7R0.4 CCCNCC(=O)C 99413200ab301de7320a2958deb213a6 [2,0,0,0,0,0|2,0,0]=4 4842 B7R0.4 CCCNCC(=O)N c6bdb30f5ce304ac84a3a29975920160 [2,0,0,0,0,0|2,0,0]=4 4843 B7R0.4 CCCNCC(=O)O 1172f6559bfe8e46309ea809f909cc38 [2,0,0,0,0,0|1,0,0]=3 4844 B7R0.4 CCCOCC(=O)C 96075066d7d27bc87eaacf968c44bcad [2,0,0,0,0,0|2,0,0]=4 4845 B7R0.4 CCCOCC(=O)N 96a8c77dd39980465075569d7697e39d [2,0,0,0,0,0|2,0,0]=4 4846 B7R0.4 CCCOCC(=O)O 23aff310a77cf1d0723d729060ccc5ab [2,0,0,0,0,0|1,0,0]=3 4847 B7R0.4 CCCOCS(=O)O 0f12db2563a680e281a3900efd4625e1 [2,0,0,0,0,0|2,0,0]=4 4848 B7R0.4 CCNCCC(=O)N 41bbba81e733b9d1286775aca2565c1c [2,0,0,0,0,0|2,0,0]=4 4849 B7R0.4 CCNCCC(=O)O 88c0515bc1747e6ea081f59eb14f48f3 [2,0,0,0,0,0|1,0,0]=3 4850 B7R0.4 CCNCCS(=O)O 128b1e77080fe0113eae546bdfad2510 [2,0,0,0,0,0|2,0,0]=4 4851 B7R0.4 CCOCCC(=O)C cbf951a39aabdc9cae79b2b81520e5d8 [2,0,0,0,0,0|2,0,0]=4 4852 B7R0.4 CCOCCC(=O)N 6008011299c8bcf06da6d1d485db82cf [2,0,0,0,0,0|2,0,0]=4 4853 B7R0.4 CCOCCC(=O)O b43dd4fe6d8527741fde301ee2762516 [2,0,0,0,0,0|1,0,0]=3 4854 B7R0.4 COCNCC(=O)O 63e693e6a6943d7d076b731aa43d021d [2,0,0,0,0,0|2,0,0]=4 4855 B7R0.4 COCOCC(=O)O a468e60279d972337d82cd5f7b4a85c0 [2,0,0,0,0,0|2,0,0]=4 4856 B7R0.4 CSCNCC(=O)O 5c5440b473179a79f0a0bde7f261b934 [2,0,0,0,0,0|2,0,0]=4 4857 B7R0.4 CSCOCC(=O)O bc53fc5d2082b4879e00ca1b9daacd0d [2,0,0,0,0,0|2,0,0]=4 4858 B7R0.4 O=C(O)CCNCF 05f9560a9c5090f2158d127e76253bb5 [2,0,0,0,0,0|2,0,0]=4 4859 B7R0.4 O=C(O)CCNCO 4eda81a5ddb9ef19630be70331f35e71 [2,0,0,0,0,0|2,0,0]=4 4860 B7R0.4 O=C(O)CCOCF 47a2f1a64d70f1fd70ee05dd145bf666 [2,0,0,0,0,0|2,0,0]=4 4861 B7R0.4 O=C(O)CNCCBr 8130f29cad0df7ca3ee5b483ea3f0ae7 [2,0,0,0,0,0|2,0,0]=4 4862 B7R0.4 O=C(O)CNCCF 6ae595578428cb8e8437866b629b8546 [2,0,0,0,0,0|2,0,0]=4 4863 B7R0.4 O=C(O)CNCCI b126f2904311dc397f067e9011020ab9 [2,0,0,0,0,0|2,0,0]=4 4864 B7R0.4 O=C(O)CNCCO 8a2a254c2a92a8e0b0d875df2fbb7a98 [2,0,0,0,0,0|2,0,0]=4 4865 B7R0.4 O=C(O)CNCCS a3afb9ba49fa1ab4342d38d48d1d7ee5 [2,0,0,0,0,0|2,0,0]=4 4866 B7R0.4 O=C(O)COCCF 0bf6b93a21a854bfb19752b49752a6aa [2,0,0,0,0,0|2,0,0]=4 4867 B7R0.4 O=C(O)COCCS d255bc31bb2be8a37fe42b47fabd36dd [2,0,0,0,0,0|2,0,0]=4 4868 B9R0.5 C=CCC(C)CNCCC 57145e6cde5992e28644e2005aca4a52 [1,1,0,0,0,0|2,0,0]=4 4869 B9R0.5 C=CCC(C)COCCC 7e85aeea39477af9cfd8878a56719121 [1,1,0,0,0,0|2,0,0]=4 4870 B9R0.5 C=CCC(C)OCCCC f19d39a50fdfd6ad2267d2fbf05a2b41 [1,1,0,0,0,0|2,0,0]=4 4871 B9R0.5 C=CCC(O)CNCCC bdbda0676a7bef81a38b347a29437e3c [1,1,0,0,0,0|2,0,0]=4 4872 B9R0.5 C=CCCCN(C)CCC 7d841d352abee3c82fe33663f6b18bb0 [1,1,0,0,0,0|2,0,0]=4 4873 B9R0.5 C=CCCC[C@H](C)OCC 1a7f26f08a4aab831c049f86e95105db [1,1,0,0,0,0|2,0,0]=4 4874 B9R0.5 C=CCCNC(C)CCC 3371aa09ea9d2447d2686676bccef260 [1,1,0,0,0,0|2,0,0]=4 4875 B9R0.5 C=CCCN[C@@H](C)CCC cffaa158bfffbde18d6888855f7065f2 [1,1,0,0,0,0|2,0,0]=4 4876 B9R0.5 C=CCCOC(C)CCC 3bc391c8caa568c3a41dda672f336f05 [1,1,0,0,0,0|2,0,0]=4 4877 B9R0.5 C=CCCO[C@@H](C)CCC 634f8c2d0d3b6aefd8ef784383af89c4 [1,1,0,0,0,0|2,0,0]=4 4878 B9R0.5 C=CCCO[C@H](C)CCC e04f21559b7527421350b2a9527639e7 [1,1,0,0,0,0|2,0,0]=4 4879 B9R0.5 C=CCN(C)CCCCC 0b10691c54227c175c8cdf0755b7f63b [1,1,0,0,0,0|2,0,0]=4 4880 B9R0.5 C=CCNCC(O)CCC 5aaf4a352f55e309e610ecb0c1303e08 [1,1,0,0,0,0|2,0,0]=4 4881 B9R0.5 C=CCOCC(C)CCC 62c75ffd71b3ed1355d16fce7eaab29a [1,1,0,0,0,0|2,0,0]=4 4882 B9R0.5 C=CC[C@@H](C)OCCCC b20fd45ea1dd5c3cccb6f7a22cc0e480 [1,1,0,0,0,0|2,0,0]=4 4883 B9R0.5 C=CC[C@H](C)OCCCC 591b4bbc39f98a534a3a9dc1d5e7fa51 [1,1,0,0,0,0|2,0,0]=4 4884 B9R0.5 CC(CCO)CNCC=O d799a6bdd3bda94c7b10b0789cf1ffd6 [1,1,0,0,0,0|2,0,0]=4 4885 B9R0.5 CC(CCO)NCCC=O a6c8a33bf962ab1984f30ab5076e714c [1,1,0,0,0,0|2,0,0]=4 4886 B9R0.5 CCCC(=S)OCCC=O 141f60b34558e8dbf5ffba7be4ff80f9 [1,1,0,0,0,0|1,0,1]=4 4887 B9R0.5 CCCC(C)CNCCO 3bc26c15d8ec8db27660e3919bc41d54 [1,1,0,0,0,0|1,0,1]=4 4888 B9R0.5 CCCC(C)COCC=O b4ade1b0aa3eb14511461dd6fdcc445d [1,1,0,0,0,0|1,0,0]=3 4889 B9R0.5 CCCC(C)NC/C=C\O c93946b0de8d17c8ad6f99cefa864482 [1,1,0,0,0,0|1,0,1]=4 4890 B9R0.5 CCCC(C)NCCC=O 5b5f62290e2d559dfcdedcae1cf5a40f [1,1,0,0,0,0|1,0,0]=3 4891 B9R0.5 CCCC(C)NCCCO f622547af18556e616e7380ad9ee1969 [1,1,0,0,0,0|1,0,1]=4 4892 B9R0.5 CCCC(C)OCCC=O 075091b3402d4383d6ae76faf45828e2 [1,1,0,0,0,0|1,0,0]=3 4893 B9R0.5 CCCC(O)CNCC=O 0ab60eacd08ef644a7eb6587b3e377fb [1,1,0,0,0,0|1,0,0]=3 4894 B9R0.5 CCCC(O)CNCCO d1eee4b251f066db3df0bab92085c28a [1,1,0,0,0,0|1,0,1]=4 4895 B9R0.5 CCCCCC(C)NC=O 8ebcf0f9aaad2891aad2d805d5730b90 [1,1,0,0,0,0|1,0,0]=3 4896 B9R0.5 CCCCCC(C)NCO 79997f757bd22c3676dd0e07aa87d23c [1,1,0,0,0,0|1,0,1]=4 4897 B9R0.5 CCCCCN(C)CC=O 78bb5a09a7732691e4b2ef4ef4683cdd [1,1,0,0,0,0|1,0,0]=3 4898 B9R0.5 CCCCCN(C)CCO 34410e1ec8513358afcc09dffe161858 [1,1,0,0,0,0|1,0,1]=4 4899 B9R0.5 CCCCC[C@H](C)NC=O e9ec5cd528aff38be097392db8efa5ac [1,1,0,0,0,0|1,0,0]=3 4900 B9R0.5 CCCCC[C@H](C)NCO dadd1abcf3546c9c0b9e976ac187033b [1,1,0,0,0,0|1,0,1]=4 4901 B9R0.5 CCCCNC(=O)CC=O 836473a80945117a02207b121e995b64 [1,1,0,0,0,0|1,0,1]=4 4902 B9R0.5 CCCCNC(C)CCO 060a7a1335f70c0676cfbb86f416e991 [1,1,0,0,0,0|1,0,1]=4 4903 B9R0.5 CCCCN[C@@H](C)CCO cd3d50136741c2b9579e5ce175e949c5 [1,1,0,0,0,0|1,0,1]=4 4904 B9R0.5 CCCCN[C@H](C)CCO fc9bdedfd734c26acec6b6121aa8cb84 [1,1,0,0,0,0|1,0,1]=4 4905 B9R0.5 CCCN(C)CCCC=O 733054530e6832de68ab4ede91eabb86 [1,1,0,0,0,0|1,0,0]=3 4906 B9R0.5 CCCN(C)CCCCO 3d32b13ab18b3ef9a88401c3421fd62f [1,1,0,0,0,0|1,0,1]=4 4907 B9R0.5 CCCNCC(C)CCO 47e0bbb51b8a79c96dd13c961ecc0dea [1,1,0,0,0,0|1,0,1]=4 4908 B9R0.5 CCCNC[C@@H](O)CCO 0911566ceb0cc95fa86b387a531110c6 [1,1,0,0,0,0|1,0,1]=4 4909 B9R0.5 CCCOC[C@@H](O)CCO 8f4ac1d9a59c7be3b1d0e4ed72d56dee [1,1,0,0,0,0|1,0,1]=4 4910 B9R0.5 CCC[C@@H](C)OCCC=O 3bd84e647c49cab84f4c3f78c7f376dd [1,1,0,0,0,0|1,0,0]=3 4911 B9R0.5 CCC[C@H](C)NC/C=C\O 8d52c9d789e30bf7c68d63162492dc07 [1,1,0,0,0,0|1,0,1]=4 4912 B9R0.5 CCC[C@H](C)NCCC=O 8965a7a737d28b5a320abc650f4b57db [1,1,0,0,0,0|1,0,0]=3 4913 B9R0.5 CCC[C@H](C)NCCCO b55f9f9c5d2b5585fcebd32b6ae9676f [1,1,0,0,0,0|1,0,1]=4 4914 B9R0.5 CCC[C@H](C)OCCC=O 5603414e98a7234f79a82c4a13052426 [1,1,0,0,0,0|1,0,0]=3 4915 B9R0.5 CCOC(C)CNCC=O e8032f71289b0514416b8c99734f449c [1,1,0,0,0,0|2,0,0]=4 4916 B9R0.5 CCOC(C)COCC=O 6735ed8d4a4675a4fe4153179dde31c8 [1,1,0,0,0,0|2,0,0]=4 4917 B9R0.5 CCOCCN(C)CC=O 7acec88657f57cb021d93d1cfad83ba5 [1,1,0,0,0,0|2,0,0]=4 4918 B9R0.5 CN(CC=O)CCCCO 837ff6a1ec2106692e579c582051f56a [1,1,0,0,0,0|2,0,0]=4 4919 B9R0.5 CN(CCF)CCCC=O 6bec50a8c71665434b5d54891df7aca2 [1,1,0,0,0,0|2,0,0]=4 4920 B9R0.5 CN(CCO)CCCC=O 618e3514c562728808d02f6c835e3847 [1,1,0,0,0,0|2,0,0]=4 4921 B9R0.5 COCC(C)COCC=O 3384b3b68006ae88937e9b7190c22f19 [1,1,0,0,0,0|2,0,0]=4 4922 B9R0.5 COCC(C)NCCC=O 84657248a83c0b2f192b7872d5572a48 [1,1,0,0,0,0|2,0,0]=4 4923 B9R0.5 COCC(C)OCCC=O 9dbf86a21160103535d5e1a32d202237 [1,1,0,0,0,0|2,0,0]=4 4924 B9R0.5 COCC(O)CNCC=O 4335fb092c58f6a51ce9efc9cfd047ce [1,1,0,0,0,0|2,0,0]=4 4925 B9R0.5 COCCCN(C)CC=O 635fdf23af030f1cf489d4fee368aafe [1,1,0,0,0,0|2,0,0]=4 4926 B9R0.5 COC[C@@H](C)NCCC=O a84ffc67c49c414f13b8ff5a4bef93ea [1,1,0,0,0,0|2,0,0]=4 4927 B9R0.5 COC[C@@H](C)OCCC=O 1878b95e9f8b2ae0da6c47a7441586dc [1,1,0,0,0,0|2,0,0]=4 4928 B9R0.5 COC[C@@H](O)CNCC=O c02b66f326f6df58f3d6af0de8924974 [1,1,0,0,0,0|2,0,0]=4 4929 B9R0.5 COC[C@H](C)COCC=O 9ba7ae727f991a2d31d3f4bbf5bfafc3 [1,1,0,0,0,0|2,0,0]=4 4930 B9R0.5 COC[C@H](C)NCCC=O 1495ff0acd371faf726cbb8d8dd09cd6 [1,1,0,0,0,0|2,0,0]=4 4931 B9R0.5 COC[C@H](C)OCCC=O cdcfeab974dcf787b65a1e1a858be05d [1,1,0,0,0,0|2,0,0]=4 4932 B9R0.5 CSCC(C)OCCC=O a28892617707d880aa61248959cd2e72 [1,1,0,0,0,0|2,0,0]=4 4933 B9R0.5 C[C@@H](CCO)NCCC=O a0d89b70352c0aaa07d4daed1aaca58e [1,1,0,0,0,0|2,0,0]=4 4934 B9R0.5 C[C@H](CCO)NCCC=O 9ae79c56e5f7c51137e66cf3304f5ad1 [1,1,0,0,0,0|2,0,0]=4 4935 B9R0.18 C=CCCC(C)NCCC 240e8313686bab03145fdf8e05a079de [1,1,0,0,0,0|2,0,0]=4 4936 B9R0.18 C=CCCC(C)OCCC 7912a5c88e116a41f225a0605d7ee9b9 [1,1,0,0,0,0|2,0,0]=4 4937 B9R0.18 C=CCCC(O)CNCC 5526933c2601f900d214598338a32d02 [1,1,0,0,0,0|2,0,0]=4 4938 B9R0.18 C=CCCN(C)CCCC 982bda51df0f37fb4c6a42577f4401e6 [1,1,0,0,0,0|2,0,0]=4 4939 B9R0.18 C=CCC[C@@H](C)OCCC 99173135eb582288011948d677068cc8 [1,1,0,0,0,0|2,0,0]=4 4940 B9R0.18 C=CCNC(C)CCCC b7e84b71e08b90f5001bff3ed3e79daa [1,1,0,0,0,0|2,0,0]=4 4941 B9R0.18 C=CCN[C@H](C)CCCC 717efbfcef1985e4262e18519df5cea0 [1,1,0,0,0,0|2,0,0]=4 4942 B9R0.18 C=CCOC(C)CCCC e05948ecaeff8c28551c390203faa54a [1,1,0,0,0,0|2,0,0]=4 4943 B9R0.18 C=CCO[C@@H](C)CCCC 785b4fd0e7d2a1185c3f37e0ca8f48b9 [1,1,0,0,0,0|2,0,0]=4 4944 B9R0.18 C=CCO[C@H](C)CCCC 8279474ab6fe084178c62f137ffa8b53 [1,1,0,0,0,0|2,0,0]=4 4945 B9R0.18 CC(CCCO)NCC=O c7f19c3ade85d6e05312f1a58a72a0b0 [1,1,0,0,0,0|2,0,0]=4 4946 B9R0.18 CCCCC(C)NCC=O 17b13b22e791a7a0520f1bfd34f0e857 [1,1,0,0,0,0|1,0,0]=3 4947 B9R0.18 CCCCC(C)NCCO ff47d9e2568b188c4923b45bf7987a40 [1,1,0,0,0,0|1,0,1]=4 4948 B9R0.18 CCCCC(C)OCC=O eda04f1a17d81cf08f2f32366dad6c90 [1,1,0,0,0,0|1,0,0]=3 4949 B9R0.18 CCCCC(O)CNC=O eec15ce6abd05c06c56bfdaadbde9a0b [1,1,0,0,0,0|1,0,0]=3 4950 B9R0.18 CCCCC(O)CNCO 2dafc47aa294ecb110a3a11ecf631ac8 [1,1,0,0,0,0|1,0,1]=4 4951 B9R0.18 CCCCN(C)C/C=C\O b670acc8005386db650855df49e5a609 [1,1,0,0,0,0|1,0,1]=4 4952 B9R0.18 CCCCN(C)CCC=O bf49116c9af507ce2cb2ede0349f47b2 [1,1,0,0,0,0|1,0,0]=3 4953 B9R0.18 CCCCN(C)CCCO 57af9b9f3fe16b52eec79be093a09ab2 [1,1,0,0,0,0|1,0,1]=4 4954 B9R0.18 CCCC[C@@H](C)NCC=O 04b56f2fdbafe2353e082e13229eedf1 [1,1,0,0,0,0|1,0,0]=3 4955 B9R0.18 CCCC[C@@H](C)NCCO 91f3234cc374ccfce736aaecc9b5736e [1,1,0,0,0,0|1,0,1]=4 4956 B9R0.18 CCCC[C@@H](C)OCC=O 993915524a0a10ada5c5e7e66a19b57f [1,1,0,0,0,0|1,0,0]=3 4957 B9R0.18 CCCC[C@H](C)OCC=O 64aea713a6e78b2a7c1dcccee369110a [1,1,0,0,0,0|1,0,0]=3 4958 B9R0.18 CCCNC(=O)CCC=O 5522fa26a355fc8eec3036c5a7687322 [1,1,0,0,0,0|1,0,1]=4 4959 B9R0.18 CCCNC(C)CCCO e35a72c6f447647387525857cf3e6cf3 [1,1,0,0,0,0|1,0,1]=4 4960 B9R0.18 CCCN[C@H](C)CCCO 558264158e702c6f14ae3c30e7ce5099 [1,1,0,0,0,0|1,0,1]=4 4961 B9R0.18 CCNC[C@H](C)CCCO 59acf7998511cccd05de89c8199a3646 [1,1,0,0,0,0|1,0,1]=4 4962 B9R0.18 CCOCC(C)OCC=O 87171cd27869753cf4db9a5f37f279d2 [1,1,0,0,0,0|2,0,0]=4 4963 B9R0.18 CCOCC(O)CNC=O 5d9760e4c74be187414696b964d2f786 [1,1,0,0,0,0|2,0,0]=4 4964 B9R0.18 CN(CCC=O)CCCO 08286588e072c3b728da4dbcd3937da1 [1,1,0,0,0,0|2,0,0]=4 4965 B9R0.18 COCCC(C)OCC=O d178477da94c6d9f9961f612dbf593df [1,1,0,0,0,0|2,0,0]=4 4966 B9R0.18 COCCN(C)CCC=O fa9ef9375e774603351f15368a01f26c [1,1,0,0,0,0|2,0,0]=4 4967 B9R0.18 CSCCC(C)OCC=O 1beb2ad0681904a21447ab254d6c6257 [1,1,0,0,0,0|2,0,0]=4 4968 B9R0.18 CSCCN(C)CCC=O aef8759b9ae729fbfdfb40b183dbf66e [1,1,0,0,0,0|2,0,0]=4 4969 B9R0.18 C[C@H](CCCO)CNC=O 55135246a811de86327512e6eb7c8cd9 [1,1,0,0,0,0|2,0,0]=4 4970 B9R0.18 C[C@H](CCCO)NCC=O 60c5b1603c2bcf27c36775727a810895 [1,1,0,0,0,0|2,0,0]=4 4971 B9R0.45 C#CCCCCCNC=O 353c9727650993b322d351830acdf93c [1,1,0,0,0,0|0,0,2]=4 4972 B9R0.45 C#CCCCCCNCC 14ea92e09ae5d59f435532a2fedd7cb8 [1,1,0,0,0,0|1,0,1]=4 4973 B9R0.45 C#CCCCCCOCC 76da78402f2580ea24a7954fbf49c65e [1,1,0,0,0,0|1,0,1]=4 4974 B9R0.45 C#CCCCCNCC=O 3a09dc1858ad390906bd1e47abb1db64 [1,1,0,0,0,0|0,0,2]=4 4975 B9R0.45 C#CCCCCNCCC 720f4ace558aca91e3140192969837a4 [1,1,0,0,0,0|1,0,1]=4 4976 B9R0.45 C#CCCCCOCC=O 7374e2bc75ec57e5871816f717aa486e [1,1,0,0,0,0|0,0,2]=4 4977 B9R0.45 C#CCCCCOCCC 88be43598906413b514321fe6489b41b [1,1,0,0,0,0|1,0,1]=4 4978 B9R0.45 C#CCCCNCCC=O 7b0b27f264bc3ae35c14d958ceda0115 [1,1,0,0,0,0|0,0,2]=4 4979 B9R0.45 C#CCCCNCCCC 28864ce458b4f28b4cea859a70886cf4 [1,1,0,0,0,0|1,0,1]=4 4980 B9R0.45 C#CCCCOCCC=O 6b7d5bb471ddee763f561d365417d401 [1,1,0,0,0,0|0,0,2]=4 4981 B9R0.45 C#CCCCOCCCC 455b20947599c42b63a460c5f97b230b [1,1,0,0,0,0|1,0,1]=4 4982 B9R0.45 C#CCCNCCCC=O a1f87276a48ea4f220498258837dbff3 [1,1,0,0,0,0|0,0,2]=4 4983 B9R0.45 C#CCCNCCCCC 0b0b4c4dc2ba9dc503e534c3f7a4e896 [1,1,0,0,0,0|1,0,1]=4 4984 B9R0.45 C#CCCOCCCC=O a9c0773ccdd8f76a801b34d952a72ab6 [1,1,0,0,0,0|0,0,2]=4 4985 B9R0.45 C#CCCOCCCCC 0b844e7d38a15bf2cf13b79058ea6790 [1,1,0,0,0,0|1,0,1]=4 4986 B9R0.45 C#CCNCCCCC=O 02fc946c0a3cb4a5e6c689f7bad2f348 [1,1,0,0,0,0|0,0,2]=4 4987 B9R0.45 C#CCNCCCCCC cb41f91861b4ad09b2fdb148c3b6a6cd [1,1,0,0,0,0|1,0,1]=4 4988 B9R0.45 C#CCOCCCCC=O f7ac2e6bf97c3a62b974c9b5c6d64ab1 [1,1,0,0,0,0|0,0,2]=4 4989 B9R0.45 C#CCOCCCCCC f5db1c348f2482ec2d74aff14ea6fbb8 [1,1,0,0,0,0|1,0,1]=4 4990 B9R0.45 C/C=C/CCCOCC=O 1133dd39557966bbfc717550ad829422 [1,1,0,0,0,0|0,0,2]=4 4991 B9R0.45 C/C=C/CCCOCCC 6078f7ffc27dfa8185f6236738ef681e [1,1,0,0,0,0|1,0,1]=4 4992 B9R0.45 C/C=C/CCOCCC=O c4c6e811a3e16a2c2124752f9d8b1849 [1,1,0,0,0,0|0,0,2]=4 4993 B9R0.45 C/C=C/CCOCCCC 34807d765a53dafaafda84290da499b4 [1,1,0,0,0,0|1,0,1]=4 4994 B9R0.45 C/C=C/CNCCCCC 173af57cfda70fbf416f0d5599bfa036 [1,1,0,0,0,0|1,0,1]=4 4995 B9R0.45 C/C=C/COCCCC=O a185a9427aaa2100c7d1e383b492c807 [1,1,0,0,0,0|0,0,2]=4 4996 B9R0.45 C/C=C/COCCCCC 802c5cbc78037013e3e1230ad72e88ef [1,1,0,0,0,0|1,0,1]=4 4997 B9R0.45 C/C=C\CCCNCCC bd38004b14a3ffe818d001cefe29aee7 [1,1,0,0,0,0|1,0,1]=4 4998 B9R0.45 C/C=C\CCCOCC=O d18705bb046350f1567ecd8aed8ca6a7 [1,1,0,0,0,0|0,0,2]=4 4999 B9R0.45 C/C=C\CCCOCCC 083c73f409535e210af3eb7849dd56ad [1,1,0,0,0,0|1,0,1]=4 5000 B9R0.45 C/C=C\CNCCCCC 2ee64f407eb13d42c64dbdca505fc819 [1,1,0,0,0,0|1,0,1]=4 5001 B9R0.45 C/C=C\COCCCC=O 1b77c800485ae4c0e70553fb49479328 [1,1,0,0,0,0|0,0,2]=4 5002 B9R0.45 C/C=C\COCCCCC 49d9ba2c76d4226b734a25af963b3a40 [1,1,0,0,0,0|1,0,1]=4 5003 B9R0.45 C=C=CCCOCCCC 5bd6b2c5c25cc2126ad420d63c19c871 [1,1,0,0,0,0|2,0,0]=4 5004 B9R0.45 C=CCCCCCNC=O 37acb8face8da4e33847766c3e966de6 [1,1,0,0,0,0|0,0,2]=4 5005 B9R0.45 C=CCCCCCNCC 890f1c6c1d85667d7cffa859ba2c1d3e [1,1,0,0,0,0|1,0,0]=3 5006 B9R0.45 C=CCCCCCNCF 5758c179fab104be34b09f047afc1fd5 [1,1,0,0,0,0|2,0,0]=4 5007 B9R0.45 C=CCCCCCNCO 4058549cb0627342cdb023e8e5d092ea [1,1,0,0,0,0|2,0,0]=4 5008 B9R0.45 C=CCCCCCOCC 23f590b48ebd5146440db0699ec4bb83 [1,1,0,0,0,0|1,0,0]=3 5009 B9R0.45 C=CCCCCCOCF b04f839cfe9fd44ba94f605d82c4d0ae [1,1,0,0,0,0|2,0,0]=4 5010 B9R0.45 C=CCCCCNCC=O f0ee6c8a8d5e62e34bed7266da448702 [1,1,0,0,0,0|0,0,2]=4 5011 B9R0.45 C=CCCCCNCCBr 07640e6f216624020c084c51b2b6c0e3 [1,1,0,0,0,0|2,0,0]=4 5012 B9R0.45 C=CCCCCNCCC 1c3124d4bfead54322e8b6cd10acbe7e [1,1,0,0,0,0|1,0,0]=3 5013 B9R0.45 C=CCCCCNCCF bb135346f8d1f2fd9649100cc9cfdedb [1,1,0,0,0,0|2,0,0]=4 5014 B9R0.45 C=CCCCCNCCI 0a6513107528ba2abea852f44f3eb8ef [1,1,0,0,0,0|2,0,0]=4 5015 B9R0.45 C=CCCCCNCCO e90dd5dffbcd01a756bbd1f730cda699 [1,1,0,0,0,0|2,0,0]=4 5016 B9R0.45 C=CCCCCNCCS 981cc28718f0e82344c822015e52ce6e [1,1,0,0,0,0|2,0,0]=4 5017 B9R0.45 C=CCCCCNCOC 5b0c229bd641ac48d7ec078b3fc2ec2d [1,1,0,0,0,0|2,0,0]=4 5018 B9R0.45 C=CCCCCNCSC 12aaafcb136d8a0d0bd01b0db509102e [1,1,0,0,0,0|2,0,0]=4 5019 B9R0.45 C=CCCCCOCC=O 4cdebe78f89dc273e9c86e4da9bd53c6 [1,1,0,0,0,0|0,0,2]=4 5020 B9R0.45 C=CCCCCOCCC f624e5cfeefd7c8f70f95b431a05113e [1,1,0,0,0,0|1,0,0]=3 5021 B9R0.45 C=CCCCCOCCF e5688e416989ce0b8e2de252ce333c03 [1,1,0,0,0,0|2,0,0]=4 5022 B9R0.45 C=CCCCCOCCS 10dfd3c079a28d4d3066722414bfb2da [1,1,0,0,0,0|2,0,0]=4 5023 B9R0.45 C=CCCCCOCOC 374793be8a31c9ce728cb14abf402af4 [1,1,0,0,0,0|2,0,0]=4 5024 B9R0.45 C=CCCCCOCSC 195324d17fdf202ccef6359b6b5e3bb9 [1,1,0,0,0,0|2,0,0]=4 5025 B9R0.45 C=CCCCNCCC=O b5f2a59fd8e719a8a9da68d8ba7268fd [1,1,0,0,0,0|0,0,2]=4 5026 B9R0.45 C=CCCCNCCCC fa1d0b4e193451fb553c9cd2afd75cca [1,1,0,0,0,0|1,0,0]=3 5027 B9R0.45 C=CCCCNCCCCl c0c501ba24935f3fdc55a6800c85d9f5 [1,1,0,0,0,0|2,0,0]=4 5028 B9R0.45 C=CCCCNCCCF 4fbf6888b4902e4977d561796e7f3c35 [1,1,0,0,0,0|2,0,0]=4 5029 B9R0.45 C=CCCCNCCCO 49ff67fd32a7e48d035cc39e8c6c93f5 [1,1,0,0,0,0|2,0,0]=4 5030 B9R0.45 C=CCCCNCCCS e91fc8975e9281b0c28f44d8e3139816 [1,1,0,0,0,0|2,0,0]=4 5031 B9R0.45 C=CCCCNCCOC 759115f4101e6143ad6ba137d2cb2134 [1,1,0,0,0,0|2,0,0]=4 5032 B9R0.45 C=CCCCNCCSC 835ee46189c1f88d4cdbdcc67650ffcb [1,1,0,0,0,0|2,0,0]=4 5033 B9R0.45 C=CCCCNCOCC f02bd04312dd897bff39b6bd9b93bc49 [1,1,0,0,0,0|2,0,0]=4 5034 B9R0.45 C=CCCCOCCC=O c8bdd6d9eb4b2f37ce346479c10f311b [1,1,0,0,0,0|0,0,2]=4 5035 B9R0.45 C=CCCCOCCCC e8806365586991cd800b2ef6da7fc881 [1,1,0,0,0,0|1,0,0]=3 5036 B9R0.45 C=CCCCOCCCF 2e6d7089b14dd641e54a76ae7dadaa14 [1,1,0,0,0,0|2,0,0]=4 5037 B9R0.45 C=CCCCOCCCS 00ab52b736b42ecb74aa8e1b43a7e9be [1,1,0,0,0,0|2,0,0]=4 5038 B9R0.45 C=CCCCOCCOC 3f3e29bd58ea27c0ff854dd25e431ca0 [1,1,0,0,0,0|2,0,0]=4 5039 B9R0.45 C=CCCCOCCSC 27b8b1769c1651eaa64484ccb85191f8 [1,1,0,0,0,0|2,0,0]=4 5040 B9R0.45 C=CCCCOCOCC 1cb3725d57ca40858b757ece9ea622f2 [1,1,0,0,0,0|2,0,0]=4 5041 B9R0.45 C=CCCNCCCC=O b39d2f6f1f09b8a0598e7314d1e74905 [1,1,0,0,0,0|0,0,2]=4 5042 B9R0.45 C=CCCNCCCCC a855019ae48c9b8cf6923444d001ccd3 [1,1,0,0,0,0|1,0,0]=3 5043 B9R0.45 C=CCCNCCCCCl a117ce913481632f0688d24994247e2a [1,1,0,0,0,0|2,0,0]=4 5044 B9R0.45 C=CCCNCCCCF efc5a9a56f0e77778e0d77be991290d0 [1,1,0,0,0,0|2,0,0]=4 5045 B9R0.45 C=CCCNCCCCO 483ccf905bb3e32f0679d7de05961fd6 [1,1,0,0,0,0|2,0,0]=4 5046 B9R0.45 C=CCCNCCCCS eb80eda9fad56453c79d6797c2b54750 [1,1,0,0,0,0|2,0,0]=4 5047 B9R0.45 C=CCCNCCCOC f114ed09e62c1c84dddd4497e61d0709 [1,1,0,0,0,0|2,0,0]=4 5048 B9R0.45 C=CCCNCCCSC 82fa4646237d709aa853365c812d6ebb [1,1,0,0,0,0|2,0,0]=4 5049 B9R0.45 C=CCCNCCOCC 3004d01d837d0f88a49d7ce90fd1bde4 [1,1,0,0,0,0|2,0,0]=4 5050 B9R0.45 C=CCCNCCSCC 407d8c67af07288795fc606cb0bad476 [1,1,0,0,0,0|2,0,0]=4 5051 B9R0.45 C=CCCOCCCC=O 7836d275180373c5f8265311bdcc7219 [1,1,0,0,0,0|0,0,2]=4 5052 B9R0.45 C=CCCOCCCCC 6e7cf8472e35f7c7bd7858bc8c7bfd04 [1,1,0,0,0,0|1,0,0]=3 5053 B9R0.45 C=CCCOCCCCF d4ec7484466a64c13890e327fd29e039 [1,1,0,0,0,0|2,0,0]=4 5054 B9R0.45 C=CCCOCCCCS 46572775d6dca25538d12c4917173d07 [1,1,0,0,0,0|2,0,0]=4 5055 B9R0.45 C=CCCOCCCOC 2c2711f1681894e043a28c331b1790e2 [1,1,0,0,0,0|2,0,0]=4 5056 B9R0.45 C=CCCOCCCSC a45023388d7b0125e3891a4f7bb25903 [1,1,0,0,0,0|2,0,0]=4 5057 B9R0.45 C=CCCOCCOCC d362d26f2d685dd3fa35bff0ccc84647 [1,1,0,0,0,0|2,0,0]=4 5058 B9R0.45 C=CCCOCCSCC fcb13c630a689c43c3fade0981e1cb62 [1,1,0,0,0,0|2,0,0]=4 5059 B9R0.45 C=CCNCCCCCC 6384eba9acd253c5ddf82f9491922adb [1,1,0,0,0,0|1,0,0]=3 5060 B9R0.45 C=CCNCCCCCCl 39b003764fbe36df5eaf2287055cfd68 [1,1,0,0,0,0|2,0,0]=4 5061 B9R0.45 C=CCNCCCCCO b81fe78c797f2a70aa21f5595d13d0f6 [1,1,0,0,0,0|2,0,0]=4 5062 B9R0.45 C=CCNCCCCOC 8d21e2ed462bb4954ce80ad5a5ca8a27 [1,1,0,0,0,0|2,0,0]=4 5063 B9R0.45 C=CCNCCCCSC cb376474ea5d0373c451927e013a14c9 [1,1,0,0,0,0|2,0,0]=4 5064 B9R0.45 C=CCNCCCOCC 2c5fb06034b78ea915033df9203a28d2 [1,1,0,0,0,0|2,0,0]=4 5065 B9R0.45 C=CCNCCOCCC 2f529c37c6157fe0a2cf6ac6ecb62671 [1,1,0,0,0,0|2,0,0]=4 5066 B9R0.45 C=CCOCCCCC=O 37f121bf5671a3553e184a5b90c564ae [1,1,0,0,0,0|0,0,2]=4 5067 B9R0.45 C=CCOCCCCCC 87e2c78ad35addafbe1ba3af3a2416ee [1,1,0,0,0,0|1,0,0]=3 5068 B9R0.45 C=CCOCCCCOC 128cb8201d6a9addfa90ce2aa3d56855 [1,1,0,0,0,0|2,0,0]=4 5069 B9R0.45 C=CCOCCCCSC d6f879632d2f8647ad8df3191aa8d592 [1,1,0,0,0,0|2,0,0]=4 5070 B9R0.45 C=CCOCCCOCC 07f39b6bf8d420b1e0d79a059a1cabfd [1,1,0,0,0,0|2,0,0]=4 5071 B9R0.45 C=CCOCCCSCC 010127de1abeb4b03bb349c6ddd307c9 [1,1,0,0,0,0|2,0,0]=4 5072 B9R0.45 C=CCOCCNCCC 9694c4d9a9f18cb3ea4ec1572bfb4ddb [1,1,0,0,0,0|2,0,0]=4 5073 B9R0.45 C=CCOCCOCCC efb69812f28efe0f9f62374b7669e490 [1,1,0,0,0,0|2,0,0]=4 5074 B9R0.45 C=CCOCCSCCC 06be4be84f87fa36d14a267f98502073 [1,1,0,0,0,0|2,0,0]=4 5075 B9R0.45 C=COCCCCOCC af306989d4deb93a89f269ce19f884c9 [1,1,0,0,0,0|2,0,0]=4 5076 B9R0.45 C=COCCCNCCC 48f364dfd76ffa0b91930c0b5e61593d [1,1,0,0,0,0|2,0,0]=4 5077 B9R0.45 C=COCCNCCCC a4714520314ca7cd019c104ad0112ac9 [1,1,0,0,0,0|2,0,0]=4 5078 B9R0.45 C=COCCOCCCC c861b9e6afb5156062cdccf5beab2100 [1,1,0,0,0,0|2,0,0]=4 5079 B9R0.45 CC#CCCCOCC=O 663ad91ba809ad42bac7437ef74a39d4 [1,1,0,0,0,0|0,0,2]=4 5080 B9R0.45 CC#CCCOCCC=O adbd8f28d576c2681f49f27738617938 [1,1,0,0,0,0|0,0,2]=4 5081 B9R0.45 CC#CCNCCCC=O bcce9f4979a2e0e65bb7ba52ff1f90f5 [1,1,0,0,0,0|0,0,2]=4 5082 B9R0.45 CC#CCOCCCC=O c6eeb649665bb251aa6aec99d9e318c2 [1,1,0,0,0,0|0,0,2]=4 5083 B9R0.45 CC/C=C/CCOCC=O ad17a670e163a34530891c854a5f696c [1,1,0,0,0,0|0,0,2]=4 5084 B9R0.45 CC/C=C/COCCC=O d6f550e324359bfac415f041e46bdeb8 [1,1,0,0,0,0|0,0,2]=4 5085 B9R0.45 CC/C=C\CCOCC=O 43305c6de6e2aa8f989b2fa311880427 [1,1,0,0,0,0|0,0,2]=4 5086 B9R0.45 CC/C=C\COCCC=O c07660cf26a3506f42ef614da4e3c32d [1,1,0,0,0,0|0,0,2]=4 5087 B9R0.45 CC=CCCCOCC=O a48ec6b46a57870327d7e3aa293527bd [1,1,0,0,0,0|0,0,2]=4 5088 B9R0.45 CC=CCCCOCCC 544004ad9efa2af2fea80f1c7a474136 [1,1,0,0,0,0|1,0,1]=4 5089 B9R0.45 CC=CCNCCCC=O 1a18e01e901881cc24737017710eefb2 [1,1,0,0,0,0|0,0,2]=4 5090 B9R0.45 CC=CCNCCCCC 4ef4adafa1d8c573d6eb296bc442117e [1,1,0,0,0,0|1,0,1]=4 5091 B9R0.45 CC=CCOCCCC=O 069786811dbce850711240f2a30802c2 [1,1,0,0,0,0|0,0,2]=4 5092 B9R0.45 CC=CCOCCCCC 805449d8867d5a337059530a7812a078 [1,1,0,0,0,0|1,0,1]=4 5093 B9R0.45 CCC#CCCOCC=O f3592ea51856d33dfc0b4bb86b6a1514 [1,1,0,0,0,0|0,0,2]=4 5094 B9R0.45 CCC#CCOCCC=O 0baf7b445d32c592c84a854d0b977403 [1,1,0,0,0,0|0,0,2]=4 5095 B9R0.45 CCC/C=C/COCC=O 4b38aa72153068d33113c423eeaba184 [1,1,0,0,0,0|0,0,2]=4 5096 B9R0.45 CCC/C=C\COCC=O bf01e182e8daf457f7933faee15ce932 [1,1,0,0,0,0|0,0,2]=4 5097 B9R0.45 CCCC#CCOCC=O a97331af7fccddc94ac63e85e9270e0b [1,1,0,0,0,0|0,0,2]=4 5098 B9R0.45 CCCCCCCNC#N 248b00270638672a211be30b41165ea4 [1,1,0,0,0,0|1,0,1]=4 5099 B9R0.45 CCCCCCCNC=O 9b073fb330d599f3dde0b2db41b840f2 [1,1,0,0,0,0|0,0,0]=2 5100 B9R0.45 CCCCCCCNCC 31fa4e94f188453162c86e218e83a3fe [1,1,0,0,0,0|1,0,1]=4 5101 B9R0.45 CCCCCCCNCF 39b29e109b290c792595feab642af08e [1,1,0,0,0,0|1,0,1]=4 5102 B9R0.45 CCCCCCCNCO 7598d2cec5f82b679ede94b43530bd89 [1,1,0,0,0,0|0,0,1]=3 5103 B9R0.45 CCCCCCCOCC afc5a86de4d9d2aada96fa893fe06937 [1,1,0,0,0,0|1,0,1]=4 5104 B9R0.45 CCCCCCCOCF 34dddba0abdfe53e071e6123614e32ad [1,1,0,0,0,0|1,0,1]=4 5105 B9R0.45 CCCCCCNCC#N f1982764285efd94f6d8f1be2d766cd1 [1,1,0,0,0,0|1,0,1]=4 5106 B9R0.45 CCCCCCNCC=O 7bf21a30ec03a5d95442fb7cb6f190b9 [1,1,0,0,0,0|0,0,0]=2 5107 B9R0.45 CCCCCCNCCBr 432851e349f9c8ac31da8524f48578e2 [1,1,0,0,0,0|1,0,1]=4 5108 B9R0.45 CCCCCCNCCC e9c4dc74296e69be276b9ef8aee733d2 [1,1,0,0,0,0|1,0,1]=4 5109 B9R0.45 CCCCCCNCCF 9254cc0c3491162ddb811a1ca350686d [1,1,0,0,0,0|1,0,1]=4 5110 B9R0.45 CCCCCCNCCI 211348b41f09447d155ab96e959b3555 [1,1,0,0,0,0|1,0,1]=4 5111 B9R0.45 CCCCCCNCCO 2c640e5cf0d398eb15c3da8e201ff9a9 [1,1,0,0,0,0|0,0,1]=3 5112 B9R0.45 CCCCCCNCCS 295b56fa02564919637f2af1760de842 [1,1,0,0,0,0|0,1,1]=4 5113 B9R0.45 CCCCCCNCOC aba2e41598bd49d27de9d216a6960960 [1,1,0,0,0,0|1,0,1]=4 5114 B9R0.45 CCCCCCNCSC 26b8d5c53ba2ffb7a0ad7aeefcef29cb [1,1,0,0,0,0|2,0,0]=4 5115 B9R0.45 CCCCCCOCC#N 41f322377cad05989d164a4262163638 [1,1,0,0,0,0|1,0,1]=4 5116 B9R0.45 CCCCCCOCC=O bd855bb441849ecb00a1d491cea228b2 [1,1,0,0,0,0|0,0,0]=2 5117 B9R0.45 CCCCCCOCCC e53b5b4f9e861a4f0969c775813c954e [1,1,0,0,0,0|1,0,1]=4 5118 B9R0.45 CCCCCCOCCF 5c07b9abefb4c7383b2510ed2f25aa7d [1,1,0,0,0,0|1,0,1]=4 5119 B9R0.45 CCCCCCOCCS dfca5cb8f17cf53fc21013be4aea075a [1,1,0,0,0,0|0,1,1]=4 5120 B9R0.45 CCCCCCOCOC 6663dbbf181def3e6cf6b976451eb0e9 [1,1,0,0,0,0|1,0,1]=4 5121 B9R0.45 CCCCCCOCSC ea8aeb7aec2e44107948b184f1a2484b [1,1,0,0,0,0|2,0,0]=4 5122 B9R0.45 CCCCCNC/C=C/Cl dd2b4d6593db8690c89984276577f51f [1,1,0,0,0,0|1,0,1]=4 5123 B9R0.45 CCCCCNC/C=C\Cl fb74b9636967ca4beacb07a8f7ddd469 [1,1,0,0,0,0|1,0,1]=4 5124 B9R0.45 CCCCCNC/C=C\O a03bd9f596fd925d470752532a1e67bf [1,1,0,0,0,0|0,0,1]=3 5125 B9R0.45 CCCCCNCCC#N cebb46d01d125ec08ad6d11a0ca21676 [1,1,0,0,0,0|1,0,1]=4 5126 B9R0.45 CCCCCNCCC=O eb975a62ee073d19d198cbf0dd0dbc33 [1,1,0,0,0,0|0,0,0]=2 5127 B9R0.45 CCCCCNCCCC 4b3b475ebd19f4e81120126dc44604b9 [1,1,0,0,0,0|1,0,1]=4 5128 B9R0.45 CCCCCNCCCCl 109aece1b500375b78357a337e9896e4 [1,1,0,0,0,0|1,0,1]=4 5129 B9R0.45 CCCCCNCCCF 5ad689e26c296fbe8637b1c72c8b1ac8 [1,1,0,0,0,0|1,0,1]=4 5130 B9R0.45 CCCCCNCCCO 3cb5b804fc7f29c415be4738c214f571 [1,1,0,0,0,0|0,0,1]=3 5131 B9R0.45 CCCCCNCCCS 7d387ec49be60b8d3336c43db9a47159 [1,1,0,0,0,0|0,1,1]=4 5132 B9R0.45 CCCCCNCCOC 0d0c9f836b1b0f565b919320cde5807e [1,1,0,0,0,0|1,0,1]=4 5133 B9R0.45 CCCCCNCCON 3f6e33ed7c17c07fd46f073b64cb680f [1,1,0,0,0,0|1,0,1]=4 5134 B9R0.45 CCCCCNCCSC 738dc92cc1ee7c68b53e333bc3c1249e [1,1,0,0,0,0|2,0,0]=4 5135 B9R0.45 CCCCCOC/C=C/Cl 902b3675920ce425dd913260445c6a1b [1,1,0,0,0,0|1,0,1]=4 5136 B9R0.45 CCCCCOC/C=C\Cl 3081f394d252ec216de633eb3f90aefe [1,1,0,0,0,0|1,0,1]=4 5137 B9R0.45 CCCCCOCC=CCl 1caf48ce8f7b269d545bfce57c62ccdf [1,1,0,0,0,0|1,0,1]=4 5138 B9R0.45 CCCCCOCCC#N b56a90d4adc45e9e40fb67d86d26f6c5 [1,1,0,0,0,0|1,0,1]=4 5139 B9R0.45 CCCCCOCCC=O ed64f81c6eb909127bbb96fe2d29088b [1,1,0,0,0,0|0,0,0]=2 5140 B9R0.45 CCCCCOCCCC 452d4f5e08ae861a8237c2e4edaffcee [1,1,0,0,0,0|1,0,1]=4 5141 B9R0.45 CCCCCOCCCF fafa7792cbca75bb6104f416c496b552 [1,1,0,0,0,0|1,0,1]=4 5142 B9R0.45 CCCCCOCCCS d7a2eff0ce3ac908cbe201d57fc422a2 [1,1,0,0,0,0|0,1,1]=4 5143 B9R0.45 CCCCCOCCOC 64d0f3f4ad4f7f2b3f2cc5427c5eba08 [1,1,0,0,0,0|1,0,1]=4 5144 B9R0.45 CCCCCOCCSC 35787b22863a0bdd2a717cb23597facb [1,1,0,0,0,0|2,0,0]=4 5145 B9R0.45 CCCCNCCCC#N 68e4f040892091fa5c455116d9aa7e49 [1,1,0,0,0,0|1,0,1]=4 5146 B9R0.45 CCCCNCCCC=O be1900420fface744e26218846840016 [1,1,0,0,0,0|0,0,0]=2 5147 B9R0.45 CCCCNCCCCCl 8e0e9ebf8dfb1495f624013ef828e19e [1,1,0,0,0,0|1,0,1]=4 5148 B9R0.45 CCCCNCCCCF 953d043841cd25eff2ef5c3d0831f1dd [1,1,0,0,0,0|1,0,1]=4 5149 B9R0.45 CCCCNCCCCO 74a60cb017e8f2dcfff3bd80cde22232 [1,1,0,0,0,0|0,0,1]=3 5150 B9R0.45 CCCCNCCCCS 293a84436b4673ea4650c3832cb6a843 [1,1,0,0,0,0|0,1,1]=4 5151 B9R0.45 CCCCNCCCOC 788f960a3da4a154a6d1eb4fd6357034 [1,1,0,0,0,0|1,0,1]=4 5152 B9R0.45 CCCCNCCCSC 1307aea73f697be7347c70961c337c72 [1,1,0,0,0,0|2,0,0]=4 5153 B9R0.45 CCCCOC/C=C/C=O 2da2f2ec693713191f08b0d2f08d4dd9 [1,1,0,0,0,0|0,0,2]=4 5154 B9R0.45 CCCCOCCCC#N 3485bfd63f5f243eafd22661b7976f88 [1,1,0,0,0,0|1,0,1]=4 5155 B9R0.45 CCCCOCCCC=O e3a2ccc9f19eff655a1e3387aa118b3a [1,1,0,0,0,0|0,0,0]=2 5156 B9R0.45 CCCCOCCCCF 42830ea441c5128d22602f571e3205b9 [1,1,0,0,0,0|1,0,1]=4 5157 B9R0.45 CCCCOCCCCS ec359e1317d20b353c1e6ee1fa4be1a0 [1,1,0,0,0,0|0,1,1]=4 5158 B9R0.45 CCCCOCCCOC 94ce11a6d684ef526eb2e193b6598c58 [1,1,0,0,0,0|1,0,1]=4 5159 B9R0.45 CCCCOCCCSC 62b74f8edfba0d3c5255c58121a65cb5 [1,1,0,0,0,0|2,0,0]=4 5160 B9R0.45 CCCCOCCNC=O 4226cf4337dc176d54852a303582fe15 [1,1,0,0,0,0|1,0,0]=3 5161 B9R0.45 CCCCOCCNCO cd975e60385ed19fb54161372698cee4 [1,1,0,0,0,0|1,0,1]=4 5162 B9R0.45 CCCCOCCOC=O 731530ac43d06b0807181f538b37c31d [1,1,0,0,0,0|1,0,0]=3 5163 B9R0.45 CCCCOCNCCO 6bb9eca64afcebb6f28e84a821a2a862 [1,1,0,0,0,0|1,0,1]=4 5164 B9R0.45 CCCNCCCCC#N e58f5053a708c2b2922849441f0ef1c2 [1,1,0,0,0,0|1,0,1]=4 5165 B9R0.45 CCCNCCCCC=O f2022f14c7209eed0862d6ecf6b84706 [1,1,0,0,0,0|0,0,0]=2 5166 B9R0.45 CCCNCCCCCCl 2d5ae8cd51b6a7e591941cb7b0622e55 [1,1,0,0,0,0|1,0,1]=4 5167 B9R0.45 CCCNCCCCCF 7ddf79ca6b37ad2b5e8ddc392231f404 [1,1,0,0,0,0|1,0,1]=4 5168 B9R0.45 CCCNCCCCCO f3d6f4913e5f254c1bf460b36dd70b4c [1,1,0,0,0,0|0,0,1]=3 5169 B9R0.45 CCCNCCCCOC 3a911d7832cca15ffba1db8d75c3525f [1,1,0,0,0,0|1,0,1]=4 5170 B9R0.45 CCCNCCCCON 9849545adc0af6ce550f1dc9bd374ca6 [1,1,0,0,0,0|1,0,1]=4 5171 B9R0.45 CCCNCCCCSC 83af594d195aec376428f00fc6e6852d [1,1,0,0,0,0|2,0,0]=4 5172 B9R0.45 CCCNCCOCC=O 1acace12342365729be0b4a1c8839b77 [1,1,0,0,0,0|1,0,0]=3 5173 B9R0.45 CCCNCCOCCO 26e2580fee42af23b6bec1a5344f6efe [1,1,0,0,0,0|1,0,1]=4 5174 B9R0.45 CCCNCCSCCO 1f86c5fc79a4d95fd86404e323963902 [1,1,0,0,0,0|1,0,1]=4 5175 B9R0.45 CCCOCCCCC#N 609dbdde15359686ba1703d0b40c485a [1,1,0,0,0,0|1,0,1]=4 5176 B9R0.45 CCCOCCCCC=O 8b78d2c4a466c2768be601b9198fb016 [1,1,0,0,0,0|0,0,0]=2 5177 B9R0.45 CCCOCCCCCF b14e93115958730ea8214bff1c89eb77 [1,1,0,0,0,0|1,0,1]=4 5178 B9R0.45 CCCOCCCCOC 3aa974714759e935d3dbeb5a361d1541 [1,1,0,0,0,0|1,0,1]=4 5179 B9R0.45 CCCOCCCCSC 28df677e6e1829a07cbf3784e5a5b453 [1,1,0,0,0,0|2,0,0]=4 5180 B9R0.45 CCCOCCCNC=O 3f83c74e540093398b86151d188b589d [1,1,0,0,0,0|1,0,0]=3 5181 B9R0.45 CCCOCCCNCO f453546a549baebba8d4dda9dd1f2b96 [1,1,0,0,0,0|1,0,1]=4 5182 B9R0.45 CCCOCCNCC=O cdec424df104fd1655eaaf340942285e [1,1,0,0,0,0|1,0,0]=3 5183 B9R0.45 CCCOCCNCCO 2fe038760c01b7075e45b162c476ceb9 [1,1,0,0,0,0|1,0,1]=4 5184 B9R0.45 CCCOCCOCC=O 486de8dd4e53e5f78a86ffc7c128bf3d [1,1,0,0,0,0|1,0,0]=3 5185 B9R0.45 CCCSCCOCC=O e8465b63891a9e011620a8eb43746fcd [1,1,0,0,0,0|1,0,0]=3 5186 B9R0.45 CCNCCCCCC#N 4fc10c41a4ee7406a902ba3cc176c872 [1,1,0,0,0,0|1,0,1]=4 5187 B9R0.45 CCNCCCCCCCl 59b5285c49bc16b0b152df55e767300a [1,1,0,0,0,0|1,0,1]=4 5188 B9R0.45 CCNCCCCCCO 59b1923e7d0b8671db87a813cf6b4ab5 [1,1,0,0,0,0|0,0,1]=3 5189 B9R0.45 CCNCCCCCOC fc15d1f5a98279f7f6e7e0686f586bf9 [1,1,0,0,0,0|1,0,1]=4 5190 B9R0.45 CCNCCCOCCO 6c261c514fd28efb5350d358913fae05 [1,1,0,0,0,0|1,0,1]=4 5191 B9R0.45 CCNCCOCCCO 0587f8b538abe097ec5a15ca1741ae9c [1,1,0,0,0,0|1,0,1]=4 5192 B9R0.45 CCOCCCCCC#N 9f2d6d43772316271944d8067a0ddcf5 [1,1,0,0,0,0|1,0,1]=4 5193 B9R0.45 CCOCCCCCCF 1581be03b145221792da0e70f0dc7ced [1,1,0,0,0,0|1,0,1]=4 5194 B9R0.45 CCOCCCCCCS 890481a3122baa8d804b207afa67ebc3 [1,1,0,0,0,0|0,1,1]=4 5195 B9R0.45 CCOCCCNCC=O 1df50ec465f64bbc25635b22e5db7849 [1,1,0,0,0,0|1,0,0]=3 5196 B9R0.45 CCOCCCNCCO 2b9ad8b94ae5a803722e62535f4291fd [1,1,0,0,0,0|1,0,1]=4 5197 B9R0.45 CCOCCCOCC=O cf6a32481fe179a2dab7e02bde302388 [1,1,0,0,0,0|1,0,0]=3 5198 B9R0.45 CCOCCNC/C=C\O 0aa78a5fbd95032696d68861b712e14e [1,1,0,0,0,0|1,0,1]=4 5199 B9R0.45 CCOCCNCCC=O 1589f5d637413f41c0bad2d8a4cd3b81 [1,1,0,0,0,0|1,0,0]=3 5200 B9R0.45 CCOCCNCCCO f920b2cdd5960150c1761b62d58446b4 [1,1,0,0,0,0|1,0,1]=4 5201 B9R0.45 CCOCCOCCC=O fba0b09a493de7243832a69755d5a406 [1,1,0,0,0,0|1,0,0]=3 5202 B9R0.45 CCOCNCCCCO 8a098d07046f425046fb40aa034ce721 [1,1,0,0,0,0|1,0,1]=4 5203 B9R0.45 CCOCOCCCC=O 8ebce82bd916a55c6d87bc905a09f51f [1,1,0,0,0,0|1,0,0]=3 5204 B9R0.45 CCOCOCCNC=O 1f04069abdc79a13f2b31dcce221deef [1,1,0,0,0,0|2,0,0]=4 5205 B9R0.45 CCOCOCCOC=O 3f9d016c5825b4d3c13708d373f1904b [1,1,0,0,0,0|2,0,0]=4 5206 B9R0.45 CCSCCCCNC=O e3da595d950c9d5eba0c543529449821 [1,1,0,0,0,0|1,0,0]=3 5207 B9R0.45 CCSCCCCNCO b5317d3d243e051b414811fd9803b081 [1,1,0,0,0,0|1,0,1]=4 5208 B9R0.45 CCSCCCNCCO b73a81c9666f167eb7df0d9e4e845db9 [1,1,0,0,0,0|1,0,1]=4 5209 B9R0.45 CCSCCCOCC=O ff794a905fa0fbec7cf974222d58c65f [1,1,0,0,0,0|1,0,0]=3 5210 B9R0.45 CCSCCNC/C=C\O 25741737a09ab9cf25d1e1da49f5fc71 [1,1,0,0,0,0|1,0,1]=4 5211 B9R0.45 CCSCCNCCC=O a73cdd3c5e667bfa86a2f130b2447f60 [1,1,0,0,0,0|1,0,0]=3 5212 B9R0.45 CCSCCNCCCO d094498045f2b61ea374614f3a36e63e [1,1,0,0,0,0|1,0,1]=4 5213 B9R0.45 CCSCCOCCC=O 4abc77696f56ecc9cbf6b43c5ce07dd7 [1,1,0,0,0,0|1,0,0]=3 5214 B9R0.45 COCCCCCNC=O e93060d28d3ca03cb27bbc266d47205c [1,1,0,0,0,0|1,0,0]=3 5215 B9R0.45 COCCCCCNCO bcbefdff7df1910d96b91030fdd66d71 [1,1,0,0,0,0|1,0,1]=4 5216 B9R0.45 COCCCCNCC=O bc0f621bc614bad8c542e04b6f8c00d4 [1,1,0,0,0,0|1,0,0]=3 5217 B9R0.45 COCCCCNCCO c64f84dda1c7e1a3b83c8677baf02563 [1,1,0,0,0,0|1,0,1]=4 5218 B9R0.45 COCCCCOCC=O 5bf6bdc536c03e33ef79afe0bce39d17 [1,1,0,0,0,0|1,0,0]=3 5219 B9R0.45 COCCCNC/C=C\O 7a8902930f1f9f59b8140ba9fba85efe [1,1,0,0,0,0|1,0,1]=4 5220 B9R0.45 COCCCNCCC=O b57190bb20fa468cbc8789f244d6b619 [1,1,0,0,0,0|1,0,0]=3 5221 B9R0.45 COCCCNCCCO 80827af578dfd9221e88944d50b47203 [1,1,0,0,0,0|1,0,1]=4 5222 B9R0.45 COCCCOCCC=O b6a7a464a93f4512a62aaafac7d2c3bf [1,1,0,0,0,0|1,0,0]=3 5223 B9R0.45 COCCNCCCC=O 8de8c440c27ce646b454682cc54ec04c [1,1,0,0,0,0|1,0,0]=3 5224 B9R0.45 COCCNCCCCO 98a0ba2b4e7cfdb77ca7eb5bd158bcce [1,1,0,0,0,0|1,0,1]=4 5225 B9R0.45 COCCOCCCC=O 4eced31e0a91724ea66865665efb8a73 [1,1,0,0,0,0|1,0,0]=3 5226 B9R0.45 COCCOCCNC=O 5e7b5dc6a2bdf3c54f930b381d1b5f5a [1,1,0,0,0,0|2,0,0]=4 5227 B9R0.45 COCCOCCOC=O e4b02c69ad76bfd6e69932198cedf7cf [1,1,0,0,0,0|2,0,0]=4 5228 B9R0.45 COCNCCCCCO 1110af8acba3f65702890e8caffb75f5 [1,1,0,0,0,0|1,0,1]=4 5229 B9R0.45 COCOCCCCC=O 1e9f4f95dc82f1192a72acc421b3ceb4 [1,1,0,0,0,0|1,0,0]=3 5230 B9R0.45 COCOCCOCC=O 56cd8f5e42e3aae0878d43f728c9efb2 [1,1,0,0,0,0|2,0,0]=4 5231 B9R0.45 CSCCCCNCC=O ceb16b1926dbac74a0dccfe6e9c90c38 [1,1,0,0,0,0|1,0,0]=3 5232 B9R0.45 CSCCCCNCCO 71aec6063e81fccb3b9166d912cdd51e [1,1,0,0,0,0|1,0,1]=4 5233 B9R0.45 CSCCCCOCC=O c382918f846eeb37fed2c51c97422532 [1,1,0,0,0,0|1,0,0]=3 5234 B9R0.45 CSCCCNC/C=C\O e7fdc99181aca5fb372020cfd9c7eca5 [1,1,0,0,0,0|1,0,1]=4 5235 B9R0.45 CSCCCNCCC=O d38fed5441cd6c2e041c6d8986238557 [1,1,0,0,0,0|1,0,0]=3 5236 B9R0.45 CSCCCNCCCO 28a7baa82e21352faa8b2b7ae1ad9e7c [1,1,0,0,0,0|1,0,1]=4 5237 B9R0.45 CSCCCOCCC=O 8295bf8657dc69649b9faab665f00482 [1,1,0,0,0,0|1,0,0]=3 5238 B9R0.45 CSCCNCCCC=O 8d7d5642d85386280bfc36051d0df084 [1,1,0,0,0,0|1,0,0]=3 5239 B9R0.45 CSCCNCCCCO 62e46910418c4ce52244f7fbd91c204a [1,1,0,0,0,0|1,0,1]=4 5240 B9R0.45 CSCCOCCCC=O 52e7ca7dbd7d70965091faf706831a8b [1,1,0,0,0,0|1,0,0]=3 5241 B9R0.45 CSCCOCCNC=O 45e773006217e1f2d795f168e07555a6 [1,1,0,0,0,0|2,0,0]=4 5242 B9R0.45 CSCCOCCOC=O 40e891e92003ea888885a83977e0fbb7 [1,1,0,0,0,0|2,0,0]=4 5243 B9R0.45 CSCNCCCCCO 5bb2e7db9b994ef76c056647cef0a208 [1,1,0,0,0,0|1,0,1]=4 5244 B9R0.45 CSCOCCCCC=O e279a2cb99bc97e67b45db8cbfac7c12 [1,1,0,0,0,0|1,0,0]=3 5245 B9R0.45 CSCOCCOCC=O bffa0b86bda7eab4537345618cfe61ad [1,1,0,0,0,0|2,0,0]=4 5246 B9R0.45 N#CCCCCCNC=O a3dece92023954edd0841cbe0f7c23ab [1,1,0,0,0,0|1,0,1]=4 5247 B9R0.45 N#CCCCCNCC=O 5b4e022c5419fd9ebb78c5d132cdbe22 [1,1,0,0,0,0|1,0,1]=4 5248 B9R0.45 N#CCCCCOCC=O a86c5ccc5668a8da4e1062f9b8cd25d8 [1,1,0,0,0,0|1,0,1]=4 5249 B9R0.45 N#CCCCNCCC=O add15463c2f6133e790c57557155adf3 [1,1,0,0,0,0|1,0,1]=4 5250 B9R0.45 N#CCCCOCCC=O 0a6df9c30b4a59527dbedb9f11421c96 [1,1,0,0,0,0|1,0,1]=4 5251 B9R0.45 N#CCCNCCCC=O bc2f87bb4da75e86e42f68ebd8e9391d [1,1,0,0,0,0|1,0,1]=4 5252 B9R0.45 N#CCCOCCCC=O d6a9ec1909ce723f0328c3000aa7c7e2 [1,1,0,0,0,0|1,0,1]=4 5253 B9R0.45 N#CCNCCCCC=O 21463f9e6f65ccef1d23ef141a3d8667 [1,1,0,0,0,0|1,0,1]=4 5254 B9R0.45 N#CCOCCCCC=O cb025efacedea55aeaa23f228f24ab02 [1,1,0,0,0,0|1,0,1]=4 5255 B9R0.45 N#CNCCCCCC=O 5e624ca6b4f41f0539c147be0d44df02 [1,1,0,0,0,0|1,0,1]=4 5256 B9R0.45 NOCCNCCCC=O adc84148913736be6fd155b0da37ca06 [1,1,0,0,0,0|2,0,0]=4 5257 B9R0.45 O/C=C\CNCCCCCl 32d99f4bcc2d097dc5f961a7d77eb85e [1,1,0,0,0,0|1,0,1]=4 5258 B9R0.45 O/C=C\CNCCCCO 3aa0b00108be3944a3394c12f0569f56 [1,1,0,0,0,0|1,0,1]=4 5259 B9R0.45 O/C=C\CNCCCCS e7c825c7fbc5972a6c8f8ade5068f2d0 [1,1,0,0,0,0|1,0,1]=4 5260 B9R0.45 O=CCCCCNCCBr 5abec0ed0917442c8c232cdb425a9841 [1,1,0,0,0,0|1,0,0]=3 5261 B9R0.45 O=CCCCCNCCF eb9f24cce8e482daf38d14d9d549bbb1 [1,1,0,0,0,0|1,0,0]=3 5262 B9R0.45 O=CCCCCNCCI 70b4665906e4318f4c49372e2844c374 [1,1,0,0,0,0|1,0,0]=3 5263 B9R0.45 O=CCCCCNCCO 85ae23fbf5ae9276f3b511278a68fed1 [1,1,0,0,0,0|1,0,0]=3 5264 B9R0.45 O=CCCCCNCCS deffd1d2c176beb2f0f71b26a9711ee2 [1,1,0,0,0,0|1,0,0]=3 5265 B9R0.45 O=CCCCCOCC=O 7ef8386ecbb49019770effbfa4132a27 [1,1,0,0,0,0|1,0,1]=4 5266 B9R0.45 O=CCCCCOCCF 9b2c7b33aa8c8f306ca8eb570fcf7b58 [1,1,0,0,0,0|1,0,0]=3 5267 B9R0.45 O=CCCCCOCCS bc4f0fef628b9966ab9f3b44089a7d10 [1,1,0,0,0,0|1,0,0]=3 5268 B9R0.45 O=CCCCNCCCCl 3dae4dda634271ae27163fd45f5d3163 [1,1,0,0,0,0|1,0,0]=3 5269 B9R0.45 O=CCCCNCCCO 58ef7b77b7be690608fd65ce9c6abe71 [1,1,0,0,0,0|1,0,0]=3 5270 B9R0.45 O=CCCCOCCC=O de1a62baa6fb31c701c46d9e029ef69d [1,1,0,0,0,0|1,0,1]=4 5271 B9R0.45 O=CCCCOCCCF e1070872c292eb7b879ef21318c9c15c [1,1,0,0,0,0|1,0,0]=3 5272 B9R0.45 O=CCCCOCCCS 138cbbec11bd45b1a4d85bf9b5287b7a [1,1,0,0,0,0|1,0,0]=3 5273 B9R0.45 O=CCCNCCCCCl f851f5adb29aefdb303aca6a0afddb51 [1,1,0,0,0,0|1,0,0]=3 5274 B9R0.45 O=CCCNCCCCO e756673586d39ac10639a8b5db39bc11 [1,1,0,0,0,0|1,0,0]=3 5275 B9R0.45 O=CCCNCCCCS a16cbec588d57d2616e56c10fc4cf764 [1,1,0,0,0,0|1,0,0]=3 5276 B9R0.45 O=CCCOCCCCF b28a94840b1fc0f0b86ff0a09810e8f8 [1,1,0,0,0,0|1,0,0]=3 5277 B9R0.45 O=CCCOCCCCS 1e02f2461dcb63ee34b6c10ad7ae6e80 [1,1,0,0,0,0|1,0,0]=3 5278 B9R0.45 O=CCNCCCCCCl a090314f6f7fb6541d79b47c4505cb08 [1,1,0,0,0,0|1,0,0]=3 5279 B9R0.45 O=CCNCCCCCO e20d30c887448f62cb966ff66604b03d [1,1,0,0,0,0|1,0,0]=3 5280 B9R0.45 O=CCNCCOCCO de08778415c857e8542965cf026469b7 [1,1,0,0,0,0|2,0,0]=4 5281 B9R0.45 O=CCNCCOCCS 7851b687cdf6989a2552d5cf39972361 [1,1,0,0,0,0|2,0,0]=4 5282 B9R0.45 O=CCNCCSCCO d264e55e90c1c69869186baf5c4b2562 [1,1,0,0,0,0|2,0,0]=4 5283 B9R0.45 O=CCOCCNCCBr 9819b5c51421182fcdb248da2578a61b [1,1,0,0,0,0|2,0,0]=4 5284 B9R0.45 O=CCOCCNCCF e9530f27022516b2df446fd4acb3c2b4 [1,1,0,0,0,0|2,0,0]=4 5285 B9R0.45 O=CCOCCNCCI 982e6a53b402275ae463ac8e959e2533 [1,1,0,0,0,0|2,0,0]=4 5286 B9R0.45 O=CCOCCNCCO a2db44e87b2fb5f984ed853f6da8166f [1,1,0,0,0,0|2,0,0]=4 5287 B9R0.45 O=CCOCCNCCS 30555c8d14175bdff7d9852359d5da46 [1,1,0,0,0,0|2,0,0]=4 5288 B9R0.45 O=CCOCCOCCF 8034a51f97cd228bd06c22d3c7378cb2 [1,1,0,0,0,0|2,0,0]=4 5289 B9R0.45 O=CCOCCOCCS 78becc0461eb1993db100c499f5982b4 [1,1,0,0,0,0|2,0,0]=4 5290 B9R0.45 O=CNCCCCCCCl a8d8b40eb8e24dc175f39e3613e37fe1 [1,1,0,0,0,0|1,0,0]=3 5291 B9R0.45 O=CNCCCCCCO da506faeac8e24bf810b2dadaf20a2f0 [1,1,0,0,0,0|1,0,0]=3 5292 B9R0.45 O=CNCCCOCCO c13219eb813f52a6a7b71943199239d8 [1,1,0,0,0,0|2,0,0]=4 5293 B9R0.45 O=CNCCOCCCF aecb41e1dec5d5cfb70b44dddd0a16bd [1,1,0,0,0,0|2,0,0]=4 5294 B9R0.45 O=CNCCOCCCO 2927b39b5e49691c6067a00f092b2e7d [1,1,0,0,0,0|2,0,0]=4 5295 B9R0.45 O=CNCCOCCCS 2f83dfa3851bd131879a6c8d5ea708d2 [1,1,0,0,0,0|2,0,0]=4 5296 B9R0.45 O=COCCOCCCF c6307ebf3fb8c4d9a04e9e143e22f0f0 [1,1,0,0,0,0|2,0,0]=4 5297 B9R0.45 O=COCCOCCCS d7818eb647bba146b010bb20a5b86538 [1,1,0,0,0,0|2,0,0]=4 5298 B9R0.45 OCCCCCCNCF 9f8dd59df8b832f35306dcc311b8ba0b [1,1,0,0,0,0|1,0,1]=4 5299 B9R0.45 OCCCCCCNCO b03974d5eaea260ed44c4429a42a8efd [1,1,0,0,0,0|1,0,1]=4 5300 B9R0.45 OCCCCCNCCBr b6fe72a70aa9ee94c38953fc5fa03507 [1,1,0,0,0,0|1,0,1]=4 5301 B9R0.45 OCCCCCNCCF efe70d32a4c6133cd05e8c1bf8301a0a [1,1,0,0,0,0|1,0,1]=4 5302 B9R0.45 OCCCCCNCCI 4b343205ce8465baed90cb0f419c6c4d [1,1,0,0,0,0|1,0,1]=4 5303 B9R0.45 OCCCCCNCCO c6e0d5af126a56a449acd76dabb0d0a6 [1,1,0,0,0,0|1,0,1]=4 5304 B9R0.45 OCCCCCNCCS 81db03003d62237a4ac003bf8b7c1409 [1,1,0,0,0,0|1,0,1]=4 5305 B9R0.45 OCCCCNCCCCl 5d4dd36721e99428cdc35a6893c3e2fe [1,1,0,0,0,0|1,0,1]=4 5306 B9R0.45 OCCCCNCCCF 6f20b166a61175e5d8c115f1b02448f2 [1,1,0,0,0,0|1,0,1]=4 5307 B9R0.45 OCCCCNCCCO 5785bad1b39de5e973646d0653e00598 [1,1,0,0,0,0|1,0,1]=4 5308 B9R0.45 OCCCCNCCCS 15be786d5d00bee1f4424bf326f6da44 [1,1,0,0,0,0|1,0,1]=4 5309 B9R0.45 OCCCNCCCCCl 19919d9b789640b88d6d653b90e1be74 [1,1,0,0,0,0|1,0,1]=4 5310 B9R0.45 OCCCNCCCCF 1b694695d8d20de2554ac05a72c91dce [1,1,0,0,0,0|1,0,1]=4 5311 B9R0.45 OCCCNCCCCS 8e91b12d63d803cd106ce9f5169f8923 [1,1,0,0,0,0|1,0,1]=4 5312 B9R0.45 OCCNCCCCCCl e9f98005127c4b0d506088db3b60ee60 [1,1,0,0,0,0|1,0,1]=4 5313 B9R0.45 OCCNCCCCCF 758b4b8080a41888cab6ab1d11640066 [1,1,0,0,0,0|1,0,1]=4 5314 B9R0.45 OCNCCCCCCCl 6c66f104945205670f9512f61ea483f8 [1,1,0,0,0,0|1,0,1]=4 5315 B9R0.46 C=C(C=O)OCCCCC 73f23f9026875d2248a24c18d18361c4 [1,1,0,0,0,0|1,0,1]=4 5316 B9R0.46 C=C(CC)COCCC=O 296af6eef6b4a65342a27e1ab77a8137 [1,1,0,0,0,0|1,0,1]=4 5317 B9R0.46 C=CC(C)COCCCC 608053865d7cfd6e5d03832e4e889079 [1,1,0,0,0,0|2,0,0]=4 5318 B9R0.46 C=CC(C)NCCCCC e4ef36d1ca81148e5be66a55d1064b7e [1,1,0,0,0,0|2,0,0]=4 5319 B9R0.46 C=CC(C)OCCCCC 1e28f1d3c351070f3d11fb5c824849ee [1,1,0,0,0,0|2,0,0]=4 5320 B9R0.46 C=CC(O)CNCCCC 62bcdd9c10c55126c8e92a97a0820f32 [1,1,0,0,0,0|2,0,0]=4 5321 B9R0.46 C=CCCCCN(C)CC bb712c250fc17a78671543e773bd3068 [1,1,0,0,0,0|2,0,0]=4 5322 B9R0.46 C=CCCCNC(C)CC 42223dd5e5b64b64060777e9f4c40150 [1,1,0,0,0,0|2,0,0]=4 5323 B9R0.46 C=CCCCN[C@@H](C)CC 037d7be40daaf3cc92d2fab932bedffd [1,1,0,0,0,0|2,0,0]=4 5324 B9R0.46 C=CCCCN[C@H](C)CC 70c683919fdfa0aede8ebad77b6f9d53 [1,1,0,0,0,0|2,0,0]=4 5325 B9R0.46 C=CCCCOC(C)CC 37e8ea4b03808467d80b9e9cd385bea1 [1,1,0,0,0,0|2,0,0]=4 5326 B9R0.46 C=CCCCO[C@@H](C)CC abbd602e7f93f4b12023e906c8ad0004 [1,1,0,0,0,0|2,0,0]=4 5327 B9R0.46 C=CCCCO[C@H](C)CC 007e4760c2d7a5023e666e085fdc2f12 [1,1,0,0,0,0|2,0,0]=4 5328 B9R0.46 C=CCCNCC(C)CC 774510d6074bd83d1ab4d24c1d18de64 [1,1,0,0,0,0|2,0,0]=4 5329 B9R0.46 C=CCCNCC(O)CC a8bf7ce1c29a7e91f0f39f3b2bf163a6 [1,1,0,0,0,0|2,0,0]=4 5330 B9R0.46 C=CCCNC[C@@H](C)CC bdbe0fbc3e03bb79c9c72d2fb0f5b833 [1,1,0,0,0,0|2,0,0]=4 5331 B9R0.46 C=CCCNC[C@H](C)CC f60acee3cd0923166034d018db3ac193 [1,1,0,0,0,0|2,0,0]=4 5332 B9R0.46 C=CCCNC[C@H](O)CC a7cbf1ad9da3bae9b3ca12c4c9671d26 [1,1,0,0,0,0|2,0,0]=4 5333 B9R0.46 C=CCCOCC(C)CC 728ba19dbb1d3147b7b292d82ccd3920 [1,1,0,0,0,0|2,0,0]=4 5334 B9R0.46 C=CCCOC[C@@H](C)CC 5e502b4f62f3acf0ba191253c86c3c22 [1,1,0,0,0,0|2,0,0]=4 5335 B9R0.46 C=CCCOC[C@H](C)CC 0fa4e329561f6df162ea8c2a70c22a75 [1,1,0,0,0,0|2,0,0]=4 5336 B9R0.46 C=CCNCCC(C)CC b228c852ce6d3939ccc4101ea5c92dfd [1,1,0,0,0,0|2,0,0]=4 5337 B9R0.46 C=CCOCCC(C)CC 5e8e7402f2d49a682e79b096ff9fa744 [1,1,0,0,0,0|2,0,0]=4 5338 B9R0.46 C=CCOCCC(S)CC 3aaf6c4216be2cdc4f1bfe59ac8192de [1,1,0,0,0,0|2,0,0]=4 5339 B9R0.46 C=CCOCC[C@@H](C)CC b8130feedf60b4d66e54966082720777 [1,1,0,0,0,0|2,0,0]=4 5340 B9R0.46 C=C[C@H](C)OCCCCC d1676930d2cd78672945fe179ff4da42 [1,1,0,0,0,0|2,0,0]=4 5341 B9R0.46 CC(C=O)NCCCCCl 578f8df0cf2c2ec3a9947a8bdfdd4c9a [1,1,0,0,0,0|2,0,0]=4 5342 B9R0.46 CC(C=O)NCCCCO 058005ffd19202b24a3052385e7ba593 [1,1,0,0,0,0|2,0,0]=4 5343 B9R0.46 CC(C=O)NCCCCS 7d52d0d2462682eef85c367a61b7f060 [1,1,0,0,0,0|2,0,0]=4 5344 B9R0.46 CC(C=O)OCCCCF b779475fea9936c9a40116733fadd837 [1,1,0,0,0,0|2,0,0]=4 5345 B9R0.46 CC(C=O)OCCCCS ee511cea976ef5b499265a61524eedbd [1,1,0,0,0,0|2,0,0]=4 5346 B9R0.46 CC(CF)OCCCC=O 62afa987f228ca725705744b4bb44d2e [1,1,0,0,0,0|2,0,0]=4 5347 B9R0.46 CC(CO)CCCNC=O 2da4c407608a3357ec193b0031a8c7cf [1,1,0,0,0,0|2,0,0]=4 5348 B9R0.46 CC(CO)CCNCC=O f81509e853ced68a1db26871973b826a [1,1,0,0,0,0|2,0,0]=4 5349 B9R0.46 CC(CO)CNCCC=O 85b41041e2d8fa633e0ab0a6be7a3fa0 [1,1,0,0,0,0|2,0,0]=4 5350 B9R0.46 CC(CO)NCCCC=O 2ff549803205bf2e5767b6eb5ecad836 [1,1,0,0,0,0|2,0,0]=4 5351 B9R0.46 CC(CS)OCCCC=O 6cc5334f315ad6dccb161036aee6dfb0 [1,1,0,0,0,0|2,0,0]=4 5352 B9R0.46 CCC(=O)COCCC=O caea3de9902aa906e712e11f093daab0 [1,1,0,0,0,0|1,0,1]=4 5353 B9R0.46 CCC(C)CCNCC=O a6e7e31b7174e33afbb2e49091f71799 [1,1,0,0,0,0|1,0,0]=3 5354 B9R0.46 CCC(C)CCNCCO a127043b6f5458f1c87d32ad0b8a32cb [1,1,0,0,0,0|1,0,1]=4 5355 B9R0.46 CCC(C)CCOCC=O ffa804ef82eba2baed5b236b8174cc5b [1,1,0,0,0,0|1,0,0]=3 5356 B9R0.46 CCC(C)CNC/C=C\O 90bd54a66986bb6bce0703b366636de2 [1,1,0,0,0,0|1,0,1]=4 5357 B9R0.46 CCC(C)CNCCC=O d1c23829c335ff019dcbfacafd5d0460 [1,1,0,0,0,0|1,0,0]=3 5358 B9R0.46 CCC(C)CNCCCO b7f672fe5bfa18562ef1c8fe33c0250f [1,1,0,0,0,0|1,0,1]=4 5359 B9R0.46 CCC(C)COCCC=O 2d73e4df98095e84f26e8630b8c1ab90 [1,1,0,0,0,0|1,0,0]=3 5360 B9R0.46 CCC(C)NCCCC=O ed3b198797f9907d63520eb2a7b47340 [1,1,0,0,0,0|1,0,0]=3 5361 B9R0.46 CCC(C)NCCCCO 6bd45ecd51d75108562e5caa61fe948c [1,1,0,0,0,0|1,0,1]=4 5362 B9R0.46 CCC(C)OCCCC=O 490e4bd62c6c0bc054893d7857d462c9 [1,1,0,0,0,0|1,0,0]=3 5363 B9R0.46 CCC(C)OCCNC=O a01a9adcadc461327c7aab245a262d96 [1,1,0,0,0,0|2,0,0]=4 5364 B9R0.46 CCC(C)OCCOC=O 186c75d581c36984caa7089474780127 [1,1,0,0,0,0|2,0,0]=4 5365 B9R0.46 CCC(O)CNC/C=C\O 5486a19119aec4202bff499e11ea5364 [1,1,0,0,0,0|1,0,1]=4 5366 B9R0.46 CCC(O)CNCCC=O cd5859b03f179b813ebaa6940985c168 [1,1,0,0,0,0|1,0,0]=3 5367 B9R0.46 CCC(O)CNCCCO 93bcd9fc899e572447921b7df9cd4341 [1,1,0,0,0,0|1,0,1]=4 5368 B9R0.46 CCC(S)CCOCC=O ec52efc3fa4920f55eb496eb0701f7dc [1,1,0,0,0,0|1,0,0]=3 5369 B9R0.46 CCCCCCN(C)C=O bb80d4044c0f59026002adf38475cf21 [1,1,0,0,0,0|1,0,0]=3 5370 B9R0.46 CCCCCCN(C)CO 8a5f907b8eb3248d8092765efbdfb7c6 [1,1,0,0,0,0|1,0,1]=4 5371 B9R0.46 CCCCCNC(=O)C=O f4e49d97916bc3a259206e9c19346054 [1,1,0,0,0,0|1,0,1]=4 5372 B9R0.46 CCCCCNC(C)C=O a1e76f644541968a2425e9e5ecba0c50 [1,1,0,0,0,0|1,0,0]=3 5373 B9R0.46 CCCCCNC(C)CO 130d859b8c3ec8415f617cafd7916a21 [1,1,0,0,0,0|1,0,1]=4 5374 B9R0.46 CCCCCN[C@@H](C)CO 20ec0daf9e04887c5212a5e8c7959dfd [1,1,0,0,0,0|1,0,1]=4 5375 B9R0.46 CCCCCN[C@H](C)C=O f165fdff1e1cb70bd9666da848ba80ab [1,1,0,0,0,0|1,0,0]=3 5376 B9R0.46 CCCCCN[C@H](C)CO febfc95055d8ed2fb693276cce938384 [1,1,0,0,0,0|1,0,1]=4 5377 B9R0.46 CCCCCOC(C)C=O e16af054a8530937c558322756befd3b [1,1,0,0,0,0|1,0,0]=3 5378 B9R0.46 CCCCCO[C@H](C)C=O a119465539c723056c69d3cef66a5d39 [1,1,0,0,0,0|1,0,0]=3 5379 B9R0.46 CCCCNCC(C)CO 6da21364419b0c7c5b26455490267f1e [1,1,0,0,0,0|1,0,1]=4 5380 B9R0.46 CCCCNCC(F)CO ef01462d286e8a24585409774347d156 [1,1,0,0,0,0|1,0,1]=4 5381 B9R0.46 CCCCNCC(O)CO ac983613601cebc54cf5c91f0789f011 [1,1,0,0,0,0|1,0,1]=4 5382 B9R0.46 CCCCNC[C@@H](C)CO eb284f538845d26c0292210363d3a9ae [1,1,0,0,0,0|1,0,1]=4 5383 B9R0.46 CCCCNC[C@@H](F)CO 08389c84f685c72abadef416a081d169 [1,1,0,0,0,0|1,0,1]=4 5384 B9R0.46 CCCCNC[C@@H](O)CO c855f4138f8af3c3918926fa7f309a61 [1,1,0,0,0,0|1,0,1]=4 5385 B9R0.46 CCCCNC[C@H](C)CO a46d55579d54fa2f3df45167dc865bff [1,1,0,0,0,0|1,0,1]=4 5386 B9R0.46 CCCCNC[C@H](F)CO 8825965ce4d1c5b6f67f1eed1e05bf29 [1,1,0,0,0,0|1,0,1]=4 5387 B9R0.46 CCCCNC[C@H](O)CO 19bfe4bb7f3792b152156a3887152ef5 [1,1,0,0,0,0|1,0,1]=4 5388 B9R0.46 CCCCOCC(O)CO 1717e932150717b75d8ad0553e2508d5 [1,1,0,0,0,0|1,0,1]=4 5389 B9R0.46 CCCCOC[C@@H](O)CO 83f3d645ad47a54afee07c67e38801d8 [1,1,0,0,0,0|1,0,1]=4 5390 B9R0.46 CCCCOC[C@H](O)CO 5961558aa91f8ff37bdd6ab712320a6b [1,1,0,0,0,0|1,0,1]=4 5391 B9R0.46 CCCNCCC(C)CO 118cba905597f4a9d0e6d27edffe4f3f [1,1,0,0,0,0|1,0,1]=4 5392 B9R0.46 CCCNCCC(O)CO 7b15bb4f22a27a1184f0c23b9426da4d [1,1,0,0,0,0|1,0,1]=4 5393 B9R0.46 CCCNCC[C@@H](C)CO 9de671ae77164dcceeedf8d4084dec20 [1,1,0,0,0,0|1,0,1]=4 5394 B9R0.46 CCCOCCN(C)C=O 1992e4eb6f9e42487b54ea3b9d8f7b64 [1,1,0,0,0,0|2,0,0]=4 5395 B9R0.46 CCN(C)CCCCC=O 74bce0e309052ddf19f81d22decddd11 [1,1,0,0,0,0|1,0,0]=3 5396 B9R0.46 CCN(C)CCCCCO cc23bd2adbd47cdaf3363f05e9df12a8 [1,1,0,0,0,0|1,0,1]=4 5397 B9R0.46 CCN(C)CCCNC=O a00a4d07cd80f4382708c0945aa2c234 [1,1,0,0,0,0|2,0,0]=4 5398 B9R0.46 CCN(C)CCOCC=O 82ff7a29890a5c811a75777b8b83be09 [1,1,0,0,0,0|2,0,0]=4 5399 B9R0.46 CCNCCCC(C)CO c290f8dab7c2bada2b0324bd81530e9f [1,1,0,0,0,0|1,0,1]=4 5400 B9R0.46 CCOCCNC(C)C=O ac06f2b178201ef3dd4641d04af68161 [1,1,0,0,0,0|2,0,0]=4 5401 B9R0.46 CCOCCN[C@H](C)C=O f604da704a4a0aac9ac989ce73c1a879 [1,1,0,0,0,0|2,0,0]=4 5402 B9R0.46 CCOCCOC(C)C=O bfd7603acdd2ea90fa45278098ccd23c [1,1,0,0,0,0|2,0,0]=4 5403 B9R0.46 CCOCCO[C@H](C)C=O 94336986a5ea608124cb78550c83363a [1,1,0,0,0,0|2,0,0]=4 5404 B9R0.46 CCSCCNC(C)C=O 6f56a8e5c7dfa0b4daa7bb0d5811fb21 [1,1,0,0,0,0|2,0,0]=4 5405 B9R0.46 CCSCCN[C@H](C)C=O b7bc62394b42e9a1420767b1af956a3b [1,1,0,0,0,0|2,0,0]=4 5406 B9R0.46 CCSCCOC(C)C=O a41a819229db3c7394ce97008565cc09 [1,1,0,0,0,0|2,0,0]=4 5407 B9R0.46 CCSCCO[C@H](C)C=O 25594d2fa741da9eafa868d67605c8e2 [1,1,0,0,0,0|2,0,0]=4 5408 B9R0.46 CC[C@@H](C)CNCCCO 4c3ce44a0c3881eab07a109768c53076 [1,1,0,0,0,0|1,0,1]=4 5409 B9R0.46 CC[C@@H](C)COCCC=O 73ea6284a99d686bca8912bc4d397db8 [1,1,0,0,0,0|1,0,0]=3 5410 B9R0.46 CC[C@@H](C)NCCCC=O e1be8b6d98f789c65613c869a985540c [1,1,0,0,0,0|1,0,0]=3 5411 B9R0.46 CC[C@@H](C)NCCCCO 75ad8c2daeead95458d1a1e8dccddd24 [1,1,0,0,0,0|1,0,1]=4 5412 B9R0.46 CC[C@@H](C)OCCCC=O affc126d70813ac032232a3d21f0923c [1,1,0,0,0,0|1,0,0]=3 5413 B9R0.46 CC[C@@H](O)CNC/C=C\O 69b8df0c26033788f9408bbecd65cb25 [1,1,0,0,0,0|1,0,1]=4 5414 B9R0.46 CC[C@@H](O)CNCCC=O 7c53ec8f7aba46128b14d414a03d6336 [1,1,0,0,0,0|1,0,0]=3 5415 B9R0.46 CC[C@@H](O)CNCCCO 08b86832c312e48f7b7fa53b09edf713 [1,1,0,0,0,0|1,0,1]=4 5416 B9R0.46 CC[C@H](C)CCOCC=O 80dda8846c63ca08a849cc59acf34bed [1,1,0,0,0,0|1,0,0]=3 5417 B9R0.46 CC[C@H](C)CNC/C=C\O 55fce6d0bf68eea0a0fb8506f2d646b0 [1,1,0,0,0,0|1,0,1]=4 5418 B9R0.46 CC[C@H](C)CNCCC=O e358f485d099c641cfa1fcd506941f98 [1,1,0,0,0,0|1,0,0]=3 5419 B9R0.46 CC[C@H](C)CNCCCO bbc2f0a02e4faf0f630ff6066f9a60d3 [1,1,0,0,0,0|1,0,1]=4 5420 B9R0.46 CC[C@H](C)COCCC=O 02998a6cb7d56226c823a7da35ede65f [1,1,0,0,0,0|1,0,0]=3 5421 B9R0.46 CC[C@H](C)NCCCC=O 27877691633ef91afbfdce76ea02c29f [1,1,0,0,0,0|1,0,0]=3 5422 B9R0.46 CC[C@H](C)NCCCCO d56b8ae9eee11ef68d54b6dc3022e7f4 [1,1,0,0,0,0|1,0,1]=4 5423 B9R0.46 CC[C@H](C)OCCCC=O 0bd2ba4d0329602504b9b03e6e85ee4b [1,1,0,0,0,0|1,0,0]=3 5424 B9R0.46 CN(C=O)CCCCCO c53771f4b7aac7f2d7cf4ff756dc1493 [1,1,0,0,0,0|2,0,0]=4 5425 B9R0.46 COC(C)CCOCC=O 0b0c48ce86b0d4306b127755a8a5c6f8 [1,1,0,0,0,0|2,0,0]=4 5426 B9R0.46 COC(C)COCCC=O 1c36be6f84a622a44fb09ef73d1e8b0b [1,1,0,0,0,0|2,0,0]=4 5427 B9R0.46 COCCCCN(C)C=O c4af9136179b3511052f27a49eec2e11 [1,1,0,0,0,0|2,0,0]=4 5428 B9R0.46 COCCCNC(C)C=O d0b57509a08585728203c70aacad460e [1,1,0,0,0,0|2,0,0]=4 5429 B9R0.46 COCCCN[C@H](C)C=O f09d9480a60b0665d83e9a9347e5a5da [1,1,0,0,0,0|2,0,0]=4 5430 B9R0.46 COCCCOC(C)C=O 9a5f6e6c676de8d2d1f397929db56613 [1,1,0,0,0,0|2,0,0]=4 5431 B9R0.46 COCCCO[C@H](C)C=O d25ebb3e6fd7ff8cf98932d3166da8ba [1,1,0,0,0,0|2,0,0]=4 5432 B9R0.46 CO[C@@H](C)CNCCC=O d42d6f1bdf5c47bd7bf630f292bb9b89 [1,1,0,0,0,0|2,0,0]=4 5433 B9R0.46 CO[C@@H](C)COCCC=O 2d8c32f25fa94583e225dee2b9906562 [1,1,0,0,0,0|2,0,0]=4 5434 B9R0.46 CO[C@H](C)CNCCC=O 3bcce37fdb9b08a0f72bbf2efda5f9ee [1,1,0,0,0,0|2,0,0]=4 5435 B9R0.46 CO[C@H](C)COCCC=O db37f78f0a842b040b6f83c3ddcdcebc [1,1,0,0,0,0|2,0,0]=4 5436 B9R0.46 CSCCCNC(C)C=O 76f568b0480b2d9069e3a33a7387861a [1,1,0,0,0,0|2,0,0]=4 5437 B9R0.46 CSCCCN[C@H](C)C=O b9b57ee4edd5974d5a56a770a1225d56 [1,1,0,0,0,0|2,0,0]=4 5438 B9R0.46 CSCCCOC(C)C=O 85ce6f2df0bf4eb3046e0837d7f2a789 [1,1,0,0,0,0|2,0,0]=4 5439 B9R0.46 CSCCCO[C@H](C)C=O ac3078874cb1236d51f37e300aadddf1 [1,1,0,0,0,0|2,0,0]=4 5440 B9R0.46 C[C@@H](CO)CCNCC=O a4e4182d6caae77f60047b228eea3c9e [1,1,0,0,0,0|2,0,0]=4 5441 B9R0.46 C[C@@H](CO)NCCCC=O 32999263e3d3a4c5346151fa32e8decd [1,1,0,0,0,0|2,0,0]=4 5442 B9R0.46 C[C@H](C=O)NCCCCCl e6c8baff8c1d12bdc1a6f40a2a3826b8 [1,1,0,0,0,0|2,0,0]=4 5443 B9R0.46 C[C@H](C=O)NCCCCO eb09c7f19ebf18215ec378c737164712 [1,1,0,0,0,0|2,0,0]=4 5444 B9R0.46 C[C@H](C=O)NCCCCS 87575fcf87743d54375253c008709169 [1,1,0,0,0,0|2,0,0]=4 5445 B9R0.46 C[C@H](C=O)OCCCCF f7bf3d2a1c35392a291f6751000fb4da [1,1,0,0,0,0|2,0,0]=4 5446 B9R0.46 C[C@H](C=O)OCCCCS 5d26a25ff8edfe0f5f9804badd01e01e [1,1,0,0,0,0|2,0,0]=4 5447 B9R0.46 C[C@H](CO)CNCCC=O c835017ff9056078e703d1da50ffe107 [1,1,0,0,0,0|2,0,0]=4 5448 B9R0.46 C[C@H](CO)NCCCC=O a5dd3b34cfb9d476a44ac4ee4e2c185d [1,1,0,0,0,0|2,0,0]=4 5449 B9R0.46 C[C@H](CS)OCCCC=O d09a6f242723d9211fa1abbf74bce5bb [1,1,0,0,0,0|2,0,0]=4 5450 B9R0.46 O=CCCNCC(Br)CBr a0b296f7efe9c67afd38abcbe6d738e4 [1,1,0,0,0,0|2,0,0]=4 5451 B9R0.46 O=CCCNCC(F)CO d1aabf8279290ce397e30542b4489cdf [1,1,0,0,0,0|2,0,0]=4 5452 B9R0.46 O=CCCNCC(O)CO 32628ad2fbf9648173a8a19c1520ad1f [1,1,0,0,0,0|2,0,0]=4 5453 B9R0.46 O=CCCNC[C@@H](F)CO b36c3d96f419c946512bf3f8cbbfe087 [1,1,0,0,0,0|2,0,0]=4 5454 B9R0.46 O=CCCNC[C@@H](O)CO ceed442a8d59a219e9c0942637e24e07 [1,1,0,0,0,0|2,0,0]=4 5455 B9R0.46 O=CCCNC[C@H](F)CO caa1693b032038a7bfd1c580cf7b0b67 [1,1,0,0,0,0|2,0,0]=4 5456 B9R0.46 O=CCCNC[C@H](O)CO 2c369bcd1fa533ee816c2c01f4aaed3f [1,1,0,0,0,0|2,0,0]=4 5457 B9R0.46 O=CCCOCC(Br)CBr e07361fb2e61eb3b6112f6ddbb5cb56d [1,1,0,0,0,0|2,0,0]=4 5458 B9R0.46 O=CCCOCC(Cl)CCl b4781f152e0fa5cd93f6e91bc39c8358 [1,1,0,0,0,0|2,0,0]=4 5459 B9R0.46 O=CCCOCC(O)CO 53480de88d7a20a84ad4df0dba0f3eac [1,1,0,0,0,0|2,0,0]=4 5460 B9R0.46 O=CCCOCC(S)CS 9b6ef62958959ed8017b6a4c0fb69249 [1,1,0,0,0,0|2,0,0]=4 5461 B9R0.46 O=CCCOC[C@@H](O)CO ef2f507bccdd84d0c39d37ba8fd15058 [1,1,0,0,0,0|2,0,0]=4 5462 B9R0.46 O=CCCOC[C@H](O)CO 77cb19d7bfed29451009fb29f3e004e3 [1,1,0,0,0,0|2,0,0]=4 5463 B9R0.46 O=CCNCCC(O)CO 5ce0793796242fd83d17450860a90d67 [1,1,0,0,0,0|2,0,0]=4 5464 B9R0.1 C=C(CC)CNCC(=O)O 3494cd583a0b63f9a90da7dbe9a93496 [1,1,0,0,0,0|1,0,1]=4 5465 B9R0.1 C=C(CC)COCC(=O)O ee3b330f9d46b7ad6bddc2068ae1158b [1,1,0,0,0,0|1,0,1]=4 5466 B9R0.1 CC(CF)OCCC(=O)O e6767e000962bf0da8753ce7298bf1cf [1,1,0,0,0,0|2,0,0]=4 5467 B9R0.1 CC(CO)CNCC(=O)O 545002bd59f1a831ceb97793e95beb08 [1,1,0,0,0,0|2,0,0]=4 5468 B9R0.1 CC(CO)NCCC(=O)O 7af196631507732ccee08e53dff47c19 [1,1,0,0,0,0|2,0,0]=4 5469 B9R0.1 CCC(=O)CNCC(=O)O 7018cc82507b5cf3388be4a1b0a3b91b [1,1,0,0,0,0|1,0,1]=4 5470 B9R0.1 CCC(=O)COCC(=O)O 1a72a234de91ee3fa394daead68a119d [1,1,0,0,0,0|1,0,1]=4 5471 B9R0.1 CCC(C)CCNC(=O)C 2da423144efbc22bf5c1e3503bb1535e [1,1,0,0,0,0|2,0,0]=4 5472 B9R0.1 CCC(C)CNCC(=O)C 38219368305ac283b328948de524c748 [1,1,0,0,0,0|2,0,0]=4 5473 B9R0.1 CCC(C)CNCC(=O)N 16522a2e22028faf802074861520249b [1,1,0,0,0,0|2,0,0]=4 5474 B9R0.1 CCC(C)CNCC(=O)O 87c69323a9e1a04a6ee6d76377703b82 [1,1,0,0,0,0|1,0,0]=3 5475 B9R0.1 CCC(C)COCC(=O)C bd04825963a18a80e53433b8af338adb [1,1,0,0,0,0|2,0,0]=4 5476 B9R0.1 CCC(C)COCC(=O)N 2a0ba5bb8f81333cdbeea70ace57393a [1,1,0,0,0,0|2,0,0]=4 5477 B9R0.1 CCC(C)COCC(=O)O 1a5759c434f27c176d5bad2fa82f04ef [1,1,0,0,0,0|1,0,0]=3 5478 B9R0.1 CCC(C)COCS(=O)O aa2f448e10aac758f905eaea4ded0bb5 [1,1,0,0,0,0|2,0,0]=4 5479 B9R0.1 CCC(C)NCCC(=O)C 553b77e78208b9e578091ff5b7a7dbdb [1,1,0,0,0,0|2,0,0]=4 5480 B9R0.1 CCC(C)NCCC(=O)N 1a4e576a5df92bfad9c34a96c5e494ae [1,1,0,0,0,0|2,0,0]=4 5481 B9R0.1 CCC(C)NCCC(=O)O a58859ee191bb6759b209bcd54bebe4e [1,1,0,0,0,0|1,0,0]=3 5482 B9R0.1 CCC(C)NCCS(=O)O 72c84b7af723b02c5376adf14512bab4 [1,1,0,0,0,0|2,0,0]=4 5483 B9R0.1 CCC(C)OCCC(=O)C 3c4819c84edde006647b7f4661484ff1 [1,1,0,0,0,0|2,0,0]=4 5484 B9R0.1 CCC(C)OCCC(=O)N c80df9816dad84b994c7ec7d952479b6 [1,1,0,0,0,0|2,0,0]=4 5485 B9R0.1 CCC(C)OCCC(=O)O 861df1c98ebd5a3521ba6de3206bc80e [1,1,0,0,0,0|1,0,0]=3 5486 B9R0.1 CCC(O)CNCC(=O)C ede59564767224e151ba36bea1af43f8 [1,1,0,0,0,0|2,0,0]=4 5487 B9R0.1 CCC(O)CNCC(=O)N 0115c55aa91aa51240c8355946838a03 [1,1,0,0,0,0|2,0,0]=4 5488 B9R0.1 CCC(O)CNCC(=O)O 03d5356d375bf79d740c17da46436b7f [1,1,0,0,0,0|1,0,0]=3 5489 B9R0.1 CCN(C)CCCC(=O)C 41478ee9c5261856d551150317f5e6d2 [1,1,0,0,0,0|2,0,0]=4 5490 B9R0.1 CCN(C)CCCC(=O)N 5457b0b5f3c627b5bbae3b3b0443c3e6 [1,1,0,0,0,0|2,0,0]=4 5491 B9R0.1 CCN(C)CCCC(=O)O 95bc41ded99741417784aba721ce87aa [1,1,0,0,0,0|1,0,0]=3 5492 B9R0.1 CC[C@@H](C)CNCC(=O)C 57a59e48f50a2bc35515a82d8a8c3a79 [1,1,0,0,0,0|2,0,0]=4 5493 B9R0.1 CC[C@@H](C)CNCC(=O)N 86fe84e58c34c31bc79a8f984286262c [1,1,0,0,0,0|2,0,0]=4 5494 B9R0.1 CC[C@@H](C)CNCC(=O)O 98f2dd2d2950413d052b4cb7e53dbe2b [1,1,0,0,0,0|1,0,0]=3 5495 B9R0.1 CC[C@@H](C)COCC(=O)C 3ea96dffd188de143cbb785260b39e0c [1,1,0,0,0,0|2,0,0]=4 5496 B9R0.1 CC[C@@H](C)COCC(=O)N 740f240e3f600ed639946b1e0e9b224f [1,1,0,0,0,0|2,0,0]=4 5497 B9R0.1 CC[C@@H](C)COCC(=O)O 8b143e0422b6a9e950b67a2c284bdd65 [1,1,0,0,0,0|1,0,0]=3 5498 B9R0.1 CC[C@@H](C)COCS(=O)O 19b9a9e681b592b4e47910d2bc3144b8 [1,1,0,0,0,0|2,0,0]=4 5499 B9R0.1 CC[C@@H](C)NCCC(=O)C ee2823585fbc4d880fa3f68fe921eb3d [1,1,0,0,0,0|2,0,0]=4 5500 B9R0.1 CC[C@@H](C)NCCC(=O)N b6b2677e5edf0741bd651bdbb3611804 [1,1,0,0,0,0|2,0,0]=4 5501 B9R0.1 CC[C@@H](C)NCCC(=O)O 1e341985822ae038516e7d3d57e3d5f1 [1,1,0,0,0,0|1,0,0]=3 5502 B9R0.1 CC[C@@H](C)OCCC(=O)C 49267d242cdea675a244728a918e9b2e [1,1,0,0,0,0|2,0,0]=4 5503 B9R0.1 CC[C@@H](C)OCCC(=O)N 94e454e36f118d64a2660378253d5f3a [1,1,0,0,0,0|2,0,0]=4 5504 B9R0.1 CC[C@@H](C)OCCC(=O)O 460df0b016032744699dec10515440f9 [1,1,0,0,0,0|1,0,0]=3 5505 B9R0.1 CC[C@@H](O)CNCC(=O)N 8d91f413ccf87ad2db7b150f686cd85b [1,1,0,0,0,0|2,0,0]=4 5506 B9R0.1 CC[C@@H](O)CNCC(=O)O 03733baf1864df61afe14ccbe323ed3e [1,1,0,0,0,0|1,0,0]=3 5507 B9R0.1 CC[C@H](C)CNCC(=O)C f6e69c2b87b1b94a0f2513a65f560c31 [1,1,0,0,0,0|2,0,0]=4 5508 B9R0.1 CC[C@H](C)CNCC(=O)N 1896affdbe0b42f4fa2702bb9fa0f52c [1,1,0,0,0,0|2,0,0]=4 5509 B9R0.1 CC[C@H](C)CNCC(=O)O 3004fae72bd867afedf99bbbfea959f0 [1,1,0,0,0,0|1,0,0]=3 5510 B9R0.1 CC[C@H](C)COCC(=O)C 80eb9e48ec554962e19de8a0a5190a68 [1,1,0,0,0,0|2,0,0]=4 5511 B9R0.1 CC[C@H](C)COCC(=O)N 618c87bafaf60a39a5844b8445445aab [1,1,0,0,0,0|2,0,0]=4 5512 B9R0.1 CC[C@H](C)COCC(=O)O d94c701382e65cef3df369dbbe944763 [1,1,0,0,0,0|1,0,0]=3 5513 B9R0.1 CC[C@H](C)COCS(=O)O 39955f728c40bf5dcc7b4871cd9bc9b3 [1,1,0,0,0,0|2,0,0]=4 5514 B9R0.1 CC[C@H](C)NCCC(=O)C 5a9b435e46c65397c3b77d227f6c8d6d [1,1,0,0,0,0|2,0,0]=4 5515 B9R0.1 CC[C@H](C)NCCC(=O)N 20e8289367182a2a107c4742c2451855 [1,1,0,0,0,0|2,0,0]=4 5516 B9R0.1 CC[C@H](C)NCCC(=O)O 9ce7a4b5931e874b441152425137209a [1,1,0,0,0,0|1,0,0]=3 5517 B9R0.1 CC[C@H](C)OCCC(=O)C 57f743174dad87e641f434790222523a [1,1,0,0,0,0|2,0,0]=4 5518 B9R0.1 CC[C@H](C)OCCC(=O)N 13ca221b762a4b3d6b0303649fde7620 [1,1,0,0,0,0|2,0,0]=4 5519 B9R0.1 CC[C@H](C)OCCC(=O)O 8aec70cd34e530a63d290d1ba3130012 [1,1,0,0,0,0|1,0,0]=3 5520 B9R0.1 CN(CF)CCCC(=O)O ca2d2af989107fbb2003dee075ad73ef [1,1,0,0,0,0|2,0,0]=4 5521 B9R0.1 CN(CO)CCCC(=O)O 15d2d5e0a3745bcbc8af1be8c111eca1 [1,1,0,0,0,0|2,0,0]=4 5522 B9R0.1 COC(C)CNCC(=O)O dbf8e5faee7152132e5d4bb3bd4e4843 [1,1,0,0,0,0|2,0,0]=4 5523 B9R0.1 COC(C)COCC(=O)O 80e727ea49a776af207e2b913ddb7306 [1,1,0,0,0,0|2,0,0]=4 5524 B9R0.1 CO[C@@H](C)CNCC(=O)O 65dd78747dc8a0d82266cff86cc9f8ee [1,1,0,0,0,0|2,0,0]=4 5525 B9R0.1 CO[C@@H](C)COCC(=O)O a1f6e6081969a90d511bdcf1d36c7fb3 [1,1,0,0,0,0|2,0,0]=4 5526 B9R0.1 CO[C@H](C)CNCC(=O)O 84e5827c180a6cfe438de358774cfb15 [1,1,0,0,0,0|2,0,0]=4 5527 B9R0.1 CO[C@H](C)COCC(=O)O 1bc7d85404b0152996a2e6730e1ced0b [1,1,0,0,0,0|2,0,0]=4 5528 B9R0.1 C[C@@H](CO)CNCC(=O)O f57e9d31ced751b25fdd665565e647c4 [1,1,0,0,0,0|2,0,0]=4 5529 B9R0.1 C[C@@H](CO)NCCC(=O)O b5ac644d36a232bdd1950d74e0718263 [1,1,0,0,0,0|2,0,0]=4 5530 B9R0.1 C[C@H](CO)CNCC(=O)O ce3fe074090d41b3d881458baf420cde [1,1,0,0,0,0|2,0,0]=4 5531 B9R0.1 C[C@H](CO)NCCC(=O)O a31ff9e016b023eff4f0af52b348f8ec [1,1,0,0,0,0|2,0,0]=4 5532 B9R0.1 O=C(O)CNCC(Br)CBr ef99ec62c4dafd35d1f7c73687c4dec8 [1,1,0,0,0,0|2,0,0]=4 5533 B9R0.1 O=C(O)CNCC(F)CO 85480065cb6f22ce4951c43a5529025b [1,1,0,0,0,0|2,0,0]=4 5534 B9R0.1 O=C(O)CNCC(O)CF 7fd10536ea2bd1a0c281f0149c46efaf [1,1,0,0,0,0|2,0,0]=4 5535 B9R0.1 O=C(O)CNCC(O)CO 5f4a685d53a0215015208fab45cb0871 [1,1,0,0,0,0|2,0,0]=4 5536 B9R0.1 O=C(O)CNC[C@@H](F)CO b256d92caab1484241eb0944f0d426c8 [1,1,0,0,0,0|2,0,0]=4 5537 B9R0.1 O=C(O)CNC[C@@H](O)CO 2e94e974e33de52da795c25edb2b7b46 [1,1,0,0,0,0|2,0,0]=4 5538 B9R0.1 O=C(O)CNC[C@H](F)CO 88b9d73cd1b06b779c0e456bbf2e093b [1,1,0,0,0,0|2,0,0]=4 5539 B9R0.1 O=C(O)CNC[C@H](O)CO 54e6a925352e55eb05de7ec2030c642a [1,1,0,0,0,0|2,0,0]=4 5540 B9R0.1 O=C(O)COCC(Br)CBr c9888022ccc9e04c0d413c09e25a4398 [1,1,0,0,0,0|2,0,0]=4 5541 B9R0.1 O=C(O)COCC(Cl)CCl 994d616ba6176a710bbd4f21d078567d [1,1,0,0,0,0|2,0,0]=4 5542 B9R0.1 O=C(O)COCC(O)CO 250d3f6a92b33993adc8c4afdc32ab2a [1,1,0,0,0,0|2,0,0]=4 5543 B9R0.1 O=C(O)COCC(S)CS b6b6009a9d63c8f64670de6b0713a6af [1,1,0,0,0,0|2,0,0]=4 5544 B9R0.1 O=C(O)COC[C@@H](O)CO 60e0a11559d7478c0b36eb2f406dfa86 [1,1,0,0,0,0|2,0,0]=4 5545 B9R0.1 O=C(O)COC[C@H](O)CO 846143e05728715a8a55aff47672ac25 [1,1,0,0,0,0|2,0,0]=4 5546 B9R0.4 CC(CC(=O)O)NCCBr e7e4b6e2fc1ea75d46b4b42316397fca [1,1,0,0,0,0|2,0,0]=4 5547 B9R0.4 CC(CC(=O)O)NCCF d1685d2be3fcc9d24c11d15d0d1d1325 [1,1,0,0,0,0|2,0,0]=4 5548 B9R0.4 CC(CC(=O)O)NCCI 94de66baab7b311efb40a9409058838e [1,1,0,0,0,0|2,0,0]=4 5549 B9R0.4 CC(CC(=O)O)NCCO 363ffb708fc7cb9d3ee89320c343223e [1,1,0,0,0,0|2,0,0]=4 5550 B9R0.4 CC(CC(=O)O)NCCS cdbc52c158398597a14b9e2a91a129d1 [1,1,0,0,0,0|2,0,0]=4 5551 B9R0.4 CC(CC(=O)O)OCCF 9f416da46c9c293ab23e60b18d16f471 [1,1,0,0,0,0|2,0,0]=4 5552 B9R0.4 CC(CC(=O)O)OCCS 3dd9e26375cdcf4681c093bf5c86e3fc [1,1,0,0,0,0|2,0,0]=4 5553 B9R0.4 CCCCC(C)NC(=O)C 8c6d1ed0c215b53ce5178d84ca54f179 [1,1,0,0,0,0|2,0,0]=4 5554 B9R0.4 CCCCN(C)CC(=O)N 11a1371995cbb23558bde2849897cd1f [1,1,0,0,0,0|2,0,0]=4 5555 B9R0.4 CCCCN(C)CC(=O)O 2ab0d2e55fe8aec010bf103a963bc69a [1,1,0,0,0,0|1,0,0]=3 5556 B9R0.4 CCCC[C@@H](C)NC(=O)C 438042d33778c53023e503021e96ec24 [1,1,0,0,0,0|2,0,0]=4 5557 B9R0.4 CCCNC(C)CC(=O)O 2d5bf9ae8b9d33e8e5f89637131f543d [1,1,0,0,0,0|1,0,0]=3 5558 B9R0.4 CCCN[C@@H](C)CC(=O)O 7dd12827a70b6d0f3eb1d105dd87e0f1 [1,1,0,0,0,0|1,0,0]=3 5559 B9R0.4 CCCN[C@H](C)CC(=O)O 49558fe427823d5af7fc8494312831dd [1,1,0,0,0,0|1,0,0]=3 5560 B9R0.4 CCCOC(C)CC(=O)N 7cf4be07e7dc937d6ecb8463967854c0 [1,1,0,0,0,0|2,0,0]=4 5561 B9R0.4 CCCOC(C)CC(=O)O 464f5b57c4d27de1c96f770591eff582 [1,1,0,0,0,0|1,0,0]=3 5562 B9R0.4 CCCO[C@@H](C)CC(=O)O 672c62b3f5b285724de30ca7be3b4175 [1,1,0,0,0,0|1,0,0]=3 5563 B9R0.4 CCCO[C@H](C)CC(=O)O 78d34951f815792f2a0561852a75d7ea [1,1,0,0,0,0|1,0,0]=3 5564 B9R0.4 CCNCC(O)CC(=O)O 02bb2a3b8bce33db43c21894720f909a [1,1,0,0,0,0|1,0,0]=3 5565 B9R0.4 CCNC[C@@H](O)CC(=O)O 54b4ddf2085c3305103a3bf1339d420e [1,1,0,0,0,0|1,0,0]=3 5566 B9R0.4 CCNC[C@H](O)CC(=O)O 4584b045ec61df30c14bf052bebdc4b7 [1,1,0,0,0,0|1,0,0]=3 5567 B9R0.4 CCOCN(C)CC(=O)O 4256c877b9befd6c7672b731e0ef19d3 [1,1,0,0,0,0|2,0,0]=4 5568 B9R0.4 CN(CCCF)CC(=O)O daae18585a4edad046d8e7cf5857ea62 [1,1,0,0,0,0|2,0,0]=4 5569 B9R0.4 CN(CCCO)CC(=O)O 92663a30e18fe103a2042493da2adef9 [1,1,0,0,0,0|2,0,0]=4 5570 B9R0.4 CN(CCCS)CC(=O)O e6cefed2a7241559ae7d60ae4a2c5333 [1,1,0,0,0,0|2,0,0]=4 5571 B9R0.4 COCCN(C)CC(=O)O 3ec55bcb2ffdbac5ba2cd2153b901598 [1,1,0,0,0,0|2,0,0]=4 5572 B9R0.4 COCNC(C)CC(=O)O bdd3c4ac12ec667d560eb5ade66eadf9 [1,1,0,0,0,0|2,0,0]=4 5573 B9R0.4 COCN[C@@H](C)CC(=O)O 4b81306ee6db218e1b372a75a0b0c2f0 [1,1,0,0,0,0|2,0,0]=4 5574 B9R0.4 COCN[C@H](C)CC(=O)O 818aa4572c41952106f807fa5cf3ab38 [1,1,0,0,0,0|2,0,0]=4 5575 B9R0.4 COCOC(C)CC(=O)O e4795a30f6180746c828b10734be8c74 [1,1,0,0,0,0|2,0,0]=4 5576 B9R0.4 COCO[C@@H](C)CC(=O)O 49833e6f04b5f2fdf75e458c967a7948 [1,1,0,0,0,0|2,0,0]=4 5577 B9R0.4 COCO[C@H](C)CC(=O)O 765396246824776e46490c64897c4638 [1,1,0,0,0,0|2,0,0]=4 5578 B9R0.4 CSCCN(C)CC(=O)O 0f0cc55bdca109b4ba7871c4d09278eb [1,1,0,0,0,0|2,0,0]=4 5579 B9R0.4 CSCNC(C)CC(=O)O 4241a9c2ff111280db351016191e8370 [1,1,0,0,0,0|2,0,0]=4 5580 B9R0.4 CSCN[C@@H](C)CC(=O)O 726b4fd612fce34bc66b4c1104c65f69 [1,1,0,0,0,0|2,0,0]=4 5581 B9R0.4 CSCN[C@H](C)CC(=O)O 93bb6ece58999a9701d836c8d56af5da [1,1,0,0,0,0|2,0,0]=4 5582 B9R0.4 CSCOC(C)CC(=O)O 8960316d76a52d36cff0632f6a8a6a82 [1,1,0,0,0,0|2,0,0]=4 5583 B9R0.4 CSCO[C@@H](C)CC(=O)O 950648eb7385f49e6308659ead0c2a76 [1,1,0,0,0,0|2,0,0]=4 5584 B9R0.4 CSCO[C@H](C)CC(=O)O e5cb5d5e67dbe01167902ba3b365c14b [1,1,0,0,0,0|2,0,0]=4 5585 B9R0.4 C[C@@H](CC(=O)O)NCCF 618a0c24e5c55843ce8edb4caec723f0 [1,1,0,0,0,0|2,0,0]=4 5586 B9R0.4 C[C@@H](CC(=O)O)NCCO f1302a077d62282b824321ee35a8059e [1,1,0,0,0,0|2,0,0]=4 5587 B9R0.4 C[C@@H](CC(=O)O)NCCS 5d7d40247ddb99f3d68b90786e69ddbb [1,1,0,0,0,0|2,0,0]=4 5588 B9R0.4 C[C@@H](CC(=O)O)OCCF 5c0f2e4119dfa55ab335c16ab0367197 [1,1,0,0,0,0|2,0,0]=4 5589 B9R0.4 C[C@@H](CC(=O)O)OCCS 95108e5655092fc4113468a510808654 [1,1,0,0,0,0|2,0,0]=4 5590 B9R0.4 C[C@H](CC(=O)O)NCCF 20751cb9b29a347f4c1a5217e86a8518 [1,1,0,0,0,0|2,0,0]=4 5591 B9R0.4 C[C@H](CC(=O)O)NCCO 5a022e1cde4048f3a447d9f460edd75d [1,1,0,0,0,0|2,0,0]=4 5592 B9R0.4 C[C@H](CC(=O)O)NCCS 0e4f4fa60a5012cf1fca3e5091c18f41 [1,1,0,0,0,0|2,0,0]=4 5593 B9R0.4 C[C@H](CC(=O)O)OCCF f5b48f7a21ef3e4b18c68d6fc0bb22c6 [1,1,0,0,0,0|2,0,0]=4 5594 B9R0.4 C[C@H](CC(=O)O)OCCS a1e94870d79cddf896a1bd4028514c04 [1,1,0,0,0,0|2,0,0]=4 5595 B9R0.4 O=C(O)CC(O)CNCF 9de17aeb8156f9b30eae4a928d55d408 [1,1,0,0,0,0|2,0,0]=4 5596 B9R0.4 O=C(O)CC(O)CNCO d51ade6d66756563bbc84453fda67d62 [1,1,0,0,0,0|2,0,0]=4 5597 B9R0.4 O=C(O)C[C@@H](O)CNCF e06fd31c8d2997a1f63214946e26a10a [1,1,0,0,0,0|2,0,0]=4 5598 B9R0.4 O=C(O)C[C@@H](O)CNCO aa032d8b3fc8a184994c5d27aeeb5075 [1,1,0,0,0,0|2,0,0]=4 5599 B9R0.4 O=C(O)C[C@H](O)CNCF 8c3349543124a531516a5ca6a55a4ab6 [1,1,0,0,0,0|2,0,0]=4 5600 B9R0.4 O=C(O)C[C@H](O)CNCO 19fadec569eb61b632db1521edc1b9f2 [1,1,0,0,0,0|2,0,0]=4 5601 B9R0.38 CCCCNCS(=O)(=O)O 007c1dfa0321cdc0245df468cea7c92e [1,1,0,0,0,0|2,0,0]=4 5602 B9R0.38 CCCNCCS(=O)(=O)O 125660fb3634ce638a0dd477f18c2998 [1,1,0,0,0,0|2,0,0]=4 5603 B9R0.38 CCCOCCS(=O)(=O)O e43acf3fef2bd06fb3b24a9a2d5ea63f [1,1,0,0,0,0|2,0,0]=4 5604 B9R0.38 CCNCCCS(=O)(=O)O faa55f24fabb8dc0aae5f0daba718695 [1,1,0,0,0,0|2,0,0]=4 5605 B9R0.38 CCOCCCS(=O)(=O)O 71130b7c1cbfcc6b3c1a7c6c681de977 [1,1,0,0,0,0|2,0,0]=4 5606 B9R0.47 C=C(CNCCC)C(=O)O cc82fa0972a2a8db8be4ec490c803358 [1,1,0,0,0,0|1,0,1]=4 5607 B9R0.47 C=C(COCCC)C(=O)O 6349e1fecc0027622ab4063869db7ad1 [1,1,0,0,0,0|1,0,1]=4 5608 B9R0.47 CC(CNCCBr)C(=O)O c7d1487fde4ea4cc6653ff5635f8ed6d [1,1,0,0,0,0|2,0,0]=4 5609 B9R0.47 CC(CNCCF)C(=O)O 4255c25247e223f121134f538e55471f [1,1,0,0,0,0|2,0,0]=4 5610 B9R0.47 CC(CNCCI)C(=O)O 92baf5147337d51bf46031c8dc51d184 [1,1,0,0,0,0|2,0,0]=4 5611 B9R0.47 CC(CNCCO)C(=O)O 1240dbd52a9116186b4b4b867d423d4f [1,1,0,0,0,0|2,0,0]=4 5612 B9R0.47 CC(CNCCS)C(=O)O 8bec92f1ed20dfa81c8b7d9a96584477 [1,1,0,0,0,0|2,0,0]=4 5613 B9R0.47 CC(COCCF)C(=O)O 01ce687756d0dd1ab9f72a0c7b92f276 [1,1,0,0,0,0|2,0,0]=4 5614 B9R0.47 CC(COCCS)C(=O)O 7f379f5afd379c32c0e55dbfb90e0420 [1,1,0,0,0,0|2,0,0]=4 5615 B9R0.47 CC(NCCCCl)C(=O)O 87c1b2f8eb75c9e344e6bd77fe97f7fa [1,1,0,0,0,0|2,0,0]=4 5616 B9R0.47 CC(NCCCF)C(=O)O e8e044f4c6f4318f6c04584f0c35c239 [1,1,0,0,0,0|2,0,0]=4 5617 B9R0.47 CC(NCCCO)C(=O)O 85f38683fe4195dd46b335aca2a1e7a5 [1,1,0,0,0,0|2,0,0]=4 5618 B9R0.47 CC(NCCCS)C(=O)O 754798345f16a24354356fb98070b0ee [1,1,0,0,0,0|2,0,0]=4 5619 B9R0.47 CC(OCCCF)C(=O)O ddfcf78dbb1fe50f64d18343e663a33b [1,1,0,0,0,0|2,0,0]=4 5620 B9R0.47 CCCCCN(C)C(=O)C 2c74dcf8a8d2f2ed76b3ed946ed64f15 [1,1,0,0,0,0|2,0,0]=4 5621 B9R0.47 CCCCNC(C)C(=O)C d47055cc2a147dbd562c227dbc7db49f [1,1,0,0,0,0|2,0,0]=4 5622 B9R0.47 CCCCNC(C)C(=O)N c1d89b7252340bc9da2585b545e036ca [1,1,0,0,0,0|2,0,0]=4 5623 B9R0.47 CCCCNC(C)C(=O)O 5312a5a4ac0d505f773570b1c1dc7471 [1,1,0,0,0,0|1,0,0]=3 5624 B9R0.47 CCCCNC(F)C(=O)N 3ff69ecd1c639241490ed859b671e0fc [1,1,0,0,0,0|2,0,0]=4 5625 B9R0.47 CCCCNC(O)C(=O)O 374139cd4b934cd91b6a9ec96c5a0b99 [1,1,0,0,0,0|1,0,0]=3 5626 B9R0.47 CCCCN[C@@H](C)C(=O)N 6a337a73927e9aeefb9d4f7b78d7ceaa [1,1,0,0,0,0|2,0,0]=4 5627 B9R0.47 CCCCN[C@@H](C)C(=O)O 519d28cb2ff838f7dcf305efd2de1951 [1,1,0,0,0,0|1,0,0]=3 5628 B9R0.47 CCCCN[C@H](C)C(=O)N f7a764574606da7e80ffbc0019505c38 [1,1,0,0,0,0|2,0,0]=4 5629 B9R0.47 CCCCN[C@H](C)C(=O)O cd795f2ef98308f6ebf803867211dca8 [1,1,0,0,0,0|1,0,0]=3 5630 B9R0.47 CCCCOC(C)C(=O)C 3b3363fbf77442cb469e854d17d868a5 [1,1,0,0,0,0|2,0,0]=4 5631 B9R0.47 CCCCOC(C)C(=O)N 93ffcc07fd8ca6c83cba6693932eaa12 [1,1,0,0,0,0|2,0,0]=4 5632 B9R0.47 CCCCOC(C)C(=O)O db49def1ae579c60f3b0671857091689 [1,1,0,0,0,0|1,0,0]=3 5633 B9R0.47 CCCCOC(F)C(=O)N 9f9586d0cf25ed0afb06f8dc8ddcc70c [1,1,0,0,0,0|2,0,0]=4 5634 B9R0.47 CCCCOC(F)C(=O)O 8211b720c423c5874363ee681b819aaa [1,1,0,0,0,0|1,0,0]=3 5635 B9R0.47 CCCCO[C@@H](C)C(=O)N 0aa9ebfb7acab02e489bdc74aacc1a54 [1,1,0,0,0,0|2,0,0]=4 5636 B9R0.47 CCCCO[C@@H](C)C(=O)O cd3f9b9b4a86455f190433fe9f8db5a9 [1,1,0,0,0,0|1,0,0]=3 5637 B9R0.47 CCCCO[C@@H](F)C(=O)O 000616a107be951056a3f838e90d9eca [1,1,0,0,0,0|1,0,0]=3 5638 B9R0.47 CCCCO[C@H](C)C(=O)N 896278da9cdaad47181bea917da86f53 [1,1,0,0,0,0|2,0,0]=4 5639 B9R0.47 CCCCO[C@H](C)C(=O)O e439b368527339689ee28968ccfcc65d [1,1,0,0,0,0|1,0,0]=3 5640 B9R0.47 CCCNCC(=O)C(=O)O 4e1ace0c3acec461be076667f808e14c [1,1,0,0,0,0|1,0,1]=4 5641 B9R0.47 CCCNCC(C)C(=O)O df101b2a4eccba21dd748dca20be9479 [1,1,0,0,0,0|1,0,0]=3 5642 B9R0.47 CCCNCC(F)C(=O)O c424bf5fdad9394b2863cdbd39db5b69 [1,1,0,0,0,0|1,0,0]=3 5643 B9R0.47 CCCNCC(O)C(=O)O 2648cab5ee8c3b07365f1f506b48755c [1,1,0,0,0,0|1,0,0]=3 5644 B9R0.47 CCCNC[C@@H](C)C(=O)O 83ebdb782f465b5108f0a9b96c31c62f [1,1,0,0,0,0|1,0,0]=3 5645 B9R0.47 CCCNC[C@@H](O)C(=O)O 5bb6cbd33c7a84f97677cc53d1e89528 [1,1,0,0,0,0|1,0,0]=3 5646 B9R0.47 CCCNC[C@H](C)C(=O)O b977d522c2650a4380e1fc55b1dfdbae [1,1,0,0,0,0|1,0,0]=3 5647 B9R0.47 CCCNC[C@H](O)C(=O)O 780ad4a9450a1bac8a15804493ca1eef [1,1,0,0,0,0|1,0,0]=3 5648 B9R0.47 CCCOCC(=O)C(=O)O 3444cb5fc32d35bbafaf1d62d3b1c125 [1,1,0,0,0,0|1,0,1]=4 5649 B9R0.47 CCCOCC(C)C(=O)C 0fb5e42fbfa851146ec077857c58aebf [1,1,0,0,0,0|2,0,0]=4 5650 B9R0.47 CCCOCC(C)C(=O)O ff2ba4e0a2c279fc884d0931d786ae76 [1,1,0,0,0,0|1,0,0]=3 5651 B9R0.47 CCCOC[C@@H](C)C(=O)O 4a2415868647637e65ed1231682aaac2 [1,1,0,0,0,0|1,0,0]=3 5652 B9R0.47 CCCOC[C@H](C)C(=O)O 706288de414bed30341fbfa56c954104 [1,1,0,0,0,0|1,0,0]=3 5653 B9R0.47 CCNCCC(F)C(=O)O 3e22a7816eb30765d4c29cc51ffeed2c [1,1,0,0,0,0|1,0,0]=3 5654 B9R0.47 CCNCCC(O)C(=O)O fb8274a5700c97b8157ec9912644b4bf [1,1,0,0,0,0|1,0,0]=3 5655 B9R0.47 CCNCC[C@H](O)C(=O)O a43a204ad767fe5fa54ef33d97357dbf [1,1,0,0,0,0|1,0,0]=3 5656 B9R0.47 CCOCNC(C)C(=O)O dfe10c13f6592b279307d8e83c8991d9 [1,1,0,0,0,0|2,0,0]=4 5657 B9R0.47 CCOCNC(O)C(=O)O 2eaf68b0120e204516043043fab9491a [1,1,0,0,0,0|2,0,0]=4 5658 B9R0.47 CCOCN[C@@H](C)C(=O)O f6fed97e3681e72514abbb327f6e55ff [1,1,0,0,0,0|2,0,0]=4 5659 B9R0.47 CCOCN[C@H](C)C(=O)O 29650a66c22a04835dc99b3cf816f11d [1,1,0,0,0,0|2,0,0]=4 5660 B9R0.47 COCCNC(C)C(=O)O 3dcb727b806eeb48340dd25fe7843a88 [1,1,0,0,0,0|2,0,0]=4 5661 B9R0.47 COCCNC(O)C(=O)O 90dc0fa361e99690ebcea00d62511070 [1,1,0,0,0,0|2,0,0]=4 5662 B9R0.47 COCCN[C@@H](C)C(=O)O afcd1e929322bbedf60e26fdb25456ea [1,1,0,0,0,0|2,0,0]=4 5663 B9R0.47 COCCN[C@H](C)C(=O)O b2206a406198f7737874637527256ac3 [1,1,0,0,0,0|2,0,0]=4 5664 B9R0.47 COCCOC(C)C(=O)O bdf1a254b37216a8d2ed7da014c4517c [1,1,0,0,0,0|2,0,0]=4 5665 B9R0.47 COCCO[C@@H](C)C(=O)O cbbf64fcf81523201b9bad4f65fe6537 [1,1,0,0,0,0|2,0,0]=4 5666 B9R0.47 COCCO[C@H](C)C(=O)O 8c368e06685828adf2f4670b10d06793 [1,1,0,0,0,0|2,0,0]=4 5667 B9R0.47 COCNCC(C)C(=O)O 05462c327fafd80058f6d1e0dfa3108b [1,1,0,0,0,0|2,0,0]=4 5668 B9R0.47 COCNCC(F)C(=O)O 433eb510799659023252bee2e8d31bd7 [1,1,0,0,0,0|2,0,0]=4 5669 B9R0.47 COCNCC(O)C(=O)O decc56ef836464a1b1d19b121be115d1 [1,1,0,0,0,0|2,0,0]=4 5670 B9R0.47 COCNC[C@@H](C)C(=O)O f9dd75e64ded44b26cb7fc01372aa764 [1,1,0,0,0,0|2,0,0]=4 5671 B9R0.47 COCNC[C@@H](O)C(=O)O 59fabaf541e24c1aa9992c1efe450e9c [1,1,0,0,0,0|2,0,0]=4 5672 B9R0.47 COCNC[C@H](C)C(=O)O f14df5e6ad666ce26a46acfb2aeb8f9f [1,1,0,0,0,0|2,0,0]=4 5673 B9R0.47 COCNC[C@H](O)C(=O)O 54c752c4bd35365d5717769acf0c9e27 [1,1,0,0,0,0|2,0,0]=4 5674 B9R0.47 COCOCC(C)C(=O)O 825d844e04641eb0c67ac1b06f1eb637 [1,1,0,0,0,0|2,0,0]=4 5675 B9R0.47 COCOC[C@@H](C)C(=O)O adaa2caa52dd0ef544a35895f18c3c9a [1,1,0,0,0,0|2,0,0]=4 5676 B9R0.47 COCOC[C@H](C)C(=O)O ea4f1e0e5bcf519933f11891eb54bc8e [1,1,0,0,0,0|2,0,0]=4 5677 B9R0.47 CSCCNC(C)C(=O)O 60bf705794e4408180812a2ae158d2d2 [1,1,0,0,0,0|2,0,0]=4 5678 B9R0.47 CSCCNC(O)C(=O)O f10f77c5a3f9d790e93ba445a5bd3946 [1,1,0,0,0,0|2,0,0]=4 5679 B9R0.47 CSCCN[C@@H](C)C(=O)O 01615809f663430a5a6648f5d5b73079 [1,1,0,0,0,0|2,0,0]=4 5680 B9R0.47 CSCCN[C@H](C)C(=O)O aa9133372803438b2121e5a4bcc4b30f [1,1,0,0,0,0|2,0,0]=4 5681 B9R0.47 CSCCOC(C)C(=O)O 7b056b3e548abb94964af17236ce4835 [1,1,0,0,0,0|2,0,0]=4 5682 B9R0.47 CSCCO[C@@H](C)C(=O)O a461cacb6f24ab66f4b4b675fdf36e50 [1,1,0,0,0,0|2,0,0]=4 5683 B9R0.47 CSCCO[C@H](C)C(=O)O 4ef0eee61363938af1f7ba8295e247ad [1,1,0,0,0,0|2,0,0]=4 5684 B9R0.47 CSCNCC(C)C(=O)O 1ff0a35570388c74932f94248d4ac666 [1,1,0,0,0,0|2,0,0]=4 5685 B9R0.47 CSCNCC(F)C(=O)O cb13c5860554711783b8c5c1d4a35d92 [1,1,0,0,0,0|2,0,0]=4 5686 B9R0.47 CSCNCC(O)C(=O)O f60102e935f50b1b60cb2bed2764d7db [1,1,0,0,0,0|2,0,0]=4 5687 B9R0.47 CSCNC[C@@H](C)C(=O)O 52fc234e46b891500028d9b0ed33eb9c [1,1,0,0,0,0|2,0,0]=4 5688 B9R0.47 CSCNC[C@@H](O)C(=O)O e41f4e9a1f8675b7ff106d3a130bbeee [1,1,0,0,0,0|2,0,0]=4 5689 B9R0.47 CSCNC[C@H](C)C(=O)O e48d1d0c8457da10f5ebd04a236eed5a [1,1,0,0,0,0|2,0,0]=4 5690 B9R0.47 CSCNC[C@H](O)C(=O)O b925b952f19a973d8a63427b76b36db3 [1,1,0,0,0,0|2,0,0]=4 5691 B9R0.47 CSCOCC(C)C(=O)O fdc02bbb43502f5c97aa6cc131ca3e7b [1,1,0,0,0,0|2,0,0]=4 5692 B9R0.47 CSCOC[C@@H](C)C(=O)O f78b2b8375299d81220e5cc7d9e3dbfe [1,1,0,0,0,0|2,0,0]=4 5693 B9R0.47 CSCOC[C@H](C)C(=O)O bcff4cb87e281e7aed01590d3e181462 [1,1,0,0,0,0|2,0,0]=4 5694 B9R0.47 C[C@@H](CNCCF)C(=O)O 757260ffee4b9173cbce3c789f17745b [1,1,0,0,0,0|2,0,0]=4 5695 B9R0.47 C[C@@H](CNCCO)C(=O)O aef019050d33774a670561fe56b1e9c9 [1,1,0,0,0,0|2,0,0]=4 5696 B9R0.47 C[C@@H](CNCCS)C(=O)O 45b16f8a63ff0b189fbdfd15250207c3 [1,1,0,0,0,0|2,0,0]=4 5697 B9R0.47 C[C@@H](COCCF)C(=O)O 669c921fce0e06bd678115eebc8c85f7 [1,1,0,0,0,0|2,0,0]=4 5698 B9R0.47 C[C@@H](COCCS)C(=O)O dae5bc031e98558fade7cf9c9693a59f [1,1,0,0,0,0|2,0,0]=4 5699 B9R0.47 C[C@@H](NCCCCl)C(=O)O a6a0f8f4d4b6f3207dad245c45161e73 [1,1,0,0,0,0|2,0,0]=4 5700 B9R0.47 C[C@@H](NCCCF)C(=O)O b39375a1f674e88f2c3f5aa0ee7dc2a6 [1,1,0,0,0,0|2,0,0]=4 5701 B9R0.47 C[C@@H](NCCCO)C(=O)O c8d943c08754c016f5adf50e8e84f40c [1,1,0,0,0,0|2,0,0]=4 5702 B9R0.47 C[C@@H](NCCCS)C(=O)O d084c98d8f8ea928c73e28584055ca5c [1,1,0,0,0,0|2,0,0]=4 5703 B9R0.47 C[C@@H](OCCCF)C(=O)O a8c18e800a5a23d1f1971078ddf7ebda [1,1,0,0,0,0|2,0,0]=4 5704 B9R0.47 C[C@H](CNCCF)C(=O)O 4340086171eb5cd6535ef3a219dc3758 [1,1,0,0,0,0|2,0,0]=4 5705 B9R0.47 C[C@H](CNCCO)C(=O)O 31b14c6f1bcc278cf7469081e7aa9229 [1,1,0,0,0,0|2,0,0]=4 5706 B9R0.47 C[C@H](CNCCS)C(=O)O 63087b39c7edb2644f0780996f2b6fd1 [1,1,0,0,0,0|2,0,0]=4 5707 B9R0.47 C[C@H](COCCF)C(=O)O 01b65224eebbd4f1edd7aef24e90fab9 [1,1,0,0,0,0|2,0,0]=4 5708 B9R0.47 C[C@H](COCCS)C(=O)O 11c95f2941d4973124e2e18e075d4c11 [1,1,0,0,0,0|2,0,0]=4 5709 B9R0.47 C[C@H](NCCCCl)C(=O)O 87153e4a57ba8429a20364e258186ae9 [1,1,0,0,0,0|2,0,0]=4 5710 B9R0.47 C[C@H](NCCCF)C(=O)O 455f51c1bc6306b88a3c27de650423be [1,1,0,0,0,0|2,0,0]=4 5711 B9R0.47 C[C@H](NCCCO)C(=O)O dbe202cded99362dfc45aa71c39b7eb5 [1,1,0,0,0,0|2,0,0]=4 5712 B9R0.47 C[C@H](NCCCS)C(=O)O bd56693ec2b9ed459b50dfc13b1f4492 [1,1,0,0,0,0|2,0,0]=4 5713 B9R0.47 C[C@H](OCCCF)C(=O)O 025d1de81ef19c2829e9c715489ed779 [1,1,0,0,0,0|2,0,0]=4 5714 B9R0.47 O=C(O)C(F)CCNCF 2abb8d1fe88b0111fdbfb97f08985175 [1,1,0,0,0,0|2,0,0]=4 5715 B9R0.47 O=C(O)C(F)CCNCO 1c16d4233a720ae5a11c0b544d4e8538 [1,1,0,0,0,0|2,0,0]=4 5716 B9R0.47 O=C(O)C(F)CNCCF bc27c59f49d09f14551c721c4213d464 [1,1,0,0,0,0|2,0,0]=4 5717 B9R0.47 O=C(O)C(F)CNCCO 597c59dba8debc3a750f38fb05b95366 [1,1,0,0,0,0|2,0,0]=4 5718 B9R0.47 O=C(O)C(F)CNCCS 256baf77c4e810fe87f77ab9eb17e3a1 [1,1,0,0,0,0|2,0,0]=4 5719 B9R0.47 O=C(O)C(O)CCNCF 978e7a242bdd10f5361f85f00f74a696 [1,1,0,0,0,0|2,0,0]=4 5720 B9R0.47 O=C(O)C(O)CCNCO 2ba2720a3da106e551885ac55efe3c3c [1,1,0,0,0,0|2,0,0]=4 5721 B9R0.47 O=C(O)C(O)CNCCF 892296d858aed3a8b2bdced17cb03706 [1,1,0,0,0,0|2,0,0]=4 5722 B9R0.47 O=C(O)C(O)CNCCI 551ce46f1a6c4059d0ddf6cb67a2a002 [1,1,0,0,0,0|2,0,0]=4 5723 B9R0.47 O=C(O)C(O)CNCCO d2bf09f48377f15f821580767e3429b2 [1,1,0,0,0,0|2,0,0]=4 5724 B9R0.47 O=C(O)C(O)CNCCS 7a001e29e68c999b97b9febbdf61354a [1,1,0,0,0,0|2,0,0]=4 5725 B9R0.47 O=C(O)C(O)NCCCF d198fc87f8a140da8525b1f899a1d113 [1,1,0,0,0,0|2,0,0]=4 5726 B9R0.47 O=C(O)C(O)NCCCO 1964c40dd265d0751cbf6e9db2c18a82 [1,1,0,0,0,0|2,0,0]=4 5727 B9R0.47 O=C(O)C(O)NCCCS 280cf89800f0c0fb2f6939e643e90d8e [1,1,0,0,0,0|2,0,0]=4 5728 B9R0.47 O=C(O)[C@@H](O)CCNCF 752ab70d2be40a9c9af5bd04c1064498 [1,1,0,0,0,0|2,0,0]=4 5729 B9R0.47 O=C(O)[C@@H](O)CCNCO 6291bbc1a4f2e1ea1f5c3bc5f4667f5f [1,1,0,0,0,0|2,0,0]=4 5730 B9R0.47 O=C(O)[C@@H](O)CNCCF 1f722cb60445ae222b0c65467451da98 [1,1,0,0,0,0|2,0,0]=4 5731 B9R0.47 O=C(O)[C@@H](O)CNCCI 10f6f5e94768506bcf731ced65012583 [1,1,0,0,0,0|2,0,0]=4 5732 B9R0.47 O=C(O)[C@@H](O)CNCCO cb0c725a39540e509a82a31572e081bf [1,1,0,0,0,0|2,0,0]=4 5733 B9R0.47 O=C(O)[C@@H](O)CNCCS 3c37a51c4462b5737c9d42367d0b82fa [1,1,0,0,0,0|2,0,0]=4 5734 B9R0.47 O=C(O)[C@H](O)CNCCF ffdf19b8b8a4a72db66db50281457bde [1,1,0,0,0,0|2,0,0]=4 5735 B9R0.47 O=C(O)[C@H](O)CNCCO ffc079c1bb43161077e31f96585637b4 [1,1,0,0,0,0|2,0,0]=4 5736 B9R0.47 O=C(O)[C@H](O)CNCCS aac0d2989cac0e7da0faa02ccf107405 [1,1,0,0,0,0|2,0,0]=4 5737 B9R0.48 CC(CCC(=O)O)NCF a92d39df8a126f0852271a9b340958b4 [1,1,0,0,0,0|2,0,0]=4 5738 B9R0.48 CC(CCC(=O)O)OCF 8a850024bcf506861cc56e2f4b203d76 [1,1,0,0,0,0|2,0,0]=4 5739 B9R0.48 CC(CCO)NCC(=O)O facbaef0695b9d4fe56ffc8af771a40f [1,1,0,0,0,0|2,0,0]=4 5740 B9R0.48 CCCC(=S)OCC(=O)O 1c62169da41f2cb2acdc293fd6559f2d [1,1,0,0,0,0|1,0,1]=4 5741 B9R0.48 CCCC(C)NCC(=O)C 6b8217a6e509e4e9ac7eac79852a2211 [1,1,0,0,0,0|2,0,0]=4 5742 B9R0.48 CCCC(C)NCC(=O)N c7599e8ca497fbac7099aebf1f0f8aac [1,1,0,0,0,0|2,0,0]=4 5743 B9R0.48 CCCC(C)NCC(=O)O cc1e9c4996e6fef62cc1269e902e2107 [1,1,0,0,0,0|1,0,0]=3 5744 B9R0.48 CCCC(C)OCC(=O)C 1cb96080ad3b5f1e9dd4a42dcc86b0a0 [1,1,0,0,0,0|2,0,0]=4 5745 B9R0.48 CCCC(C)OCC(=O)N 7e6999709f4494a1ecc876c304501582 [1,1,0,0,0,0|2,0,0]=4 5746 B9R0.48 CCCC(C)OCC(=O)O 841e752dc9ac365809a80143d547b4ea [1,1,0,0,0,0|1,0,0]=3 5747 B9R0.48 CCCC(C)OCS(=O)O 5fd3c2b57cde05de71deaa29073d7460 [1,1,0,0,0,0|2,0,0]=4 5748 B9R0.48 CCCC(O)CNC(=O)C 5b570a4d674c9d38425ae4777e887a42 [1,1,0,0,0,0|2,0,0]=4 5749 B9R0.48 CCCN(C)CCC(=O)C b29483cd50605788c7eef5f63dcb49c2 [1,1,0,0,0,0|2,0,0]=4 5750 B9R0.48 CCCN(C)CCC(=O)N df69e561042543f03748d6be46a7cd9c [1,1,0,0,0,0|2,0,0]=4 5751 B9R0.48 CCCN(C)CCC(=O)O c326725f005578bca676b9f1f6f13638 [1,1,0,0,0,0|1,0,0]=3 5752 B9R0.48 CCC[C@@H](C)OCC(=O)N c33601ccdbc26af4c94de37ccd60dbb7 [1,1,0,0,0,0|2,0,0]=4 5753 B9R0.48 CCC[C@@H](C)OCC(=O)O 51c501112f8d973994eff73221ed5619 [1,1,0,0,0,0|1,0,0]=3 5754 B9R0.48 CCC[C@H](C)NCC(=O)N 2f193e4895d45290d1e4c025c650c03f [1,1,0,0,0,0|2,0,0]=4 5755 B9R0.48 CCC[C@H](C)NCC(=O)O e4aa324610e7a29c03d24a187e7b9bea [1,1,0,0,0,0|1,0,0]=3 5756 B9R0.48 CCC[C@H](C)OCC(=O)N 838feb7f628304bf0a6aa0910dbfc330 [1,1,0,0,0,0|2,0,0]=4 5757 B9R0.48 CCC[C@H](C)OCC(=O)O 21190ebbab7da0abc6514346eed4dcf5 [1,1,0,0,0,0|1,0,0]=3 5758 B9R0.48 CCNC(C)CCC(=O)O 7dbe459581ff5b66cbefd9a1d696ad43 [1,1,0,0,0,0|1,0,0]=3 5759 B9R0.48 CCN[C@@H](C)CCC(=O)O c2d632f7e33174af2c524d9023ca075b [1,1,0,0,0,0|1,0,0]=3 5760 B9R0.48 CCOC(C)CCC(=O)O 31641a6cc61a92f98818e768ef37979d [1,1,0,0,0,0|1,0,0]=3 5761 B9R0.48 CN(CCF)CCC(=O)O 98b30d2a6b798aa5402f2613938994ad [1,1,0,0,0,0|2,0,0]=4 5762 B9R0.48 CN(CCO)CCC(=O)O dff5f325047c0f022e242f8ab09a0166 [1,1,0,0,0,0|2,0,0]=4 5763 B9R0.48 CN(CCS)CCC(=O)O 834e8dabd4decc6fedd4ae2dee1a1dfb [1,1,0,0,0,0|2,0,0]=4 5764 B9R0.48 COCC(C)NCC(=O)O e01666d87959623998976d0fafabe1b4 [1,1,0,0,0,0|2,0,0]=4 5765 B9R0.48 COCC(C)OCC(=O)O af12d17716abae98c4b6439f05d9b8db [1,1,0,0,0,0|2,0,0]=4 5766 B9R0.48 COCN(C)CCC(=O)O 0303bd9b3e27ba66031eea0a93003c39 [1,1,0,0,0,0|2,0,0]=4 5767 B9R0.48 COC[C@@H](C)NCC(=O)O e8166a8a6f9778cdf58111f239ebd7ae [1,1,0,0,0,0|2,0,0]=4 5768 B9R0.48 COC[C@@H](C)OCC(=O)O 98562fabe6feb10b85b2a34b6a556f9c [1,1,0,0,0,0|2,0,0]=4 5769 B9R0.48 COC[C@H](C)NCC(=O)O 6115e49dc0a4f10f9f15c2b7faed79c6 [1,1,0,0,0,0|2,0,0]=4 5770 B9R0.48 COC[C@H](C)OCC(=O)O 3f04353f9edb1d4c983cf07f5d5e3249 [1,1,0,0,0,0|2,0,0]=4 5771 B9R0.48 CSCC(C)OCC(=O)O 55d35686540ec9ccedd07c412d0e4191 [1,1,0,0,0,0|2,0,0]=4 5772 B9R0.48 CSCN(C)CCC(=O)O 014d9e48ffe569c3e580b87ffc15fcd1 [1,1,0,0,0,0|2,0,0]=4 5773 B9R0.48 C[C@@H](CCC(=O)O)NCF b06f766ae4850f0433b3999a4509184a [1,1,0,0,0,0|2,0,0]=4 5774 B9R0.48 C[C@@H](CCO)NCC(=O)O e3de9f2ceaa95fe96caa8265de6dee4c [1,1,0,0,0,0|2,0,0]=4 5775 B9R0.48 C[C@H](CCO)NCC(=O)O a393ad11daa1ce12621ddeee9e978586 [1,1,0,0,0,0|2,0,0]=4 5776 B9R0.55 C=C(C)CCNCC(=O)O 14f79230f366d4f53483d592ca1209f4 [1,1,0,0,0,0|1,0,1]=4 5777 B9R0.55 C=C(C)CCOCC(=O)O d511df34cdc214eb72cb2dd39c037f73 [1,1,0,0,0,0|1,0,1]=4 5778 B9R0.55 C=C(C)CNCCC(=O)O c94702ac8441eb8e035c8c88a218653b [1,1,0,0,0,0|1,0,1]=4 5779 B9R0.55 C=C(C)COCCC(=O)O e23f99666316477d86f1528d4f6e582f [1,1,0,0,0,0|1,0,1]=4 5780 B9R0.55 CC(=O)CCCOC(C)C ca9590f9812dfe3bbd12d00e8d8da35d [1,1,0,0,0,0|2,0,0]=4 5781 B9R0.55 CC(=O)CCNCC(=O)O 40694212f6627e29d6641d6f27eb6cbd [1,1,0,0,0,0|1,0,1]=4 5782 B9R0.55 CC(=O)CCNCC(C)C 4c46adea65c7a7a18afa0eb496cf810e [1,1,0,0,0,0|2,0,0]=4 5783 B9R0.55 CC(=O)CCNCC(C)O 1e4535b6e0ff075e7741b213424a4a2f [1,1,0,0,0,0|2,0,0]=4 5784 B9R0.55 CC(=O)CCNC[C@@H](C)O d673557cdbf1f592c8dda2f56361c517 [1,1,0,0,0,0|2,0,0]=4 5785 B9R0.55 CC(=O)CCNC[C@H](C)O 45bdb4c19b607b23643637f75b4e9707 [1,1,0,0,0,0|2,0,0]=4 5786 B9R0.55 CC(=O)CCOCC(=O)O 9074473ccbed0d52dad15c2ee2e3d18e [1,1,0,0,0,0|1,0,1]=4 5787 B9R0.55 CC(=O)CCOCC(C)C 9ee5575ae874bec3c1972a6d60564d69 [1,1,0,0,0,0|2,0,0]=4 5788 B9R0.55 CC(=O)CCOCC(C)F c746ebaf009979f59ee11e75904265b4 [1,1,0,0,0,0|2,0,0]=4 5789 B9R0.55 CC(=O)CCOCC(C)S 84f9642d3544369c1856724fb718e0a9 [1,1,0,0,0,0|2,0,0]=4 5790 B9R0.55 CC(=O)CCOC[C@@H](C)F c8502d42a16118aee52b1137ce3c8158 [1,1,0,0,0,0|2,0,0]=4 5791 B9R0.55 CC(=O)CCOC[C@H](C)F ce373016b0ed0d862bfa7566abaf2432 [1,1,0,0,0,0|2,0,0]=4 5792 B9R0.55 CC(=O)CNCCC(=O)O f7e1177d8b3728ece360d0f60d2f3d30 [1,1,0,0,0,0|1,0,1]=4 5793 B9R0.55 CC(=O)CNCCC(C)C a808dcd2847c2da2ce54f5f0db358bfb [1,1,0,0,0,0|2,0,0]=4 5794 B9R0.55 CC(=O)CNCCC(C)O bb1baaff82472d97dc1cb89a36c3c257 [1,1,0,0,0,0|2,0,0]=4 5795 B9R0.55 CC(=O)COCCC(=O)O 9181529c791e851b859a70ea035f0690 [1,1,0,0,0,0|1,0,1]=4 5796 B9R0.55 CC(=O)COCCC(C)C 6db7d2dfcb34356d041afbdf4ad10eaf [1,1,0,0,0,0|2,0,0]=4 5797 B9R0.55 CC(=O)NCCCC(C)C fb53002ebde56b3103c957e1e4a39dab [1,1,0,0,0,0|2,0,0]=4 5798 B9R0.55 CC(C)CCNCC(=O)N a0656cb8464b6fd8b1ff4bd15f50cbc4 [1,1,0,0,0,0|2,0,0]=4 5799 B9R0.55 CC(C)CCNCC(=O)O bae9df2f573f745ee71bdebc170a935b [1,1,0,0,0,0|1,0,0]=3 5800 B9R0.55 CC(C)CCOCC(=O)N a6054c15c949445f04569adc9e755ebb [1,1,0,0,0,0|2,0,0]=4 5801 B9R0.55 CC(C)CCOCC(=O)O e88766c3f11bcdb2fdb3cb88ad21cf09 [1,1,0,0,0,0|1,0,0]=3 5802 B9R0.55 CC(C)CCOCS(=O)O 86661055fa920a1b3121c7cd1555f374 [1,1,0,0,0,0|2,0,0]=4 5803 B9R0.55 CC(C)CNCCC(=O)N f954dfdd0d8f70498d61cb3d06960ab2 [1,1,0,0,0,0|2,0,0]=4 5804 B9R0.55 CC(C)CNCCC(=O)O c1d65499ae131aec028ce1008fad9272 [1,1,0,0,0,0|1,0,0]=3 5805 B9R0.55 CC(C)CNCCS(=O)O dfa1fe188cc20667a2b65b212e676b93 [1,1,0,0,0,0|2,0,0]=4 5806 B9R0.55 CC(C)COCCC(=O)N e7a69b8b783cbc96e187123cf43e59f4 [1,1,0,0,0,0|2,0,0]=4 5807 B9R0.55 CC(C)COCCC(=O)O 1a7492ddc84059d0e80957dca0a4ad8a [1,1,0,0,0,0|1,0,0]=3 5808 B9R0.55 CC(C)NCCCC(=O)N 9e4c383ef9d91eb38a1cb9ea76545b30 [1,1,0,0,0,0|2,0,0]=4 5809 B9R0.55 CC(C)NCCCC(=O)O 01eb41f71d44f45aa45fe88cad39755b [1,1,0,0,0,0|1,0,0]=3 5810 B9R0.55 CC(C)OCCCC(=O)N 51a23f79a38cac73ae7b6c43c25b7bcc [1,1,0,0,0,0|2,0,0]=4 5811 B9R0.55 CC(C)OCNCC(=O)O 116e31958898eaa4d243bb8a4f561aab [1,1,0,0,0,0|2,0,0]=4 5812 B9R0.55 CC(C)OCOCC(=O)O 185be0dff94a3b667aca878d046b91c5 [1,1,0,0,0,0|2,0,0]=4 5813 B9R0.55 CC(F)COCCC(=O)N 051b0a8baa8c4dea0155e2e210bb1bb0 [1,1,0,0,0,0|2,0,0]=4 5814 B9R0.55 CC(F)COCCC(=O)O 576299124ecf48074968b3f5485a6420 [1,1,0,0,0,0|1,0,0]=3 5815 B9R0.55 CC(O)CCNCC(=O)N d60e66bceb90389360a4002efcacb8fa [1,1,0,0,0,0|2,0,0]=4 5816 B9R0.55 CC(O)CCNCC(=O)O f5b9d99827273ca6405b63a402359712 [1,1,0,0,0,0|1,0,0]=3 5817 B9R0.55 CC(O)CNCCC(=O)N 9e22e19f884b1ca5fa9ba22b71f71819 [1,1,0,0,0,0|2,0,0]=4 5818 B9R0.55 CC(O)CNCCC(=O)O 5882e34934c12d2feca68ee09fe20110 [1,1,0,0,0,0|1,0,0]=3 5819 B9R0.55 CC(O)CNCCS(=O)O 508e710c16cab6c037e8a01eec63d97e [1,1,0,0,0,0|2,0,0]=4 5820 B9R0.55 CC(S)COCCC(=O)N 9925d76f35cd27119937fa03b6552995 [1,1,0,0,0,0|2,0,0]=4 5821 B9R0.55 CC(S)COCCC(=O)O b635c1384c7caeef54ad902ade79227f [1,1,0,0,0,0|1,0,0]=3 5822 B9R0.55 CN(C)CCNCC(=O)O 634f8ba28991fe4a91743dfcd1ec664b [1,1,0,0,0,0|2,0,0]=4 5823 B9R0.55 CN(C)CCOCC(=O)O 841429c0c14a54a981cd653dba3ce73c [1,1,0,0,0,0|2,0,0]=4 5824 B9R0.55 CN(C)CNCCC(=O)O f2f92c2697e6f0a8922b2579c214314b [1,1,0,0,0,0|2,0,0]=4 5825 B9R0.55 CN(C)COCCC(=O)O 2dce7716534601e6d7ec7d3859ddf712 [1,1,0,0,0,0|2,0,0]=4 5826 B9R0.55 CS(=O)CCNCC(=O)O d14fa2db8bf0bb5b19c1028796e497cd [1,1,0,0,0,0|2,0,0]=4 5827 B9R0.55 CS(=O)CCOCC(=O)O 52722d02a38e3b2fdc3782816d19eb63 [1,1,0,0,0,0|2,0,0]=4 5828 B9R0.55 C[C@@H](F)COCCC(=O)N e8464d6d578a523cad90edd215e8b2e9 [1,1,0,0,0,0|2,0,0]=4 5829 B9R0.55 C[C@@H](F)COCCC(=O)O 34c340ab2328f74479e9fcc514019d74 [1,1,0,0,0,0|1,0,0]=3 5830 B9R0.55 C[C@@H](O)CCNCC(=O)N e3e96ff2d37d9d270a814377a2485d08 [1,1,0,0,0,0|2,0,0]=4 5831 B9R0.55 C[C@@H](O)CCNCC(=O)O 6cb5155f5967c169f19da87fcc6fe141 [1,1,0,0,0,0|1,0,0]=3 5832 B9R0.55 C[C@@H](O)CNCCC(=O)N 1baae5cd66b2e5daebca417d839cf2e7 [1,1,0,0,0,0|2,0,0]=4 5833 B9R0.55 C[C@@H](O)CNCCC(=O)O 89bce0b12fdfcc97280f28e831e10e33 [1,1,0,0,0,0|1,0,0]=3 5834 B9R0.55 C[C@@H](O)CNCCS(=O)O f44d4d0563eb1080e8281f6caa53356f [1,1,0,0,0,0|2,0,0]=4 5835 B9R0.55 C[C@H](F)COCCC(=O)N 8bb5fcd0562b02c1c8d088b599f0ea14 [1,1,0,0,0,0|2,0,0]=4 5836 B9R0.55 C[C@H](F)COCCC(=O)O c8248d4a649741bb9f67d6321d2c0f56 [1,1,0,0,0,0|1,0,0]=3 5837 B9R0.55 C[C@H](O)CCNCC(=O)N 36179dc6c044d28e22b9c0cf92811207 [1,1,0,0,0,0|2,0,0]=4 5838 B9R0.55 C[C@H](O)CCNCC(=O)O ee12b5275e40fded6221f388dcb65b90 [1,1,0,0,0,0|1,0,0]=3 5839 B9R0.55 C[C@H](O)CNCCC(=O)N 424f4efc3eaaa1977a5002054a49e49e [1,1,0,0,0,0|2,0,0]=4 5840 B9R0.55 C[C@H](O)CNCCC(=O)O 1700bfa1d15f33a96885ae735b30c8fc [1,1,0,0,0,0|1,0,0]=3 5841 B9R0.55 C[C@H](O)CNCCS(=O)O bd36c73b17d8b3f3b24b05470356739e [1,1,0,0,0,0|2,0,0]=4 5842 B9R0.55 O=C(O)CCNCC(F)F 83bfb620b6c72f7ea03c8ba8a106a893 [1,1,0,0,0,0|2,0,0]=4 5843 B9R0.55 O=C(O)CCOCC(F)F 6d860de1df08a6938b930a866fb948de [1,1,0,0,0,0|2,0,0]=4 5844 B9R0.55 O=C(O)CNCCC(F)F 36a1eacdaf75399080e933c29ff5f4e8 [1,1,0,0,0,0|2,0,0]=4 5845 B9R0.55 O=C(O)COCCC(F)F e697405c68cd45ae6bdf74d2e05b079c [1,1,0,0,0,0|2,0,0]=4 5846 B11R0.1 CC(CCO)NC(C)CC(=O)O 12b2d0e89a8605a9b017fb40151e8e9c [0,2,0,0,0,0|2,0,0]=4 5847 B11R0.1 CC(CCO)N[C@@H](C)CC(=O)O 78929606634ca7d57895d5a9a331ef18 [0,2,0,0,0,0|2,0,0]=4 5848 B11R0.1 CC(CCO)N[C@H](C)CC(=O)O 01058c49057dc50890f2d734cafadafb [0,2,0,0,0,0|2,0,0]=4 5849 B11R0.1 CCCC(=O)CN(C)CC(=O)O 9dbd6f100f50ecc4f4775ef565ea8935 [0,2,0,0,0,0|1,0,1]=4 5850 B11R0.1 CCCC(=S)OC(C)CC(=O)O 80c157f3122784f77dbc11a9192810cb [0,2,0,0,0,0|1,0,1]=4 5851 B11R0.1 CCCC(C)CN(C)CC(=O)N d0253e014efb93f11d524f80267b28ff [0,2,0,0,0,0|2,0,0]=4 5852 B11R0.1 CCCC(C)CN(C)CC(=O)O 891339aa4551fe994be4f07976b9acb3 [0,2,0,0,0,0|1,0,0]=3 5853 B11R0.1 CCCC(C)NC(C)CC(=O)O a43e4670cbc803fd448c085c94efc009 [0,2,0,0,0,0|1,0,0]=3 5854 B11R0.1 CCCC(C)N[C@@H](C)CC(=O)O 4abb3a499e9a889b0df165740158e2e2 [0,2,0,0,0,0|1,0,0]=3 5855 B11R0.1 CCCC(C)N[C@H](C)CC(=O)O 379d486ec9e93c4af5e968e07d7d3c10 [0,2,0,0,0,0|1,0,0]=3 5856 B11R0.1 CCCC(C)OC(C)CC(=O)N a3b396fa306fc50996c15e1b0563d896 [0,2,0,0,0,0|2,0,0]=4 5857 B11R0.1 CCCN(C)CC(=O)CC(=O)O 25d570270d058e948c5637c430e56df6 [0,2,0,0,0,0|1,0,1]=4 5858 B11R0.1 CCOC(C)CN(C)CC(=O)O 8456bf1553530791298ad05bf5809296 [0,2,0,0,0,0|2,0,0]=4 5859 B11R0.1 CN(CC(=O)O)C[C@@H](O)CCO 87a87456f9f410ce4b222f2a3c5db5a9 [0,2,0,0,0,0|2,0,0]=4 5860 B11R0.1 COCC(C)NC(C)CC(=O)O 38dbc5486ad475bfdcb634d8bd22ba57 [0,2,0,0,0,0|2,0,0]=4 5861 B11R0.1 COCC(C)N[C@@H](C)CC(=O)O deb4e959cef4d7f314cdaea059477a06 [0,2,0,0,0,0|2,0,0]=4 5862 B11R0.1 COCC(C)N[C@H](C)CC(=O)O 3e47c1a5be88c9028bdc7cdf8fadac68 [0,2,0,0,0,0|2,0,0]=4 5863 B11R0.1 COCC(C)OC(C)CC(=O)O 4d1fa105cee2b621b53dbe864a7ef9fb [0,2,0,0,0,0|2,0,0]=4 5864 B11R0.1 COCC(C)O[C@@H](C)CC(=O)O 361e2d9db88747ab6709b9c5968016ba [0,2,0,0,0,0|2,0,0]=4 5865 B11R0.1 COCC(C)O[C@H](C)CC(=O)O 1ad52e2b08a02270622d6d2f653c1a9f [0,2,0,0,0,0|2,0,0]=4 5866 B11R0.1 COCC(O)CN(C)CC(=O)O c63c61e2411982361d4cce27f62d7307 [0,2,0,0,0,0|2,0,0]=4 5867 B11R0.1 COC[C@@H](C)NC(C)CC(=O)O 42ff51f190834a037df42974bd683313 [0,2,0,0,0,0|2,0,0]=4 5868 B11R0.1 COC[C@H](C)NC(C)CC(=O)O 5657bf96b5d89de0b2ed86764b813003 [0,2,0,0,0,0|2,0,0]=4 5869 B11R0.6 C=C(C)CCCN(C)CC(=O)O e75c49b47c8d4420caec90f2541f1760 [0,2,0,0,0,0|1,0,1]=4 5870 B11R0.6 C=C(C)CCNC(C)CC(=O)O b6175fbdac85072c6f44be7e44b36e7c [0,2,0,0,0,0|1,0,1]=4 5871 B11R0.6 C=C(C)CCN[C@@H](C)CC(=O)O 9db50b350acf8878480510cf8e3cc442 [0,2,0,0,0,0|1,0,1]=4 5872 B11R0.6 C=C(C)CCN[C@H](C)CC(=O)O ed82b5e2a586b5cc5842f157fa37a189 [0,2,0,0,0,0|1,0,1]=4 5873 B11R0.6 C=C(C)CN(C)CCCC(=O)O 34a4bb2b49bc932ceb2ce1464cb0d1a1 [0,2,0,0,0,0|1,0,1]=4 5874 B11R0.6 C=C(C)CNCC(O)CC(=O)O ea67254c54bb5475dc8a640b8a445b6b [0,2,0,0,0,0|1,0,1]=4 5875 B11R0.6 C=C(C)CNC[C@@H](O)CC(=O)O 7e9a16bf747c66c49f958e59c342e175 [0,2,0,0,0,0|1,0,1]=4 5876 B11R0.6 C=C(C)CNC[C@H](O)CC(=O)O c10ff8cf00bd20fb911af6a06f22f89a [0,2,0,0,0,0|1,0,1]=4 5877 B11R0.6 CC(=O)CCCN(C)CC(=O)O b24a7b1b58e67810b8f38cfc8ddc1f65 [0,2,0,0,0,0|1,0,1]=4 5878 B11R0.6 CC(=O)CCCN(C)CC(C)C 7ab901f54f5c931ee876070363146c09 [0,2,0,0,0,0|2,0,0]=4 5879 B11R0.6 CC(=O)CCCN(C)CC(C)O 58c1c952ee5f90cba124769a11be30c7 [0,2,0,0,0,0|2,0,0]=4 5880 B11R0.6 CC(=O)CCCN(C)C[C@H](C)O eb3acc6f2bd588571c780588b0db0747 [0,2,0,0,0,0|2,0,0]=4 5881 B11R0.6 CC(=O)CCNC(C)CC(=O)O 45ea83d36268d8400c290305ed88e24d [0,2,0,0,0,0|1,0,1]=4 5882 B11R0.6 CC(=O)CCNC(C)CC(C)C 9eb26a08330c5074ea90e5eee2194373 [0,2,0,0,0,0|2,0,0]=4 5883 B11R0.6 CC(=O)CCNC(C)CC(C)O 7fce6235fc70e94ad73c5c8de9699e1b [0,2,0,0,0,0|2,0,0]=4 5884 B11R0.6 CC(=O)CCN[C@@H](C)CC(=O)O 1e813a037ae1354ad5ba36fbf2d49e1d [0,2,0,0,0,0|1,0,1]=4 5885 B11R0.6 CC(=O)CCN[C@H](C)CC(=O)O 5931748e401b0b5cb89c015949c334cd [0,2,0,0,0,0|1,0,1]=4 5886 B11R0.6 CC(=O)CCOC(C)CC(=O)O 37e716d83b4c62ed4d4a23cb9bd07fa0 [0,2,0,0,0,0|1,0,1]=4 5887 B11R0.6 CC(=O)CCOC(C)CC(C)C 6a36e2e6f1fbcd2c51d34912b6a39fcb [0,2,0,0,0,0|2,0,0]=4 5888 B11R0.6 CC(=O)CCO[C@@H](C)CC(=O)O 6e6de87ee3a171cc35cde5143e19befe [0,2,0,0,0,0|1,0,1]=4 5889 B11R0.6 CC(=O)CCO[C@@H](C)CC(C)C e047d72739a85c6789267462621e1409 [0,2,0,0,0,0|2,0,0]=4 5890 B11R0.6 CC(=O)CCO[C@H](C)CC(=O)O 67249366fa8376327841756cc0566f40 [0,2,0,0,0,0|1,0,1]=4 5891 B11R0.6 CC(=O)CCO[C@H](C)CC(C)C c76de4756a3bccc473991c9022237b31 [0,2,0,0,0,0|2,0,0]=4 5892 B11R0.6 CC(=O)NC(C)CCCC(C)C a1e8b5f53c6c07facbb948ebbde1fe9c [0,2,0,0,0,0|2,0,0]=4 5893 B11R0.6 CC(C)CC(=O)CNCC(=O)O f1f62edfba9a2c03205409b4c1e38892 [0,2,0,0,0,0|1,0,1]=4 5894 B11R0.6 CC(C)CC(=O)COCC(=O)O 2907aefcc348eb101535d185b925667c [0,2,0,0,0,0|1,0,1]=4 5895 B11R0.6 CC(C)CC(C)COCC(=O)N 32cbe87a529fe519dcd06619fc787d24 [0,2,0,0,0,0|2,0,0]=4 5896 B11R0.6 CC(C)CC(C)COCC(=O)O 0a09b4d608c81997d49f213631a89958 [0,2,0,0,0,0|1,0,0]=3 5897 B11R0.6 CC(C)CC(C)NCCC(=O)N 9590c6cf2b14975d45b345f30901bf92 [0,2,0,0,0,0|2,0,0]=4 5898 B11R0.6 CC(C)CC(C)NCCC(=O)O 4e5ccdc0f84035342145820171df90e9 [0,2,0,0,0,0|1,0,0]=3 5899 B11R0.6 CC(C)CC(C)NCCS(=O)O 259a8ff239f957e35bc43cddaaaaedff [0,2,0,0,0,0|2,0,0]=4 5900 B11R0.6 CC(C)CC(C)OCCC(=O)N ce7cb5ac41a1066e49236953faedef6b [0,2,0,0,0,0|2,0,0]=4 5901 B11R0.6 CC(C)CC(C)OCCC(=O)O 3a395c36c85cf0a48c614e61e22c13ac [0,2,0,0,0,0|1,0,0]=3 5902 B11R0.6 CC(C)CC(O)CNCC(=O)N 47c0a433ef6dca98cac9df4f3ae22b12 [0,2,0,0,0,0|2,0,0]=4 5903 B11R0.6 CC(C)CC(O)CNCC(=O)O 06ad81149081c56b63c6fc7e8b66b422 [0,2,0,0,0,0|1,0,0]=3 5904 B11R0.6 CC(C)CCCN(C)CC(=O)N 5917853d346715abb13dbafb91136a6d [0,2,0,0,0,0|2,0,0]=4 5905 B11R0.6 CC(C)CCCN(C)CC(=O)O 581cd1f540f8bc6bebf2b9b03ad373f9 [0,2,0,0,0,0|1,0,0]=3 5906 B11R0.6 CC(C)CCNC(C)CC(=O)O 7bd89cfed6b7eae8093f45dc8310d3c5 [0,2,0,0,0,0|1,0,0]=3 5907 B11R0.6 CC(C)CCN[C@@H](C)CC(=O)O 3900296e0791478440863c5b6cc4487f [0,2,0,0,0,0|1,0,0]=3 5908 B11R0.6 CC(C)CCN[C@H](C)CC(=O)O 410161627a32fa148f61fc6358d644d2 [0,2,0,0,0,0|1,0,0]=3 5909 B11R0.6 CC(C)CCOC(C)CC(=O)N 52a9c867101d9a9a99fe4d6eaca397c8 [0,2,0,0,0,0|2,0,0]=4 5910 B11R0.6 CC(C)CCOC(C)CC(=O)O a88e70ee874d34c33118f49007658e3c [0,2,0,0,0,0|1,0,0]=3 5911 B11R0.6 CC(C)CCO[C@@H](C)CC(=O)O b8eb64908e7c0edb23784f0078906053 [0,2,0,0,0,0|1,0,0]=3 5912 B11R0.6 CC(C)CCO[C@H](C)CC(=O)O 7335bf0cb2d51fce336340ed56eb97a5 [0,2,0,0,0,0|1,0,0]=3 5913 B11R0.6 CC(C)CN(C)CCCC(=O)N 464a3f4ce3cbb0ffc512cdcbafd890f9 [0,2,0,0,0,0|2,0,0]=4 5914 B11R0.6 CC(C)CN(C)CCCC(=O)O 6cea0d4a6f44cb75f67188df404823a4 [0,2,0,0,0,0|1,0,0]=3 5915 B11R0.6 CC(C)CNCC(=O)CC(=O)O cb4916ca40aa876c2a6688408a5c028e [0,2,0,0,0,0|1,0,1]=4 5916 B11R0.6 CC(C)CNCC(O)CC(=O)O 76da47fe4120e9ce274a033bb36c07bb [0,2,0,0,0,0|1,0,0]=3 5917 B11R0.6 CC(C)CNC[C@@H](O)CC(=O)O d1c4a030a95ab8bfda18d353494b286f [0,2,0,0,0,0|1,0,0]=3 5918 B11R0.6 CC(C)CNC[C@H](O)CC(=O)O eb894d8174843a29f8d58864ee94d749 [0,2,0,0,0,0|1,0,0]=3 5919 B11R0.6 CC(C)COCC(=O)CC(=O)O 373816fbc8c91ba4f8619a21d85d301c [0,2,0,0,0,0|1,0,1]=4 5920 B11R0.6 CC(C)C[C@@H](C)OCCC(=O)N f46f5ea20e09d62b66a55386eea90b99 [0,2,0,0,0,0|2,0,0]=4 5921 B11R0.6 CC(C)C[C@@H](C)OCCC(=O)O da1a346fef35b51ff2063cfd073e28c3 [0,2,0,0,0,0|1,0,0]=3 5922 B11R0.6 CC(C)C[C@H](C)OCCC(=O)N 44d5d3b0f013f87cd12e0204e4e1e663 [0,2,0,0,0,0|2,0,0]=4 5923 B11R0.6 CC(C)C[C@H](C)OCCC(=O)O bef5de94d82013acbcf258cca548e315 [0,2,0,0,0,0|1,0,0]=3 5924 B11R0.6 CC(C)OCCN(C)CC(=O)O e63c210f2ef00c958ebba1fefb3418cf [0,2,0,0,0,0|2,0,0]=4 5925 B11R0.6 CC(C)OCN[C@@H](C)CC(=O)O 07f0319c116145101c83210b27f8fa7c [0,2,0,0,0,0|2,0,0]=4 5926 B11R0.6 CC(C)OCN[C@H](C)CC(=O)O c05e172822cebefd71d94a7b1706fe8c [0,2,0,0,0,0|2,0,0]=4 5927 B11R0.6 CC(C)OCOC(C)CC(=O)O cf2c9efdff6aa737fa9d7a171089094e [0,2,0,0,0,0|2,0,0]=4 5928 B11R0.6 CC(C)OCO[C@@H](C)CC(=O)O cc14ad5a9271737a0a5a9c6fe7a1709f [0,2,0,0,0,0|2,0,0]=4 5929 B11R0.6 CC(C)OCO[C@H](C)CC(=O)O 009a1ce5d4093c80a8dba5548cf24ca2 [0,2,0,0,0,0|2,0,0]=4 5930 B11R0.6 CC(C)SCCN(C)CC(=O)O 67015682f6856ba16c8a886cd5956654 [0,2,0,0,0,0|2,0,0]=4 5931 B11R0.6 CC(CC(=O)O)NCCC(F)F 77550a3f25ae2360b37149670d4a0fdc [0,2,0,0,0,0|2,0,0]=4 5932 B11R0.6 CC(CC(=O)O)NCCN(C)C 2eb3818b1aa4605f2c202406e171e2b2 [0,2,0,0,0,0|2,0,0]=4 5933 B11R0.6 CC(CC(=O)O)NCCS(=O)C 0510462cfb13a98398a87025dc262ffe [0,2,0,0,0,0|2,0,0]=4 5934 B11R0.6 CC(CC(=O)O)NCC[C@@H](C)O f34f979f4da659a4cb126c3ffd689cd6 [0,2,0,0,0,0|1,0,0]=3 5935 B11R0.6 CC(CC(=O)O)NCC[C@H](C)O 38a5e72663c0e6f705cca0ec9766346a [0,2,0,0,0,0|1,0,0]=3 5936 B11R0.6 CC(CC(=O)O)NCOC(C)C 33c6e9ee7340bea1b07bd63e642326a6 [0,2,0,0,0,0|2,0,0]=4 5937 B11R0.6 CC(CC(=O)O)OCCC(F)F 57b997b6520716ea9aead7e85d8d2ab7 [0,2,0,0,0,0|2,0,0]=4 5938 B11R0.6 CC(CC(=O)O)OCCS(=O)C e2054e8ed63825503f898af48f431d02 [0,2,0,0,0,0|2,0,0]=4 5939 B11R0.6 CC(CCOC(C)C)CC(=O)O 8cfa999a97729aeebcbdea93bfca8c97 [0,2,0,0,0,0|1,0,0]=3 5940 B11R0.6 CC(CN(C)C)NCCC(=O)O 923181fdb9613b53975e4336d17a70b1 [0,2,0,0,0,0|2,0,0]=4 5941 B11R0.6 CC(CN(C)C)OCCC(=O)O 473ad7ab74a3424664b957a077b4901d [0,2,0,0,0,0|2,0,0]=4 5942 B11R0.6 CC(CNCC(=O)O)CN(C)C 3a4eef0d2f4a18b6a3682badc9d7b083 [0,2,0,0,0,0|2,0,0]=4 5943 B11R0.6 CC(COCC(=O)O)CN(C)C b5ead29877965f5e0991dd05f675f537 [0,2,0,0,0,0|2,0,0]=4 5944 B11R0.6 CC(F)COCC(=O)CC(=O)O 41b381dd158e6040ba9cc916a8b434fd [0,2,0,0,0,0|1,0,1]=4 5945 B11R0.6 CC(O)CC(C)NCCC(=O)N 9f795d0615c5e2ec93776d4b6cdc2ba9 [0,2,0,0,0,0|2,0,0]=4 5946 B11R0.6 CC(O)CC(C)NCCC(=O)O ec0115be52faee21986695652eb72f02 [0,2,0,0,0,0|1,0,0]=3 5947 B11R0.6 CC(O)CCCN(C)CC(=O)N 82e29edc45cb287cddc10fc381f5dbed [0,2,0,0,0,0|2,0,0]=4 5948 B11R0.6 CC(O)CCCN(C)CC(=O)O 58a53839c9aa55ae691f3c9d7eefd233 [0,2,0,0,0,0|1,0,0]=3 5949 B11R0.6 CC(O)CCNC(C)CC(=O)O 76140eaf0db112fafe71c4f52cb32e5a [0,2,0,0,0,0|1,0,0]=3 5950 B11R0.6 CC(O)CCN[C@@H](C)CC(=O)O fcfd3c4904229a981c9ee80f2dd16963 [0,2,0,0,0,0|1,0,0]=3 5951 B11R0.6 CC(O)CCN[C@H](C)CC(=O)O 87ed9944812462d826d407f95b0f280b [0,2,0,0,0,0|1,0,0]=3 5952 B11R0.6 CC(O)CN(C)CCCC(=O)N 485d49fc1930274baddc7095f11a6188 [0,2,0,0,0,0|2,0,0]=4 5953 B11R0.6 CC(O)CN(C)CCCC(=O)O c048f28324c51887d0bbf959b6e9c90e [0,2,0,0,0,0|1,0,0]=3 5954 B11R0.6 CC(O)CNCC(=O)CC(=O)O b2b3e27f60eef31e83fa7593867bf337 [0,2,0,0,0,0|1,0,1]=4 5955 B11R0.6 CC(O)CNCC(O)CC(=O)O 81165c6bf10209cbbb6bae1a43550979 [0,2,0,0,0,0|1,0,0]=3 5956 B11R0.6 CC(O)CNC[C@@H](O)CC(=O)O 2b747264f9aad332e150469f8a97c67e [0,2,0,0,0,0|1,0,0]=3 5957 B11R0.6 CC(O)CNC[C@H](O)CC(=O)O 28a480b3fe64ae5d13fe26fb64098ab7 [0,2,0,0,0,0|1,0,0]=3 5958 B11R0.6 CC(S)COCC(=O)CC(=O)O 177ed2013af9af1799fa012d6e469296 [0,2,0,0,0,0|1,0,1]=4 5959 B11R0.6 CN(C)CC(O)CNCC(=O)O 8ec921130efb46dcd9beea747cbf6716 [0,2,0,0,0,0|2,0,0]=4 5960 B11R0.6 CN(C)CCCN(C)CC(=O)O 6987e85f5802f3ccede502bb358eb758 [0,2,0,0,0,0|2,0,0]=4 5961 B11R0.6 CN(C)CN(C)CCCC(=O)O a4f485f5b88c6b228852042d78d0a0f3 [0,2,0,0,0,0|2,0,0]=4 5962 B11R0.6 CN(C)CNCC(O)CC(=O)O 7a3d8c64fbe326e2bfc9b1e0ff62fd57 [0,2,0,0,0,0|2,0,0]=4 5963 B11R0.6 CN(C)CNC[C@@H](O)CC(=O)O 43314710bc21e740c61aaf7f36d2a9a6 [0,2,0,0,0,0|2,0,0]=4 5964 B11R0.6 CN(C)CNC[C@H](O)CC(=O)O 6b16fb09a87e78387c24a5c5260da6a5 [0,2,0,0,0,0|2,0,0]=4 5965 B11R0.6 CN(CCCC(=O)O)CC(F)F 0d3271c6ca48ed024e55504a0574e4cd [0,2,0,0,0,0|2,0,0]=4 5966 B11R0.6 C[C@@H](CC(=O)O)NCCN(C)C 89b89286ace9c3fdf124251abf6f4657 [0,2,0,0,0,0|2,0,0]=4 5967 B11R0.6 C[C@@H](CC(=O)O)NCCS(=O)C d59de97dd6760430819d09cc5c994eae [0,2,0,0,0,0|2,0,0]=4 5968 B11R0.6 C[C@@H](CC(=O)O)OCCS(=O)C a49cbd2d3912cda47ad04adc5319a15b [0,2,0,0,0,0|2,0,0]=4 5969 B11R0.6 C[C@@H](CN(C)C)NCCC(=O)O 5992d75eefb98de7ac0a7bd7a107d53c [0,2,0,0,0,0|2,0,0]=4 5970 B11R0.6 C[C@@H](CN(C)C)OCCC(=O)O ddebbc36a12b9fb8696f1a8b76e1c085 [0,2,0,0,0,0|2,0,0]=4 5971 B11R0.6 C[C@@H](COCC(=O)O)CN(C)C 4b01a172f367945643bd1a79a1424c50 [0,2,0,0,0,0|2,0,0]=4 5972 B11R0.6 C[C@@H](F)COCC(=O)CC(=O)O 9d110c838a33811fceef3d6840c8b87b [0,2,0,0,0,0|1,0,1]=4 5973 B11R0.6 C[C@@H](O)CN(C)CCCC(=O)N 2685c525158e452c52aee51424d029d4 [0,2,0,0,0,0|2,0,0]=4 5974 B11R0.6 C[C@@H](O)CN(C)CCCC(=O)O bd8686a6efe0853fb549e5a85731d221 [0,2,0,0,0,0|1,0,0]=3 5975 B11R0.6 C[C@@H](O)CNCC(=O)CC(=O)O de63503ace9c3911216bc42ad39a0cc9 [0,2,0,0,0,0|1,0,1]=4 5976 B11R0.6 C[C@@H](O)CNCC(O)CC(=O)O 0eece8472d38079e67d618eec555fc21 [0,2,0,0,0,0|1,0,0]=3 5977 B11R0.6 C[C@@H](O)CNC[C@@H](O)CC(=O)O 2394fb5da4ef5e222d283267b9de56cd [0,2,0,0,0,0|1,0,0]=3 5978 B11R0.6 C[C@@H](O)CNC[C@H](O)CC(=O)O f37b06015c0850ca9f010d421b2f90af [0,2,0,0,0,0|1,0,0]=3 5979 B11R0.6 C[C@H](CC(=O)O)NCCN(C)C 338398cf33658072c7ad90a65edcf1e7 [0,2,0,0,0,0|2,0,0]=4 5980 B11R0.6 C[C@H](CC(=O)O)NCCS(=O)C fdcfb203334fb63c8a3bc4172d8192c0 [0,2,0,0,0,0|2,0,0]=4 5981 B11R0.6 C[C@H](CC(=O)O)OCCS(=O)C a8ecadf4f828d2f535e1ee993af611de [0,2,0,0,0,0|2,0,0]=4 5982 B11R0.6 C[C@H](CN(C)C)NCCC(=O)O 856cfd38bcfdb37d1a90fd589158360d [0,2,0,0,0,0|2,0,0]=4 5983 B11R0.6 C[C@H](CN(C)C)OCCC(=O)O 6b42877eb5aea9a094474a7f2572f4f3 [0,2,0,0,0,0|2,0,0]=4 5984 B11R0.6 C[C@H](COCC(=O)O)CN(C)C d2ef242eebdc18fe4b114ee970507504 [0,2,0,0,0,0|2,0,0]=4 5985 B11R0.6 C[C@H](F)COCC(=O)CC(=O)O e268da173faf50629e2bda6e0f25ee63 [0,2,0,0,0,0|1,0,1]=4 5986 B11R0.6 C[C@H](O)CN(C)CCCC(=O)N 37470a02bafded24017b84abc4bbbd7f [0,2,0,0,0,0|2,0,0]=4 5987 B11R0.6 C[C@H](O)CN(C)CCCC(=O)O 0ab78485430f1f6a72ffc0b50075d6ff [0,2,0,0,0,0|1,0,0]=3 5988 B11R0.6 C[C@H](O)CNCC(=O)CC(=O)O 948ce9852a01ebd0cbd299ca7586e53c [0,2,0,0,0,0|1,0,1]=4 5989 B11R0.6 C[C@H](O)CNCC(O)CC(=O)O 17f5eee8e8264ad2d7e3f0429522c686 [0,2,0,0,0,0|1,0,0]=3 5990 B11R0.6 C[C@H](O)CNC[C@@H](O)CC(=O)O 9f465275413b51a07eeb179316db7fb2 [0,2,0,0,0,0|1,0,0]=3 5991 B11R0.6 C[C@H](O)CNC[C@H](O)CC(=O)O 3d6488d337630d9f6b3fe056d69dd55e [0,2,0,0,0,0|1,0,0]=3 5992 B11R0.6 O=C(O)CC(O)CNCC(F)F 94c2b83b6fd6de26c51f2f1f36bc21af [0,2,0,0,0,0|2,0,0]=4 5993 B11R0.6 O=C(O)C[C@@H](O)CNCC(F)F 47545622821fe6831eb8ccc3a6c9539e [0,2,0,0,0,0|2,0,0]=4 5994 B11R0.6 O=C(O)C[C@H](O)CNCC(F)F 6c80e290358278d944a57c92fb03c31f [0,2,0,0,0,0|2,0,0]=4 5995 B11R0.45 C#CC(CCC)OCCC(=O)C cf8f19b42c67f6fb500c975a72f91eba [0,2,0,0,0,0|2,0,0]=4 5996 B11R0.45 C#CC(CCC)OCCC(=O)N e88f5faa707b4df9a2a5b725d745e944 [0,2,0,0,0,0|2,0,0]=4 5997 B11R0.45 C#CC(CCC)OCCC(=O)O fed4183e4bf48cce1398a587112d8a73 [0,2,0,0,0,0|1,0,0]=3 5998 B11R0.45 C=CC(CCC)OCCC(=O)C 3f3905be3a43714c3e5f21e759b3d72d [0,2,0,0,0,0|2,0,0]=4 5999 B11R0.45 C=CC(CCC)OCCC(=O)N a65668b265a358aa27b5c4ae7b786eec [0,2,0,0,0,0|2,0,0]=4 6000 B11R0.45 C=CC(CCC)OCCC(=O)O cbc7914e7c053677f8bf1d6a312ce800 [0,2,0,0,0,0|1,0,0]=3 6001 B11R0.45 CCC(COC)NCCC(=O)O 007e760ab426d4140075349fafc35a13 [0,2,0,0,0,0|2,0,0]=4 6002 B11R0.45 CCC(COC)OCCC(=O)O 109dac5e00ef75a1d211dc979a4aa8b3 [0,2,0,0,0,0|2,0,0]=4 6003 B11R0.45 CCCC(C#N)OCCC(=O)C 6185979b8450cf2cd02b68d5dc2d7777 [0,2,0,0,0,0|2,0,0]=4 6004 B11R0.45 CCCC(C#N)OCCC(=O)N 6783de18b6ce07636a9e1a901bb0cc28 [0,2,0,0,0,0|2,0,0]=4 6005 B11R0.45 CCCC(C#N)OCCC(=O)O 57c303764cb2dcf124eb7d0553a0f1fc [0,2,0,0,0,0|1,0,0]=3 6006 B11R0.45 CCCC(CC)COCC(=O)N e75693bc5b7c907ac2d8158ba0d61efd [0,2,0,0,0,0|2,0,0]=4 6007 B11R0.45 CCCC(CC)COCC(=O)O 0a07cc93323aabca29a119419f74de9e [0,2,0,0,0,0|1,0,0]=3 6008 B11R0.45 CCCC(CC)NCCC(=O)N 6dde7c15ccf12d04379041092798af99 [0,2,0,0,0,0|2,0,0]=4 6009 B11R0.45 CCCC(CC)NCCC(=O)O 87afa9b06596c8fb9822a2d89573fabd [0,2,0,0,0,0|1,0,0]=3 6010 B11R0.45 CCCC(CC)NCCS(=O)O 08371a27a68b037d4e55b39aeffc571a [0,2,0,0,0,0|2,0,0]=4 6011 B11R0.45 CCCC(CC)OCCC(=O)C 5bb7770e07b9baacdb60c41d4c36d2b4 [0,2,0,0,0,0|2,0,0]=4 6012 B11R0.45 CCCC(CC)OCCC(=O)N 650a24c9d1ca6ca2af126bbade6172c9 [0,2,0,0,0,0|2,0,0]=4 6013 B11R0.45 CCCC(CC)OCCC(=O)O 64192e8805d7193b6561d34ea75edc29 [0,2,0,0,0,0|1,0,0]=3 6014 B11R0.45 CCCC(CO)NCCC(=O)C 5f14558e6a629c77aa99aaebbd3b4928 [0,2,0,0,0,0|2,0,0]=4 6015 B11R0.45 CCCC(CO)NCCC(=O)N de60b7f8d519b788643103e9f792a76a [0,2,0,0,0,0|2,0,0]=4 6016 B11R0.45 CCCC(CO)NCCC(=O)O fd38f011d9553c28f4f37012c64074eb [0,2,0,0,0,0|1,0,0]=3 6017 B11R0.45 CCCN(CC)CCCC(=O)C dbfec841f1594b93f3ccbe44ae2ba4fd [0,2,0,0,0,0|2,0,0]=4 6018 B11R0.45 CCCN(CC)CCCC(=O)N 54a5fe58e6ec8994298ec569491c72bf [0,2,0,0,0,0|2,0,0]=4 6019 B11R0.45 CCC[C@@H](CC)OCCC(=O)C 19c77d1b8f2d0946ca3560c3ef4c823b [0,2,0,0,0,0|2,0,0]=4 6020 B11R0.45 CCC[C@@H](CC)OCCC(=O)N 79fbb551c996bdbb5c54582e62fb7fa5 [0,2,0,0,0,0|2,0,0]=4 6021 B11R0.45 CCC[C@@H](CC)OCCC(=O)O 2c02e1dc8e8920a3010881b7719d251f [0,2,0,0,0,0|1,0,0]=3 6022 B11R0.45 CCC[C@@H](CO)NCCC(=O)C 887fb42b2975a0544a7fd2dc8b7d71c3 [0,2,0,0,0,0|2,0,0]=4 6023 B11R0.45 CCC[C@@H](CO)NCCC(=O)N 51d62ba698f887481f6d6d2add790d3b [0,2,0,0,0,0|2,0,0]=4 6024 B11R0.45 CCC[C@@H](CO)NCCC(=O)O 573733e16c2867b53e66c176341f2b06 [0,2,0,0,0,0|1,0,0]=3 6025 B11R0.45 CCC[C@H](CO)NCCC(=O)C deafc7385a34b8e125d9720abdd34ad8 [0,2,0,0,0,0|2,0,0]=4 6026 B11R0.45 CCC[C@H](CO)NCCC(=O)N 5834b14a7615f1697423106451b9baa3 [0,2,0,0,0,0|2,0,0]=4 6027 B11R0.45 CCC[C@H](CO)NCCC(=O)O f8741052230873142788a3314d4b7f88 [0,2,0,0,0,0|1,0,0]=3 6028 B11R0.45 CCOC(CC)CNCC(=O)O 93ad4bdb15a10fc0d8dbdf3fc486a78c [0,2,0,0,0,0|2,0,0]=4 6029 B11R0.45 CCOC(CC)COCC(=O)O 3dbf31cfeda885c480496450f4c13b08 [0,2,0,0,0,0|2,0,0]=4 6030 B11R0.45 COCC(CO)NCCC(=O)O 662a345ccbf9b113881d6e0c61398acf [0,2,0,0,0,0|2,0,0]=4 6031 B11R0.45 CSCC(CO)NCCC(=O)O ee9d4f268a2f2c8acad8b3e8efc23ca9 [0,2,0,0,0,0|2,0,0]=4 6032 B11R0.45 O=C(O)CCCN(CO)CCO 3528607560278a29f4cd90932dea6a26 [0,2,0,0,0,0|2,0,0]=4 6033 B11R0.45 O=C(O)CCNC(CO)CCO 85a112ed97d45add798665b450114b69 [0,2,0,0,0,0|2,0,0]=4 6034 B11R0.45 O=C(O)CCN[C@@H](CO)CCO 3b92ea3492edae38655af13e589880e1 [0,2,0,0,0,0|2,0,0]=4 6035 B11R0.45 O=C(O)CCOC(CCl)CCCl 45317cc55f7d34408cdd303e42d8ba66 [0,2,0,0,0,0|2,0,0]=4 6036 B11R0.45 O=C(O)CCO[C@@H](CO)CCO 898684bc455596ef19494fa5b4c52e82 [0,2,0,0,0,0|2,0,0]=4 6037 B11R0.59 CC(CCC(=O)O)N(C)CCF 9733ea82173fb373630ff413cda47e09 [0,2,0,0,0,0|2,0,0]=4 6038 B11R0.59 CC(CCO)N(C)CCC(=O)O be2d867c2c37159911889b2c715dc1a1 [0,2,0,0,0,0|2,0,0]=4 6039 B11R0.59 CCCC(C)N(C)CCC(=O)N 01055c563721a2d9d475a79ec59553eb [0,2,0,0,0,0|2,0,0]=4 6040 B11R0.59 CCCC(C)N(C)CCC(=O)O 5324e1654cf05e56ffc354a3332fe52d [0,2,0,0,0,0|1,0,0]=3 6041 B11R0.59 CCCN(C)C(C)CCC(=O)O 3ee99fa1e6a0ccd652ed9b877e654320 [0,2,0,0,0,0|1,0,0]=3 6042 B11R0.59 COCC(C)N(C)CCC(=O)O e6afd1021820b21be38d1b883015f62c [0,2,0,0,0,0|2,0,0]=4 6043 B11R0.59 C[C@@H](CCO)N(C)CCC(=O)O 2fb5fa3f06750a39101e2bc313d0cec3 [0,2,0,0,0,0|2,0,0]=4 6044 B11R0.104 CC(C)(CCO)NCCC(=O)O 0fc70a40748b81436bd232d8bc4183be [0,2,0,0,0,0|2,0,0]=4 6045 B11R0.104 CCCC(C)(O)CNCC(=O)N 29b25c1be1ac312d06607dfa78f8ead2 [0,2,0,0,0,0|2,0,0]=4 6046 B11R0.104 CCCC(C)(O)CNCC(=O)O a39055491780673af87eddad5b53e175 [0,2,0,0,0,0|1,0,0]=3 6047 B11R0.104 CCOC(C)(C)COCC(=O)O 30944ac94b6b63cd3a9c896018ed27b7 [0,2,0,0,0,0|2,0,0]=4 6048 B11R0.104 COCC(C)(C)COCC(=O)O 4da927049c685f057bd39fcae9d1a071 [0,2,0,0,0,0|2,0,0]=4 6049 B11R0.104 COCC(C)(C)NCCC(=O)O 85b42dffef13eae4aa0c014e3796d70d [0,2,0,0,0,0|2,0,0]=4 6050 B11R0.104 COCC(C)(O)CNCC(=O)O 61a25d5db17c8ff881452b5d9ebc80cb [0,2,0,0,0,0|2,0,0]=4 6051 B11R0.104 CSCC(C)(C)NCCC(=O)O 4938026293acf773da1072ae681c49dd [0,2,0,0,0,0|2,0,0]=4 6052 B11R0.141 C=C(CNC(C)CCC)C(=O)O 640103b0de59380c23691687e20e7126 [0,2,0,0,0,0|1,0,1]=4 6053 B11R0.141 C=C(CN[C@@H](C)CCC)C(=O)O cfa206d33c5930cf799cf24f173e1231 [0,2,0,0,0,0|1,0,1]=4 6054 B11R0.141 C=C(COC(C)CCC)C(=O)O cc3acf02af10d266c148f3435a8a3e47 [0,2,0,0,0,0|1,0,1]=4 6055 B11R0.141 C=C(CO[C@@H](C)CCC)C(=O)O d8ff2cb4465c6d06498c4d27b9f61d0e [0,2,0,0,0,0|1,0,1]=4 6056 B11R0.141 C=C(CO[C@H](C)CCC)C(=O)O 9ca6f89f486b2557c2551960f1afe539 [0,2,0,0,0,0|1,0,1]=4 6057 B11R0.141 CC(CCO)CNC(C)C(=O)O 15c023932e499c178725aeddf6e544c4 [0,2,0,0,0,0|2,0,0]=4 6058 B11R0.141 CC(CCO)CN[C@@H](C)C(=O)O cc656c3d1658f73245a24a0b46101dd7 [0,2,0,0,0,0|2,0,0]=4 6059 B11R0.141 CC(CCO)CN[C@H](C)C(=O)O c64df21ec19ae14c2b3f732443f23d7b [0,2,0,0,0,0|2,0,0]=4 6060 B11R0.141 CC(CCO)NCC(C)C(=O)O 33a8e34f3d341201b5a03578121dcf19 [0,2,0,0,0,0|2,0,0]=4 6061 B11R0.141 CC(CCO)NCC(O)C(=O)O 4b5a0b6ef936a7e6d0c053f87ba7b567 [0,2,0,0,0,0|2,0,0]=4 6062 B11R0.141 CC(CCO)NC[C@@H](C)C(=O)O 77751ad6168aca339a1ce2f79090301a [0,2,0,0,0,0|2,0,0]=4 6063 B11R0.141 CC(CCO)NC[C@@H](O)C(=O)O f64ca9f83d31f9664a79b8a6df51d6bd [0,2,0,0,0,0|2,0,0]=4 6064 B11R0.141 CC(CCO)NC[C@H](C)C(=O)O 9ec541ce796b3baf9bd02bacb12981d8 [0,2,0,0,0,0|2,0,0]=4 6065 B11R0.141 CC(CCO)NC[C@H](O)C(=O)O 0763f3227cf4461389cb988cf49391fa [0,2,0,0,0,0|2,0,0]=4 6066 B11R0.141 CC(CN[C@@H](C)CCO)C(=O)O 69c1d250a360c8c6fdad70748b5a7ca5 [0,2,0,0,0,0|2,0,0]=4 6067 B11R0.141 CC(CN[C@H](C)CCO)C(=O)O 24d5d82fb25be148168be14e87be1bda [0,2,0,0,0,0|2,0,0]=4 6068 B11R0.141 CC(NC[C@@H](O)CCO)C(=O)O fb7c831df8e0e4723487aaea0f47c17a [0,2,0,0,0,0|2,0,0]=4 6069 B11R0.141 CC(OC[C@@H](O)CCO)C(=O)O 58d2ddf5e207b4100f5124d326f9023b [0,2,0,0,0,0|2,0,0]=4 6070 B11R0.141 CCCC(=O)CNC(C)C(=O)O 056caf885e101858a1c978b171ebd2c8 [0,2,0,0,0,0|1,0,1]=4 6071 B11R0.141 CCCC(=O)CNC(O)C(=O)O 78c8cc351db638200059c47271f907ce [0,2,0,0,0,0|1,0,1]=4 6072 B11R0.141 CCCC(=O)CN[C@@H](C)C(=O)O cfe29b60713412b230aac935ce5c198d [0,2,0,0,0,0|1,0,1]=4 6073 B11R0.141 CCCC(=O)CN[C@H](C)C(=O)O 0dd671b5d33396c755c55914e47b9755 [0,2,0,0,0,0|1,0,1]=4 6074 B11R0.141 CCCC(=S)OCC(C)C(=O)O 0f6fa7d9d9029fd5d2fe9ee28361d4da [0,2,0,0,0,0|1,0,1]=4 6075 B11R0.141 CCCC(C)CNC(C)C(=O)N 7c5196f14f6bb191ada29a6a5303adc2 [0,2,0,0,0,0|2,0,0]=4 6076 B11R0.141 CCCC(C)CNC(C)C(=O)O 8ceeb2e5f1d64d4434a021aa91b0bc81 [0,2,0,0,0,0|1,0,0]=3 6077 B11R0.141 CCCC(C)CNC(O)C(=O)O f9fc0efa897aba242dce2dde638dee64 [0,2,0,0,0,0|1,0,0]=3 6078 B11R0.141 CCCC(C)CN[C@@H](C)C(=O)N 4f94937f8013828c593e54e745612f27 [0,2,0,0,0,0|2,0,0]=4 6079 B11R0.141 CCCC(C)CN[C@@H](C)C(=O)O e44714cc0165b67e27c4039a1150940d [0,2,0,0,0,0|1,0,0]=3 6080 B11R0.141 CCCC(C)CN[C@H](C)C(=O)N 94c5c3e3e472c7ba6ba962d2f80d46e5 [0,2,0,0,0,0|2,0,0]=4 6081 B11R0.141 CCCC(C)CN[C@H](C)C(=O)O 917b15250696d6987f78c899c49d74e7 [0,2,0,0,0,0|1,0,0]=3 6082 B11R0.141 CCCC(C)COC(C)C(=O)C e2cab7dc7783ea2349f281662e33fbd8 [0,2,0,0,0,0|2,0,0]=4 6083 B11R0.141 CCCC(C)COC(C)C(=O)N 5d667a782298c402a53b38af950a29c0 [0,2,0,0,0,0|2,0,0]=4 6084 B11R0.141 CCCC(C)COC(C)C(=O)O 7aeab42bcbfc587a5cc7882e0c461d2a [0,2,0,0,0,0|1,0,0]=3 6085 B11R0.141 CCCC(C)COC(F)C(=O)N 03fee2cd3a0136f4e220ddf832573c86 [0,2,0,0,0,0|2,0,0]=4 6086 B11R0.141 CCCC(C)CO[C@@H](C)C(=O)N 642829133d0a4d320e69cdf783ab4bb5 [0,2,0,0,0,0|2,0,0]=4 6087 B11R0.141 CCCC(C)CO[C@@H](C)C(=O)O 95e5ada472b01505a833140317ca55b9 [0,2,0,0,0,0|1,0,0]=3 6088 B11R0.141 CCCC(C)CO[C@H](C)C(=O)N c1a51dddde7713276570dbccb0fc6a56 [0,2,0,0,0,0|2,0,0]=4 6089 B11R0.141 CCCC(C)CO[C@H](C)C(=O)O a68da97b1cacf672f4a62f0fa2f0f5f8 [0,2,0,0,0,0|1,0,0]=3 6090 B11R0.141 CCCC(C)NCC(=O)C(=O)O 97ff9c89215b9f35b4fee2f98fb08ca9 [0,2,0,0,0,0|1,0,1]=4 6091 B11R0.141 CCCC(C)NCC(C)C(=O)O f077bedfa344fb4108aa31d94a1f4078 [0,2,0,0,0,0|1,0,0]=3 6092 B11R0.141 CCCC(C)NCC(O)C(=O)O c088723bb60614a5d48eee7f4d45b889 [0,2,0,0,0,0|1,0,0]=3 6093 B11R0.141 CCCC(C)NC[C@@H](C)C(=O)O 95a565da7a5865154e31a3bc7a579f50 [0,2,0,0,0,0|1,0,0]=3 6094 B11R0.141 CCCC(C)NC[C@@H](O)C(=O)O d6f12b0b2d53522d9bc2382976245e27 [0,2,0,0,0,0|1,0,0]=3 6095 B11R0.141 CCCC(C)NC[C@H](C)C(=O)O 2908199db340f0070943768181562b34 [0,2,0,0,0,0|1,0,0]=3 6096 B11R0.141 CCCC(C)NC[C@H](O)C(=O)O 0ef46fce5a6ff3018e398946a4682cff [0,2,0,0,0,0|1,0,0]=3 6097 B11R0.141 CCCC(C)OCC(C)C(=O)C 75f3290e38c17b8323884c8412ca159a [0,2,0,0,0,0|2,0,0]=4 6098 B11R0.141 CCCC(C)OCC(C)C(=O)O 0fdabd1bfddf8cc368c1e8b0faa03041 [0,2,0,0,0,0|1,0,0]=3 6099 B11R0.141 CCCC(C)OC[C@@H](C)C(=O)O 05c6ab3736de5a59571ff2a185daf71c [0,2,0,0,0,0|1,0,0]=3 6100 B11R0.141 CCCC(C)OC[C@H](C)C(=O)O 03bd9b4e6ddd974d3473b2fc10911024 [0,2,0,0,0,0|1,0,0]=3 6101 B11R0.141 CCCC(O)CNC(C)C(=O)C 1cd58f16266de02a22a233e23c0fcbc5 [0,2,0,0,0,0|2,0,0]=4 6102 B11R0.141 CCCC(O)CNC(C)C(=O)N 8d4c80736d663321ddf90068663a1603 [0,2,0,0,0,0|2,0,0]=4 6103 B11R0.141 CCCC(O)CNC(C)C(=O)O b097afc8f4609160fe13c100e65a4c9f [0,2,0,0,0,0|1,0,0]=3 6104 B11R0.141 CCCC(O)CNC(F)C(=O)N 95146c80be5e2962f61c683515ab62d6 [0,2,0,0,0,0|2,0,0]=4 6105 B11R0.141 CCCC(O)CNC(F)C(=O)O a0914cdefd4e8aec719c89f83425f20c [0,2,0,0,0,0|1,0,0]=3 6106 B11R0.141 CCCC(O)CN[C@@H](C)C(=O)N 277281b045d60da29883602d929a00d9 [0,2,0,0,0,0|2,0,0]=4 6107 B11R0.141 CCCC(O)CN[C@@H](C)C(=O)O b8bbb008d6b0ff08077949fe405d19ba [0,2,0,0,0,0|1,0,0]=3 6108 B11R0.141 CCCC(O)CN[C@@H](F)C(=O)O 1dd937db6f850422e97b5daef2471b2f [0,2,0,0,0,0|1,0,0]=3 6109 B11R0.141 CCCC(O)CN[C@H](C)C(=O)N b1b13337da31d98f635c8bcb9b4412ce [0,2,0,0,0,0|2,0,0]=4 6110 B11R0.141 CCCC(O)CN[C@H](C)C(=O)O 55b84b4d4cabc87d69c61a7446577740 [0,2,0,0,0,0|1,0,0]=3 6111 B11R0.141 CCC[C@@H](C)OCC(C)C(=O)O 9d9f714bef0630f5550fb4405580a3d4 [0,2,0,0,0,0|1,0,0]=3 6112 B11R0.141 CCC[C@H](C)NCC(=O)C(=O)O a1eb51d4aca91530fd776000d03249db [0,2,0,0,0,0|1,0,1]=4 6113 B11R0.141 CCC[C@H](C)NCC(C)C(=O)O 972f2341163158ffe1358b0b5bc57fa3 [0,2,0,0,0,0|1,0,0]=3 6114 B11R0.141 CCC[C@H](C)NCC(O)C(=O)O 8f768a2e8688890c2fd936fdc40dba59 [0,2,0,0,0,0|1,0,0]=3 6115 B11R0.141 CCC[C@H](C)NC[C@H](O)C(=O)O 4b839268ab0eedb03c22ec314dfa2cc4 [0,2,0,0,0,0|1,0,0]=3 6116 B11R0.141 CCC[C@H](C)OCC(C)C(=O)O e75d4311e57f40aecdd135f7d10ca591 [0,2,0,0,0,0|1,0,0]=3 6117 B11R0.141 CCOC(C)CNC(C)C(=O)O 7ddd8611a3f6066a8658ebc67da5e243 [0,2,0,0,0,0|2,0,0]=4 6118 B11R0.141 CCOC(C)CN[C@@H](C)C(=O)O 12f39da1cad018adba42888d01ad5b15 [0,2,0,0,0,0|2,0,0]=4 6119 B11R0.141 CCOC(C)CN[C@H](C)C(=O)O 1544df44f48954934bb6895c121079e0 [0,2,0,0,0,0|2,0,0]=4 6120 B11R0.141 CCOC(C)COC(C)C(=O)O 6387c2bae88ab2430ba09cb4b635b117 [0,2,0,0,0,0|2,0,0]=4 6121 B11R0.141 CCOC(C)CO[C@@H](C)C(=O)O d42b6d2918d816b672c2a26e90a11e93 [0,2,0,0,0,0|2,0,0]=4 6122 B11R0.141 CCOC(C)CO[C@H](C)C(=O)O e893c7998059f2e3c2be90883fff9ed6 [0,2,0,0,0,0|2,0,0]=4 6123 B11R0.141 COCC(C)NCC(C)C(=O)O c37c97e10f9ffe2b30895f259c79ad6d [0,2,0,0,0,0|2,0,0]=4 6124 B11R0.141 COCC(C)NCC(F)C(=O)O 93fc5223e947180e20bd0278cde695f2 [0,2,0,0,0,0|2,0,0]=4 6125 B11R0.141 COCC(C)NCC(O)C(=O)O a5fc1ec910855e0159c37f1182e4222d [0,2,0,0,0,0|2,0,0]=4 6126 B11R0.141 COCC(C)NC[C@@H](C)C(=O)O ec2efbb2d4fa376b2d3af53762b8f81e [0,2,0,0,0,0|2,0,0]=4 6127 B11R0.141 COCC(C)NC[C@@H](O)C(=O)O a8f66ec016bef33979d537e7ea2dca49 [0,2,0,0,0,0|2,0,0]=4 6128 B11R0.141 COCC(C)NC[C@H](C)C(=O)O a355d424e814cd1d1f81097b63079781 [0,2,0,0,0,0|2,0,0]=4 6129 B11R0.141 COCC(C)NC[C@H](O)C(=O)O 234982f951d7a2fa48e43427cb00c876 [0,2,0,0,0,0|2,0,0]=4 6130 B11R0.141 COCC(C)OCC(C)C(=O)O 18a33e7529a16294020b4c96175a4215 [0,2,0,0,0,0|2,0,0]=4 6131 B11R0.141 COCC(C)OC[C@@H](C)C(=O)O a9e7a4958b24cba5876ae254b769cd48 [0,2,0,0,0,0|2,0,0]=4 6132 B11R0.141 COCC(C)OC[C@H](C)C(=O)O e8a391a5be8091716636953466f6dbae [0,2,0,0,0,0|2,0,0]=4 6133 B11R0.141 COCC(O)CNC(C)C(=O)O 91482175f68bff1b1d445a72ac3dd77c [0,2,0,0,0,0|2,0,0]=4 6134 B11R0.141 COCC(O)CNC(F)C(=O)O adc9323dd5de9d4a7cd66eb4665224d0 [0,2,0,0,0,0|2,0,0]=4 6135 B11R0.141 COCC(O)CNC(O)C(=O)O 53de74ac70fe0bd4e1fe25e0838cb702 [0,2,0,0,0,0|2,0,0]=4 6136 B11R0.141 COCC(O)CN[C@@H](C)C(=O)O d52885d95e74e9b9cf06519335ed20a5 [0,2,0,0,0,0|2,0,0]=4 6137 B11R0.141 COCC(O)CN[C@@H](F)C(=O)O a7d384307a5b198365d0fd36ece3e20f [0,2,0,0,0,0|2,0,0]=4 6138 B11R0.141 COCC(O)CN[C@H](C)C(=O)O a1df0e58def33341b39d6ca35bac613b [0,2,0,0,0,0|2,0,0]=4 6139 B11R0.141 COC[C@@H](C)NCC(C)C(=O)O 759dcbb214b4b6068fdb7528a314fef2 [0,2,0,0,0,0|2,0,0]=4 6140 B11R0.141 COC[C@@H](C)NCC(O)C(=O)O c6b64b2cc8bc75295f241fb7f419e578 [0,2,0,0,0,0|2,0,0]=4 6141 B11R0.141 COC[C@@H](C)NC[C@H](O)C(=O)O d094f275892d17457799c170caff5949 [0,2,0,0,0,0|2,0,0]=4 6142 B11R0.141 COC[C@@H](C)OCC(C)C(=O)O 84e40b68c9c4f59bb47e20644699718e [0,2,0,0,0,0|2,0,0]=4 6143 B11R0.141 COC[C@@H](O)CNC(C)C(=O)O 17c8128ee890af26e28479da44866219 [0,2,0,0,0,0|2,0,0]=4 6144 B11R0.141 COC[C@@H](O)CNC(F)C(=O)O f996ba1b66eb05e5e0d1d67967159a08 [0,2,0,0,0,0|2,0,0]=4 6145 B11R0.141 COC[C@@H](O)CN[C@@H](C)C(=O)O 997c493a221131fa6aad313118527b33 [0,2,0,0,0,0|2,0,0]=4 6146 B11R0.141 COC[C@@H](O)CN[C@@H](F)C(=O)O 0dcf53504e871590174268a5645af89e [0,2,0,0,0,0|2,0,0]=4 6147 B11R0.141 COC[C@@H](O)CN[C@H](C)C(=O)O b2bbe97574d017fb016d12c45662b9c1 [0,2,0,0,0,0|2,0,0]=4 6148 B11R0.141 COC[C@H](C)NCC(C)C(=O)O 75831b13a73979dca37c66a0f5c4b275 [0,2,0,0,0,0|2,0,0]=4 6149 B11R0.141 COC[C@H](C)NCC(O)C(=O)O 13e64ffd46a4760f33e45cfc6d221e1e [0,2,0,0,0,0|2,0,0]=4 6150 B11R0.141 COC[C@H](C)NC[C@H](O)C(=O)O a764edd8b93e15db9c7932ae102122af [0,2,0,0,0,0|2,0,0]=4 6151 B11R0.141 COC[C@H](C)OCC(C)C(=O)O 9e6d64c60ab8cdd2c294d8abfee7bab2 [0,2,0,0,0,0|2,0,0]=4 6152 B11R0.141 CSCC(C)OCC(C)C(=O)O 7540064b59aedb60d2afd7ce15fd5c35 [0,2,0,0,0,0|2,0,0]=4 6153 B11R0.141 C[C@@H](CCO)NCC(O)C(=O)O dc74903a6072fa64b1f74fc1639f9123 [0,2,0,0,0,0|2,0,0]=4 6154 B11R0.141 C[C@@H](CCO)NC[C@H](O)C(=O)O bb619a7bcbd3dbe9711013bb1e1e8524 [0,2,0,0,0,0|2,0,0]=4 6155 B11R0.141 C[C@@H](NC[C@@H](O)CCO)C(=O)O 62959999efef882abde697104e51d09c [0,2,0,0,0,0|2,0,0]=4 6156 B11R0.141 C[C@@H](OC[C@@H](O)CCO)C(=O)O 9f2d72bf7a94ecee46c6955ce746f55b [0,2,0,0,0,0|2,0,0]=4 6157 B11R0.141 C[C@H](CCO)NCC(O)C(=O)O be9ee467ad06379b445663bd3b599a85 [0,2,0,0,0,0|2,0,0]=4 6158 B11R0.141 C[C@H](CCO)NC[C@H](O)C(=O)O a4bd5d004a9f5530c13ca627af8ebe96 [0,2,0,0,0,0|2,0,0]=4 6159 B11R0.141 C[C@H](NC[C@@H](O)CCO)C(=O)O b8dfbf3f00a4c89119b3e21ee7674f2d [0,2,0,0,0,0|2,0,0]=4 6160 B11R0.141 C[C@H](OC[C@@H](O)CCO)C(=O)O 122cbc887a00fd96370876487445e02a [0,2,0,0,0,0|2,0,0]=4 6161 B11R0.141 O=C(O)C(O)NC[C@@H](O)CCO c5d0319088475d7db793e36337be5afe [0,2,0,0,0,0|2,0,0]=4 6162 B11R0.145 CC(CO)N(C)CCCC(=O)O b0d3043c05336e015977f5216a237296 [0,2,0,0,0,0|2,0,0]=4 6163 B11R0.145 CCC(=O)C(C)NCCC(=O)O 2d98e5e6bced3fcfda194e130f747e05 [0,2,0,0,0,0|1,0,1]=4 6164 B11R0.145 CCC(C)C(=O)CNCC(=O)O 1bae06283cce4acdefa30be2265978a9 [0,2,0,0,0,0|1,0,1]=4 6165 B11R0.145 CCC(C)C(=O)COCC(=O)O f2d21e1396ee2a0b2da59abf857bddba [0,2,0,0,0,0|1,0,1]=4 6166 B11R0.145 CCC(C)C(C)NCCC(=O)C 529a0a6b41a852ac1e35e54ef1867e15 [0,2,0,0,0,0|2,0,0]=4 6167 B11R0.145 CCC(C)C(C)NCCC(=O)N 647857ff9f8fbbc51335b240a6d8f9b2 [0,2,0,0,0,0|2,0,0]=4 6168 B11R0.145 CCC(C)C(C)NCCC(=O)O 8187ee3787b839cf7529de66dfc606dd [0,2,0,0,0,0|1,0,0]=3 6169 B11R0.145 CCC(C)C(C)OCCC(=O)C 298b7153d7b1719b127bff8bfcfcee8f [0,2,0,0,0,0|2,0,0]=4 6170 B11R0.145 CCC(C)C(C)OCCC(=O)N 5c804c3280e3001b910a7aae325b92b0 [0,2,0,0,0,0|2,0,0]=4 6171 B11R0.145 CCC(C)C(C)OCCC(=O)O a112f166d566b551acac86da3e535fb0 [0,2,0,0,0,0|1,0,0]=3 6172 B11R0.145 CCC(C)N(C)CCCC(=O)C 0b9034f9bf9692d81f0f741f6a8bdd01 [0,2,0,0,0,0|2,0,0]=4 6173 B11R0.145 CCC(C)N(C)CCCC(=O)N b05262fbfd0c429c08fb1689f884d3b6 [0,2,0,0,0,0|2,0,0]=4 6174 B11R0.145 CCC(C)N(C)CCCC(=O)O 427380640cf2c54ee7f3655b00e85d64 [0,2,0,0,0,0|1,0,0]=3 6175 B11R0.145 CCC(S)C(C)COCC(=O)N e3671d1789b05f52aad04c4f648379db [0,2,0,0,0,0|2,0,0]=4 6176 B11R0.145 CCC(S)C(C)COCC(=O)O 62072fca2b5f77c50139da2dd9128a4b [0,2,0,0,0,0|1,0,0]=3 6177 B11R0.145 CCN(C)C(C)COCC(=O)O ec4f71c2b328ddfb66ae10b86cf678aa [0,2,0,0,0,0|2,0,0]=4 6178 B11R0.145 CCN(C)[C@@H](C)COCC(=O)O 32753f28603b34b00ce4e52adc68b167 [0,2,0,0,0,0|2,0,0]=4 6179 B11R0.145 CCN(C)[C@H](C)COCC(=O)O 983cddb31db2952050cb3c86f068a75e [0,2,0,0,0,0|2,0,0]=4 6180 B11R0.145 COC(C)C(C)OCCC(=O)O 66423fc76489c65e1b3f7b34a9727e06 [0,2,0,0,0,0|2,0,0]=4 6181 B11R0.145 C[C@@H](CO)N(C)CCCC(=O)O b8678bf94d8258b7cb0b86013525b4b1 [0,2,0,0,0,0|2,0,0]=4 6182 B11R0.145 C[C@H](CO)N(C)CCCC(=O)O d284e91d6ba47bcbce4066900cae2654 [0,2,0,0,0,0|2,0,0]=4 6183 B11R0.147 C#CCCN(C)CCCC(=O)O 133b93b05f9bbdaa61bfdeebf901574c [0,2,0,0,0,0|0,0,2]=4 6184 B11R0.147 C/C=C/CN(C)CCCC(=O)O 8a02bfffc596bc38de00131c3c9c1252 [0,2,0,0,0,0|0,0,2]=4 6185 B11R0.147 C/C=C\CN(C)CCCC(=O)O 3e0a7e89d825d6634851279065789024 [0,2,0,0,0,0|0,0,2]=4 6186 B11R0.147 C=C(Br)CCOC(C)CCCC 57fbef68903a7a44638db1b29ab29722 [0,2,0,0,0,0|2,0,0]=4 6187 B11R0.147 C=C(Br)CNCC(O)CCCC 002d1d48600762044db7fc0c7b4bde5f [0,2,0,0,0,0|2,0,0]=4 6188 B11R0.147 C=C(Br)COCC(C)CCCC 6435aa5f33030a828c9d1151e9717b6d [0,2,0,0,0,0|2,0,0]=4 6189 B11R0.147 C=C(C)CCCN(C)CCCC a3bbebdbfb7ec9975aae54e657595804 [0,2,0,0,0,0|2,0,0]=4 6190 B11R0.147 C=C(C)CCNC(C)CCCC 5132ba6f10db886702a5ae14cd8822e6 [0,2,0,0,0,0|2,0,0]=4 6191 B11R0.147 C=C(C)CCN[C@H](C)CCCC 97f4861932181f63d962ad1a8ca3a7de [0,2,0,0,0,0|2,0,0]=4 6192 B11R0.147 C=C(C)CCOC(C)CCCC eed93de6087a786daad053845bf45aa8 [0,2,0,0,0,0|2,0,0]=4 6193 B11R0.147 C=C(C)CCO[C@@H](C)CCCC 51b1ba7b81bd29b0a0d65e4292d030c1 [0,2,0,0,0,0|2,0,0]=4 6194 B11R0.147 C=C(C)CCO[C@H](C)CCCC 95bd20b65d7919c04c476c5aaee6a6e7 [0,2,0,0,0,0|2,0,0]=4 6195 B11R0.147 C=C(C)CNCC(O)CCCC e0f2ae830f520c3d9bedda231e681f48 [0,2,0,0,0,0|2,0,0]=4 6196 B11R0.147 C=C(C)COCC(C)CCCC 0d6c2674863aa4710898f6db4b2071ad [0,2,0,0,0,0|2,0,0]=4 6197 B11R0.147 C=C(Cl)CNCC(O)CCCC 471f2584b3646ed948f161c16b7aa1ee [0,2,0,0,0,0|2,0,0]=4 6198 B11R0.147 C=C(Cl)COCC(C)CCCC fc47d7dc41f5fca362bb45130b0be302 [0,2,0,0,0,0|2,0,0]=4 6199 B11R0.147 C=C(F)CNCC(O)CCCC fb9de16a3f3a7dc9a1f97ae33dfb2df1 [0,2,0,0,0,0|2,0,0]=4 6200 B11R0.147 C=C(F)COCC(C)CCCC 4e24cf9c78b835b6a60c3088d6fc77a2 [0,2,0,0,0,0|2,0,0]=4 6201 B11R0.147 C=CCCC(C)NCCC(=O)O 336c37156388903affc4d3fac03da16f [0,2,0,0,0,0|0,0,2]=4 6202 B11R0.147 C=CCCC(C)OCCC(=O)O c8005f5a8bf42c9b20de5db906950509 [0,2,0,0,0,0|0,0,2]=4 6203 B11R0.147 C=CCCC(O)CNCC(=O)O b682c721d9fa6728137e9d00e94695b5 [0,2,0,0,0,0|0,0,2]=4 6204 B11R0.147 C=CCCN(C)CCCC(=O)O 0ba853d0f3ac6a911361fd3d33b1d9d6 [0,2,0,0,0,0|0,0,2]=4 6205 B11R0.147 C=CCC[C@@H](C)OCCC(=O)O 39dc89129a3bc546d97c0d0caf093529 [0,2,0,0,0,0|0,0,2]=4 6206 B11R0.147 C=CCC[C@@H](O)CNCC(=O)O 72191a00a7a0ec1d5615ec262f326774 [0,2,0,0,0,0|0,0,2]=4 6207 B11R0.147 CC(=O)CCCN(C)CCCO fc02099084e6be0f0ec0fa4a56c25490 [0,2,0,0,0,0|2,0,0]=4 6208 B11R0.147 CC(=O)CCNC(C)CCCO 001f5a0128ff4b06b11147cb0bfc8d93 [0,2,0,0,0,0|2,0,0]=4 6209 B11R0.147 CC(=O)CCN[C@H](C)CCCO 23aca1da87fed57649f169a88df98cd0 [0,2,0,0,0,0|2,0,0]=4 6210 B11R0.147 CC(CCC#N)NCCC(=O)O 0729f5a1190c32c47a15e5f67f4c6d05 [0,2,0,0,0,0|1,0,1]=4 6211 B11R0.147 CC(CCC#N)OCCC(=O)O 16e0d4ab4e4066faf442b8556c567ae2 [0,2,0,0,0,0|1,0,1]=4 6212 B11R0.147 CC(CCCO)NCCC(=O)N e3e45b61f76b65686744a6c63d8893f7 [0,2,0,0,0,0|2,0,0]=4 6213 B11R0.147 CC(CCCO)NCCC(=O)O 0a84f673b85627d338064254e1b9d482 [0,2,0,0,0,0|1,0,0]=3 6214 B11R0.147 CC(CCCO)NCCS(=O)O 75285de08b88b5bebf65c2ed6fcce369 [0,2,0,0,0,0|2,0,0]=4 6215 B11R0.147 CCC#CC(C)OCCC(=O)O 9fe01789c580bcc57150d9e7d31f88d1 [0,2,0,0,0,0|0,0,2]=4 6216 B11R0.147 CCCCC(=O)NCCC(=O)N 048c5b243b14fe09bf0ac19371807795 [0,2,0,0,0,0|1,0,1]=4 6217 B11R0.147 CCCCC(=O)NCCS(=O)O 43d7fdf198fafd42d478fbde65b6a1da [0,2,0,0,0,0|1,0,1]=4 6218 B11R0.147 CCCCC(C)COCC(=O)N 0c47a81ee857be86a93c87a99d89593c [0,2,0,0,0,0|1,0,0]=3 6219 B11R0.147 CCCCC(C)COCC(=O)O 9ef64333eda5ab77446d850437b4b702 [0,2,0,0,0,0|0,0,0]=2 6220 B11R0.147 CCCCC(C)COC[N+](=O)[O-] c4c46fa215e9aa4816f5e1afebea0a16 [0,2,0,0,0,0|1,0,1]=4 6221 B11R0.147 CCCCC(C)NCCC(=O)C edcd28c8eaa8bf7db1d99a2ef0778d5c [0,2,0,0,0,0|1,0,0]=3 6222 B11R0.147 CCCCC(C)NCCC(=O)N 14a90b758e7a718aaea53884a12b78ad [0,2,0,0,0,0|1,0,0]=3 6223 B11R0.147 CCCCC(C)NCCC(=O)O c7b1f15f3546628c2966408987ee05d4 [0,2,0,0,0,0|0,0,0]=2 6224 B11R0.147 CCCCC(C)NCCC(=S)N aafbce0cfd20f6a4859cdefcf8b1aa7b [0,2,0,0,0,0|1,1,0]=4 6225 B11R0.147 CCCCC(C)NCCC(C)O 5228767d4eae014027fcab6cbf47345b [0,2,0,0,0,0|1,0,1]=4 6226 B11R0.147 CCCCC(C)NCCS(=O)C 0766821aaf5459d16d5f61928195e1f8 [0,2,0,0,0,0|2,0,0]=4 6227 B11R0.147 CCCCC(C)NCCS(=O)O a6239b5c52a32f0915315c1ddaa48240 [0,2,0,0,0,0|1,0,0]=3 6228 B11R0.147 CCCCC(C)NCC[C@@H](C)O 92392685f0b98d3de410a27475b9862c [0,2,0,0,0,0|1,0,1]=4 6229 B11R0.147 CCCCC(C)NCC[C@H](C)O a65475a40409c36c47f9e4d0358a16f7 [0,2,0,0,0,0|1,0,1]=4 6230 B11R0.147 CCCCC(C)NCOC(=O)C 6e9dce9d46a1b923193ab716bfc9a2b4 [0,2,0,0,0,0|2,0,0]=4 6231 B11R0.147 CCCCC(C)NCSC(=O)N 3ccc75edc3ee531337095cf9b15235ee [0,2,0,0,0,0|2,0,0]=4 6232 B11R0.147 CCCCC(C)OCCC(=O)C ebeebc9e296cbe6f0a98ad631ab6f24b [0,2,0,0,0,0|1,0,0]=3 6233 B11R0.147 CCCCC(C)OCCC(=O)N bb32f8eea69e27f7214519c9c704ee7e [0,2,0,0,0,0|1,0,0]=3 6234 B11R0.147 CCCCC(C)OCCS(=O)C e3b48eab272e3cb316f44a8d4afae1d5 [0,2,0,0,0,0|2,0,0]=4 6235 B11R0.147 CCCCC(C)OCC[N+](=O)[O-] 3d30bed66ac88aa9e8ef2b525b66f942 [0,2,0,0,0,0|1,0,1]=4 6236 B11R0.147 CCCCC(C)OCNC(=O)C aa5f8abe48d6be083b29716c596a2478 [0,2,0,0,0,0|2,0,0]=4 6237 B11R0.147 CCCCC(C)OCNC(=O)N 494b9a35ad7d9688657774edd0d30a9b [0,2,0,0,0,0|2,0,0]=4 6238 B11R0.147 CCCCC(C)OCOC(=O)C 8707e50adfbd9cf727be9afd38249d28 [0,2,0,0,0,0|2,0,0]=4 6239 B11R0.147 CCCCC(C)OCSC(=O)N 8bdb6068cc82fb3c680bd08b6ec3f426 [0,2,0,0,0,0|2,0,0]=4 6240 B11R0.147 CCCCC(O)CNCC(=O)N 9c9ea850869139399386cf5bd9f959d2 [0,2,0,0,0,0|1,0,0]=3 6241 B11R0.147 CCCCC(O)CNCC(=O)O 12d23a216214115c26b91a124bcfe6f6 [0,2,0,0,0,0|0,0,0]=2 6242 B11R0.147 CCCCC(O)CNCC(C)O a3d66189769c24571be83277b3791ff4 [0,2,0,0,0,0|1,0,1]=4 6243 B11R0.147 CCCCC(O)CNC[C@@H](C)O e526b2974f0fc2e9d7a8548bbfe380ee [0,2,0,0,0,0|1,0,1]=4 6244 B11R0.147 CCCCC(O)CNC[C@H](C)O ffae387dc27e3628bdcda8b9e8d3f55e [0,2,0,0,0,0|1,0,1]=4 6245 B11R0.147 CCCCC(O)CNC[N+](=O)[O-] 501d44df227bda3cab765fa07d367675 [0,2,0,0,0,0|1,0,1]=4 6246 B11R0.147 CCCCN(C)C/C=C/C(=O)O 1468e44538bb2dcf9e68348869022de5 [0,2,0,0,0,0|0,0,2]=4 6247 B11R0.147 CCCCN(C)CC=CC(=O)O 91523936f35958628669ae3746fa7c61 [0,2,0,0,0,0|0,0,2]=4 6248 B11R0.147 CCCCN(C)CCCC(=O)C abc7666fa9422368eaa5ed52008f4eec [0,2,0,0,0,0|1,0,0]=3 6249 B11R0.147 CCCCN(C)CCCC(=O)N 10f1e70d4deedd76e23ba9a5f3f7fa86 [0,2,0,0,0,0|1,0,0]=3 6250 B11R0.147 CCCCN(C)CCCC(=O)O d27e769f81999c0feb094daf3684f278 [0,2,0,0,0,0|0,0,0]=2 6251 B11R0.147 CCCCN(C)CCCC(C)O 8828aaf31a48439873b0a5abdd1f9a16 [0,2,0,0,0,0|1,0,1]=4 6252 B11R0.147 CCCCN(C)CCNC(=O)C 8985735d8cd42c899f6b3fbec1391089 [0,2,0,0,0,0|2,0,0]=4 6253 B11R0.147 CCCCN(C)CCNC(=O)N 6e57adea16c5f88c9b968f75df8f704b [0,2,0,0,0,0|2,0,0]=4 6254 B11R0.147 CCCCN(C)CCOC(=O)C 714223575f85b8f8990d992ef459625f [0,2,0,0,0,0|2,0,0]=4 6255 B11R0.147 CCCCN(C)CCSC(=O)C 07b8f687006e717691584254362b8553 [0,2,0,0,0,0|2,0,0]=4 6256 B11R0.147 CCCC[C@@H](C)NCCC(=O)C 3e4c3a2c28f0952148627b465ed49444 [0,2,0,0,0,0|1,0,0]=3 6257 B11R0.147 CCCC[C@@H](C)NCCC(=O)N 382fc32873833cfb372f737620bc6e46 [0,2,0,0,0,0|1,0,0]=3 6258 B11R0.147 CCCC[C@@H](C)NCCC(=O)O b6fdd76e08178d66c6878d9a951d46a6 [0,2,0,0,0,0|0,0,0]=2 6259 B11R0.147 CCCC[C@@H](C)NCCC(C)O ae2f72547e0b03abd5bd9d3d09840961 [0,2,0,0,0,0|1,0,1]=4 6260 B11R0.147 CCCC[C@@H](C)NCCS(=O)C abbe8d6fbc43c32d4cf1a7740675fa03 [0,2,0,0,0,0|2,0,0]=4 6261 B11R0.147 CCCC[C@@H](C)NCOC(=O)C 938fb5bed858bb933b87ccf5ebb2ef2d [0,2,0,0,0,0|2,0,0]=4 6262 B11R0.147 CCCC[C@@H](C)NCSC(=O)N 78fd3228785543ce4bd309cad4d036ce [0,2,0,0,0,0|2,0,0]=4 6263 B11R0.147 CCCC[C@@H](C)OCCC(=O)C 8b14055ccd1479780072337616d0a089 [0,2,0,0,0,0|1,0,0]=3 6264 B11R0.147 CCCC[C@@H](C)OCCC(=O)N 5c6d7a40bb14456849afe49dc50b1f66 [0,2,0,0,0,0|1,0,0]=3 6265 B11R0.147 CCCC[C@@H](C)OCCS(=O)C 1569f4a8517a0020bc2f28f70216145b [0,2,0,0,0,0|2,0,0]=4 6266 B11R0.147 CCCC[C@@H](C)OCOC(=O)C 45360ae62bb947f18e1ba611bc1d94f3 [0,2,0,0,0,0|2,0,0]=4 6267 B11R0.147 CCCC[C@@H](C)OCSC(=O)N e86c8322888cee2afd407ec804655e99 [0,2,0,0,0,0|2,0,0]=4 6268 B11R0.147 CCCC[C@H](C)OCCC(=O)C 1870b86809036ac20fc9a5cf943b11ce [0,2,0,0,0,0|1,0,0]=3 6269 B11R0.147 CCCC[C@H](C)OCCC(=O)N 962eee950358e00235cebb697af38cfc [0,2,0,0,0,0|1,0,0]=3 6270 B11R0.147 CCCC[C@H](C)OCCS(=O)C 3d5ad9fd159224bc8b03ebdf908a00c5 [0,2,0,0,0,0|2,0,0]=4 6271 B11R0.147 CCCC[C@H](C)OCOC(=O)C 5d53659ac5a06022d4172787f1e9b842 [0,2,0,0,0,0|2,0,0]=4 6272 B11R0.147 CCCC[C@H](C)OCSC(=O)N 9e4b9c52f4ad001999a460ff25919a74 [0,2,0,0,0,0|2,0,0]=4 6273 B11R0.147 CCCNC(=O)CCCC(=O)C c5a6c1fa0c374636854f24398695434a [0,2,0,0,0,0|1,0,1]=4 6274 B11R0.147 CCCNC(=O)CCCC(=O)N 7cc2aab195c89524748d57707a5cc05b [0,2,0,0,0,0|1,0,1]=4 6275 B11R0.147 CCCNC(=O)CNCC(=O)O 20c0c14c0cb06299066491247d633b24 [0,2,0,0,0,0|1,0,1]=4 6276 B11R0.147 CCCNC(=O)NCCC(=O)O 164a58b7fe725725702c92b2161137f4 [0,2,0,0,0,0|1,0,1]=4 6277 B11R0.147 CCCNC(=S)NCCC(=O)O 8b0189db54bb6a3003893d6e8c2ce51c [0,2,0,0,0,0|1,0,1]=4 6278 B11R0.147 CCCOC(=O)CNCC(=O)O ca38d75bfe1967e25a90ee5e2668578c [0,2,0,0,0,0|1,0,1]=4 6279 B11R0.147 CCCOC(=O)COCC(=O)O a9073d193a3fdd4b64080cd2591a05c4 [0,2,0,0,0,0|1,0,1]=4 6280 B11R0.147 CCOCC(C)COCC(=O)N 27de9a17135cdb0122eda86bc6f3c466 [0,2,0,0,0,0|2,0,0]=4 6281 B11R0.147 CCOCC(C)COCC(=O)O 1860f499eedd358b2cf3ff06452df843 [0,2,0,0,0,0|1,0,0]=3 6282 B11R0.147 CCOCC(C)OCCC(=O)C d8ba14d388a60dc6c32b84b65522ba98 [0,2,0,0,0,0|2,0,0]=4 6283 B11R0.147 CCOCC(C)OCCC(=O)N 19cfc68b6beda7551ca48002172c774d [0,2,0,0,0,0|2,0,0]=4 6284 B11R0.147 CCOCC(C)OCCC(=O)O 23fb76fb6f1d42ad22e9f31fb991ae25 [0,2,0,0,0,0|1,0,0]=3 6285 B11R0.147 CCOCC(O)CNCC(=O)N 2fac40ebbe685d020a9a67ac6a4ffa04 [0,2,0,0,0,0|2,0,0]=4 6286 B11R0.147 CCOCC(O)CNCC(=O)O 612508c3ec489602335763d22880faab [0,2,0,0,0,0|1,0,0]=3 6287 B11R0.147 CCOCN(C)CCCC(=O)N 15e80500ad054a01cd7529ab6e685a61 [0,2,0,0,0,0|2,0,0]=4 6288 B11R0.147 CCOCN(C)CCCC(=O)O 432497fae05909ebec99c176eca0e18c [0,2,0,0,0,0|1,0,0]=3 6289 B11R0.147 CN(CCC#N)CCCC(=O)O ff1f771b5d2377753c15af9e7c9aba91 [0,2,0,0,0,0|1,0,1]=4 6290 B11R0.147 CN(CCC=O)CCCC(=O)O 3f4953d79ca5c8abf0cd8a42b5820739 [0,2,0,0,0,0|1,0,1]=4 6291 B11R0.147 CN(CCCC(=O)O)CCON e59c5fbbbc505428027d3a83df5fa76d [0,2,0,0,0,0|2,0,0]=4 6292 B11R0.147 CN(CCCF)CCCC(=O)N b806bb1ced7f6acb6535b9b1ac212ca8 [0,2,0,0,0,0|2,0,0]=4 6293 B11R0.147 CN(CCCF)CCCC(=O)O 7847e8daa408c57a846702c31809d4ce [0,2,0,0,0,0|1,0,0]=3 6294 B11R0.147 CN(CCCO)CCCC(=O)N d49d812b78f009b8f7a33ff621899bb3 [0,2,0,0,0,0|2,0,0]=4 6295 B11R0.147 CN(CCCO)CCCC(=O)O 5943ca1e540c5e55779b3ddbe6e0cecd [0,2,0,0,0,0|1,0,0]=3 6296 B11R0.147 CN(CCCS)CCCC(=O)N 3572e4a0a7d4f8b9ce771f76770672aa [0,2,0,0,0,0|2,0,0]=4 6297 B11R0.147 CN(CCCS)CCCC(=O)O 7ae1a8afe0cc8572683c4290214feb77 [0,2,0,0,0,0|1,0,0]=3 6298 B11R0.147 COCCC(C)OCCC(=O)C 7765a67a47dc2ce162d9f23399c3d6a5 [0,2,0,0,0,0|2,0,0]=4 6299 B11R0.147 COCCC(C)OCCC(=O)N 915453c3f66c90ce61bfc355f441599f [0,2,0,0,0,0|2,0,0]=4 6300 B11R0.147 COCCC(C)OCCC(=O)O 5f1a4a68dc31488f5e97217537da23e3 [0,2,0,0,0,0|1,0,0]=3 6301 B11R0.147 COCCN(C)CCCC(=O)C 682c56647ec72218af4b3d1a6947e278 [0,2,0,0,0,0|2,0,0]=4 6302 B11R0.147 COCCN(C)CCCC(=O)N b528bbcc1ecd1020c64aba6ef9ed4d0e [0,2,0,0,0,0|2,0,0]=4 6303 B11R0.147 COCCN(C)CCCC(=O)O 16873fc523c100821b9185b70f451e80 [0,2,0,0,0,0|1,0,0]=3 6304 B11R0.147 COCO[C@H](C)COCC(=O)O 566e62752d7febd890185f1f3cc2fe22 [0,2,0,0,0,0|2,0,0]=4 6305 B11R0.147 CSCCC(=O)CNCC(=O)O 2aeec0f86b02d2e49eda413816c89508 [0,2,0,0,0,0|1,0,1]=4 6306 B11R0.147 CSCCC(=O)COCC(=O)O 87e1c52ab5ecc794eee5ce7562c16441 [0,2,0,0,0,0|1,0,1]=4 6307 B11R0.147 CSCCC(C)OCCC(=O)C cbaa8bf546d3b15568217916a3216bc4 [0,2,0,0,0,0|2,0,0]=4 6308 B11R0.147 CSCCC(C)OCCC(=O)N e17d187736420bf98739f840bde62bae [0,2,0,0,0,0|2,0,0]=4 6309 B11R0.147 CSCCN(C)CCCC(=O)C 126a64101469389c73477dd6ffee2653 [0,2,0,0,0,0|2,0,0]=4 6310 B11R0.147 CSCCN(C)CCCC(=O)N 21a8414caa0d5f80d19752ae14839c53 [0,2,0,0,0,0|2,0,0]=4 6311 B11R0.147 CSCCN(C)CCCC(=O)O 7b4a665c8b89f94cbd680bd369471d99 [0,2,0,0,0,0|1,0,0]=3 6312 B11R0.147 C[C@H](CCCO)CNCC(=O)N 6bef60ed27a5b71d43f1cea2d32f162c [0,2,0,0,0,0|2,0,0]=4 6313 B11R0.147 C[C@H](CCCO)CNCC(=O)O 5a64b86a049ce0228ff2384ea32773b8 [0,2,0,0,0,0|1,0,0]=3 6314 B11R0.147 C[C@H](CCCO)NCCC(=O)N 38318391a77b101322ada15a5e0ff1c2 [0,2,0,0,0,0|2,0,0]=4 6315 B11R0.147 C[C@H](CCCO)NCCC(=O)O f39244f1439986cbae7056b6fb46fb5c [0,2,0,0,0,0|1,0,0]=3 6316 B11R0.174 C=C(CNCC(O)CCC)OC 3fa613c1d00c0af6eabb58cfd4bb2241 [0,2,0,0,0,0|2,0,0]=4 6317 B11R0.174 C=C(CO)CNCC(O)CCC be4b1c1e221743fabaa9db9dcbf92df3 [0,2,0,0,0,0|2,0,0]=4 6318 B11R0.174 C=C(COCC(C)CCC)OC e837bce360e94c7f479e4e319ad18888 [0,2,0,0,0,0|2,0,0]=4 6319 B11R0.174 C=CC(=O)CCCN(C)CCC 0f49c3147e93c1b4f3e6aa40bf12aca9 [0,2,0,0,0,0|2,0,0]=4 6320 B11R0.174 CC(CCO)CNCC(=O)CO 496c5921590f0c35c579d4485d491546 [0,2,0,0,0,0|2,0,0]=4 6321 B11R0.174 CC(CCO)NCCC(=O)NO 140f1c618a668c1312ca0006c6518fff [0,2,0,0,0,0|2,0,0]=4 6322 B11R0.174 CCCC(=O)CNCC(=O)NO 7a3d5e7c2b4d8c523aeaa2a97d61824a [0,2,0,0,0,0|1,0,1]=4 6323 B11R0.174 CCCC(=O)CNCC(=O)OC bb3ba4579c3040cc77323cc5f3644d99 [0,2,0,0,0,0|1,0,1]=4 6324 B11R0.174 CCCC(=O)COCC(=O)OC d8a821b54199b187b9b76f19cf13332f [0,2,0,0,0,0|1,0,1]=4 6325 B11R0.174 CCCC(=O)NCCC(=O)NO 9c7fc143f27edbc7ca7ad1aa9d6b93ef [0,2,0,0,0,0|1,0,1]=4 6326 B11R0.174 CCCC(=O)NCCC(=O)OC 4d6fb7da32841880d13d6f13be995f2c [0,2,0,0,0,0|1,0,1]=4 6327 B11R0.174 CCCC(=S)OCCC(=O)OC fc5d4b6a28a0db2c29f6eabef0f1c853 [0,2,0,0,0,0|1,0,1]=4 6328 B11R0.174 CCCC(C)CNCC(=O)NC 993d824ece04ef0bea85472a7369b3cc [0,2,0,0,0,0|2,0,0]=4 6329 B11R0.174 CCCC(C)CNCC(=O)NO 43c4ca738e4d7e67584ef78a3ce46185 [0,2,0,0,0,0|1,0,0]=3 6330 B11R0.174 CCCC(C)CNCC(=O)OC d94197d0b88a2b807c1a7f37d3ee1a25 [0,2,0,0,0,0|1,0,0]=3 6331 B11R0.174 CCCC(C)COCC(=O)CC 2f5ba697e16ef33dc53d647af5814161 [0,2,0,0,0,0|2,0,0]=4 6332 B11R0.174 CCCC(C)COCC(=O)NC edd73d349d5bf9f27362b6f2027de1df [0,2,0,0,0,0|2,0,0]=4 6333 B11R0.174 CCCC(C)COCC(=O)OC c8cdc297b47c32fa9cddb65adece86bf [0,2,0,0,0,0|1,0,0]=3 6334 B11R0.174 CCCC(C)NCCC(=O)NC a7b09d4d7e9303fcb220bb19ade78195 [0,2,0,0,0,0|2,0,0]=4 6335 B11R0.174 CCCC(C)NCCC(=O)NO 50546ec9d2e82081671ca5ff517a4c05 [0,2,0,0,0,0|1,0,0]=3 6336 B11R0.174 CCCC(C)NCCC(=O)OC b1a1031e1f4ba318e932bfdc77e4bbf7 [0,2,0,0,0,0|1,0,0]=3 6337 B11R0.174 CCCC(C)NCOC(=O)OC 8200f3900fed417a21930cb37808b363 [0,2,0,0,0,0|2,0,0]=4 6338 B11R0.174 CCCC(C)OCCC(=O)NC c9889a5d08f15bb7e53151fbe47a30c1 [0,2,0,0,0,0|2,0,0]=4 6339 B11R0.174 CCCC(C)OCCC(=O)OC 037e1108d805876d37178c6543ab693c [0,2,0,0,0,0|1,0,0]=3 6340 B11R0.174 CCCC(O)CNCC(=O)CC 1803f22c854025bbe4bd14bf9bf2eaa4 [0,2,0,0,0,0|2,0,0]=4 6341 B11R0.174 CCCC(O)CNCC(=O)CO d7db3efad85d3dfa9117f981c6cf0e60 [0,2,0,0,0,0|1,0,0]=3 6342 B11R0.174 CCCC(O)CNCC(=O)NC bda39870f8bb859389556943ac0489f2 [0,2,0,0,0,0|2,0,0]=4 6343 B11R0.174 CCCC(O)CNCC(=O)OC 58110736a5c625cd64b261c983eddab2 [0,2,0,0,0,0|1,0,0]=3 6344 B11R0.174 CCCN(C)CCCC(=O)NC f6a9430110ef82185efc0600af0e9151 [0,2,0,0,0,0|2,0,0]=4 6345 B11R0.174 CCCN(C)CCCC(=O)OC 69d253e88d1e61d854220b1416f9e5a8 [0,2,0,0,0,0|1,0,0]=3 6346 B11R0.174 CCC[C@@H](C)OCCC(=O)NC 035e47698d213f6078a4d5c7e9eef88b [0,2,0,0,0,0|2,0,0]=4 6347 B11R0.174 CCC[C@@H](C)OCCC(=O)OC 32237384edc5023d6814a4db0ac158df [0,2,0,0,0,0|1,0,0]=3 6348 B11R0.174 CCC[C@H](C)NCCC(=O)NC d93e5e75fdcdb5332c78dcd17f2e257d [0,2,0,0,0,0|2,0,0]=4 6349 B11R0.174 CCC[C@H](C)NCCC(=O)OC f5e14de7c9ec227b55f117b06e1e2b4c [0,2,0,0,0,0|1,0,0]=3 6350 B11R0.174 CCC[C@H](C)NCOC(=O)OC 95ab1a2d4cedcabf47b683615396f95f [0,2,0,0,0,0|2,0,0]=4 6351 B11R0.174 CCC[C@H](C)OCCC(=O)NC 2ac040afa545d7bfd2f66a4781bb911d [0,2,0,0,0,0|2,0,0]=4 6352 B11R0.174 CCC[C@H](C)OCCC(=O)OC 74cc17c2b75c46a3b125dab63bb50b4b [0,2,0,0,0,0|1,0,0]=3 6353 B11R0.174 CCOC(C)CNCC(=O)CO 063fc999d9805b210381b7523058d9a9 [0,2,0,0,0,0|2,0,0]=4 6354 B11R0.174 CCOC(C)CNCC(=O)OC edf8b03a1cfaeb0c5c6b04a803a2d5e8 [0,2,0,0,0,0|2,0,0]=4 6355 B11R0.174 CCOC(C)COCC(=O)OC 312357baff8b65ad92e6a191aa467670 [0,2,0,0,0,0|2,0,0]=4 6356 B11R0.174 COC(=O)CCCN(C)CCF 09dfbaff29014306f2b247b74807fa7f [0,2,0,0,0,0|2,0,0]=4 6357 B11R0.174 COC(=O)CCCN(C)CCO 246e6a389b50326103e655ced64787ce [0,2,0,0,0,0|2,0,0]=4 6358 B11R0.174 COC(=O)CCNC(C)CCO 6a848b22addac05e670a9286d4265cd7 [0,2,0,0,0,0|2,0,0]=4 6359 B11R0.174 COC(=O)CCN[C@@H](C)CCO 93aae746dc3bfb454ac1fcba4d6b3957 [0,2,0,0,0,0|2,0,0]=4 6360 B11R0.174 COC(=O)CCN[C@H](C)CCO cdb4d972c897401ec8dd365b05b91edd [0,2,0,0,0,0|2,0,0]=4 6361 B11R0.174 COC(=O)CCOC(C)CSC db9335bc539a442a91374d39fe8c0bb0 [0,2,0,0,0,0|2,0,0]=4 6362 B11R0.174 COC(=O)CNCC(C)CCO 265da4f164b33f1fb5981ff3cd008195 [0,2,0,0,0,0|2,0,0]=4 6363 B11R0.174 COC(=O)COC[C@@H](O)CCO 5efaa51353d68ceade5225a8fc031cd2 [0,2,0,0,0,0|2,0,0]=4 6364 B11R0.174 COCC(C)COCC(=O)OC 1d79501a0f9dc1a384a50f68ea27ca64 [0,2,0,0,0,0|2,0,0]=4 6365 B11R0.174 COCC(C)NCCC(=O)NO 3398376ae34d8ecd20985ec03d674036 [0,2,0,0,0,0|2,0,0]=4 6366 B11R0.174 COCC(C)NCCC(=O)OC 9abf36c46243c8e9b47f5bc62c4f8a94 [0,2,0,0,0,0|2,0,0]=4 6367 B11R0.174 COCC(C)OCCC(=O)OC 4763275fbee52774001be3c4d8d3e9fe [0,2,0,0,0,0|2,0,0]=4 6368 B11R0.174 COCC(O)CNCC(=O)CO 03851ff162bc048af76f3a60c1a7afda [0,2,0,0,0,0|2,0,0]=4 6369 B11R0.174 COCC(O)CNCC(=O)NO 2066aa5174c0995621dc9efd7caea854 [0,2,0,0,0,0|2,0,0]=4 6370 B11R0.174 COCC(O)CNCC(=O)OC ecb4efa9ea1103430eb029c46c1f9106 [0,2,0,0,0,0|2,0,0]=4 6371 B11R0.174 COC[C@@H](C)NCCC(=O)OC 722c8e45dd73beb201e1d880c9462385 [0,2,0,0,0,0|2,0,0]=4 6372 B11R0.174 COC[C@@H](C)OCCC(=O)OC fa97f0504a2f5fed6974e9f65d5bb97d [0,2,0,0,0,0|2,0,0]=4 6373 B11R0.174 COC[C@@H](O)CNCC(=O)CO 3102689e7ea69edc8a30b977a2dea753 [0,2,0,0,0,0|2,0,0]=4 6374 B11R0.174 COC[C@@H](O)CNCC(=O)OC 3e4a54eaa80295abfb6bea83a56483ca [0,2,0,0,0,0|2,0,0]=4 6375 B11R0.174 COC[C@H](C)COCC(=O)OC bfb4792b5828e1883acb48a630ffa7d3 [0,2,0,0,0,0|2,0,0]=4 6376 B11R0.174 COC[C@H](C)NCCC(=O)OC f2a039c4699012d039d65197db5d6517 [0,2,0,0,0,0|2,0,0]=4 6377 B11R0.174 COC[C@H](C)OCCC(=O)OC 928cfb883aab802e991ed977e9fe54f8 [0,2,0,0,0,0|2,0,0]=4 6378 B11R0.180 CCCC(C)CNCS(=O)(=O)O 372d03d4fcdb70f9be8d92a6dc2f152b [0,2,0,0,0,0|2,0,0]=4 6379 B11R0.180 CCCC(C)NCCS(=O)(=O)O 91865b689387028fae89e643c855f95d [0,2,0,0,0,0|2,0,0]=4 6380 B11R0.180 CCCC(C)OCCS(=O)(=O)O 5dea90b1ccaa7c318826e4a88d791f6b [0,2,0,0,0,0|2,0,0]=4 6381 B11R0.180 CCCC(O)CNCS(=O)(=O)O 718226fb0e39cbdd6cc5c468d5ccf80b [0,2,0,0,0,0|2,0,0]=4 6382 B11R0.180 CCCN(C)CCCS(=O)(=O)O 8ba0019c105376f51f8380aca94a6d58 [0,2,0,0,0,0|2,0,0]=4 6383 B11R0.180 CCC[C@@H](C)OCCS(=O)(=O)O 83221168616d48181e5d4ff66704e6c3 [0,2,0,0,0,0|2,0,0]=4 6384 B11R0.180 CCC[C@H](C)NCCS(=O)(=O)O a5d355eeef20be9a0f0ed9bb80e9d760 [0,2,0,0,0,0|2,0,0]=4 6385 B11R0.180 CCC[C@H](C)OCCS(=O)(=O)O c38c87e2b7a7d546fafd24379c644ea2 [0,2,0,0,0,0|2,0,0]=4 6386 B11R0.2 C#CCCCCN(C)CC(=O)O 1bacac60fb5e4b3de7e40fbf6f805905 [0,2,0,0,0,0|0,0,2]=4 6387 B11R0.2 C#CCCCNC(C)CC(=O)O e5d7940d944aa3486980e94de9ea4ad4 [0,2,0,0,0,0|0,0,2]=4 6388 B11R0.2 C#CCCCN[C@@H](C)CC(=O)O 0a4551cec41d649d40e89ddf8e3ce6aa [0,2,0,0,0,0|0,0,2]=4 6389 B11R0.2 C#CCCCN[C@H](C)CC(=O)O 5c8e6efe7f1b10678d518e8a8f0735f3 [0,2,0,0,0,0|0,0,2]=4 6390 B11R0.2 C#CCCCOC(C)CC(=O)O 048a5f8a1977ee05801e2902fce82430 [0,2,0,0,0,0|0,0,2]=4 6391 B11R0.2 C#CCCCO[C@@H](C)CC(=O)O 3bbb100ab30189a6ab0bd3cfca89c114 [0,2,0,0,0,0|0,0,2]=4 6392 B11R0.2 C#CCCCO[C@H](C)CC(=O)O 2628cd78b9e40d88d142ea94eb499db8 [0,2,0,0,0,0|0,0,2]=4 6393 B11R0.2 C#CCCNCC(O)CC(=O)O 6c9908d8de0ff6323c9f9510f62c40f7 [0,2,0,0,0,0|0,0,2]=4 6394 B11R0.2 C#CCCNC[C@@H](O)CC(=O)O 6212f800612fddfb1f85ab72cbbff7c8 [0,2,0,0,0,0|0,0,2]=4 6395 B11R0.2 C#CCCNC[C@H](O)CC(=O)O 6dceff4f4c46aa28b18a9206e6610be5 [0,2,0,0,0,0|0,0,2]=4 6396 B11R0.2 C#CCNCCC(C)CC(=O)O fc59790d10c20c793930fe0434070723 [0,2,0,0,0,0|0,0,2]=4 6397 B11R0.2 C#CCOCCC(C)CC(=O)O f52de2e8f88c44fc632cef412f422159 [0,2,0,0,0,0|0,0,2]=4 6398 B11R0.2 C/C=C/CCOC(C)CC(=O)O ee950a258b9dc157bab59b800e5cd237 [0,2,0,0,0,0|0,0,2]=4 6399 B11R0.2 C/C=C/CNCC(O)CC(=O)O b57aec1813c0f10473009e25ecfdcd17 [0,2,0,0,0,0|0,0,2]=4 6400 B11R0.2 C/C=C/CNC[C@@H](O)CC(=O)O 6cebfad36bbde9ce27ce4396e3eccddb [0,2,0,0,0,0|0,0,2]=4 6401 B11R0.2 C/C=C/CNC[C@H](O)CC(=O)O 4737224d084e11f1d141e277fb13620f [0,2,0,0,0,0|0,0,2]=4 6402 B11R0.2 C/C=C\CCCN(C)CC(=O)O dec2a18d5989b86da41ad5e481315b52 [0,2,0,0,0,0|0,0,2]=4 6403 B11R0.2 C/C=C\CNCC(O)CC(=O)O 2c760e8130cc7e78ec738cf793ff787f [0,2,0,0,0,0|0,0,2]=4 6404 B11R0.2 C/C=C\CNC[C@@H](O)CC(=O)O ae780dc13ce9b71233c4f2537c1f3a6a [0,2,0,0,0,0|0,0,2]=4 6405 B11R0.2 C/C=C\CNC[C@H](O)CC(=O)O b44e01d013a74d41f45ca2a7a9734c5f [0,2,0,0,0,0|0,0,2]=4 6406 B11R0.2 C=C(Br)CN(C)CCCCCC 4756b923780623448cd46b178e1dcca8 [0,2,0,0,0,0|2,0,0]=4 6407 B11R0.2 C=C(C)CN(C)CCCCCC 25e3a185530a490738a93b4cf149d5af [0,2,0,0,0,0|2,0,0]=4 6408 B11R0.2 C=C(Cl)CN(C)CCCCCC fa49bf42c14b74e1020aff57d25d90d6 [0,2,0,0,0,0|2,0,0]=4 6409 B11R0.2 C=CCCCCN(C)CC(=O)O 18367dceb2b3a20182a1300d45c94504 [0,2,0,0,0,0|0,0,2]=4 6410 B11R0.2 C=CCCCNC(C)CC(=O)O e88385591f109e5ccb6cd9db4f674a16 [0,2,0,0,0,0|0,0,2]=4 6411 B11R0.2 C=CCCCN[C@@H](C)CC(=O)O 6624fe1d528d72bf55f18e827fe5de4c [0,2,0,0,0,0|0,0,2]=4 6412 B11R0.2 C=CCCCN[C@H](C)CC(=O)O f81a8d09bbdd109c7b34008d5a7188eb [0,2,0,0,0,0|0,0,2]=4 6413 B11R0.2 C=CCCCOC(C)CC(=O)O 7db8181421a3540b64e316ca5fa6d925 [0,2,0,0,0,0|0,0,2]=4 6414 B11R0.2 C=CCCCO[C@@H](C)CC(=O)O 9a38c7dbbb0d537b283f2cef8c07b852 [0,2,0,0,0,0|0,0,2]=4 6415 B11R0.2 C=CCCCO[C@H](C)CC(=O)O 8f91f1a49776bd2e354d270e3e1aea8b [0,2,0,0,0,0|0,0,2]=4 6416 B11R0.2 C=CCCNCC(O)CC(=O)O 7a09c74223ee371fd41a82e413a1814c [0,2,0,0,0,0|0,0,2]=4 6417 B11R0.2 C=CCCNC[C@@H](O)CC(=O)O c4eb6b76e60982c2f61532eaa9683327 [0,2,0,0,0,0|0,0,2]=4 6418 B11R0.2 C=CCCNC[C@H](O)CC(=O)O 462e57b866cc82513846c0535ffc78fe [0,2,0,0,0,0|0,0,2]=4 6419 B11R0.2 CC#CCCOC(C)CC(=O)O 3c0c380ca833dc12df18ceb9f97b75a5 [0,2,0,0,0,0|0,0,2]=4 6420 B11R0.2 CC(CC(=O)N)OCCCCF a1ae5726da49cabf57006544ec2b88c2 [0,2,0,0,0,0|2,0,0]=4 6421 B11R0.2 CC(CC(=O)O)NCCCC#N 541e0842d5580c096c25dd2abc4403cb [0,2,0,0,0,0|1,0,1]=4 6422 B11R0.2 CC(CC(=O)O)NCCCC=O ee9d93472910ac671c0fa69eebff9ed1 [0,2,0,0,0,0|1,0,1]=4 6423 B11R0.2 CC(CC(=O)O)NCCCCCl b331d0c86b049005bf08062a71d294c4 [0,2,0,0,0,0|1,0,0]=3 6424 B11R0.2 CC(CC(=O)O)NCCCCF 0ab1ef0cfae5c2805fd9d4711c296ea0 [0,2,0,0,0,0|1,0,0]=3 6425 B11R0.2 CC(CC(=O)O)NCCCCO 6e13e79fbb4ef5e1dab6d3cf15f5e138 [0,2,0,0,0,0|1,0,0]=3 6426 B11R0.2 CC(CC(=O)O)NCCCCS b1ff01afe8b912f8bf615c463090cd2d [0,2,0,0,0,0|1,0,0]=3 6427 B11R0.2 CC(CC(=O)O)OCCCC#N 4ca5dad571399cbd22e44ba5c0f1f1de [0,2,0,0,0,0|1,0,1]=4 6428 B11R0.2 CC(CC(=O)O)OCCCC=O e2a469c73cc3552276e1d79d041d532c [0,2,0,0,0,0|1,0,1]=4 6429 B11R0.2 CC(CC(=O)O)OCCCCF 83ec30abf4260741aee18f3da935bde5 [0,2,0,0,0,0|1,0,0]=3 6430 B11R0.2 CC(CCNCC#N)CC(=O)O 56ddb9c8bec4a51dff71800d9b895206 [0,2,0,0,0,0|1,0,1]=4 6431 B11R0.2 CC(CCNCCBr)CC(=O)O bba1e8138b07ce55051d0aabea777ad3 [0,2,0,0,0,0|1,0,0]=3 6432 B11R0.2 CC(CCNCCF)CC(=O)O 981d7b96788088140e88d6f568d7e70a [0,2,0,0,0,0|1,0,0]=3 6433 B11R0.2 CC(CCNCCI)CC(=O)O 1fb2dd48d2ae1d6e4aaa846221efafd4 [0,2,0,0,0,0|1,0,0]=3 6434 B11R0.2 CC(CCNCCO)CC(=O)O ef40bd0cccd720b29e6419d585cbd8c9 [0,2,0,0,0,0|1,0,0]=3 6435 B11R0.2 CC(CCNCCS)CC(=O)O 763121a5e4adb3523211fa7efd1ad56f [0,2,0,0,0,0|1,0,0]=3 6436 B11R0.2 CC(CCOCC#N)CC(=O)O 88e3c00e02a124846cf29d9ec463ea15 [0,2,0,0,0,0|1,0,1]=4 6437 B11R0.2 CC(CCOCCF)CC(=O)O 8b0e6d33ad5baeaace35366d9ba4a1ef [0,2,0,0,0,0|1,0,0]=3 6438 B11R0.2 CC(CCOCCS)CC(=O)O bdb288c9ac72be4a538660ab84972031 [0,2,0,0,0,0|1,0,0]=3 6439 B11R0.2 CC/C=C/CNC(C)CC(=O)O 95a6ef507372b34f43e966570e644176 [0,2,0,0,0,0|0,0,2]=4 6440 B11R0.2 CC/C=C/CN[C@@H](C)CC(=O)O 08643acea314a90a150b7e8dbff75f19 [0,2,0,0,0,0|0,0,2]=4 6441 B11R0.2 CC/C=C/CN[C@H](C)CC(=O)O 66dcdc9523df2d200fa177cec07076cc [0,2,0,0,0,0|0,0,2]=4 6442 B11R0.2 CC/C=C/COC(C)CC(=O)O ba502d56855c1f75de22310017b74b3d [0,2,0,0,0,0|0,0,2]=4 6443 B11R0.2 CC/C=C/CO[C@@H](C)CC(=O)O cc53d3e596f907dd366d83a41ace2732 [0,2,0,0,0,0|0,0,2]=4 6444 B11R0.2 CC/C=C/CO[C@H](C)CC(=O)O 174138683e85e2c4f066e30bdee3cc42 [0,2,0,0,0,0|0,0,2]=4 6445 B11R0.2 CC/C=C\CCN(C)CC(=O)O ce9937a86397677247a7c5a80f81b3ed [0,2,0,0,0,0|0,0,2]=4 6446 B11R0.2 CC/C=C\COC(C)CC(=O)O 96e4c13cb5e0c35b520a878d3bd622be [0,2,0,0,0,0|0,0,2]=4 6447 B11R0.2 CCC/C=C/CN(C)CC(=O)O 397e74fe27cec6f732b96823b2ff274f [0,2,0,0,0,0|0,0,2]=4 6448 B11R0.2 CCC/C=C\CN(C)CC(=O)O 93acd36d43f25a3d8720f6765a577d1d [0,2,0,0,0,0|0,0,2]=4 6449 B11R0.2 CCCCCCC(C)NC(=O)C 7d2594c88fb8150c121e8324175f88c5 [0,2,0,0,0,0|1,0,0]=3 6450 B11R0.2 CCCCCCN(C)CC(=O)N 2afd7c62493d1775bf0dfb85f9ba8679 [0,2,0,0,0,0|1,0,0]=3 6451 B11R0.2 CCCCCCN(C)CC(=O)O fffbd83ababffa159958606d9a112cce [0,2,0,0,0,0|0,0,0]=2 6452 B11R0.2 CCCCCCN(C)CC(C)O a9dd09345b7ade61af05dba120ab6503 [0,2,0,0,0,0|1,0,1]=4 6453 B11R0.2 CCCCCCN(C)C[C@@H](C)O c920e3f5d8a26d97a0c4849baa4d03d2 [0,2,0,0,0,0|1,0,1]=4 6454 B11R0.2 CCCCCCN(C)C[C@H](C)O 94f3e4ffc4936f66a71ce3f1da85b272 [0,2,0,0,0,0|1,0,1]=4 6455 B11R0.2 CCCCCCN(C)C[N+](=O)[O-] 3e4082bfed5e0b59ff26738647c4da85 [0,2,0,0,0,0|1,0,1]=4 6456 B11R0.2 CCCCCC[C@@H](C)NC(=O)C af528d8f66525ad70454e456f4855ab6 [0,2,0,0,0,0|1,0,0]=3 6457 B11R0.2 CCCCCC[C@H](C)NC(=O)C 4ac5ea84352b83ba49d889143f6264a1 [0,2,0,0,0,0|1,0,0]=3 6458 B11R0.2 CCCCCNC(=O)CC(=O)C b9f6fefcf600ebaa9b87d233da70a209 [0,2,0,0,0,0|1,0,1]=4 6459 B11R0.2 CCCCCNC(=O)CC(=O)N 710f88fe373ae09649f4f4c926d58dc6 [0,2,0,0,0,0|1,0,1]=4 6460 B11R0.2 CCCCCNC(C)CC(=O)O 35ff80d8a8ecd4079ace6eaf7231bc4a [0,2,0,0,0,0|0,0,0]=2 6461 B11R0.2 CCCCCNC(C)CC(C)O 64648d0e2e8ea3834876aee95836a97d [0,2,0,0,0,0|1,0,1]=4 6462 B11R0.2 CCCCCNC(C)OC(=O)C 651d421f1dff9a2897abeac0ec7ca1a5 [0,2,0,0,0,0|2,0,0]=4 6463 B11R0.2 CCCCCN[C@@H](C)CC(=O)O c45c1d80dfd9c8037699654c10768e13 [0,2,0,0,0,0|0,0,0]=2 6464 B11R0.2 CCCCCN[C@H](C)CC(=O)O de2ba2e7faa23b2ad6983512ff9a06fc [0,2,0,0,0,0|0,0,0]=2 6465 B11R0.2 CCCCCOC(C)CC(=O)N f8e1b826266308c0b0e93a288800c0a5 [0,2,0,0,0,0|1,0,0]=3 6466 B11R0.2 CCCCCOC(C)CC(=O)O c4f6d91d5cba7a6eb60e8eedc267d663 [0,2,0,0,0,0|0,0,0]=2 6467 B11R0.2 CCCCCOC(C)C[N+](=O)[O-] 10cef706fb85e41b9f1d9a5715e673c9 [0,2,0,0,0,0|1,0,1]=4 6468 B11R0.2 CCCCCOC(C)OC(=O)C b3f4881419ed11c1fe16fad8e148a6d9 [0,2,0,0,0,0|2,0,0]=4 6469 B11R0.2 CCCCCO[C@@H](C)CC(=O)O 760c1d1cf7508749ba57f8e374efa729 [0,2,0,0,0,0|0,0,0]=2 6470 B11R0.2 CCCCCO[C@H](C)CC(=O)O 8b6a404610ba4ea008d74ddda615d1d3 [0,2,0,0,0,0|0,0,0]=2 6471 B11R0.2 CCCCNCC(=O)CC(=O)O 924460e29012324689885e436a9da05b [0,2,0,0,0,0|0,0,1]=3 6472 B11R0.2 CCCCNCC(O)CC(=O)O 5cd44d1731f9375b8f32ca873f44f433 [0,2,0,0,0,0|0,0,0]=2 6473 B11R0.2 CCCCNC[C@@H](O)CC(=O)O 26599441bd630ac3e4d20d4b6672416d [0,2,0,0,0,0|0,0,0]=2 6474 B11R0.2 CCCCNC[C@H](O)CC(=O)O a6b23ab90314f2eda54f59837c52415c [0,2,0,0,0,0|0,0,0]=2 6475 B11R0.2 CCCCOCC(=O)CC(=O)O bee6e58f12e6a46c40700c754be2d5be [0,2,0,0,0,0|0,0,1]=3 6476 B11R0.2 CCCCOCC(C)NC(=O)C e161e9db7251f8f77526dfd842c19bfc [0,2,0,0,0,0|2,0,0]=4 6477 B11R0.2 CCCCOCN(C)CC(=O)N 39b884ae6bff76e70e4a8dd71be98fd6 [0,2,0,0,0,0|2,0,0]=4 6478 B11R0.2 CCCCOCN(C)CC(=O)O 366130abc5c0618364805b732068c639 [0,2,0,0,0,0|1,0,0]=3 6479 B11R0.2 CCCCOC[C@@H](C)NC(=O)C a5e2936777c90350c2c332f2a167f0d1 [0,2,0,0,0,0|2,0,0]=4 6480 B11R0.2 CCCNCCC(C)CC(=O)O 3df807e8d4a6f4424410fa08035527d6 [0,2,0,0,0,0|0,0,0]=2 6481 B11R0.2 CCCOCCC(C)CC(=O)O 9bbb78eef3e48b584e04ea8fe4ce94ed [0,2,0,0,0,0|0,0,0]=2 6482 B11R0.2 CCCOCCN(C)CC(=O)C f9f8448b5af0567aecde1096190abb74 [0,2,0,0,0,0|2,0,0]=4 6483 B11R0.2 CCCOCCN(C)CC(=O)N 7f4bec886ae84a0ca4afaa5294e331de [0,2,0,0,0,0|2,0,0]=4 6484 B11R0.2 CCCOCCN(C)CC(=O)O 6eb60fa6cbce5573167abece5b4dd060 [0,2,0,0,0,0|1,0,0]=3 6485 B11R0.2 CCOCCCN(C)CC(=O)N 87ed155ede84bf5cdcd0c1a952a96eb2 [0,2,0,0,0,0|2,0,0]=4 6486 B11R0.2 CCOCCCN(C)CC(=O)O d36503e2c1e74cdc0f0b425927b33cc3 [0,2,0,0,0,0|1,0,0]=3 6487 B11R0.2 CCOCCNC(C)CC(=O)O a15a3fffeaf0a2f3de62a1a038696d92 [0,2,0,0,0,0|1,0,0]=3 6488 B11R0.2 CCOCCN[C@@H](C)CC(=O)O 044071e079b6d7207205dc1c3ee76ce8 [0,2,0,0,0,0|1,0,0]=3 6489 B11R0.2 CCOCCN[C@H](C)CC(=O)O 4dd36f6823dc4f005eaff8bf660467be [0,2,0,0,0,0|1,0,0]=3 6490 B11R0.2 CCOCCOC(C)CC(=O)N 1ad6ba24a6183f109432cb0a1fb5b291 [0,2,0,0,0,0|2,0,0]=4 6491 B11R0.2 CCOCCOC(C)CC(=O)O cfec32be174307cbe281e0567b463a1f [0,2,0,0,0,0|1,0,0]=3 6492 B11R0.2 CCOCCO[C@@H](C)CC(=O)O 778f64cf9be2f57ec97eeb3f8959162d [0,2,0,0,0,0|1,0,0]=3 6493 B11R0.2 CCOCCO[C@H](C)CC(=O)O 29342161c7a4e299f35958ee10b81573 [0,2,0,0,0,0|1,0,0]=3 6494 B11R0.2 CCOCNCC(O)CC(=O)O f0e005d08cf5516603fc5b7d1a459aa3 [0,2,0,0,0,0|1,0,0]=3 6495 B11R0.2 CCOCNC[C@@H](O)CC(=O)O 828ebd4a30a371da6dd94204746f68ce [0,2,0,0,0,0|1,0,0]=3 6496 B11R0.2 CCOCNC[C@H](O)CC(=O)O 4f07e848f41b1f8b44bead0f67cd13a0 [0,2,0,0,0,0|1,0,0]=3 6497 B11R0.2 CCSCCCN(C)CC(=O)N 4f9c63ba57b1c80f6e4f1ad956dbfa25 [0,2,0,0,0,0|2,0,0]=4 6498 B11R0.2 CCSCCCN(C)CC(=O)O c951f6788f00a0f0c0ef07f1b26f296c [0,2,0,0,0,0|1,0,0]=3 6499 B11R0.2 CCSCCNC(C)CC(=O)O 74d8de5b518b0ff401548001d266592c [0,2,0,0,0,0|1,0,0]=3 6500 B11R0.2 CCSCCN[C@@H](C)CC(=O)O 0e575ecfccb78779b4e018fd110711dc [0,2,0,0,0,0|1,0,0]=3 6501 B11R0.2 CCSCCN[C@H](C)CC(=O)O c49b112fc56e991990ec4431189cbc81 [0,2,0,0,0,0|1,0,0]=3 6502 B11R0.2 CCSCCOC(C)CC(=O)N e30d598390a8a5705feb04e59f3b67f3 [0,2,0,0,0,0|2,0,0]=4 6503 B11R0.2 CCSCCOC(C)CC(=O)O 5c494fcb0170a88a41ab2559a61230cd [0,2,0,0,0,0|1,0,0]=3 6504 B11R0.2 CN(CCCCC#N)CC(=O)O 93d374a59648c247501722309eef5e4a [0,2,0,0,0,0|1,0,1]=4 6505 B11R0.2 CN(CCCCC=O)CC(=O)O 621b35401dcb3806a6b053759672c2b2 [0,2,0,0,0,0|1,0,1]=4 6506 B11R0.2 CN(CCCCCF)CC(=O)N efb566dfb7dca2b5e03a100289ebbfa9 [0,2,0,0,0,0|2,0,0]=4 6507 B11R0.2 CN(CCCCCF)CC(=O)O 12639e047e14b8526dd0c46ed16ca6a0 [0,2,0,0,0,0|1,0,0]=3 6508 B11R0.2 CN(CCCCCO)CC(=O)N b92617a16bc01618e15f7cb6ac8a7930 [0,2,0,0,0,0|2,0,0]=4 6509 B11R0.2 CN(CCCCCO)CC(=O)O 83b7e21eeb46918d762b90e77be80bca [0,2,0,0,0,0|1,0,0]=3 6510 B11R0.2 CN(CCCCON)CC(=O)O 94c60390a7fbfaff94cb6c763b84d64c [0,2,0,0,0,0|2,0,0]=4 6511 B11R0.2 CN(CCOCCF)CC(=O)O 3d467d8b14d70071c3b8f69d17afde06 [0,2,0,0,0,0|2,0,0]=4 6512 B11R0.2 CN(CCOCCO)CC(=O)O 0b673cbd9105afffbc847610b1d7ee29 [0,2,0,0,0,0|2,0,0]=4 6513 B11R0.2 CN(CCOCCS)CC(=O)O 1a7937124ffe7c95c36b0e152dfef8d8 [0,2,0,0,0,0|2,0,0]=4 6514 B11R0.2 COCCCCN(C)CC(=O)N bce4d38251310c7fa37c34f644354f4b [0,2,0,0,0,0|2,0,0]=4 6515 B11R0.2 COCCCCN(C)CC(=O)O 4e3b3f81e00138eb82c9761e9e6d6a82 [0,2,0,0,0,0|1,0,0]=3 6516 B11R0.2 COCCCNC(C)CC(=O)O 9a0205d62a43a92c14b3729996b3fc84 [0,2,0,0,0,0|1,0,0]=3 6517 B11R0.2 COCCCN[C@@H](C)CC(=O)O 07532df5ef9a55af4313d8a5af39583b [0,2,0,0,0,0|1,0,0]=3 6518 B11R0.2 COCCCN[C@H](C)CC(=O)O 47def5a71bdc0bea4005c452fabf52fe [0,2,0,0,0,0|1,0,0]=3 6519 B11R0.2 COCCCOC(C)CC(=O)N 2cf5626f112621cf0fb3a899446ffbd6 [0,2,0,0,0,0|2,0,0]=4 6520 B11R0.2 COCCCOC(C)CC(=O)O 89020822910975f48996cd77d10f047b [0,2,0,0,0,0|1,0,0]=3 6521 B11R0.2 COCCCO[C@@H](C)CC(=O)O 64ff7b73fc8bf7395c9a2fe2cdb67c79 [0,2,0,0,0,0|1,0,0]=3 6522 B11R0.2 COCCCO[C@H](C)CC(=O)O d167dfc9432878848a948379fb4bcac0 [0,2,0,0,0,0|1,0,0]=3 6523 B11R0.2 COCCNCC(=O)CC(=O)O bdb1840c3006e89cec6865ec47dc2198 [0,2,0,0,0,0|1,0,1]=4 6524 B11R0.2 COCCNCC(O)CC(=O)O 7245dd8ea6e73dc86e145a8b152cc3a1 [0,2,0,0,0,0|1,0,0]=3 6525 B11R0.2 COCCNC[C@@H](O)CC(=O)O 50183035a6ca43df4d7557a2346f43bd [0,2,0,0,0,0|1,0,0]=3 6526 B11R0.2 COCCNC[C@H](O)CC(=O)O d6f2b77d0b4b5603b217903d5ac6deaf [0,2,0,0,0,0|1,0,0]=3 6527 B11R0.2 COCCOCC(=O)CC(=O)O bcc36c50188da18c0466fa20d9d00bc6 [0,2,0,0,0,0|1,0,1]=4 6528 B11R0.2 COCCOCN(C)CC(=O)O 059ea4daa03f3652e88004a901c2e46f [0,2,0,0,0,0|2,0,0]=4 6529 B11R0.2 COCOCCC(C)CC(=O)O 843ddeb10c9fd9e50e45da0778203112 [0,2,0,0,0,0|1,0,0]=3 6530 B11R0.2 COCOCCN(C)CC(=O)O 36a1358b59c95e2755dd1870e7f9580c [0,2,0,0,0,0|2,0,0]=4 6531 B11R0.2 CSCCCNC(C)CC(=O)O 52dfb832f2459c5f495ca3f890127451 [0,2,0,0,0,0|1,0,0]=3 6532 B11R0.2 CSCCCN[C@@H](C)CC(=O)O cea454f9c59cdb48628f31cb9e7d1af0 [0,2,0,0,0,0|1,0,0]=3 6533 B11R0.2 CSCCCN[C@H](C)CC(=O)O ee10f861e06f9fffd7e65f305fb1018b [0,2,0,0,0,0|1,0,0]=3 6534 B11R0.2 CSCCCOC(C)CC(=O)N ab4b029918407794987aa8fea825d68a [0,2,0,0,0,0|2,0,0]=4 6535 B11R0.2 CSCCCOC(C)CC(=O)O d0f846f0c54f0932c08009562947ebf1 [0,2,0,0,0,0|1,0,0]=3 6536 B11R0.2 CSCCCO[C@@H](C)CC(=O)O 34f00cedeee38e529f099e58f0d869ac [0,2,0,0,0,0|1,0,0]=3 6537 B11R0.2 CSCCCO[C@H](C)CC(=O)O a9143fddbc2176d077c08b4304e87268 [0,2,0,0,0,0|1,0,0]=3 6538 B11R0.2 CSCCNCC(=O)CC(=O)O 9bb04c677a929b74d4311171edc7654c [0,2,0,0,0,0|1,0,1]=4 6539 B11R0.2 CSCCNCC(O)CC(=O)O a0b90bc6bdedd8e4602f3820a767c916 [0,2,0,0,0,0|1,0,0]=3 6540 B11R0.2 CSCCNC[C@@H](O)CC(=O)O 27c7a971143bacc39e7341163fc94731 [0,2,0,0,0,0|1,0,0]=3 6541 B11R0.2 CSCCNC[C@H](O)CC(=O)O 7d84bb16b1d9a976dacbb733bf15a253 [0,2,0,0,0,0|1,0,0]=3 6542 B11R0.2 CSCCOCC(=O)CC(=O)O f9d2f3b95c9f4c3e9c9da0a046d530e3 [0,2,0,0,0,0|1,0,1]=4 6543 B11R0.2 CSCOCCN(C)CC(=O)O fa9f086e5b7fe1fc9b1228abe5cece3c [0,2,0,0,0,0|2,0,0]=4 6544 B11R0.2 C[C@@H](CC(=O)O)NCCCC#N d1fd6c39c8eaef5f188954d077b3cb3a [0,2,0,0,0,0|1,0,1]=4 6545 B11R0.2 C[C@@H](CC(=O)O)NCCCC=O 44d356bb3bb9e73104c56d50188f6d48 [0,2,0,0,0,0|1,0,1]=4 6546 B11R0.2 C[C@@H](CC(=O)O)NCCCCF f221a374204d6d070cc508a569cb6fdc [0,2,0,0,0,0|1,0,0]=3 6547 B11R0.2 C[C@@H](CC(=O)O)NCCCCO 704779c61403675510f67ed57c0e6f28 [0,2,0,0,0,0|1,0,0]=3 6548 B11R0.2 C[C@@H](CC(=O)O)OCCCC#N 26066ccc4aaa1940611a6cdc1c327dfa [0,2,0,0,0,0|1,0,1]=4 6549 B11R0.2 C[C@@H](CC(=O)O)OCCCC=O 74289a04be60128d4ff653694df330fa [0,2,0,0,0,0|1,0,1]=4 6550 B11R0.2 C[C@@H](CC(=O)O)OCCCCF e7e443470709eda4bdf8c6e4d188719b [0,2,0,0,0,0|1,0,0]=3 6551 B11R0.2 C[C@H](CC(=O)O)NCCCC#N 1661fef777733aaac8782bf69db27e4c [0,2,0,0,0,0|1,0,1]=4 6552 B11R0.2 C[C@H](CC(=O)O)NCCCC=O 7c8bebb1978e2281eb8de61b8774f4cd [0,2,0,0,0,0|1,0,1]=4 6553 B11R0.2 C[C@H](CC(=O)O)NCCCCF 64cd394c1ecb451ee05250a0826800a4 [0,2,0,0,0,0|1,0,0]=3 6554 B11R0.2 C[C@H](CC(=O)O)NCCCCO 9493a0e444e889bab899afcf7d491c35 [0,2,0,0,0,0|1,0,0]=3 6555 B11R0.2 C[C@H](CC(=O)O)OCCCC#N e7e56fb51bad9d194d1f1efcc90ff35a [0,2,0,0,0,0|1,0,1]=4 6556 B11R0.2 C[C@H](CC(=O)O)OCCCC=O 91f651deb7ed2c77ab6487807ae9a9cb [0,2,0,0,0,0|1,0,1]=4 6557 B11R0.2 C[C@H](CC(=O)O)OCCCCF 97c0633bc8ada75a21b39ea490d61d95 [0,2,0,0,0,0|1,0,0]=3 6558 B11R0.2 N#CCCNCC(O)CC(=O)O ab09a20557c8235eae8e0203caf3d660 [0,2,0,0,0,0|1,0,1]=4 6559 B11R0.2 N#CCCNC[C@@H](O)CC(=O)O 37232cb6ded36e357a4e73260988ca1d [0,2,0,0,0,0|1,0,1]=4 6560 B11R0.2 N#CCCNC[C@H](O)CC(=O)O cf1dad0cb44f438f0290bea7b0fe9a73 [0,2,0,0,0,0|1,0,1]=4 6561 B11R0.2 O=C(O)CC(=O)CNCCCCl 4291123307c3c713ca8d13a21d642ffc [0,2,0,0,0,0|1,0,1]=4 6562 B11R0.2 O=C(O)CC(=O)CNCCCO 837198fd4c62ecd8af2369575dba3c2a [0,2,0,0,0,0|1,0,1]=4 6563 B11R0.2 O=C(O)CC(=O)COCCCF 6f7371459e632894dfa6a48be5076b95 [0,2,0,0,0,0|1,0,1]=4 6564 B11R0.2 O=C(O)CC(O)CNCCCF b597f9da5bfa5502b4b824595ef9dadc [0,2,0,0,0,0|1,0,0]=3 6565 B11R0.2 O=C(O)CC(O)CNCCCO e8421a993a6e4ebc00c059e03d8b5589 [0,2,0,0,0,0|1,0,0]=3 6566 B11R0.2 O=C(O)CC(O)CNCCCS fea648af86df17193bb32e89e7cfa1c9 [0,2,0,0,0,0|1,0,0]=3 6567 B11R0.2 O=C(O)C[C@@H](O)CNCCCF 4192980fb55d1138c4144bb3a565c35f [0,2,0,0,0,0|1,0,0]=3 6568 B11R0.2 O=C(O)C[C@@H](O)CNCCCO 8fbb8fade9c7cc3a07ee7bc8b12b519d [0,2,0,0,0,0|1,0,0]=3 6569 B11R0.2 O=C(O)C[C@@H](O)CNCCCS 4c4801d0aad5ae9804124921d86ad8ff [0,2,0,0,0,0|1,0,0]=3 6570 B11R0.2 O=C(O)C[C@H](O)CNCCCF 4494c06e74da87814ee9518fabf1782a [0,2,0,0,0,0|1,0,0]=3 6571 B11R0.2 O=C(O)C[C@H](O)CNCCCO 663e42a4437f78547401fb74b1c19cf7 [0,2,0,0,0,0|1,0,0]=3 6572 B11R0.2 O=C(O)C[C@H](O)CNCCCS 1d742f00a2dc0009c7b61bf82ba5f91c [0,2,0,0,0,0|1,0,0]=3 6573 B11R0.2 O=CCCNCC(O)CC(=O)O a5d82134291a398853fd122771701d9e [0,2,0,0,0,0|1,0,1]=4 6574 B11R0.2 O=CCCNC[C@@H](O)CC(=O)O e6716139b4859e624df68e1953929f39 [0,2,0,0,0,0|1,0,1]=4 6575 B11R0.2 O=CCCNC[C@H](O)CC(=O)O 93f45fd92535606d713593f9e2e28db9 [0,2,0,0,0,0|1,0,1]=4 6576 B11R0.30 C/C(=C/CNCCCC(=O)O)/I 81393dd9290d3a414e94f2b183e16be1 [0,2,0,0,0,0|0,0,2]=4 6577 B11R0.30 C/C(=C/COCCCC(=O)O)/Cl 38dd013a17f2993ceecf433a74273a24 [0,2,0,0,0,0|0,0,2]=4 6578 B11R0.30 C/C(=C/COCCCC(=O)O)/I 2ff509dbbfa68a3044af1b151bdaa799 [0,2,0,0,0,0|0,0,2]=4 6579 B11R0.30 C/C(=C\CNCCCC(=O)O)/Cl fdfd6a988be32efd6cb62f162c7311fe [0,2,0,0,0,0|0,0,2]=4 6580 B11R0.30 C=C(Br)CCOCCCC(C)C 1cd2f6cade84b4928ad1add6fe68e112 [0,2,0,0,0,0|2,0,0]=4 6581 B11R0.30 C=C(Br)CNCCCCC(=O)O aae50b2a43bb2d7a0e909f50b44ac595 [0,2,0,0,0,0|0,0,2]=4 6582 B11R0.30 C=C(Br)CNCCCCC(C)C cac4138897af727ff92bc1661aad8366 [0,2,0,0,0,0|2,0,0]=4 6583 B11R0.30 C=C(Br)CNCCCCC(C)O b9339289422dfb1873b46d6768326030 [0,2,0,0,0,0|2,0,0]=4 6584 B11R0.30 C=C(Br)CNCCCC[C@@H](C)O 6cefeac2975eb9de66de26702ecd8681 [0,2,0,0,0,0|2,0,0]=4 6585 B11R0.30 C=C(Br)COCCCCC(=O)O 841b4538034b27166db4c5ad24813017 [0,2,0,0,0,0|0,0,2]=4 6586 B11R0.30 C=C(Br)COCCCCC(C)C fb4f2997a35fb18f6c6a289c4b34ab24 [0,2,0,0,0,0|2,0,0]=4 6587 B11R0.30 C=C(C)CCCNCCC(=O)N 5676d953f781f0ff8f816995da33d0e7 [0,2,0,0,0,0|1,0,1]=4 6588 B11R0.30 C=C(C)CCCNCCC(=O)O 544896bfdf9464fa0a936c441c95e572 [0,2,0,0,0,0|0,0,1]=3 6589 B11R0.30 C=C(C)CCCNCCC(C)C 3460e9989e76d8ec28ca7f7087cc7f1b [0,2,0,0,0,0|2,0,0]=4 6590 B11R0.30 C=C(C)CCCNCCC(C)O 32bec6ae0f35b6923811bdaf1fce125e [0,2,0,0,0,0|2,0,0]=4 6591 B11R0.30 C=C(C)CCCNCCS(=O)O 19078f1413e3575e3d902902c7f4717a [0,2,0,0,0,0|1,0,1]=4 6592 B11R0.30 C=C(C)CCCNCC[C@@H](C)O e5071c108dbb56675711165aade816fe [0,2,0,0,0,0|2,0,0]=4 6593 B11R0.30 C=C(C)CCCNCC[C@H](C)O ce96cf78fa008c363474df3787aee175 [0,2,0,0,0,0|2,0,0]=4 6594 B11R0.30 C=C(C)CCCOCCC(=O)C 0abda35b2e3f9d496c584b42d6ea7718 [0,2,0,0,0,0|1,0,1]=4 6595 B11R0.30 C=C(C)CCCOCCC(=O)N fce9df11dcdbc608edbcb5d5ba5d0bf6 [0,2,0,0,0,0|1,0,1]=4 6596 B11R0.30 C=C(C)CCCOCCC(=O)O d1d9a510249864686b07c2c599d33cf7 [0,2,0,0,0,0|0,0,1]=3 6597 B11R0.30 C=C(C)CCCOCCC(C)C ffdfbc30f09d0ffbc6d506519c2e6c35 [0,2,0,0,0,0|2,0,0]=4 6598 B11R0.30 C=C(C)CCNCCCC(=O)C 1cb95118c601357a36caebe7d2643e27 [0,2,0,0,0,0|1,0,1]=4 6599 B11R0.30 C=C(C)CCNCCCC(=O)N 14490118326f11d592276b3be60176b3 [0,2,0,0,0,0|1,0,1]=4 6600 B11R0.30 C=C(C)CCNCCCC(=O)O 4c01cc892d0c201003dffca49566a552 [0,2,0,0,0,0|0,0,1]=3 6601 B11R0.30 C=C(C)CCNCCCC(C)C 9efead5e69687021b8ef0f6110cda1e2 [0,2,0,0,0,0|2,0,0]=4 6602 B11R0.30 C=C(C)CCNCCCC(C)O 8309aa5f3c6e80eb9e68453865f58e9f [0,2,0,0,0,0|2,0,0]=4 6603 B11R0.30 C=C(C)CCOCCCC(=O)C c857b7afecf58a12a51526b4b3ab25d1 [0,2,0,0,0,0|1,0,1]=4 6604 B11R0.30 C=C(C)CCOCCCC(=O)N d60753e03fcc6d3bb100636e7a7a8d9c [0,2,0,0,0,0|1,0,1]=4 6605 B11R0.30 C=C(C)CCOCCCC(C)C ab7033516b0d29d32effc9abbac20f57 [0,2,0,0,0,0|2,0,0]=4 6606 B11R0.30 C=C(C)CNCCCCC(=O)C e5e47fbe4a23264284b3e9004bab5dfc [0,2,0,0,0,0|1,0,1]=4 6607 B11R0.30 C=C(C)CNCCCCC(=O)N 07c208af9060d31ec411e72c1734e686 [0,2,0,0,0,0|1,0,1]=4 6608 B11R0.30 C=C(C)CNCCCCC(=O)O e9f19bdfbade7f5ebcb1d3a03088003e [0,2,0,0,0,0|0,0,1]=3 6609 B11R0.30 C=C(C)CNCCCCC(C)C b0970ea41d21d962acfc89ae48f22597 [0,2,0,0,0,0|2,0,0]=4 6610 B11R0.30 C=C(C)CNCCCCC(C)O cdbb107659f1689f6d58278690f3f7b7 [0,2,0,0,0,0|2,0,0]=4 6611 B11R0.30 C=C(C)CNCCCC[C@@H](C)O 03857abf64811fd982b8a5a262263903 [0,2,0,0,0,0|2,0,0]=4 6612 B11R0.30 C=C(C)CNCCOCC(=O)O 341d888ab489099c9f65e21d06623337 [0,2,0,0,0,0|1,0,1]=4 6613 B11R0.30 C=C(C)CNCCSCC(=O)O 439950f306d0634682e555f978a53d4c [0,2,0,0,0,0|1,0,1]=4 6614 B11R0.30 C=C(C)COCCCCC(=O)C d77d62703298529e1957989657facca2 [0,2,0,0,0,0|1,0,1]=4 6615 B11R0.30 C=C(C)COCCCCC(=O)N 7acbea428b280a1bfb9fed501a2849f9 [0,2,0,0,0,0|1,0,1]=4 6616 B11R0.30 C=C(C)COCCCCC(=O)O 35e8b99d3aa4c924a74b1d98c7280906 [0,2,0,0,0,0|0,0,1]=3 6617 B11R0.30 C=C(C)COCCCCC(C)C 76ad203f4f853d27c285f768c838cd42 [0,2,0,0,0,0|2,0,0]=4 6618 B11R0.30 C=C(C)COCCOCC(=O)O ade362170870553a6a4f4565dfe46b49 [0,2,0,0,0,0|1,0,1]=4 6619 B11R0.30 C=C(Cl)COCCCCC(=O)O 6495c6d7945090ac2cd10f8a9bc1bb06 [0,2,0,0,0,0|0,0,2]=4 6620 B11R0.30 C=C(Cl)COCCCCC(C)C 69ce766a7bb660957ab31fd12ded392e [0,2,0,0,0,0|2,0,0]=4 6621 B11R0.30 C=C(F)CNCCCCC(=O)O 0439aba0cc8c17a27577baa5041ef23c [0,2,0,0,0,0|0,0,2]=4 6622 B11R0.30 C=C(F)COCCCCC(=O)O 7befe79ade50792c8803ada47635f246 [0,2,0,0,0,0|0,0,2]=4 6623 B11R0.30 C=C(F)COCCCCC(C)C 1da3a328f0c68903adc4598fff1d49e1 [0,2,0,0,0,0|2,0,0]=4 6624 B11R0.30 C=C(I)COCCCCC(C)C 359bef837f01b2b26aa1f6e1419438b8 [0,2,0,0,0,0|2,0,0]=4 6625 B11R0.30 CC(=CCCNCCC(=O)O)C c7c1903226a426a2b0165fda8ab0b968 [0,2,0,0,0,0|0,0,2]=4 6626 B11R0.30 CC(=CCCOCCC(=O)O)C 7316f6be8e7031e9fa6be94dc060d329 [0,2,0,0,0,0|0,0,2]=4 6627 B11R0.30 CC(=CCNCCCC(=O)O)C ebc7bbeeb08ce996ea89af4b74d57533 [0,2,0,0,0,0|0,0,2]=4 6628 B11R0.30 CC(=CCNCCCC(=O)O)Cl c2acdd05a0ef6302b3e23ce653579768 [0,2,0,0,0,0|0,0,2]=4 6629 B11R0.30 CC(=CCNCCCC(=O)O)I 99f10e083be6c56f1dd5bf57a3f8ab5a [0,2,0,0,0,0|0,0,2]=4 6630 B11R0.30 CC(=CCOCCCC(=O)O)C b9815020a5c8155dbf1939d53fb93751 [0,2,0,0,0,0|0,0,2]=4 6631 B11R0.30 CC(=CCOCCCC(=O)O)I 09d4e7ac4ffe3b170c9de810f742a736 [0,2,0,0,0,0|0,0,2]=4 6632 B11R0.30 CC(=O)CCCCCOC(C)C 757b0472136ac1cbb797dd6ffe7fffff [0,2,0,0,0,0|1,0,0]=3 6633 B11R0.30 CC(=O)CCCCNCC(=O)C 811b6be8c624c1494cacb792f758d2bf [0,2,0,0,0,0|1,0,1]=4 6634 B11R0.30 CC(=O)CCCCNCC(=O)N e673ecea555aa6dbf04c00e01deb9a78 [0,2,0,0,0,0|1,0,1]=4 6635 B11R0.30 CC(=O)CCCCNCC(=O)O 1c57a7ba0f4b7994ec3637755a7dd6e5 [0,2,0,0,0,0|0,0,1]=3 6636 B11R0.30 CC(=O)CCCCNCC(C)C 086583d64fdfe80870f5b9f3470e6f30 [0,2,0,0,0,0|1,0,0]=3 6637 B11R0.30 CC(=O)CCCCNCC(C)O 150661f01df1b41b256186747d770382 [0,2,0,0,0,0|1,0,0]=3 6638 B11R0.30 CC(=O)CCCCNCC(F)F 9b599ae58813e7adb57da6e5a4922217 [0,2,0,0,0,0|2,0,0]=4 6639 B11R0.30 CC(=O)CCCCNC[C@@H](C)O 877536ea410bda933fd0d11829e3f1f5 [0,2,0,0,0,0|1,0,0]=3 6640 B11R0.30 CC(=O)CCCCNC[C@H](C)O cfdd04aa9ecca29fba214bac18aab3b2 [0,2,0,0,0,0|1,0,0]=3 6641 B11R0.30 CC(=O)CCCCOCC(=O)C a9588aa72e21599b5e502af8e5e67016 [0,2,0,0,0,0|1,0,1]=4 6642 B11R0.30 CC(=O)CCCCOCC(=O)N 3685197afe2358ea7a45e83d4dd7f7be [0,2,0,0,0,0|1,0,1]=4 6643 B11R0.30 CC(=O)CCCCOCC(=O)O 9b9d1beac29b1e52af0a87800aa596f1 [0,2,0,0,0,0|0,0,1]=3 6644 B11R0.30 CC(=O)CCCCOCC(C)C 7a79126218a597dff4d8ec4e795cfcbb [0,2,0,0,0,0|1,0,0]=3 6645 B11R0.30 CC(=O)CCCCOCC(C)F bcbd60aef8b3c116db3a7fa70ce8e83f [0,2,0,0,0,0|1,0,0]=3 6646 B11R0.30 CC(=O)CCCCOCC(C)S 7832309074eede08d6a582a017a4f5bb [0,2,0,0,0,0|1,0,0]=3 6647 B11R0.30 CC(=O)CCCCOCC(F)F efdc268b19f20427b336572625c8a449 [0,2,0,0,0,0|2,0,0]=4 6648 B11R0.30 CC(=O)CCCCOCN(C)C 52e096a11eee50648e2a5d6ef5030516 [0,2,0,0,0,0|2,0,0]=4 6649 B11R0.30 CC(=O)CCCCOCS(=O)O 32e8d36794e89c243364c0a6fde95b66 [0,2,0,0,0,0|1,0,1]=4 6650 B11R0.30 CC(=O)CCCCOC[C@@H](C)F 746bce0aab382588d2193be2f829323e [0,2,0,0,0,0|1,0,0]=3 6651 B11R0.30 CC(=O)CCCCOC[C@H](C)F 04ce9cbbfb67e80646c5ae44c5a73ebb [0,2,0,0,0,0|1,0,0]=3 6652 B11R0.30 CC(=O)CCCNCCC(=O)N 3f1819f8c8fceaad5df10150eb5e7976 [0,2,0,0,0,0|1,0,1]=4 6653 B11R0.30 CC(=O)CCCNCCC(=O)O fad58c31a6bbc58fdd7ddd380df80eaa [0,2,0,0,0,0|0,0,1]=3 6654 B11R0.30 CC(=O)CCCNCCC(C)C 6c5866f61f9b5537e5ad109ebe65ed57 [0,2,0,0,0,0|1,0,0]=3 6655 B11R0.30 CC(=O)CCCNCCC(C)O e90fa3f64f3d5ab2f15000bb5aca15e9 [0,2,0,0,0,0|1,0,0]=3 6656 B11R0.30 CC(=O)CCCNCCC(F)F d543924f02c5a4e925261375bf23e7c9 [0,2,0,0,0,0|2,0,0]=4 6657 B11R0.30 CC(=O)CCCNCCN(C)C 987a18e77d814c7ba233aded7393d5e4 [0,2,0,0,0,0|2,0,0]=4 6658 B11R0.30 CC(=O)CCCNCCS(=O)C 8f704ea4ddffe3a22721f986c9ec63f1 [0,2,0,0,0,0|2,0,0]=4 6659 B11R0.30 CC(=O)CCCNCCS(=O)O e914f82be22774698a0c01e607e727e3 [0,2,0,0,0,0|1,0,1]=4 6660 B11R0.30 CC(=O)CCCNCC[C@@H](C)O 01845a444019ef69b56595bff259c90d [0,2,0,0,0,0|1,0,0]=3 6661 B11R0.30 CC(=O)CCCNCC[C@H](C)O dbf4bbd732f1f0f607a0fcba58e3d450 [0,2,0,0,0,0|1,0,0]=3 6662 B11R0.30 CC(=O)CCCOCCC(=O)C fb7953897dd67c2393ce65b2f64030e2 [0,2,0,0,0,0|1,0,1]=4 6663 B11R0.30 CC(=O)CCCOCCC(=O)N d07f3eac8a494b7f7f0536cbd2a48812 [0,2,0,0,0,0|1,0,1]=4 6664 B11R0.30 CC(=O)CCCOCCC(=O)O 0a4e8bfaee2ea1356de7862b185bfccb [0,2,0,0,0,0|0,0,1]=3 6665 B11R0.30 CC(=O)CCCOCCC(C)C ec869dd280510c00f1aed0572d475c1d [0,2,0,0,0,0|1,0,0]=3 6666 B11R0.30 CC(=O)CCCOCCC(F)F 0c787e9e73d986ceac16edf16e19732d [0,2,0,0,0,0|2,0,0]=4 6667 B11R0.30 CC(=O)CCCOCCN(C)C fd7393a12ae637e8206b4e3e4ed16923 [0,2,0,0,0,0|2,0,0]=4 6668 B11R0.30 CC(=O)CCCOCCS(=O)C 544801bf4e5223b4ae6f53ac6656de9b [0,2,0,0,0,0|2,0,0]=4 6669 B11R0.30 CC(=O)CCCOCOC(C)C d09db329a1dba9f19f79ec891be2f461 [0,2,0,0,0,0|2,0,0]=4 6670 B11R0.30 CC(=O)CCNCCCC(=O)N 202280302227b49fc362f63183fb980c [0,2,0,0,0,0|1,0,1]=4 6671 B11R0.30 CC(=O)CCNCCCC(=O)O 56f4d878dc3100248d1a3bb95b838ccd [0,2,0,0,0,0|0,0,1]=3 6672 B11R0.30 CC(=O)CCNCCCC(C)C ebc7fcb5de4dacc7e32ec9d237cbf140 [0,2,0,0,0,0|1,0,0]=3 6673 B11R0.30 CC(=O)CCNCCCN(C)C a0e60221a514149dec9d1095a9fb5dce [0,2,0,0,0,0|2,0,0]=4 6674 B11R0.30 CC(=O)CCNCCCS(=O)C 71ef2fca054234e459c2a8619c7395a5 [0,2,0,0,0,0|2,0,0]=4 6675 B11R0.30 CC(=O)CCNCCOC(C)C 318a5f7dde8ab3a8d7157b4cc2a095b5 [0,2,0,0,0,0|2,0,0]=4 6676 B11R0.30 CC(=O)CCOCCCC(=O)N 22992df27620335cfe922d5755197624 [0,2,0,0,0,0|1,0,1]=4 6677 B11R0.30 CC(=O)CCOCCCC(C)C b939bcd8111992cefd519ecf222ca090 [0,2,0,0,0,0|1,0,0]=3 6678 B11R0.30 CC(=O)CCOCCCN(C)C 826017caa291ad730b947e40abb2113c [0,2,0,0,0,0|2,0,0]=4 6679 B11R0.30 CC(=O)CCOCCOC(C)C 3e28b2b76a3992406ec7af7a5570308e [0,2,0,0,0,0|2,0,0]=4 6680 B11R0.30 CC(=O)CCOCCSC(C)C 5fcb3dbb3021cfff4c1571f660acda4f [0,2,0,0,0,0|2,0,0]=4 6681 B11R0.30 CC(=O)CNCCCCC(=O)N 59f3d521d795a462197779ec9d9d0886 [0,2,0,0,0,0|1,0,1]=4 6682 B11R0.30 CC(=O)CNCCCCC(C)C 3d35a05533fd3f24af80d939dcafa2e5 [0,2,0,0,0,0|1,0,0]=3 6683 B11R0.30 CC(=O)CNCCCCC(C)O 15573be76016b8f7bd0e839b5556feb2 [0,2,0,0,0,0|1,0,0]=3 6684 B11R0.30 CC(=O)CNCCCCN(C)C 0c55a794cfbf14ca585d9ab09cf18e17 [0,2,0,0,0,0|2,0,0]=4 6685 B11R0.30 CC(=O)CNCCCC[C@@H](C)O 873c419bc007215fffd2c2568d78654b [0,2,0,0,0,0|1,0,0]=3 6686 B11R0.30 CC(=O)CNCCOCC(=O)O 7fc70a05d3e87fb35aa782bdef5baad6 [0,2,0,0,0,0|1,0,1]=4 6687 B11R0.30 CC(=O)CNCCOCC(C)C aa0fca0fa8c504a36bac4e0a9e192cae [0,2,0,0,0,0|2,0,0]=4 6688 B11R0.30 CC(=O)COCCCCC(=O)N 4fa04be5e45018b85ba52c3db824a282 [0,2,0,0,0,0|1,0,1]=4 6689 B11R0.30 CC(=O)COCCCCC(C)C d7852fa28391ec3ec73b1da98f42a6dc [0,2,0,0,0,0|1,0,0]=3 6690 B11R0.30 CC(=O)COCCCCN(C)C 8f6a222dcfa3e4dead3daf1672e676b0 [0,2,0,0,0,0|2,0,0]=4 6691 B11R0.30 CC(=O)COCCOCC(=O)O 061cc36bc52e545d040dcc8348ce7fa8 [0,2,0,0,0,0|1,0,1]=4 6692 B11R0.30 CC(=O)COCCOCC(C)C 932d70e17b984408119bf7415b9e1908 [0,2,0,0,0,0|2,0,0]=4 6693 B11R0.30 CC(=O)NCCCCCC(=O)N 2f30c09bb665111b928290a25da3c7ba [0,2,0,0,0,0|1,0,1]=4 6694 B11R0.30 CC(=O)NCCCCCC(C)C 0c729d95049ba0127ccadd97d26dcf95 [0,2,0,0,0,0|1,0,0]=3 6695 B11R0.30 CC(=O)NCCCCCN(C)C 5d8f9fc550ec27607a81714b08399ebe [0,2,0,0,0,0|2,0,0]=4 6696 B11R0.30 CC(=O)NCCCCNC(C)C 133a6a8c7cfba0a194ec38f29c29ea4c [0,2,0,0,0,0|2,0,0]=4 6697 B11R0.30 CC(=O)NCCCNCC(=O)O 4d2b8499fee86539559159b1ee683e2a [0,2,0,0,0,0|1,0,1]=4 6698 B11R0.30 CC(=O)NCCCNCC(C)C be7b04e8a10bb69ed7af05be6eca2935 [0,2,0,0,0,0|2,0,0]=4 6699 B11R0.30 CC(=O)NCCCNCC(C)O 4dbdcfdb1e8062c0a47f4eb8dbd92fd2 [0,2,0,0,0,0|2,0,0]=4 6700 B11R0.30 CC(=O)NCCCNC[C@@H](C)O 7eb689a321eae64067b93f00fcb178eb [0,2,0,0,0,0|2,0,0]=4 6701 B11R0.30 CC(=O)NCCCNC[C@H](C)O 55d92f61c64334d30ecb6f1fa471c093 [0,2,0,0,0,0|2,0,0]=4 6702 B11R0.30 CC(=O)NCCCOCC(=O)O 2380a4448928777e053bf8f04b5926dd [0,2,0,0,0,0|1,0,1]=4 6703 B11R0.30 CC(=O)NCCCOCC(C)C 43cdaf2fd01524a73abd3ec040956573 [0,2,0,0,0,0|2,0,0]=4 6704 B11R0.30 CC(=O)NCCCOCC(C)F 8fee7be59a709effa81d095953619042 [0,2,0,0,0,0|2,0,0]=4 6705 B11R0.30 CC(=O)NCCCOCC(C)S 0ce764874912965619ae50bc45883f54 [0,2,0,0,0,0|2,0,0]=4 6706 B11R0.30 CC(=O)NCCCOC[C@@H](C)F 1f595338c0af51f799eea1d7e3bf685e [0,2,0,0,0,0|2,0,0]=4 6707 B11R0.30 CC(=O)NCCCOC[C@H](C)F 6ade657bf11ff50fffaf76fdce1e619d [0,2,0,0,0,0|2,0,0]=4 6708 B11R0.30 CC(=O)NCCNCCC(=O)O e6d552a5041bc24142b4ac26e3545745 [0,2,0,0,0,0|1,0,1]=4 6709 B11R0.30 CC(=O)NCCNCCC(C)C 0494eae6b213f3257ddb34f9e31fda80 [0,2,0,0,0,0|2,0,0]=4 6710 B11R0.30 CC(=O)NCCNCCC(C)O 6a70d47cebeaa9c639799010aa267595 [0,2,0,0,0,0|2,0,0]=4 6711 B11R0.30 CC(=O)NCCNCC[C@@H](C)O afc6b46828d1f4c605b8e125865eb10b [0,2,0,0,0,0|2,0,0]=4 6712 B11R0.30 CC(=O)NCCNCC[C@H](C)O fca09b07d6d4b106737698ae6e579473 [0,2,0,0,0,0|2,0,0]=4 6713 B11R0.30 CC(=O)NCCOCCC(=O)O d699be6960e7cd8efc7c932f8bbd672e [0,2,0,0,0,0|1,0,1]=4 6714 B11R0.30 CC(=O)NCCOCCC(C)C de895213db424c020cbe40c2e5facfc9 [0,2,0,0,0,0|2,0,0]=4 6715 B11R0.30 CC(=O)NCOCCCC(=O)O eab05ba43e8af72a71e5724cfb1df947 [0,2,0,0,0,0|1,0,1]=4 6716 B11R0.30 CC(=O)NCOCCCC(C)C 5d2dcb991f2b2442efe5a7ffc04a214e [0,2,0,0,0,0|2,0,0]=4 6717 B11R0.30 CC(=O)OCCCCOC(C)C 47fdd16a4356560af13811b8efe3a9f7 [0,2,0,0,0,0|2,0,0]=4 6718 B11R0.30 CC(=O)OCCCNCC(=O)O 6349a73d33dfc8b02c570d542d197cac [0,2,0,0,0,0|1,0,1]=4 6719 B11R0.30 CC(=O)OCCCNCC(C)C bbf3b621069ce279847559fca69d7d08 [0,2,0,0,0,0|2,0,0]=4 6720 B11R0.30 CC(=O)OCCCNCC(C)O 1dc2b310cfd4b286c437d303e6f76b06 [0,2,0,0,0,0|2,0,0]=4 6721 B11R0.30 CC(=O)OCCCNC[C@@H](C)O 804e710c303b6426cad674929ba78b15 [0,2,0,0,0,0|2,0,0]=4 6722 B11R0.30 CC(=O)OCCCNC[C@H](C)O ef3a119116e1ef1139e5ad3b4c01c813 [0,2,0,0,0,0|2,0,0]=4 6723 B11R0.30 CC(=O)OCCCOCC(=O)O 1088ae36987ee59835a02556fbea2236 [0,2,0,0,0,0|1,0,1]=4 6724 B11R0.30 CC(=O)OCCCOCC(C)C 047ef30506aeaa37eee844cde6fa0efe [0,2,0,0,0,0|2,0,0]=4 6725 B11R0.30 CC(=O)OCCCOCC(C)F c0aaa2b644c8366a5dbd8d92a6434c53 [0,2,0,0,0,0|2,0,0]=4 6726 B11R0.30 CC(=O)OCCCOCC(C)S 5e991e728af549d092246d2e4204a421 [0,2,0,0,0,0|2,0,0]=4 6727 B11R0.30 CC(=O)OCCCOC[C@@H](C)F cc50379892a3a77ece4068e8d1658839 [0,2,0,0,0,0|2,0,0]=4 6728 B11R0.30 CC(=O)OCCCOC[C@H](C)F d0496e389cc0accd271c1f56f061d029 [0,2,0,0,0,0|2,0,0]=4 6729 B11R0.30 CC(=O)OCCNCCC(=O)O ea3377cb7c74a8fa772c769b7c11180e [0,2,0,0,0,0|1,0,1]=4 6730 B11R0.30 CC(=O)OCCNCCC(C)C dd913ae0a0af7163e53f6848fad8b80d [0,2,0,0,0,0|2,0,0]=4 6731 B11R0.30 CC(=O)OCCNCCC(C)O 0fd080ecf4e89ae23c33e498d875f1ae [0,2,0,0,0,0|2,0,0]=4 6732 B11R0.30 CC(=O)OCCNCC[C@@H](C)O 88da47872e8441f39ab18f57f2cec651 [0,2,0,0,0,0|2,0,0]=4 6733 B11R0.30 CC(=O)OCCNCC[C@H](C)O 02538978e569ad704279c58695aa650c [0,2,0,0,0,0|2,0,0]=4 6734 B11R0.30 CC(=O)OCCOCCC(=O)O 212d649dbaa0d58ba3a9b83d79e24af6 [0,2,0,0,0,0|1,0,1]=4 6735 B11R0.30 CC(=O)OCCOCCC(C)C 49dcd969f82ad5f218ac0f543ee12ef4 [0,2,0,0,0,0|2,0,0]=4 6736 B11R0.30 CC(=O)OCNCCCC(=O)O 0628abec3be4815de0b4e85e4f227d5e [0,2,0,0,0,0|1,0,1]=4 6737 B11R0.30 CC(=O)OCNCCCC(C)C 10637c8ee233845b6daf22ffae3211d0 [0,2,0,0,0,0|2,0,0]=4 6738 B11R0.30 CC(=O)OCOCCCC(C)C 3188d75745351c2aa29ef0b26c876c9c [0,2,0,0,0,0|2,0,0]=4 6739 B11R0.30 CC(=O)SCCCCOC(C)C af0351cfeb8ac203c789b383affcfefb [0,2,0,0,0,0|2,0,0]=4 6740 B11R0.30 CC(=O)SCCCNCC(=O)O add0337d9d8d235d58768eeb4915e14b [0,2,0,0,0,0|1,0,1]=4 6741 B11R0.30 CC(=O)SCCCNCC(C)C 4711469d2555f6a26ab9ff1f3105f868 [0,2,0,0,0,0|2,0,0]=4 6742 B11R0.30 CC(=O)SCCCNCC(C)O 96081ecb8db3106a6bd4931fd660665b [0,2,0,0,0,0|2,0,0]=4 6743 B11R0.30 CC(=O)SCCCNC[C@@H](C)O d4d0f502dd724c5cd1df5eee6444fc2c [0,2,0,0,0,0|2,0,0]=4 6744 B11R0.30 CC(=O)SCCCNC[C@H](C)O 319fca1ecc4da4e79befd986636270ce [0,2,0,0,0,0|2,0,0]=4 6745 B11R0.30 CC(=O)SCCCOCC(=O)O d473fe56b0818e834c8391e741368c90 [0,2,0,0,0,0|1,0,1]=4 6746 B11R0.30 CC(=O)SCCCOCC(C)C 45859db52b87a343a125b2ccf6154e85 [0,2,0,0,0,0|2,0,0]=4 6747 B11R0.30 CC(=O)SCCCOCC(C)F e96ce247f1a647961695dbcb66dbd4c0 [0,2,0,0,0,0|2,0,0]=4 6748 B11R0.30 CC(=O)SCCCOCC(C)S eff84338a84b9053a9e5d290c405750f [0,2,0,0,0,0|2,0,0]=4 6749 B11R0.30 CC(=O)SCCCOC[C@@H](C)F 39fd7ca8d91fcb38c8a10ac26166a701 [0,2,0,0,0,0|2,0,0]=4 6750 B11R0.30 CC(=O)SCCCOC[C@H](C)F a7cef04f1dc396f485b7b35a4af1a9dd [0,2,0,0,0,0|2,0,0]=4 6751 B11R0.30 CC(=O)SCCNCCC(=O)O c768f53682b54b27af613108ca241187 [0,2,0,0,0,0|1,0,1]=4 6752 B11R0.30 CC(=O)SCCNCCC(C)C 07bd5b99adcbb4cb18b5260c079ceac4 [0,2,0,0,0,0|2,0,0]=4 6753 B11R0.30 CC(=O)SCCNCCC(C)O 7cd9087c5d0f055d11bbdf2887c3c180 [0,2,0,0,0,0|2,0,0]=4 6754 B11R0.30 CC(=O)SCCNCC[C@@H](C)O e32a0383c4b9ff4f6ae3053e6812d39b [0,2,0,0,0,0|2,0,0]=4 6755 B11R0.30 CC(=O)SCCNCC[C@H](C)O f3b5669beb12aec96a4ff0c84a6acab3 [0,2,0,0,0,0|2,0,0]=4 6756 B11R0.30 CC(=O)SCCOCCC(=O)O 0c38649e5847f4691cbf7d29642904d8 [0,2,0,0,0,0|1,0,1]=4 6757 B11R0.30 CC(=O)SCCOCCC(C)C 1538d690a5e5a26dc1e494b2e2f1ec01 [0,2,0,0,0,0|2,0,0]=4 6758 B11R0.30 CC(=S)OCCCNCC(=O)O 64cf1280ab06a81105c2e667d7ed344d [0,2,0,0,0,0|1,0,1]=4 6759 B11R0.30 CC(=S)OCCCOCC(=O)O b16e0378476abdab5f18176f2480cf7f [0,2,0,0,0,0|1,0,1]=4 6760 B11R0.30 CC(C)/C=C/CNCCC(=O)O 9b18975c4ccc04d5e99c9a2a5b17b93b [0,2,0,0,0,0|0,0,2]=4 6761 B11R0.30 CC(C)/C=C/COCCC(=O)O f329129cf1c35a2b684ba4945bd620a6 [0,2,0,0,0,0|0,0,2]=4 6762 B11R0.30 CC(C)CCCCNCC(=O)N aa426cff99b6725d758fb0a6757339d9 [0,2,0,0,0,0|1,0,0]=3 6763 B11R0.30 CC(C)CCCCNCC(=O)O 39a93d590261e532e6f29909d3f91c16 [0,2,0,0,0,0|0,0,0]=2 6764 B11R0.30 CC(C)CCCCNCC(C)O 8704d92212c706148a6e70765ac52f27 [0,2,0,0,0,0|1,0,1]=4 6765 B11R0.30 CC(C)CCCCNC[C@@H](C)O d86f6a0312c2db74e8cdf28d735df9a7 [0,2,0,0,0,0|1,0,1]=4 6766 B11R0.30 CC(C)CCCCNC[C@H](C)O cd13f188463ace4221966156ccd8f1b3 [0,2,0,0,0,0|1,0,1]=4 6767 B11R0.30 CC(C)CCCCOCC(=O)N 24ef63b582da970833efb0d86a881957 [0,2,0,0,0,0|1,0,0]=3 6768 B11R0.30 CC(C)CCCCOCC(=O)O 11166f2d7cea686a04aab0f10eb2bc17 [0,2,0,0,0,0|0,0,0]=2 6769 B11R0.30 CC(C)CCCCOCC(=S)N 5ad1435251c5fdfe34dad51fee9f28bc [0,2,0,0,0,0|1,1,0]=4 6770 B11R0.30 CC(C)CCCCOCS(=O)O 16179452b051abf8bf9e3a01650e37c3 [0,2,0,0,0,0|1,0,0]=3 6771 B11R0.30 CC(C)CCCCOC[N+](=O)[O-] a96988900380fdad2cfc53d9b5d9ee53 [0,2,0,0,0,0|1,0,1]=4 6772 B11R0.30 CC(C)CCCNCCC(=O)N f691e1ed05799cf321f627e70f67d4f8 [0,2,0,0,0,0|1,0,0]=3 6773 B11R0.30 CC(C)CCCNCCC(=O)O 9fddffe46eb38a449aed1424523e58eb [0,2,0,0,0,0|0,0,0]=2 6774 B11R0.30 CC(C)CCCNCCC(=S)N 800553f3b5f332409260cb6bfa42d7eb [0,2,0,0,0,0|1,1,0]=4 6775 B11R0.30 CC(C)CCCNCCC(C)O ecc093cdabf5ae43744a20a1e9748641 [0,2,0,0,0,0|1,0,1]=4 6776 B11R0.30 CC(C)CCCNCCS(=O)C c8c94d82b4424d88b4521e6f6d32cfd8 [0,2,0,0,0,0|2,0,0]=4 6777 B11R0.30 CC(C)CCCNCCS(=O)O aa10ef71943fc444a169c6b7a54bcaec [0,2,0,0,0,0|1,0,0]=3 6778 B11R0.30 CC(C)CCCNCC[C@@H](C)O 261155fbbc30b03a09a5be2dd72e330b [0,2,0,0,0,0|1,0,1]=4 6779 B11R0.30 CC(C)CCCNCC[C@H](C)O e3b6b361add023cc7c0122c58b609b08 [0,2,0,0,0,0|1,0,1]=4 6780 B11R0.30 CC(C)CCCNCSC(=O)N 71eb9f5dade448e24b4f28292d26f134 [0,2,0,0,0,0|2,0,0]=4 6781 B11R0.30 CC(C)CCCOCCC(=O)N 4a38c871264ea818f4a2d88445342696 [0,2,0,0,0,0|1,0,0]=3 6782 B11R0.30 CC(C)CCCOCCC(=O)O 045ec022986b652ea5c7631767d6500a [0,2,0,0,0,0|0,0,0]=2 6783 B11R0.30 CC(C)CCCOCCS(=O)C e3eb8a1046001929ddd9a3b2ea760e99 [0,2,0,0,0,0|2,0,0]=4 6784 B11R0.30 CC(C)CCCOCC[N+](=O)[O-] d0ccd052e60c12d2105d46b141703818 [0,2,0,0,0,0|1,0,1]=4 6785 B11R0.30 CC(C)CCCOCNC(=O)N 01311be627f18ef4fbfa0baaacd712f3 [0,2,0,0,0,0|2,0,0]=4 6786 B11R0.30 CC(C)CCCOCSC(=O)N 6fa6213005219453bbd2742d2e0a094f [0,2,0,0,0,0|2,0,0]=4 6787 B11R0.30 CC(C)CCNC/C=C/C(=O)O fa63abb5997eabfb03710616e719a9b8 [0,2,0,0,0,0|0,0,2]=4 6788 B11R0.30 CC(C)CCNCC#CC(=O)O 2f914b274e7785ae3d444ac2145b9ab1 [0,2,0,0,0,0|0,0,2]=4 6789 B11R0.30 CC(C)CCNCC=CC(=O)O 5d064a4bf1b9a689999d5b018a17ab99 [0,2,0,0,0,0|0,0,2]=4 6790 B11R0.30 CC(C)CCNCCCC(=O)N 2f3d20836b1204012b3896324c24c0ce [0,2,0,0,0,0|1,0,0]=3 6791 B11R0.30 CC(C)CCNCCCC(=O)O e6b38baa886c90ac0d215e2a16fee953 [0,2,0,0,0,0|0,0,0]=2 6792 B11R0.30 CC(C)CCNCCCC(C)O d655fe544ce63ff0dd9ad63903cf045c [0,2,0,0,0,0|1,0,1]=4 6793 B11R0.30 CC(C)CCNCCCS(=O)C d1e49ccaa102767708cb6e15467dddbe [0,2,0,0,0,0|2,0,0]=4 6794 B11R0.30 CC(C)CCNCCC[N+](=O)[O-] 4efd847852aae5cd0a4e19a77b8aaac6 [0,2,0,0,0,0|1,0,1]=4 6795 B11R0.30 CC(C)CCNCCNC(=O)N 5d159d82241b55466da706a234bafdd0 [0,2,0,0,0,0|2,0,0]=4 6796 B11R0.30 CC(C)CCOC/C=C/C(=O)O 94e0c1a3e10cd77e400f92e197de04cb [0,2,0,0,0,0|0,0,2]=4 6797 B11R0.30 CC(C)CCOCC#CC(=O)O 73bb66d65d616bd0c768a8606daf29c2 [0,2,0,0,0,0|0,0,2]=4 6798 B11R0.30 CC(C)CCOCC=CC(=O)O 4d106b42924e0cfb160e498848c9ae36 [0,2,0,0,0,0|0,0,2]=4 6799 B11R0.30 CC(C)CCOCCCC(=O)N b793772c46250531664b28a72c08195d [0,2,0,0,0,0|1,0,0]=3 6800 B11R0.30 CC(C)CCOCCC[N+](=O)[O-] 355afc05070353f86395900e7e880c79 [0,2,0,0,0,0|1,0,1]=4 6801 B11R0.30 CC(C)CCOCCNC(=O)N 2fc56426f2999afa6aa1839ba15df57c [0,2,0,0,0,0|2,0,0]=4 6802 B11R0.30 CC(C)CNCCCCC(=O)N 6f11fc49e99188a2ec093040e80a48ac [0,2,0,0,0,0|1,0,0]=3 6803 B11R0.30 CC(C)CNCCCCC(=O)O 5548bd77a92bf974b6877feef8de1811 [0,2,0,0,0,0|0,0,0]=2 6804 B11R0.30 CC(C)CNCCCCC(C)O 01b37128c8ccbbd7756317e16f6e7b60 [0,2,0,0,0,0|1,0,1]=4 6805 B11R0.30 CC(C)CNCCCC[C@@H](C)O de13a5d1554e89a41f7d32444d288b81 [0,2,0,0,0,0|1,0,1]=4 6806 B11R0.30 CC(C)CNCCOCC(=O)N b4f1d04e868f8545025007b45806ed66 [0,2,0,0,0,0|2,0,0]=4 6807 B11R0.30 CC(C)CNCCOCC(=O)O 80e81b7dcba119a32def60c9dd8be241 [0,2,0,0,0,0|1,0,0]=3 6808 B11R0.30 CC(C)CNCCSCC(=O)O 9da9e86a13299c9d51ea4eaf3970a743 [0,2,0,0,0,0|1,0,0]=3 6809 B11R0.30 CC(C)COCCC#CC(=O)O 0a0142cde6f38a688002082bcda28005 [0,2,0,0,0,0|0,0,2]=4 6810 B11R0.30 CC(C)COCCCCC(=O)N 07c931c376acd33db918386c45b02d1f [0,2,0,0,0,0|1,0,0]=3 6811 B11R0.30 CC(C)COCCCCC(=O)O 9dd6d4e8425617c9be3c7d35609714a4 [0,2,0,0,0,0|0,0,0]=2 6812 B11R0.30 CC(C)COCCCC[N+](=O)[O-] 71d5d1e8e3ebfbe3d4201c6fd39ba0ac [0,2,0,0,0,0|1,0,1]=4 6813 B11R0.30 CC(C)COCCNCC(=O)N 906a8be1f85bdd29fd54caf5cbafe89f [0,2,0,0,0,0|2,0,0]=4 6814 B11R0.30 CC(C)COCCNCC(=O)O 2736a68be015fe4a7aa2e6d508daad87 [0,2,0,0,0,0|1,0,0]=3 6815 B11R0.30 CC(C)COCCOCC(=O)N ee65f1c6a9a677607fc7a527fd675d23 [0,2,0,0,0,0|2,0,0]=4 6816 B11R0.30 CC(C)COCCOCC(=O)O 102376f215d5dc8e5c76f12781199c9c [0,2,0,0,0,0|1,0,0]=3 6817 B11R0.30 CC(C)COCCOCS(=O)O 7eb23f67b51dd0dbdc67f4513768f327 [0,2,0,0,0,0|2,0,0]=4 6818 B11R0.30 CC(C)COCCSCC(=O)N c32150437d12db02b4269d8fbddb3598 [0,2,0,0,0,0|2,0,0]=4 6819 B11R0.30 CC(C)CSCCOCC(=O)N 6a7630982a6dac7d40a8c7801128248d [0,2,0,0,0,0|2,0,0]=4 6820 B11R0.30 CC(C)CSCCOCC(=O)O ab3c38f511f498706e1b6026c172202e [0,2,0,0,0,0|1,0,0]=3 6821 B11R0.30 CC(C)NCCCCCC(=O)N 63ce2ec60713f828ce9bff6a30926442 [0,2,0,0,0,0|1,0,0]=3 6822 B11R0.30 CC(C)NCCCCCC(=O)O 0fa6dda8948ff26f06556f714a7766aa [0,2,0,0,0,0|0,0,0]=2 6823 B11R0.30 CC(C)NCCOCCC(=O)O fc063751c65cddecdcf0d46f570d2f65 [0,2,0,0,0,0|1,0,0]=3 6824 B11R0.30 CC(C)OCCCCCC(=O)N 5a8ea6c8f426585a80450570ad4eb161 [0,2,0,0,0,0|1,0,0]=3 6825 B11R0.30 CC(C)OCCCCCC(=O)O db9a0ab4c678c26853cc6d16db0df97a [0,2,0,0,0,0|0,0,0]=2 6826 B11R0.30 CC(C)OCCCNCC(=O)N 3e070d81557f1ea61557244517b0cb00 [0,2,0,0,0,0|2,0,0]=4 6827 B11R0.30 CC(C)OCCCNCC(=O)O e5b05e591aeb2ffb5c6460865f9cd0f4 [0,2,0,0,0,0|1,0,0]=3 6828 B11R0.30 CC(C)OCCCOCC(=O)N a6424f42b9d389efed8419c530b6c629 [0,2,0,0,0,0|2,0,0]=4 6829 B11R0.30 CC(C)OCCCOCC(=O)O 85d4ed8113998f359c0416d09e1a14af [0,2,0,0,0,0|1,0,0]=3 6830 B11R0.30 CC(C)OCCNCCC(=O)N fbe1ab5d077b35b1b3b46f800a22a7d0 [0,2,0,0,0,0|2,0,0]=4 6831 B11R0.30 CC(C)OCCNCCC(=O)O 82eb96625b139e80953ccb542425dd17 [0,2,0,0,0,0|1,0,0]=3 6832 B11R0.30 CC(C)OCCNCCS(=O)O e614f052401eb267080bc7c6cb10c55a [0,2,0,0,0,0|2,0,0]=4 6833 B11R0.30 CC(C)OCCOCCC(=O)N 78b48d2fb130c45c6d9258d91661d237 [0,2,0,0,0,0|2,0,0]=4 6834 B11R0.30 CC(C)OCCOCCC(=O)O 25d65e51f6d2668ac4042c35125ba0cb [0,2,0,0,0,0|1,0,0]=3 6835 B11R0.30 CC(C)OCNCCCC(=O)N cfda347df5962d3fe31b0626a8142174 [0,2,0,0,0,0|2,0,0]=4 6836 B11R0.30 CC(C)OCNCCCC(=O)O 5c7b98589ea3b97df0e670eb1208d3dc [0,2,0,0,0,0|1,0,0]=3 6837 B11R0.30 CC(C)OCOCCCC(=O)N 5122a1c4e4e733898b7b61a249842b96 [0,2,0,0,0,0|2,0,0]=4 6838 B11R0.30 CC(C)SCCCNCC(=O)N 8d928e1a6f11f5c269887ec75275591b [0,2,0,0,0,0|2,0,0]=4 6839 B11R0.30 CC(C)SCCCNCC(=O)O 152a973e5155d2e34651eb62bc1bf8d7 [0,2,0,0,0,0|1,0,0]=3 6840 B11R0.30 CC(C)SCCCOCC(=O)N 5dd78cf525facc180275b3b753a34142 [0,2,0,0,0,0|2,0,0]=4 6841 B11R0.30 CC(C)SCCCOCC(=O)O 2ba9d8423fa11ac09df26e819a8db90d [0,2,0,0,0,0|1,0,0]=3 6842 B11R0.30 CC(C)SCCNCCC(=O)N 59425221d9f1e892252e016b1b698a78 [0,2,0,0,0,0|2,0,0]=4 6843 B11R0.30 CC(C)SCCNCCC(=O)O 02a9604457009743aadc4518198c6847 [0,2,0,0,0,0|1,0,0]=3 6844 B11R0.30 CC(C)SCCNCCS(=O)O 98e0ccafe2279860da393ca203b3b338 [0,2,0,0,0,0|2,0,0]=4 6845 B11R0.30 CC(C)SCCOCCC(=O)N 03e013ab4b497961451be006a6b73186 [0,2,0,0,0,0|2,0,0]=4 6846 B11R0.30 CC(C)SCCOCCC(=O)O e6563660025b02806c4297559abbf80a [0,2,0,0,0,0|1,0,0]=3 6847 B11R0.30 CC(F)COCCCCC(=O)N fa470b8d2477e49068a03a92d26a5ee2 [0,2,0,0,0,0|1,0,0]=3 6848 B11R0.30 CC(F)COCCOCC(=O)N 0f422e3aaa3f8c618c2d0700d8502596 [0,2,0,0,0,0|2,0,0]=4 6849 B11R0.30 CC(F)COCCOCC(=O)O 3d8b0889f656d1409a140f015546799b [0,2,0,0,0,0|1,0,0]=3 6850 B11R0.30 CC(O)CCCCNCC(=O)N 1a5f4dca1abc1a7f76e8a140d06513d9 [0,2,0,0,0,0|1,0,0]=3 6851 B11R0.30 CC(O)CCCCNCC(=O)O 8ace7019a75bd4e3f2fa1cdb39804ad3 [0,2,0,0,0,0|0,0,0]=2 6852 B11R0.30 CC(O)CCCCNCC(C)O 67bff0d4b30261e0d539844b4f54d571 [0,2,0,0,0,0|1,0,1]=4 6853 B11R0.30 CC(O)CCCCNC[C@@H](C)O da3dd75a2f508f72cd24db5474965b17 [0,2,0,0,0,0|1,0,1]=4 6854 B11R0.30 CC(O)CCCCNC[C@H](C)O 79286928e9dc096f182620790310dec5 [0,2,0,0,0,0|1,0,1]=4 6855 B11R0.30 CC(O)CCCNCCC(=O)N 7584948b12f1ad68b7341d952f2e6a62 [0,2,0,0,0,0|1,0,0]=3 6856 B11R0.30 CC(O)CCCNCCC(=O)O e545876e5122d6c93c5b82e9664781f0 [0,2,0,0,0,0|0,0,0]=2 6857 B11R0.30 CC(O)CCCNCCC(=S)N 9d4cb58e5d076406d728841f5d788872 [0,2,0,0,0,0|1,1,0]=4 6858 B11R0.30 CC(O)CCCNCCC(C)O db1ef15e6d02a6c884085ac2fd3e6271 [0,2,0,0,0,0|1,0,1]=4 6859 B11R0.30 CC(O)CCCNCCS(=O)C cfd9c7ff56403d1b904574dcd13a86bb [0,2,0,0,0,0|2,0,0]=4 6860 B11R0.30 CC(O)CCCNCCS(=O)O 4d93823095a73e991adad38446f1f1c9 [0,2,0,0,0,0|1,0,0]=3 6861 B11R0.30 CC(O)CCCNCC[C@@H](C)O 06c2bfbee420c4bd595eae0214c32656 [0,2,0,0,0,0|1,0,1]=4 6862 B11R0.30 CC(O)CCCNCC[C@H](C)O 4672dd060037f322786910438f75ab6e [0,2,0,0,0,0|1,0,1]=4 6863 B11R0.30 CC(O)CCNC/C=C/C(=O)O ff4039671f1a2fe67eac4568eec990e2 [0,2,0,0,0,0|0,0,2]=4 6864 B11R0.30 CC(O)CCNCC#CC(=O)O 7905fd719dce0bcc9d41ac2a0c3c371c [0,2,0,0,0,0|0,0,2]=4 6865 B11R0.30 CC(O)CCNCC=CC(=O)O 0bbfeaa4f635841b12779c3330dedf0d [0,2,0,0,0,0|0,0,2]=4 6866 B11R0.30 CC(O)CCNCCCC(=O)N 368302aa18e149b31dd00388b7c4801d [0,2,0,0,0,0|1,0,0]=3 6867 B11R0.30 CC(O)CCNCCCC(=O)O 6ee06c85843817aac8d5c523a45d2881 [0,2,0,0,0,0|0,0,0]=2 6868 B11R0.30 CC(O)CCNCCCS(=O)C f30c0722c43d0018e704385205f182c5 [0,2,0,0,0,0|2,0,0]=4 6869 B11R0.30 CC(O)CCNCCC[N+](=O)[O-] 7d61f73af4f0daa36457724a1c28125f [0,2,0,0,0,0|1,0,1]=4 6870 B11R0.30 CC(O)CCNCCNC(=O)N a2f535b03c9738c25a9e380624260eee [0,2,0,0,0,0|2,0,0]=4 6871 B11R0.30 CC(O)CNCCCCC(=O)N 2e6edb4487eb96d4ec7e7681fb035a7d [0,2,0,0,0,0|1,0,0]=3 6872 B11R0.30 CC(O)CNCCCCC(=O)O 0fa47e549b47d5274161f6feb011a766 [0,2,0,0,0,0|0,0,0]=2 6873 B11R0.30 CC(O)CNCCCC[C@@H](C)O 1780eca4125236a6324f9c4dee4d3683 [0,2,0,0,0,0|1,0,1]=4 6874 B11R0.30 CC(O)CNCCOCC(=O)N 145fe97b16215523778b4f713807c9c7 [0,2,0,0,0,0|2,0,0]=4 6875 B11R0.30 CC(O)CNCCOCC(=O)O 2f3dccd96c7f2ba6d2fec066aebd44b6 [0,2,0,0,0,0|1,0,0]=3 6876 B11R0.30 CC(O)CNCCSCC(=O)O f401c3079724beebfa5102b1bc9f7d31 [0,2,0,0,0,0|1,0,0]=3 6877 B11R0.30 CC(S)COCCCCC(=O)N 18b84bbfb6600c34667d32a62b0e7a53 [0,2,0,0,0,0|1,0,0]=3 6878 B11R0.30 CC(S)COCCOCC(=O)N 6ef99a33374eef049a314b7152a3dd71 [0,2,0,0,0,0|2,0,0]=4 6879 B11R0.30 CC(S)COCCOCC(=O)O db8c52608dcfa5a992a428ced315853a [0,2,0,0,0,0|1,0,0]=3 6880 B11R0.30 CN(C)CCCCNCC(=O)N 34ea88a2ed26d19e7a8fe319593260f0 [0,2,0,0,0,0|2,0,0]=4 6881 B11R0.30 CN(C)CCCCNCC(=O)O 8855c115c1b33e8ce75a926b90fdf8b8 [0,2,0,0,0,0|1,0,0]=3 6882 B11R0.30 CN(C)CCCCOCC(=O)N 90354fafb25a6056b0b02b777244575d [0,2,0,0,0,0|2,0,0]=4 6883 B11R0.30 CN(C)CCCCOCC(=O)O d265e1db0b6f83c239ab2b3a4a52c191 [0,2,0,0,0,0|1,0,0]=3 6884 B11R0.30 CN(C)CCCCOCS(=O)O 6156c357590014064e8c1cd9a88dd8c2 [0,2,0,0,0,0|2,0,0]=4 6885 B11R0.30 CN(C)CCCNCCC(=O)N f521a5450871e832f84432e557037ddb [0,2,0,0,0,0|2,0,0]=4 6886 B11R0.30 CN(C)CCCNCCC(=O)O c6fb3ebe76bb222e65fe8d7ec4c7a639 [0,2,0,0,0,0|1,0,0]=3 6887 B11R0.30 CN(C)CCCNCCS(=O)O 2d1caa47e592a5a920099fde25a22fbe [0,2,0,0,0,0|2,0,0]=4 6888 B11R0.30 CN(C)CCCOCCC(=O)N 5023b9261684941ad3d511a67edfcb15 [0,2,0,0,0,0|2,0,0]=4 6889 B11R0.30 CN(C)CCCOCCC(=O)O 15c6f3353bf905a8332a6d46e9c7c5f8 [0,2,0,0,0,0|1,0,0]=3 6890 B11R0.30 CN(C)CCNCCCC(=O)N a90ea327abdd544e8f2cff207e65659a [0,2,0,0,0,0|2,0,0]=4 6891 B11R0.30 CN(C)CCNCCCC(=O)O 68a1a348f692ea2d8ad9072e6f0f2252 [0,2,0,0,0,0|1,0,0]=3 6892 B11R0.30 CN(C)CCOCCCC(=O)N 7fa13e899713a8ae9e74f909272d67e7 [0,2,0,0,0,0|2,0,0]=4 6893 B11R0.30 CN(C)CNCCCCC(=O)N b09d6e2447f41cd0373638181c587511 [0,2,0,0,0,0|2,0,0]=4 6894 B11R0.30 CN(C)CNCCCCC(=O)O 591d0069729faa79c948e6c153da7f7a [0,2,0,0,0,0|1,0,0]=3 6895 B11R0.30 CN(C)CNCCOCC(=O)O dfe21e90063cf5ee2d80da0c6f8fed3f [0,2,0,0,0,0|2,0,0]=4 6896 B11R0.30 CN(C)CNCCSCC(=O)O 8b4bebd1487542b5ef76d7e2d5657ed9 [0,2,0,0,0,0|2,0,0]=4 6897 B11R0.30 CN(C)COCCCCC(=O)N 8933a6f89580c3ccda324087f63c6da0 [0,2,0,0,0,0|2,0,0]=4 6898 B11R0.30 CN(C)COCCCCC(=O)O 20c7d94978f3b0abfb616ec30bf04664 [0,2,0,0,0,0|1,0,0]=3 6899 B11R0.30 CN(C)COCCOCC(=O)O 3046a350c3dd0b3b581757ec408df25e [0,2,0,0,0,0|2,0,0]=4 6900 B11R0.30 CS(=O)CCCNCCC(=O)N 4eaaee57dd3c8a8f9ff78abafec77b77 [0,2,0,0,0,0|2,0,0]=4 6901 B11R0.30 CS(=O)CCNCCCC(=O)N 10ff3e2bc07cc5371c55fe3a7a58c027 [0,2,0,0,0,0|2,0,0]=4 6902 B11R0.30 CS(=O)CCOCCCC(=O)N 6eb14e0d652360090c2724e678b967a7 [0,2,0,0,0,0|2,0,0]=4 6903 B11R0.30 C[C@@H](F)COCCCCC(=O)N 6d5c38af45ac42c78d648fe2763859fb [0,2,0,0,0,0|1,0,0]=3 6904 B11R0.30 C[C@@H](F)COCCOCC(=O)N 4813fa94e062e01a8e9307b414396a78 [0,2,0,0,0,0|2,0,0]=4 6905 B11R0.30 C[C@@H](F)COCCOCC(=O)O 8a00426e588dde48ba1cda2c83918f23 [0,2,0,0,0,0|1,0,0]=3 6906 B11R0.30 C[C@@H](O)CCCCNCC(=O)N b4f78c7094b894b3b333d7e47750465b [0,2,0,0,0,0|1,0,0]=3 6907 B11R0.30 C[C@@H](O)CCCCNCC(=O)O 383e38e7bfaf5340113526b5bf38e00f [0,2,0,0,0,0|0,0,0]=2 6908 B11R0.30 C[C@@H](O)CCCCNC[C@@H](C)O fb1f7d4a43501f7330a34f8ea0469478 [0,2,0,0,0,0|1,0,1]=4 6909 B11R0.30 C[C@@H](O)CCNC/C=C/C(=O)O 30b71662652ec825e0d2f410fdd87d6f [0,2,0,0,0,0|0,0,2]=4 6910 B11R0.30 C[C@@H](O)CCNCC=CC(=O)O f360a56877ffb450b663d0814aa189e7 [0,2,0,0,0,0|0,0,2]=4 6911 B11R0.30 C[C@@H](O)CCNCCCC(=O)N 13d94837b1f5c9d0a1b4a39b0bf3f2e7 [0,2,0,0,0,0|1,0,0]=3 6912 B11R0.30 C[C@@H](O)CCNCCCC(=O)O 9848f914bbdde66026dc5d82813febcd [0,2,0,0,0,0|0,0,0]=2 6913 B11R0.30 C[C@@H](O)CCNCCC[N+](=O)[O-] 55d60495256bfc1b33493a8953eb3d34 [0,2,0,0,0,0|1,0,1]=4 6914 B11R0.30 C[C@@H](O)CCNCCNC(=O)N 2cf6fe22bd204c881e55d8afc539aa82 [0,2,0,0,0,0|2,0,0]=4 6915 B11R0.30 C[C@@H](O)CNCCCCC(=O)N 76a565e7de8c80e5ddec7d6fb2f6abed [0,2,0,0,0,0|1,0,0]=3 6916 B11R0.30 C[C@@H](O)CNCCCCC(=O)O fa7248fda5a7fc7c2d2e7dede51ec1b1 [0,2,0,0,0,0|0,0,0]=2 6917 B11R0.30 C[C@@H](O)CNCCOCC(=O)N 6b735006d88f55e60b3a361f732d5a7c [0,2,0,0,0,0|2,0,0]=4 6918 B11R0.30 C[C@@H](O)CNCCOCC(=O)O 57ab3e0fa31fdc565fe03fe66262ab63 [0,2,0,0,0,0|1,0,0]=3 6919 B11R0.30 C[C@H](F)COCCCCC(=O)N ed093c7554379d646dfaf0fcbc49bfd0 [0,2,0,0,0,0|1,0,0]=3 6920 B11R0.30 C[C@H](F)COCCOCC(=O)N 3593b4438f0a421a52ef436729af69ae [0,2,0,0,0,0|2,0,0]=4 6921 B11R0.30 C[C@H](F)COCCOCC(=O)O fd18f700d6c0e042bbd8353f5df7307a [0,2,0,0,0,0|1,0,0]=3 6922 B11R0.30 C[C@H](O)CCNC/C=C/C(=O)O cc81c78642631427523d8805454150c6 [0,2,0,0,0,0|0,0,2]=4 6923 B11R0.30 C[C@H](O)CCNCC=CC(=O)O c5701a53f40362cdc009cd75637dd9ff [0,2,0,0,0,0|0,0,2]=4 6924 B11R0.30 C[C@H](O)CCNCCCC(=O)N 016626ad4b7b3065711c0c7d6dddc8f3 [0,2,0,0,0,0|1,0,0]=3 6925 B11R0.30 C[C@H](O)CCNCCCC(=O)O 0b4d40863c274eac47c210c41da2fdff [0,2,0,0,0,0|0,0,0]=2 6926 B11R0.30 C[C@H](O)CCNCCC[N+](=O)[O-] a8db5b585b4b8709541ff61cb1725687 [0,2,0,0,0,0|1,0,1]=4 6927 B11R0.30 C[C@H](O)CCNCCNC(=O)N f06e2245178971b8714f686eae2d7b43 [0,2,0,0,0,0|2,0,0]=4 6928 B11R0.30 C[C@H](O)CNCCCCC(=O)N ad502d43c30e4eb209eb593693528c81 [0,2,0,0,0,0|1,0,0]=3 6929 B11R0.30 C[C@H](O)CNCCCCC(=O)O 43b960b9894303888fc34352756603c5 [0,2,0,0,0,0|0,0,0]=2 6930 B11R0.30 C[C@H](O)CNCCCC[C@@H](C)O 72956bd0f529f7f3fb3c418f7c197d5a [0,2,0,0,0,0|1,0,1]=4 6931 B11R0.30 C[C@H](O)CNCCOCC(=O)N 60e5bf89c5542810d82d69a9f8d4139b [0,2,0,0,0,0|2,0,0]=4 6932 B11R0.30 C[C@H](O)CNCCOCC(=O)O e1f328cb6e5c4e620629ccc246d5e00e [0,2,0,0,0,0|1,0,0]=3 6933 B11R0.30 C[C@H](O)CNCCSCC(=O)O 637be1bdd2dd40c20ae6a4206931d368 [0,2,0,0,0,0|1,0,0]=3 6934 B11R0.30 NC(=O)CCCCNCC(=O)O 6682312f5a1b38d63cd044d72fb79846 [0,2,0,0,0,0|1,0,1]=4 6935 B11R0.30 NC(=O)CCCCNCC(F)F 9adabb743ddc41da48a08cebeec555f7 [0,2,0,0,0,0|2,0,0]=4 6936 B11R0.30 NC(=O)CCCCOCC(=O)O 45ba4ceba8b92f16949d17d9cdbb81b2 [0,2,0,0,0,0|1,0,1]=4 6937 B11R0.30 NC(=O)CCCCOCC(F)F 91097c1961df19e269624de163f54f53 [0,2,0,0,0,0|2,0,0]=4 6938 B11R0.30 NC(=O)CCCNCCC(=O)O 6003a41b4b8987071f37be3cbb711c88 [0,2,0,0,0,0|1,0,1]=4 6939 B11R0.30 NC(=O)CCCNCCC(F)F d567c9a1f7d756f80d64f3630bee9eec [0,2,0,0,0,0|2,0,0]=4 6940 B11R0.30 NC(=O)CCCOCCC(=O)O 1e106da7712357d566cf80c0280b4e5f [0,2,0,0,0,0|1,0,1]=4 6941 B11R0.30 NC(=O)CCCOCCC(F)F 92682bb69c2704936df0d0316b2a12e2 [0,2,0,0,0,0|2,0,0]=4 6942 B11R0.30 NC(=O)CCNCCCC(=O)O e782ef760c5710cc0f6e8f5520fd5d44 [0,2,0,0,0,0|1,0,1]=4 6943 B11R0.30 NC(=O)CNCCCCC(=O)O cfb91fe6bce99097b386e1b9c73dd0dd [0,2,0,0,0,0|1,0,1]=4 6944 B11R0.30 NC(=O)CNCCCCC(F)F 18c4b44a6ae118c631c060ec213fd493 [0,2,0,0,0,0|2,0,0]=4 6945 B11R0.30 NC(=O)COCCCCC(=O)O 45bdfb28548944cbea97a36b8eb59637 [0,2,0,0,0,0|1,0,1]=4 6946 B11R0.30 NC(=S)CCNCCCC(=O)O 0b0fccb31b8b9cb7629e0e8403f925cd [0,2,0,0,0,0|1,0,1]=4 6947 B11R0.30 O=C(O)CCCCNCC(=O)O abfaebbce99cbb8145b3559e72aeeeca [0,2,0,0,0,0|1,0,1]=4 6948 B11R0.30 O=C(O)CCCCNCC(F)F 9c223d8ce652d420b959b2f70513cc0a [0,2,0,0,0,0|1,0,0]=3 6949 B11R0.30 O=C(O)CCCCNC[N+](=O)[O-] 8db58bf80337317523990ff12a84ea08 [0,2,0,0,0,0|2,0,0]=4 6950 B11R0.30 O=C(O)CCCCOCC(=O)O a77fd82fc2f34ce7f1215325280a8376 [0,2,0,0,0,0|1,0,1]=4 6951 B11R0.30 O=C(O)CCCCOCC(F)F 83d1f5b14fc879abdc48147fdec24ca2 [0,2,0,0,0,0|1,0,0]=3 6952 B11R0.30 O=C(O)CCCCOC[N+](=O)[O-] 7d3f3dfe14bf9b67f9e8c54a364aaf40 [0,2,0,0,0,0|2,0,0]=4 6953 B11R0.30 O=C(O)CCCNCCC(=O)O 0649a98bcffeb078ae2231333128bde3 [0,2,0,0,0,0|1,0,1]=4 6954 B11R0.30 O=C(O)CCCNCCC(F)F 2c1b3ef75bbe7cfd3b015e0f089f4ee6 [0,2,0,0,0,0|1,0,0]=3 6955 B11R0.30 O=C(O)CCCOCCC(F)F cca1cb0ac5d3c78ea3177449afc925bd [0,2,0,0,0,0|1,0,0]=3 6956 B11R0.30 O=C(O)CCCOCC[N+](=O)[O-] 5b3fefba7aa6ea0e371d4e83c59221c8 [0,2,0,0,0,0|2,0,0]=4 6957 B11R0.30 O=C(O)CCNCCOC(F)F 8a49d5cdab0dcb731c4c4856aa4789a1 [0,2,0,0,0,0|2,0,0]=4 6958 B11R0.30 O=C(O)CCOCCC[N+](=O)[O-] ee92e0b6fa6a83eccf08140641a3d8e8 [0,2,0,0,0,0|2,0,0]=4 6959 B11R0.30 O=C(O)CCOCCOC(F)F ac3f5dd810a75d7111ff00451d8a6b72 [0,2,0,0,0,0|2,0,0]=4 6960 B11R0.30 O=C(O)CNCCCCC(F)F 7f071f6e392c7aeaadb036754b526099 [0,2,0,0,0,0|1,0,0]=3 6961 B11R0.30 O=C(O)CNCCCOC(F)F 889462c232652cab5bcd8a874dc26561 [0,2,0,0,0,0|2,0,0]=4 6962 B11R0.30 O=C(O)CNCCOCC(F)F 2b64efa32ca61b4133cf6903290ede68 [0,2,0,0,0,0|2,0,0]=4 6963 B11R0.30 O=C(O)COCCCC[N+](=O)[O-] ce7047ea7b261d6b16bcb0e5d312d7e1 [0,2,0,0,0,0|2,0,0]=4 6964 B11R0.30 O=C(O)COCCNCC(F)F f6de1dd357097684d9883abc8b94995b [0,2,0,0,0,0|2,0,0]=4 6965 B11R0.30 O=C(O)COCCOCC(F)F 75166bdce3b38f1faaf655196103a2be [0,2,0,0,0,0|2,0,0]=4 6966 B11R0.30 O=C(O)CSCCNCC(F)F 9e773622c46bf70ea5f8129964139b0c [0,2,0,0,0,0|2,0,0]=4 6967 B11R0.40 C#CC(=O)NCCCCCCC 0eae3cad00dce1265569f39d62b75552 [0,2,0,0,0,0|1,0,0]=3 6968 B11R0.40 C#CC(=O)NCCCCCCCl 77d70ce351e52d35397f8357ef85f35e [0,2,0,0,0,0|2,0,0]=4 6969 B11R0.40 C#CC(=O)NCCCCCCO 06be861b8a79a9fa196a884449e166f0 [0,2,0,0,0,0|2,0,0]=4 6970 B11R0.40 C#CC(=O)NCCCCCOC 3bda713d8016b37265693d5c2d6a6936 [0,2,0,0,0,0|2,0,0]=4 6971 B11R0.40 C#CC(=O)NCCCCSCC 5720f7600d17e0abc9d18725e633e8de [0,2,0,0,0,0|2,0,0]=4 6972 B11R0.40 C#CC(=O)NCCCOCCC 6100f78b16fc43992142387e91def82d [0,2,0,0,0,0|2,0,0]=4 6973 B11R0.40 C#CC(=O)NCCOCCCC c55c0f7bb19e1f1c42aadbc0bb11dca1 [0,2,0,0,0,0|2,0,0]=4 6974 B11R0.40 C#CCCCCCNC(=O)CO 6d7e435b9ebf28334e2837ce4ee3906b [0,2,0,0,0,0|0,0,2]=4 6975 B11R0.40 C#CCCCCNCC(=O)CO 8e7de7034774d0c07d8d9ce460e5c3b3 [0,2,0,0,0,0|0,0,2]=4 6976 B11R0.40 C#CCCCCNCC(=O)NO c5b0e0720d7b1a58e0500c2499e68abd [0,2,0,0,0,0|0,0,2]=4 6977 B11R0.40 C#CCCCCNCC(=O)OC e2f6dc715589a8ece346caf0b5248175 [0,2,0,0,0,0|0,0,2]=4 6978 B11R0.40 C#CCCCCOCC(=O)OC c2244c24c70f3fcdb9ab83229390685f [0,2,0,0,0,0|0,0,2]=4 6979 B11R0.40 C#CCCCNCCC(=O)NO 550c3499aad91811e9bc02b87d4422d2 [0,2,0,0,0,0|0,0,2]=4 6980 B11R0.40 C#CCCCNCCC(=O)OC 18ffa3be0abab9e38d027d825872de3a [0,2,0,0,0,0|0,0,2]=4 6981 B11R0.40 C#CCCCOCCC(=O)OC 917ee8f1940fd4b9056d633fee275dda [0,2,0,0,0,0|0,0,2]=4 6982 B11R0.40 C#CCCNCCCC(=O)OC dcb34a5c042993e4b84919146aaba9a1 [0,2,0,0,0,0|0,0,2]=4 6983 B11R0.40 C#CCCOCCCC(=O)OC 94f35bf62568c9592f39b8d7f5a013fe [0,2,0,0,0,0|0,0,2]=4 6984 B11R0.40 C#CCNCCCCC(=O)OC b378a15e50774a5f26645dba624ea183 [0,2,0,0,0,0|0,0,2]=4 6985 B11R0.40 C#CCOCCCCC(=O)OC d08248931203da11afc6f02bf748df97 [0,2,0,0,0,0|0,0,2]=4 6986 B11R0.40 C/C=C/CCCOCC(=O)OC e6738c64f6b1d05e552b3b1b0b054e3b [0,2,0,0,0,0|0,0,2]=4 6987 B11R0.40 C/C=C/CCOCCC(=O)OC 8d4e4eea7921da3d2713e13e18d0f159 [0,2,0,0,0,0|0,0,2]=4 6988 B11R0.40 C/C=C/CNCCCC(=O)OC a4329915307a1118bed9c1ea435219a1 [0,2,0,0,0,0|0,0,2]=4 6989 B11R0.40 C/C=C/COCCCC(=O)OC 633bfc4a13989cf751ec9a3c75c24cb4 [0,2,0,0,0,0|0,0,2]=4 6990 B11R0.40 C/C=C\CCCNCC(=O)NO 05fed13575e2d5a6bc150dc51f0d3190 [0,2,0,0,0,0|0,0,2]=4 6991 B11R0.40 C/C=C\CCCNCC(=O)OC 19ba686f1de3be12e553e62d243d41e8 [0,2,0,0,0,0|0,0,2]=4 6992 B11R0.40 C/C=C\CCCOCC(=O)OC d055c54752e506493b99651e5f8db6b0 [0,2,0,0,0,0|0,0,2]=4 6993 B11R0.40 C/C=C\CNCCCC(=O)OC 058e16542f2d5379c1f070bae62b1445 [0,2,0,0,0,0|0,0,2]=4 6994 B11R0.40 C/C=C\COCCCC(=O)OC 8089b12014d3406066de0c9063c4faca [0,2,0,0,0,0|0,0,2]=4 6995 B11R0.40 C=C(C#N)CNCCCCCC a9237bdea01781a61663506d1af4c81d [0,2,0,0,0,0|2,0,0]=4 6996 B11R0.40 C=C(C#N)COCCCCCC 9a90c9c689e82338c49df4001b8b1323 [0,2,0,0,0,0|2,0,0]=4 6997 B11R0.40 C=C(C=O)OCCCCCCC 5222448d8e72f81bee19037f75e00b4c [0,2,0,0,0,0|1,0,0]=3 6998 B11R0.40 C=C(C=O)OCCCCCCF e87076c2e0d8e82df1ebadec1eb65eac [0,2,0,0,0,0|2,0,0]=4 6999 B11R0.40 C=C(C=O)OCCCCCOC e56cb896e8ad3ceb8a8a83abbd2f03c9 [0,2,0,0,0,0|2,0,0]=4 7000 B11R0.40 C=C(C=O)OCCCOCCC 239569db40d1ea46c98b3110aabcdc96 [0,2,0,0,0,0|2,0,0]=4 7001 B11R0.40 C=C(C=O)OCCOCCCC f2b81bae2e549b17c283ba1007c476b4 [0,2,0,0,0,0|2,0,0]=4 7002 B11R0.40 C=C(CC)CNCCCCCC 5673d4e4fc129c4bc12fcdeb75eab606 [0,2,0,0,0,0|2,0,0]=4 7003 B11R0.40 C=C(CC)COCCCCCC 212d40314ce0351be00200277ccfea95 [0,2,0,0,0,0|2,0,0]=4 7004 B11R0.40 C=C(CNCCCCCC)OC b50f3fa0913553bb25a4d41e332bf3c9 [0,2,0,0,0,0|1,0,0]=3 7005 B11R0.40 C=C(CNCCCCCCl)OC 1cb1858c3553d806a686df59ba0bf5b9 [0,2,0,0,0,0|2,0,0]=4 7006 B11R0.40 C=C(CNCCCCCO)OC 7c919390f7508e7dd8910a06f3652f2d [0,2,0,0,0,0|2,0,0]=4 7007 B11R0.40 C=C(CNCCCCOC)OC af4d5148c0b7d44722b281be3123cf0c [0,2,0,0,0,0|2,0,0]=4 7008 B11R0.40 C=C(CNCCCCSC)OC b8365b25f7a97ec119451b42dc111051 [0,2,0,0,0,0|2,0,0]=4 7009 B11R0.40 C=C(CNCCCOCC)OC 8c90a666a9e8448438105143d51caa28 [0,2,0,0,0,0|2,0,0]=4 7010 B11R0.40 C=C(CNCCOCCC)OC f236b86882d7627db9752e34521fefaf [0,2,0,0,0,0|2,0,0]=4 7011 B11R0.40 C=C(CO)CNCCCCCC 55d23f35995915afb4b436463be1bd8f [0,2,0,0,0,0|1,0,0]=3 7012 B11R0.40 C=C(CO)CNCCCCCCl 788090b39e211166513572cce4bf895b [0,2,0,0,0,0|2,0,0]=4 7013 B11R0.40 C=C(CO)CNCCCCCO 7b9c2ad7d196ce3286fe71761213f401 [0,2,0,0,0,0|2,0,0]=4 7014 B11R0.40 C=C(CO)CNCCCCOC 63bf4df6caff86b45f176bd334044290 [0,2,0,0,0,0|2,0,0]=4 7015 B11R0.40 C=C(CO)CNCCCCSC 0178a0e11ba2022fd16744f6e32af9a7 [0,2,0,0,0,0|2,0,0]=4 7016 B11R0.40 C=C(CO)CNCCCOCC 4b6af077bdf2343c78e529a6822e84bf [0,2,0,0,0,0|2,0,0]=4 7017 B11R0.40 C=C(CO)CNCCOCCC 1cebd92afe98b32105045a5c18d5fa6d [0,2,0,0,0,0|2,0,0]=4 7018 B11R0.40 C=C(COCCCCCC)OC 0b95e642e1e4df81a1841fb1104211cb [0,2,0,0,0,0|1,0,0]=3 7019 B11R0.40 C=C(COCCCCOC)OC 229fe40cd31f1015d5a2c69993efdd02 [0,2,0,0,0,0|2,0,0]=4 7020 B11R0.40 C=C(COCCCCSC)OC 6d188d3c5a4e9dd4927e04f86c2c486e [0,2,0,0,0,0|2,0,0]=4 7021 B11R0.40 C=C(COCCCOCC)OC 6e4ad9478e650943c7322831ea8c3687 [0,2,0,0,0,0|2,0,0]=4 7022 B11R0.40 C=C(COCCCSCC)OC 4b7a9928bb796166643448fad9fd8026 [0,2,0,0,0,0|2,0,0]=4 7023 B11R0.40 C=C(COCCOCCC)OC e9e22309f5066dadc128b2745a271c60 [0,2,0,0,0,0|2,0,0]=4 7024 B11R0.40 C=C(COCCSCCC)OC af434454cf98382d87af6d9aa02d4d21 [0,2,0,0,0,0|2,0,0]=4 7025 B11R0.40 C=CC(=O)CCCNCCCC bbe6cc9efa2cfede0189e258e7938747 [0,2,0,0,0,0|1,0,0]=3 7026 B11R0.40 C=CC(=O)CCCNCCCCl bf9d881c0ef7f2d8914a6c18e2c4ffb2 [0,2,0,0,0,0|2,0,0]=4 7027 B11R0.40 C=CC(=O)CCCNCCCO 822cc588774a981eacc82cbdf5d6c762 [0,2,0,0,0,0|2,0,0]=4 7028 B11R0.40 C=CC(=O)CCCNCCOC af90ef4b6961834f57e628af52177395 [0,2,0,0,0,0|2,0,0]=4 7029 B11R0.40 C=CC(=O)CCCNCCSC 3313fbe814b623202f03948d83afdf0e [0,2,0,0,0,0|2,0,0]=4 7030 B11R0.40 C=CC(=O)CCCOCCCC 47940038721735bb278c8d355b063009 [0,2,0,0,0,0|1,0,0]=3 7031 B11R0.40 C=CC(=O)CCCOCCCF b61827bc15146eafca67950e9d8e82c5 [0,2,0,0,0,0|2,0,0]=4 7032 B11R0.40 C=CC(=O)CCCOCCCS 285f13f24be0d5de40fb49f2e79fcd17 [0,2,0,0,0,0|2,0,0]=4 7033 B11R0.40 C=CC(=O)CCCOCCOC 1fdda731e65805ef894e8fe69fa4584e [0,2,0,0,0,0|2,0,0]=4 7034 B11R0.40 C=CC(=O)CCCOCCSC 9d28ed1195b16010328ded6bda068379 [0,2,0,0,0,0|2,0,0]=4 7035 B11R0.40 C=CC(=O)NCCCCCCC f1adb5880043356bf107a0e1433c2cec [0,2,0,0,0,0|1,0,0]=3 7036 B11R0.40 C=CC(=O)NCCCCCCCl d6d893f18d3ddffe932e019a5a24866b [0,2,0,0,0,0|2,0,0]=4 7037 B11R0.40 C=CC(=O)NCCCCCCO 03797892f22ec999c4c98ae0ea5f86fc [0,2,0,0,0,0|2,0,0]=4 7038 B11R0.40 C=CC(=O)NCCCCCOC c7baf2d321b706a0588c4f203ed80a4b [0,2,0,0,0,0|2,0,0]=4 7039 B11R0.40 C=CC(=O)NCCCCOCC fc00131a269b6500d61baa4564b55924 [0,2,0,0,0,0|2,0,0]=4 7040 B11R0.40 C=CC(=O)NCCCCSCC 938277a895496fd599c39bad1c7504b5 [0,2,0,0,0,0|2,0,0]=4 7041 B11R0.40 C=CC(=O)NCCCOCCC de06ebe26dd5670adb4d08c79f4a395c [0,2,0,0,0,0|2,0,0]=4 7042 B11R0.40 C=CC(=O)NCCNCCCC cc3072e6258eab02c4919941571a1b4d [0,2,0,0,0,0|2,0,0]=4 7043 B11R0.40 C=CC(=O)NCCOCCCC 56eae8a6d76566f347c4bebbddee2c93 [0,2,0,0,0,0|2,0,0]=4 7044 B11R0.40 C=CC(=O)NCOCCCCC 16f6433647fd40d95f1da590e5a9b86e [0,2,0,0,0,0|2,0,0]=4 7045 B11R0.40 C=CC(=O)OCCCCOCC 9981dbece93b5b764f827df65729f19c [0,2,0,0,0,0|2,0,0]=4 7046 B11R0.40 C=CC(=O)OCCNCCCC 724e8d3fb78ee299306f0449ce74fc6b [0,2,0,0,0,0|2,0,0]=4 7047 B11R0.40 C=CC(=O)OCCOCCCC caa08cd7b5d55cba49fcdf2c0960b55d [0,2,0,0,0,0|2,0,0]=4 7048 B11R0.40 C=CC(O)CNCCCCCC b79358333ab692d8b297775ed406ef8d [0,2,0,0,0,0|1,0,1]=4 7049 B11R0.40 C=CCCCCCNC(=O)CO cd204ba3b2db84dd98668282e43c1935 [0,2,0,0,0,0|0,0,2]=4 7050 B11R0.40 C=CCCCCNCC(=O)CO 61a4f8f0e687cc04e68fb9f662c8507f [0,2,0,0,0,0|0,0,2]=4 7051 B11R0.40 C=CCCCCNCC(=O)NO 6eea32b16363483c11169fd5d61ebd3e [0,2,0,0,0,0|0,0,2]=4 7052 B11R0.40 C=CCCCCNCC(=O)OC 9793dbbee288dbcc904bdfdc467eead2 [0,2,0,0,0,0|0,0,2]=4 7053 B11R0.40 C=CCCCCOCC(=O)OC c2a5e504b8fe567a17ce6510530e06a6 [0,2,0,0,0,0|0,0,2]=4 7054 B11R0.40 C=CCCCNCCC(=O)NO 5e9b8b4c18dc6e95d3dafb5843bfe7af [0,2,0,0,0,0|0,0,2]=4 7055 B11R0.40 C=CCCCNCCC(=O)OC 03ae0f5343a761711b970197563b910a [0,2,0,0,0,0|0,0,2]=4 7056 B11R0.40 C=CCCCOCCC(=O)OC af25e5caddbc710aac8373a02f9f65a9 [0,2,0,0,0,0|0,0,2]=4 7057 B11R0.40 C=CCCNCCCC(=O)OC a13f98b3ef337f4094f8371aaf20bb0e [0,2,0,0,0,0|0,0,2]=4 7058 B11R0.40 C=CCCOCCCC(=O)OC 393b6363e165ff3c61c249ab76125099 [0,2,0,0,0,0|0,0,2]=4 7059 B11R0.40 C=CCNCCCCC(=O)OC 59e25587f83759760f06f8b306103bae [0,2,0,0,0,0|0,0,2]=4 7060 B11R0.40 C=CCOCCCCC(=O)OC 2f86a5aa905bc370d55876cced815f22 [0,2,0,0,0,0|0,0,2]=4 7061 B11R0.40 CC#CCCCOCC(=O)OC 3c6dd8cdc37da413137ccfcee5220282 [0,2,0,0,0,0|0,0,2]=4 7062 B11R0.40 CC#CCCOCCC(=O)OC bd77bff3034e1b26ac0dd74f3b79d3a3 [0,2,0,0,0,0|0,0,2]=4 7063 B11R0.40 CC#CCNCCCC(=O)OC da40754c3ee09e86b13dced8fb615113 [0,2,0,0,0,0|0,0,2]=4 7064 B11R0.40 CC#CCOCCCC(=O)OC 009dbb9aaaaa0e241f416a904020e57b [0,2,0,0,0,0|0,0,2]=4 7065 B11R0.40 CC/C=C/CCOCC(=O)OC 6293af53f86b7b6af2dad649392b8297 [0,2,0,0,0,0|0,0,2]=4 7066 B11R0.40 CC/C=C/CNCCC(=O)NO 5ad145b6f4c425008113db669f037af6 [0,2,0,0,0,0|0,0,2]=4 7067 B11R0.40 CC/C=C/CNCCC(=O)OC ad326f88710a69583b37756b88f74086 [0,2,0,0,0,0|0,0,2]=4 7068 B11R0.40 CC/C=C/COCCC(=O)OC 9d1bab575902dc87d29b79791b4ad611 [0,2,0,0,0,0|0,0,2]=4 7069 B11R0.40 CC/C=C\CCNCC(=O)NO d8b0d829e39045137183a471227d7c27 [0,2,0,0,0,0|0,0,2]=4 7070 B11R0.40 CC/C=C\CCNCC(=O)OC 2fbfc155d56dcba5809aaf9a2943d0d5 [0,2,0,0,0,0|0,0,2]=4 7071 B11R0.40 CC/C=C\CCOCC(=O)OC 89064c1ffbbb951a087c64e7150f0981 [0,2,0,0,0,0|0,0,2]=4 7072 B11R0.40 CC/C=C\COCCC(=O)OC a2850a203566d3899102a1920f3d1d85 [0,2,0,0,0,0|0,0,2]=4 7073 B11R0.40 CC=CCCCOCC(=O)OC 58a58c868bcf876f660a2c30982521e3 [0,2,0,0,0,0|0,0,2]=4 7074 B11R0.40 CC=CCNCCCC(=O)OC 991e60947a5ccf80b2816288d152a8bd [0,2,0,0,0,0|0,0,2]=4 7075 B11R0.40 CC=CCOCCCC(=O)OC 2015e24a9f48f25424edf651ff14cfee [0,2,0,0,0,0|0,0,2]=4 7076 B11R0.40 CCC#CCCOCC(=O)OC b9789bd2f2c0b23abfc7d38985352c87 [0,2,0,0,0,0|0,0,2]=4 7077 B11R0.40 CCC#CCOCCC(=O)OC 08ca2d9083b13767d14c2456b0f9474f [0,2,0,0,0,0|0,0,2]=4 7078 B11R0.40 CCC(=O)CCCCNCCBr 5c9de39dbbb4f1622cb326ee2015afd4 [0,2,0,0,0,0|2,0,0]=4 7079 B11R0.40 CCC(=O)CCCCNCCF 1538830991ecbdde18b3f8a838eefc29 [0,2,0,0,0,0|2,0,0]=4 7080 B11R0.40 CCC(=O)CCCCNCCI 331d09a8ea3b8560fec2bf0c9ad0f12d [0,2,0,0,0,0|2,0,0]=4 7081 B11R0.40 CCC(=O)CCCCNCCO 4d78d7a77bab056eb08607fc74a12822 [0,2,0,0,0,0|2,0,0]=4 7082 B11R0.40 CCC(=O)CCCCNCCS a282f7b8b2c585a15b8c264e494832ce [0,2,0,0,0,0|2,0,0]=4 7083 B11R0.40 CCC(=O)CCCCOCCF a108d0d1fdedcb8697b81d2fe0293fb2 [0,2,0,0,0,0|2,0,0]=4 7084 B11R0.40 CCC(=O)CCCCOCCS e3ae9bf83285fded75c6a70492a2fac2 [0,2,0,0,0,0|2,0,0]=4 7085 B11R0.40 CCC(=O)CCCCOCOC 3aa42905db5ec08d21fdd342e9bc3739 [0,2,0,0,0,0|2,0,0]=4 7086 B11R0.40 CCC(=O)CNCCCCCCl 169847daaa232a59c508e79ce465d1e5 [0,2,0,0,0,0|2,0,0]=4 7087 B11R0.40 CCC(=O)CNCCCCCO 91c7de1de227e0265fc520775d22d8c8 [0,2,0,0,0,0|2,0,0]=4 7088 B11R0.40 CCC(=O)CNCCCCOC d5b6790bb3d7512c23a539ebe949f5a7 [0,2,0,0,0,0|2,0,0]=4 7089 B11R0.40 CCC(=O)CNCCCCSC adfe90b7cfa2d2b67fa90f773d60c43d [0,2,0,0,0,0|2,0,0]=4 7090 B11R0.40 CCC(=O)COCCCCCF 4d534a6cf979caa0f2da56f2652dc1d0 [0,2,0,0,0,0|2,0,0]=4 7091 B11R0.40 CCC(=O)COCCCCOC 4661f8c22c4d0285a2d318daa5b937e6 [0,2,0,0,0,0|2,0,0]=4 7092 B11R0.40 CCC(=O)COCCCCSC 973dc3a8bf4d40d91f3f7ce58aa6fa50 [0,2,0,0,0,0|2,0,0]=4 7093 B11R0.40 CCC(=O)NCCCCCCCl c12f1575728cff95c45926a5cd979a80 [0,2,0,0,0,0|2,0,0]=4 7094 B11R0.40 CCC(=O)NCCCCCCO e5b240676bd8c501c6689b9f6771a132 [0,2,0,0,0,0|2,0,0]=4 7095 B11R0.40 CCC(=O)NCCCCCOC 179b4dfc9da292e65446bd9e0bb45f8b [0,2,0,0,0,0|2,0,0]=4 7096 B11R0.40 CCC/C=C/CNCC(=O)NO fab1d275c71f2189be33a94e0819e479 [0,2,0,0,0,0|0,0,2]=4 7097 B11R0.40 CCC/C=C/CNCC(=O)OC 977cd2ffa57377ad6072967decfb1d10 [0,2,0,0,0,0|0,0,2]=4 7098 B11R0.40 CCC/C=C/COCC(=O)OC 04cc98d7105b52f9ce9f81076af6ea3a [0,2,0,0,0,0|0,0,2]=4 7099 B11R0.40 CCC/C=C\CNCC(=O)NO 4764691bd82c7c29eb7fddcb18fbe327 [0,2,0,0,0,0|0,0,2]=4 7100 B11R0.40 CCC/C=C\CNCC(=O)OC 1360ea2057aef13ba79a0858f65ed978 [0,2,0,0,0,0|0,0,2]=4 7101 B11R0.40 CCC/C=C\COCC(=O)OC d0d03f62c6e937ca3985487fc878763a [0,2,0,0,0,0|0,0,2]=4 7102 B11R0.40 CCCC#CCOCC(=O)OC ad556fbd28f83bdd0e84c83418bfec68 [0,2,0,0,0,0|0,0,2]=4 7103 B11R0.40 CCCCCCCCN(C)C=O 60df17e7bff532b45ddfc3473c76a602 [0,2,0,0,0,0|2,0,0]=4 7104 B11R0.40 CCCCCCCCN(C)CO fae3de65e7b8918f8c44c346d84947bf [0,2,0,0,0,0|2,0,0]=4 7105 B11R0.40 CCCCCCCNC(=O)C=O abee9ded1e7a7a6b29f3f186b2d24366 [0,2,0,0,0,0|0,0,1]=3 7106 B11R0.40 CCCCCCCNC(=O)CC 686f1ce47fd62528159d592ae6144fd0 [0,2,0,0,0,0|1,0,0]=3 7107 B11R0.40 CCCCCCCNC(=O)CF 406840209e6eaaa926c9723f43f43bb3 [0,2,0,0,0,0|1,0,0]=3 7108 B11R0.40 CCCCCCCNC(=O)CO 649c57dfd5f4fa0f4565341b8aa151e7 [0,2,0,0,0,0|0,0,0]=2 7109 B11R0.40 CCCCCCCNC(=O)CS 53771c9c8b167b3f7995337d22f4a6f9 [0,2,0,0,0,0|0,1,0]=3 7110 B11R0.40 CCCCCCCNC(C)C=O 6f8681ae95f1d8f2d4789cffbb74dc19 [0,2,0,0,0,0|1,0,1]=4 7111 B11R0.40 CCCCCCCNC(C)CO 11186d32dbdc7c7240a14960e89c6d68 [0,2,0,0,0,0|1,0,1]=4 7112 B11R0.40 CCCCCCCN[C@@H](C)CO 2e828866cd2ec0f76bc74f9725d50eb5 [0,2,0,0,0,0|1,0,1]=4 7113 B11R0.40 CCCCCCCN[C@H](C)C=O 3ac57272b4af2f67d6e154af9f11b2cb [0,2,0,0,0,0|1,0,1]=4 7114 B11R0.40 CCCCCCCN[C@H](C)CO 2ed6ae1c070d9c3e4b9dc61528b39162 [0,2,0,0,0,0|1,0,1]=4 7115 B11R0.40 CCCCCCCOC(C)C=O ce702fa237a479f3af9593c724616c46 [0,2,0,0,0,0|1,0,1]=4 7116 B11R0.40 CCCCCCCO[C@H](C)C=O 691ec2d9703b4e379442bde1f5a65178 [0,2,0,0,0,0|1,0,1]=4 7117 B11R0.40 CCCCCCNC/C(=C/Cl)/Cl d724e536ccc81f71307319d5e647b3f5 [0,2,0,0,0,0|2,0,0]=4 7118 B11R0.40 CCCCCCNCC(=O)CC c8e5732d0f65da9c5c5b2a092b9f01ac [0,2,0,0,0,0|1,0,0]=3 7119 B11R0.40 CCCCCCNCC(=O)CO 22481f5647b4924598aea5bd39f61ac5 [0,2,0,0,0,0|0,0,0]=2 7120 B11R0.40 CCCCCCNCC(=O)NC 40b08a506355532a04de3945e21a62e5 [0,2,0,0,0,0|1,0,0]=3 7121 B11R0.40 CCCCCCNCC(=O)NO 70ed1d49a75a058f80d6cb8d6355c00e [0,2,0,0,0,0|0,0,0]=2 7122 B11R0.40 CCCCCCNCC(=O)OC b4b64d05ad9791105a1ead038a87d73e [0,2,0,0,0,0|0,0,0]=2 7123 B11R0.40 CCCCCCNCC(C)CO cf0dea6bd5913beddb6515e445f99f79 [0,2,0,0,0,0|1,0,1]=4 7124 B11R0.40 CCCCCCNCC(C)OC 0cff621ac604a8bce9e3d9429b7785c4 [0,2,0,0,0,0|1,0,1]=4 7125 B11R0.40 CCCCCCNCC(F)CO d6a8e8760a6d8b374a472cfd73c264c4 [0,2,0,0,0,0|1,0,1]=4 7126 B11R0.40 CCCCCCNCC(O)CC 8d7147a52bf4359b8af3bb3315b09e14 [0,2,0,0,0,0|1,0,1]=4 7127 B11R0.40 CCCCCCNCC(O)CF 60bb4cfb3a08d5895213f451640b3788 [0,2,0,0,0,0|1,0,1]=4 7128 B11R0.40 CCCCCCNCC(O)CO db7d7ddc5e0415102c6ef78dcb41df40 [0,2,0,0,0,0|0,0,2]=4 7129 B11R0.40 CCCCCCNC[C@@H](C)CO fc1cd6b385021207c9f5ddc2eb42a052 [0,2,0,0,0,0|1,0,1]=4 7130 B11R0.40 CCCCCCNC[C@@H](C)OC 7c4b121f35ac8a52cba607f05a6e7573 [0,2,0,0,0,0|1,0,1]=4 7131 B11R0.40 CCCCCCNC[C@@H](F)CO 81010159413625c27f9dcae6cec8511d [0,2,0,0,0,0|1,0,1]=4 7132 B11R0.40 CCCCCCNC[C@@H](O)CO 4631a41a8e7b23c621f4060433d7943c [0,2,0,0,0,0|0,0,2]=4 7133 B11R0.40 CCCCCCNC[C@H](C)CO 6305c36cb8a89ed146b5b0f448427b56 [0,2,0,0,0,0|1,0,1]=4 7134 B11R0.40 CCCCCCNC[C@H](C)OC bf1ce180e50f8f2b920876a6b3eeeddc [0,2,0,0,0,0|1,0,1]=4 7135 B11R0.40 CCCCCCNC[C@H](F)CO 1d1b1beea0723c5dcc24dd722009e7bb [0,2,0,0,0,0|1,0,1]=4 7136 B11R0.40 CCCCCCNC[C@H](O)CC a1477a4b6223f7e58a557f5938808421 [0,2,0,0,0,0|1,0,1]=4 7137 B11R0.40 CCCCCCNC[C@H](O)CO 9bffc38446f234d6651d93db9c62cc8a [0,2,0,0,0,0|0,0,2]=4 7138 B11R0.40 CCCCCCOC/C(=C/Cl)/Cl 86f761b34c6cef5aa9a647b39798a90a [0,2,0,0,0,0|2,0,0]=4 7139 B11R0.40 CCCCCCOC/C(=C/I)/C 118407e3a9f9868e9525728ce4adeb55 [0,2,0,0,0,0|2,0,0]=4 7140 B11R0.40 CCCCCCOCC(=CI)C 30a7afefc4e5fafeab8c2950ea14ac5f [0,2,0,0,0,0|2,0,0]=4 7141 B11R0.40 CCCCCCOCC(=O)CC adcf10a6b79c1dbe703e4ef32ea4d479 [0,2,0,0,0,0|1,0,0]=3 7142 B11R0.40 CCCCCCOCC(=O)NC 36fff55613dedf0508c95b9965e07157 [0,2,0,0,0,0|1,0,0]=3 7143 B11R0.40 CCCCCCOCC(=O)OC 09bff5c54ea2c2317e4ffa1248f416e4 [0,2,0,0,0,0|0,0,0]=2 7144 B11R0.40 CCCCCCOCC(C)OC a0fa230585bca5f2e00c13371d45b4f7 [0,2,0,0,0,0|1,0,1]=4 7145 B11R0.40 CCCCCCOCC(O)CO ddf18778675217e7bedbbd4889e96847 [0,2,0,0,0,0|0,0,2]=4 7146 B11R0.40 CCCCCCOC[C@@H](C)OC eea6b16218526f0f26da2e08c85b1bb6 [0,2,0,0,0,0|1,0,1]=4 7147 B11R0.40 CCCCCCOC[C@@H](O)CO 4d2a9898ffd605a1a0642c3fd8b092c2 [0,2,0,0,0,0|0,0,2]=4 7148 B11R0.40 CCCCCCOC[C@H](C)OC 30171bb57d76d51c5ab163cee13542db [0,2,0,0,0,0|1,0,1]=4 7149 B11R0.40 CCCCCCOC[C@H](O)CO a86fe3adbba81d9c2d7853bccbcc0904 [0,2,0,0,0,0|0,0,2]=4 7150 B11R0.40 CCCCCNCCC(=O)NC bf2880d61bf311927f37d9459b95311c [0,2,0,0,0,0|1,0,0]=3 7151 B11R0.40 CCCCCNCCC(=O)NO 0e3cd417c385fa2267d618895d9f197e [0,2,0,0,0,0|0,0,0]=2 7152 B11R0.40 CCCCCNCCC(=O)OC 528d03f621767c5da7a29df90a9b38b7 [0,2,0,0,0,0|0,0,0]=2 7153 B11R0.40 CCCCCNCCC(C)CO 733814c2dbc4e40dc11ccb8ff86576c0 [0,2,0,0,0,0|1,0,1]=4 7154 B11R0.40 CCCCCNCCC(O)CO bb0917424ca5e15763a892df5cc68355 [0,2,0,0,0,0|0,0,2]=4 7155 B11R0.40 CCCCCNCCS(=O)CC 8ec86ef55a81575ed6017118bae7a05d [0,2,0,0,0,0|2,0,0]=4 7156 B11R0.40 CCCCCNCC[C@@H](C)CO 14e8630a92053f727b05e3015c67297a [0,2,0,0,0,0|1,0,1]=4 7157 B11R0.40 CCCCCNCOC(=O)CC 738d6b861ce276b5e51842c47cb9a606 [0,2,0,0,0,0|2,0,0]=4 7158 B11R0.40 CCCCCNCOC(=O)OC 1a984734eabc63cd259d87fe0f6d0e3a [0,2,0,0,0,0|1,0,0]=3 7159 B11R0.40 CCCCCOCCC(=O)NC d53a8d398531b211866f279fd03bc27d [0,2,0,0,0,0|1,0,0]=3 7160 B11R0.40 CCCCCOCCC(=O)OC ccac832df9f8c79f4c2f2e191d935c4d [0,2,0,0,0,0|0,0,0]=2 7161 B11R0.40 CCCCCOCCC(C)OC 351a585c2a253ba5482a00c521169e7f [0,2,0,0,0,0|1,0,1]=4 7162 B11R0.40 CCCCCOCCN(C)C=O 4a3b416200e68e3b583c4cf49622eb55 [0,2,0,0,0,0|2,0,0]=4 7163 B11R0.40 CCCCCOCOC(=O)CC 1566d44e71376e77797064cfeb4bdbd4 [0,2,0,0,0,0|2,0,0]=4 7164 B11R0.40 CCCCCOCOC(=O)OC 8437c1266fb81e44453bd4eda59a8fa6 [0,2,0,0,0,0|1,0,0]=3 7165 B11R0.40 CCCCNC/C=C/C(=O)OC b3a514a731f1acedd7ecc6400b164781 [0,2,0,0,0,0|0,0,2]=4 7166 B11R0.40 CCCCNC/C=C\C(=O)OC 471ceb065340c9365beed3e9d2ebfa53 [0,2,0,0,0,0|0,0,2]=4 7167 B11R0.40 CCCCNCC#CC(=O)OC b07dee74ff9f27fc053920faab56536a [0,2,0,0,0,0|0,0,2]=4 7168 B11R0.40 CCCCNCC=CC(=O)OC 0d0826bdd8498869565a4f15cf2066f6 [0,2,0,0,0,0|0,0,2]=4 7169 B11R0.40 CCCCNCCCC(=O)NC 5ab58c06c9aebec88dfab837bc396f59 [0,2,0,0,0,0|1,0,0]=3 7170 B11R0.40 CCCCNCCCC(=O)OC af4a3bbabc42a3dd3e1785630a7ed514 [0,2,0,0,0,0|0,0,0]=2 7171 B11R0.40 CCCCNCCCC(C)CO cd70668888afa3bd15a67434b1530b13 [0,2,0,0,0,0|1,0,1]=4 7172 B11R0.40 CCCCNCCNC(=O)CC eafd4f313dd1c9da61b2b14982bece7b [0,2,0,0,0,0|2,0,0]=4 7173 B11R0.40 CCCCOC/C=C/C(=O)OC 2578e2b41359b1205a52e699296f8f5d [0,2,0,0,0,0|0,0,2]=4 7174 B11R0.40 CCCCOC/C=C\C(=O)OC a4231358b1b34ec0f8a3eeab7233249a [0,2,0,0,0,0|0,0,2]=4 7175 B11R0.40 CCCCOCC#CC(=O)OC 8934e7b25dfb48eb96b5a4ca53d2fd91 [0,2,0,0,0,0|0,0,2]=4 7176 B11R0.40 CCCCOCC=CC(=O)OC ae9d980bde0206669ae07f1e0557de43 [0,2,0,0,0,0|0,0,2]=4 7177 B11R0.40 CCCCOCCCC(=O)NC c2d274710c85b38a446478cdb547f403 [0,2,0,0,0,0|1,0,0]=3 7178 B11R0.40 CCCCOCCCC(=O)OC 2c00c25d55f4aed289459825ca6caf67 [0,2,0,0,0,0|0,0,0]=2 7179 B11R0.40 CCCCOCCNC(=O)C=O f806f5e4168ec5d46f677ce40ac87b92 [0,2,0,0,0,0|1,0,1]=4 7180 B11R0.40 CCCCOCCNC(=O)CC e75a887cb4393e27da632a529a3d90a7 [0,2,0,0,0,0|2,0,0]=4 7181 B11R0.40 CCCCOCCNC(=O)CF bb586d0c0eed4b850113097bb31ae11b [0,2,0,0,0,0|2,0,0]=4 7182 B11R0.40 CCCCOCCNC(=O)CO 46d63bbe6e95cb3021fbf39dbedf64e4 [0,2,0,0,0,0|1,0,0]=3 7183 B11R0.40 CCCCOCCNC(=O)CS 38f4e9916264f14dafa72c5b17761622 [0,2,0,0,0,0|1,1,0]=4 7184 B11R0.40 CCCCOCCOC(=O)CC 6522276dd406ffc521118952ffb4c4ea [0,2,0,0,0,0|2,0,0]=4 7185 B11R0.40 CCCCOCCOC(=O)OC b231bf275b01e991c727c5357c04f648 [0,2,0,0,0,0|1,0,0]=3 7186 B11R0.40 CCCCOCNCC(=O)NC 616599147b30c3950bdb1b2fd39b4562 [0,2,0,0,0,0|2,0,0]=4 7187 B11R0.40 CCCCOCNCC(=O)NO 09ac782899b5e5b3655f86eea50aeb0c [0,2,0,0,0,0|1,0,0]=3 7188 B11R0.40 CCCCOCNCC(=O)OC 730d997397b70287e85ae8c4a8daeadc [0,2,0,0,0,0|1,0,0]=3 7189 B11R0.40 CCCCOCOCC(=O)CC 89e908693e91dd0d0e69177990ed0083 [0,2,0,0,0,0|2,0,0]=4 7190 B11R0.40 CCCCOCOCC(=O)NC 4b55806592c9b9b1a2f1a1bbf4f1bb36 [0,2,0,0,0,0|2,0,0]=4 7191 B11R0.40 CCCCOCOCC(=O)OC 946e25ac7c12d92c76f185574d681691 [0,2,0,0,0,0|1,0,0]=3 7192 B11R0.40 CCCNCCCCC(=O)CC a0ca041e30af7810958502bfc4beeb26 [0,2,0,0,0,0|1,0,0]=3 7193 B11R0.40 CCCNCCCCC(=O)OC 060557c49fc8b2682bce09dcecd26897 [0,2,0,0,0,0|0,0,0]=2 7194 B11R0.40 CCCNCCOCC(=O)OC 7d542560aee618cccb8ce15c1eff67f0 [0,2,0,0,0,0|1,0,0]=3 7195 B11R0.40 CCCOCCCCC(=O)CC 177be31e74ea458cdea2086674fce0ec [0,2,0,0,0,0|1,0,0]=3 7196 B11R0.40 CCCOCCCCC(=O)OC c38c96dc4e6815105987ed08074c5cd5 [0,2,0,0,0,0|0,0,0]=2 7197 B11R0.40 CCCOCCCNC(=O)C=O 930412a1d10c1c16c4fee538eaa142a0 [0,2,0,0,0,0|1,0,1]=4 7198 B11R0.40 CCCOCCCNC(=O)CC fec3893936a6956cbc39d82258f1e626 [0,2,0,0,0,0|2,0,0]=4 7199 B11R0.40 CCCOCCCNC(=O)CF fc2af4890836849f256d8addfbd4945e [0,2,0,0,0,0|2,0,0]=4 7200 B11R0.40 CCCOCCCNC(=O)CO a47934e78a1d20ef948dc30f597ef7f9 [0,2,0,0,0,0|1,0,0]=3 7201 B11R0.40 CCCOCCCNC(=O)CS bd8dcd4cb86e719aa06d2c9d0f72a033 [0,2,0,0,0,0|1,1,0]=4 7202 B11R0.40 CCCOCCNCC(=O)CC af6d8ece5f96f6d5993dca91750c6331 [0,2,0,0,0,0|2,0,0]=4 7203 B11R0.40 CCCOCCNCC(=O)CO 47b079dfc4b06824587236598da16550 [0,2,0,0,0,0|1,0,0]=3 7204 B11R0.40 CCCOCCNCC(=O)NC 31d2582b75dee5c561ae8d9d18b5f73a [0,2,0,0,0,0|2,0,0]=4 7205 B11R0.40 CCCOCCNCC(=O)NO d792239503bd5ec0bb9e8a7cfbfc479f [0,2,0,0,0,0|1,0,0]=3 7206 B11R0.40 CCCOCCNCC(=O)OC dc4681ef40747337e3903e762819be10 [0,2,0,0,0,0|1,0,0]=3 7207 B11R0.40 CCCOCCOCC(=O)CC 723ec6dd1a32570a19662d1e12346296 [0,2,0,0,0,0|2,0,0]=4 7208 B11R0.40 CCCOCCOCC(=O)NC faa395813f7f435b9e71ac3a336b018c [0,2,0,0,0,0|2,0,0]=4 7209 B11R0.40 CCCOCCOCC(=O)OC 64aebb87f3244a9d7b7f06c29592a387 [0,2,0,0,0,0|1,0,0]=3 7210 B11R0.40 CCCSCCOCC(=O)CC d2067d23d0e94c02b501473ae1f752be [0,2,0,0,0,0|2,0,0]=4 7211 B11R0.40 CCCSCCOCC(=O)NC d89728054d6897369246b7981ce18df3 [0,2,0,0,0,0|2,0,0]=4 7212 B11R0.40 CCCSCCOCC(=O)OC bfd9150e07503b75f145ebf21333d513 [0,2,0,0,0,0|1,0,0]=3 7213 B11R0.40 CCNCCCCCC(=O)OC 78bd529289af6b285c7f270dc69f9cc3 [0,2,0,0,0,0|0,0,0]=2 7214 B11R0.40 CCOCCCCCC(=O)OC 9b80041f3611c56f4bedd2a18eade3b1 [0,2,0,0,0,0|0,0,0]=2 7215 B11R0.40 CCOCCCNCC(=O)CC 4f4839c9cf33d5a6041ac0e17d66aa31 [0,2,0,0,0,0|2,0,0]=4 7216 B11R0.40 CCOCCCNCC(=O)CO 38c5656cb2b027b7ffdf35a630aad082 [0,2,0,0,0,0|1,0,0]=3 7217 B11R0.40 CCOCCCNCC(=O)NC 18ed4231805b9315b892feddb4a0f142 [0,2,0,0,0,0|2,0,0]=4 7218 B11R0.40 CCOCCCNCC(=O)NO 51be6bc87a2f7ff8eb05461ef8175c26 [0,2,0,0,0,0|1,0,0]=3 7219 B11R0.40 CCOCCCNCC(=O)OC c7485a37569a461c52aa81ad8055e3b4 [0,2,0,0,0,0|1,0,0]=3 7220 B11R0.40 CCOCCCOCC(=O)CC 9c1461ad3db61a1f493b386fb087b9cc [0,2,0,0,0,0|2,0,0]=4 7221 B11R0.40 CCOCCCOCC(=O)NC 614e23071f34b17a173bf4898b942683 [0,2,0,0,0,0|2,0,0]=4 7222 B11R0.40 CCOCCCOCC(=O)OC 57dddf421e069c47297be6f52caa57fc [0,2,0,0,0,0|1,0,0]=3 7223 B11R0.40 CCOCCNCCC(=O)NC c8e9cdaa8724994cd9561efaf096ccf3 [0,2,0,0,0,0|2,0,0]=4 7224 B11R0.40 CCOCCNCCC(=O)NO 47b978d3e7d87d74830d799207ceb727 [0,2,0,0,0,0|1,0,0]=3 7225 B11R0.40 CCOCCNCCC(=O)OC 9739503ab4bf541699a74f281c2e2b9c [0,2,0,0,0,0|1,0,0]=3 7226 B11R0.40 CCOCCNCOC(=O)OC 2f46520d864a633cb0e2110e3e899494 [0,2,0,0,0,0|2,0,0]=4 7227 B11R0.40 CCOCCOCCC(=O)NC 23bacdb097a09742d298f3766dbb8de5 [0,2,0,0,0,0|2,0,0]=4 7228 B11R0.40 CCOCCOCCC(=O)OC b15bdf82e04bdb738b2e374226a2be54 [0,2,0,0,0,0|1,0,0]=3 7229 B11R0.40 CCOCCOCOC(=O)OC 1b001321ce33a4b0045747fb5636ab5b [0,2,0,0,0,0|2,0,0]=4 7230 B11R0.40 CCOCNCCCC(=O)OC 46be0dc6a2fa53d0e3dcfb4db7331cb1 [0,2,0,0,0,0|1,0,0]=3 7231 B11R0.40 CCOCOCCCC(=O)NC 012982faa3a83b15cdc051351f5c0aca [0,2,0,0,0,0|2,0,0]=4 7232 B11R0.40 CCOCOCCOC(=O)OC f54b3c8afccb92210f71af931469dca3 [0,2,0,0,0,0|2,0,0]=4 7233 B11R0.40 CCSCCCCNC(=O)C=O d04ce70107fb9198fa34a60fe1e9b96b [0,2,0,0,0,0|1,0,1]=4 7234 B11R0.40 CCSCCCCNC(=O)CC ea0f6528589aacf58e162b969c059b14 [0,2,0,0,0,0|2,0,0]=4 7235 B11R0.40 CCSCCCCNC(=O)CF c2219e44e880e0dcebf731cee5c9c63b [0,2,0,0,0,0|2,0,0]=4 7236 B11R0.40 CCSCCCCNC(=O)CO 3d767f9c997321d233814d207e1ee524 [0,2,0,0,0,0|1,0,0]=3 7237 B11R0.40 CCSCCCCNC(=O)CS c1f619912cd145bf773fb8a015de3420 [0,2,0,0,0,0|1,1,0]=4 7238 B11R0.40 CCSCCCNCC(=O)NC 8d72ebbd34eef83f425180c3ebbaabc8 [0,2,0,0,0,0|2,0,0]=4 7239 B11R0.40 CCSCCCNCC(=O)NO 8d518ac43899a5c80d0e06dd1ac77e47 [0,2,0,0,0,0|1,0,0]=3 7240 B11R0.40 CCSCCCNCC(=O)OC d693d460276bdecc5b8f625d27e28722 [0,2,0,0,0,0|1,0,0]=3 7241 B11R0.40 CCSCCCOCC(=O)CC e95eea67d707e354332756055989bd1d [0,2,0,0,0,0|2,0,0]=4 7242 B11R0.40 CCSCCCOCC(=O)NC 2a5a295fa3b1af8becdc9290c9b7f233 [0,2,0,0,0,0|2,0,0]=4 7243 B11R0.40 CCSCCCOCC(=O)OC 3e5dce16e86bb76e36032bc19e30b6c4 [0,2,0,0,0,0|1,0,0]=3 7244 B11R0.40 CCSCCNCCC(=O)NC 04223a133b78e8421bf2d63e48f9a615 [0,2,0,0,0,0|2,0,0]=4 7245 B11R0.40 CCSCCNCCC(=O)NO 5ec51ed13ab38566690412a74ee47be9 [0,2,0,0,0,0|1,0,0]=3 7246 B11R0.40 CCSCCNCCC(=O)OC 06a359cc9c842e83d31563a3d685e384 [0,2,0,0,0,0|1,0,0]=3 7247 B11R0.40 CCSCCNCOC(=O)OC 99091e33f20ac8cdddca7f1f8400fb0e [0,2,0,0,0,0|2,0,0]=4 7248 B11R0.40 CCSCCOCCC(=O)NC 9fff369bc3243a864103a12995e4983a [0,2,0,0,0,0|2,0,0]=4 7249 B11R0.40 CCSCCOCCC(=O)OC 3a5d46de8a20f41384df05397c6e099d [0,2,0,0,0,0|1,0,0]=3 7250 B11R0.40 CCSCCOCOC(=O)OC 0c96435cf2792cfaf92b3bf76d4c8058 [0,2,0,0,0,0|2,0,0]=4 7251 B11R0.40 CNC(=O)CCCNCCCCl e1e455506db41ca85705cf437dfd38be [0,2,0,0,0,0|2,0,0]=4 7252 B11R0.40 CNC(=O)CCCNCCCO 379fba8165b6223b47704a60ed42b7bd [0,2,0,0,0,0|2,0,0]=4 7253 B11R0.40 CNC(=O)CCCNCCOC a2f99b25649136f4c30f1e999e0f2472 [0,2,0,0,0,0|2,0,0]=4 7254 B11R0.40 CNC(=O)CCCNCCSC eceb3b7a94edf81793e3ca2fae07f017 [0,2,0,0,0,0|2,0,0]=4 7255 B11R0.40 CNC(=O)CCCOCCCF cc4d5aded868bb3b806e82b702664796 [0,2,0,0,0,0|2,0,0]=4 7256 B11R0.40 CNC(=O)CCCOCCCS 8c7fe610e81e73e93c9203c0dc25d782 [0,2,0,0,0,0|2,0,0]=4 7257 B11R0.40 CNC(=O)CCCOCCOC 679110e3bc325cfc067b9e066fb8fd05 [0,2,0,0,0,0|2,0,0]=4 7258 B11R0.40 CNC(=O)CCCOCCSC 57b0429c7fad297937b249ddbc6c5318 [0,2,0,0,0,0|2,0,0]=4 7259 B11R0.40 CNC(=O)CCNCCCCCl 863621d5e1da9451abccb69ad36a59e2 [0,2,0,0,0,0|2,0,0]=4 7260 B11R0.40 CNC(=O)CCNCCCCF 946e4e57b3163fbf4e41d96ac1d3e10a [0,2,0,0,0,0|2,0,0]=4 7261 B11R0.40 CNC(=O)CCNCCCCO 5832dd33e1f03dc5d18f2150910928a4 [0,2,0,0,0,0|2,0,0]=4 7262 B11R0.40 CNC(=O)CCNCCCCS 9929ee72b36edbff45d5abffd8f80e6e [0,2,0,0,0,0|2,0,0]=4 7263 B11R0.40 CNC(=O)CCNCCCOC 985b6a1ccf1e6397ebff4215be239c54 [0,2,0,0,0,0|2,0,0]=4 7264 B11R0.40 CNC(=O)CCNCCCSC 1311b948fc9885badb5405b81798f393 [0,2,0,0,0,0|2,0,0]=4 7265 B11R0.40 CNC(=O)CCOCCCCF c4de6f38831e5bccd19015340b56ec3d [0,2,0,0,0,0|2,0,0]=4 7266 B11R0.40 CNC(=O)CCOCCCCS 2659c35ea398a3cf89c65326429e330d [0,2,0,0,0,0|2,0,0]=4 7267 B11R0.40 CNC(=O)CCOCCCOC 1a3bc4659a5dba4d2c916b745d84a2b5 [0,2,0,0,0,0|2,0,0]=4 7268 B11R0.40 CNC(=O)CCOCCCSC f3c9a86b4d20626a39fa9c5677b86fd9 [0,2,0,0,0,0|2,0,0]=4 7269 B11R0.40 CNC(=O)CNCCCCCCl 1b24bb6cfabdfe0025087d1d392598b1 [0,2,0,0,0,0|2,0,0]=4 7270 B11R0.40 CNC(=O)CNCCCCCF 7b5105d20aa8de64473ea79cf8b50525 [0,2,0,0,0,0|2,0,0]=4 7271 B11R0.40 CNC(=O)CNCCCCCO 728cf07c565537ba2c1fca79a62d199b [0,2,0,0,0,0|2,0,0]=4 7272 B11R0.40 CNC(=O)CNCCCCOC f7baaa1dac3847017477b23b2f48566a [0,2,0,0,0,0|2,0,0]=4 7273 B11R0.40 CNC(=O)CNCCCCSC 02be1b09bbf0b9bcfd517d1564f71a68 [0,2,0,0,0,0|2,0,0]=4 7274 B11R0.40 CNC(=O)COCCCCCF 30a06aacc12e6be93a441e8da3712845 [0,2,0,0,0,0|2,0,0]=4 7275 B11R0.40 CNC(=O)COCCCCOC a539f4641c3a9dab39104b55ede71de3 [0,2,0,0,0,0|2,0,0]=4 7276 B11R0.40 CNC(=O)COCCCCSC 0d9899b882fa3d6dcae7317e3bdd0e37 [0,2,0,0,0,0|2,0,0]=4 7277 B11R0.40 COC(=O)CCCCCNC#N 2a77b751cf9969a98ecbdcc20c76c056 [0,2,0,0,0,0|1,0,1]=4 7278 B11R0.40 COC(=O)CCCCCNC=O 22efc9ad3758996849ae1e958f0b43cd [0,2,0,0,0,0|1,0,1]=4 7279 B11R0.40 COC(=O)CCCCCNCF 2fdeafd19615aabdfecac65c7ee85598 [0,2,0,0,0,0|1,0,0]=3 7280 B11R0.40 COC(=O)CCCCCNCO af7eaee93a3fef3c4544e48a16c6e56f [0,2,0,0,0,0|1,0,0]=3 7281 B11R0.40 COC(=O)CCCCCOCF 3b8a2ff8fc1bef6bde3b7c835f3e6a30 [0,2,0,0,0,0|1,0,0]=3 7282 B11R0.40 COC(=O)CCCCNCC#N 9709e39fc2c870c614aaec785b8c407f [0,2,0,0,0,0|1,0,1]=4 7283 B11R0.40 COC(=O)CCCCNCC=O 4ab0720286230216fec2e56a50b11011 [0,2,0,0,0,0|1,0,1]=4 7284 B11R0.40 COC(=O)CCCCNCCBr 389a9425bed3fc47018de90353426cdc [0,2,0,0,0,0|1,0,0]=3 7285 B11R0.40 COC(=O)CCCCNCCF acdfcaf980a2e2514f502844739bd67a [0,2,0,0,0,0|1,0,0]=3 7286 B11R0.40 COC(=O)CCCCNCCI 8fc5f158498fb34376eecf1a634e8fc5 [0,2,0,0,0,0|1,0,0]=3 7287 B11R0.40 COC(=O)CCCCNCCO e7f0e01865858a91030334a948df571f [0,2,0,0,0,0|1,0,0]=3 7288 B11R0.40 COC(=O)CCCCNCCS 530b407c8654dbd48105c768dba745e8 [0,2,0,0,0,0|1,0,0]=3 7289 B11R0.40 COC(=O)CCCCNCSC a8830018c591017122980cf3745fb50b [0,2,0,0,0,0|1,0,0]=3 7290 B11R0.40 COC(=O)CCCCOCC#N 00218bc617a30ff7eb448771054e041a [0,2,0,0,0,0|1,0,1]=4 7291 B11R0.40 COC(=O)CCCCOCC=O 91396fca85df59181da3d13a3ce3ce4f [0,2,0,0,0,0|1,0,1]=4 7292 B11R0.40 COC(=O)CCCCOCCF 1d20051be253a43f413739bd5e7398e1 [0,2,0,0,0,0|1,0,0]=3 7293 B11R0.40 COC(=O)CCCCOCCS 5f146b13f8bc53f0b1d9f8770994d494 [0,2,0,0,0,0|1,0,0]=3 7294 B11R0.40 COC(=O)CCCCOCSC 0863b97c6be13255d8906e28183b8659 [0,2,0,0,0,0|1,0,0]=3 7295 B11R0.40 COC(=O)CCCNCCC#N ecb784de262c787e5f2334333db87463 [0,2,0,0,0,0|1,0,1]=4 7296 B11R0.40 COC(=O)CCCNCCC=O ff5e004c5473c559ed17b6eadd369b4e [0,2,0,0,0,0|1,0,1]=4 7297 B11R0.40 COC(=O)CCCNCCCCl 8508da7d6b43fa27c5046753d4a650fb [0,2,0,0,0,0|1,0,0]=3 7298 B11R0.40 COC(=O)CCCNCCCF c509034befe6b0b71c5e6bf9f704b220 [0,2,0,0,0,0|1,0,0]=3 7299 B11R0.40 COC(=O)CCCNCCCO ae78a0866713110e761cbc6c0669803d [0,2,0,0,0,0|1,0,0]=3 7300 B11R0.40 COC(=O)CCCNCCCS b8568108aca169fbbea4b0e8d5dcbc4d [0,2,0,0,0,0|1,0,0]=3 7301 B11R0.40 COC(=O)CCCNCCON b21b29b265c5b874c605cd7233fe49b4 [0,2,0,0,0,0|2,0,0]=4 7302 B11R0.40 COC(=O)CCCNCCSC 6bea0abab707a37e0a3725effd1a3095 [0,2,0,0,0,0|1,0,0]=3 7303 B11R0.40 COC(=O)CCCOCCC#N 621776ff379b34d9d6596994039746cc [0,2,0,0,0,0|1,0,1]=4 7304 B11R0.40 COC(=O)CCCOCCC=O 7e20773b50f615e5bf6590df878b7507 [0,2,0,0,0,0|1,0,1]=4 7305 B11R0.40 COC(=O)CCCOCCCF ad4a657375774e174695b5c380767605 [0,2,0,0,0,0|1,0,0]=3 7306 B11R0.40 COC(=O)CCCOCCCS 614db15c725c13d73ce896e4a3526258 [0,2,0,0,0,0|1,0,0]=3 7307 B11R0.40 COC(=O)CCCOCCSC a532869a6a9d1335d72148f96ad99d09 [0,2,0,0,0,0|1,0,0]=3 7308 B11R0.40 COC(=O)CCNCCCC#N 9a6a0bc2235d006b3b6e5c80fbe5892d [0,2,0,0,0,0|1,0,1]=4 7309 B11R0.40 COC(=O)CCNCCCC=O 36ecc984faa2b4edb05e1eef24adeddf [0,2,0,0,0,0|1,0,1]=4 7310 B11R0.40 COC(=O)CCNCCCCCl bb826384e531e4c800eddcc5d242e17f [0,2,0,0,0,0|1,0,0]=3 7311 B11R0.40 COC(=O)CCNCCCCF d4b42e07dbe86fc7a477b2dc03e98869 [0,2,0,0,0,0|1,0,0]=3 7312 B11R0.40 COC(=O)CCNCCCCO 01547e1a5ff564f49609eb19c19b3246 [0,2,0,0,0,0|1,0,0]=3 7313 B11R0.40 COC(=O)CCNCCCCS e5445b20c264ac106343d36efa453bce [0,2,0,0,0,0|1,0,0]=3 7314 B11R0.40 COC(=O)CCNCCCSC f634b170aff4c9918b899afbd28dc77d [0,2,0,0,0,0|1,0,0]=3 7315 B11R0.40 COC(=O)CCOCCCC#N 89eb256190d415f3ef32aa7b4bb6136a [0,2,0,0,0,0|1,0,1]=4 7316 B11R0.40 COC(=O)CCOCCCC=O 9a2e5e19c2bcf1573b84c91f41579bf1 [0,2,0,0,0,0|1,0,1]=4 7317 B11R0.40 COC(=O)CCOCCCCF fdd63d188c06e45bc0534668d783c9fe [0,2,0,0,0,0|1,0,0]=3 7318 B11R0.40 COC(=O)CCOCCCCS 3b9308a913cffb35eed8fd20b29ba3e8 [0,2,0,0,0,0|1,0,0]=3 7319 B11R0.40 COC(=O)CCOCCCSC b26f1a53d0c30e5fe57fe463fe93b69e [0,2,0,0,0,0|1,0,0]=3 7320 B11R0.40 COC(=O)CCOCCOCF 4d74cb4d67d9951b06d588607ea6219e [0,2,0,0,0,0|2,0,0]=4 7321 B11R0.40 COC(=O)CNCCCCC#N 5be3186471a79c03b3ec14277a3d0965 [0,2,0,0,0,0|1,0,1]=4 7322 B11R0.40 COC(=O)CNCCCCC=O 44cb8d3deb7b70f3ec297431d02ef7a4 [0,2,0,0,0,0|1,0,1]=4 7323 B11R0.40 COC(=O)CNCCCCCCl 0c1d69aaf18f86e286dc851d6b343161 [0,2,0,0,0,0|1,0,0]=3 7324 B11R0.40 COC(=O)CNCCCCCF 820ed3e8b866d3514f6760b96b1f6d43 [0,2,0,0,0,0|1,0,0]=3 7325 B11R0.40 COC(=O)CNCCCCCO 5569fb90468880f109cc36d64e9a9a82 [0,2,0,0,0,0|1,0,0]=3 7326 B11R0.40 COC(=O)CNCCCCON 5aa7e4651b3cc8fb416d227ed7612db7 [0,2,0,0,0,0|2,0,0]=4 7327 B11R0.40 COC(=O)CNCCCCSC b2c17859876c00fe792d17efa257daec [0,2,0,0,0,0|1,0,0]=3 7328 B11R0.40 COC(=O)CNCCOCCO d857fecd728df366e2e37ac1cfedb67c [0,2,0,0,0,0|2,0,0]=4 7329 B11R0.40 COC(=O)CNCCOCCS 1695ce910485caa6bae6424b039a45e2 [0,2,0,0,0,0|2,0,0]=4 7330 B11R0.40 COC(=O)CNCCSCCO 139acc59232a4499157abe36e901ccd6 [0,2,0,0,0,0|2,0,0]=4 7331 B11R0.40 COC(=O)COCCCCC#N 1f2fdfb728a648fc7a05998668ac7b57 [0,2,0,0,0,0|1,0,1]=4 7332 B11R0.40 COC(=O)COCCCCC=O c980f88c2addfeab188fbf48650b4298 [0,2,0,0,0,0|1,0,1]=4 7333 B11R0.40 COC(=O)COCCCCCF cba36326a78ca1f965959e137fb7ac72 [0,2,0,0,0,0|1,0,0]=3 7334 B11R0.40 COC(=O)COCCCCSC 447c9e188b6f6e43d32a8bc9d652b2ad [0,2,0,0,0,0|1,0,0]=3 7335 B11R0.40 COC(=O)COCCCOCF 16bc0079c17fee6d4c7fe217a42855a3 [0,2,0,0,0,0|2,0,0]=4 7336 B11R0.40 COC(=O)COCCNCCBr 4bec773a0c58356a00c8d6aaee402259 [0,2,0,0,0,0|2,0,0]=4 7337 B11R0.40 COC(=O)COCCNCCF 18e11886c262cd7473c5f3dfa8890b9d [0,2,0,0,0,0|2,0,0]=4 7338 B11R0.40 COC(=O)COCCNCCI dc9337944c8f41d1539a6744b2d7e6ba [0,2,0,0,0,0|2,0,0]=4 7339 B11R0.40 COC(=O)COCCNCCO cb74cd831122e9df4bb8add78cdc15bb [0,2,0,0,0,0|2,0,0]=4 7340 B11R0.40 COC(=O)COCCNCCS cf05785ecb758e5ac2a5b93c3a67dc09 [0,2,0,0,0,0|2,0,0]=4 7341 B11R0.40 COC(=O)COCCOCCF ff3128386a5c1cb228a59813ed3d26ec [0,2,0,0,0,0|2,0,0]=4 7342 B11R0.40 COC(=O)COCCOCCS af887c5e10625673873df556ffb66edd [0,2,0,0,0,0|2,0,0]=4 7343 B11R0.40 COC(=O)COCCOCSC ca5bcabc5c9d48c8703ea3dd54208e5d [0,2,0,0,0,0|2,0,0]=4 7344 B11R0.40 COC(=O)OCCOCCCF de029e7ac1644d7e90d3b7c22ec5348b [0,2,0,0,0,0|2,0,0]=4 7345 B11R0.40 COC(=O)OCCOCCCS 89fffcc0bbee4cf534fff47521a1b7a2 [0,2,0,0,0,0|2,0,0]=4 7346 B11R0.40 COC(=O)OCCOCCSC 2ceeed8cd5b255e33d51f776445a31a4 [0,2,0,0,0,0|2,0,0]=4 7347 B11R0.40 COC(=O)OCNCCCCCl 4e9a14e548c308432e06e6dbfef901f0 [0,2,0,0,0,0|2,0,0]=4 7348 B11R0.40 COC(=O)OCNCCCCO 0ccd9717301e3cf82ebb5da45eb3604c [0,2,0,0,0,0|2,0,0]=4 7349 B11R0.40 COC(=O)OCNCCCCS 426dd4d42947f05957ddb7ca13ef8bef [0,2,0,0,0,0|2,0,0]=4 7350 B11R0.40 COC(=O)OCNCCCSC 902e0b29940a4df3a1ba5a8130ae941a [0,2,0,0,0,0|2,0,0]=4 7351 B11R0.40 COC(=O)OCOCCCCF fca55a25cec8b0cea6dae367d2cdc8ec [0,2,0,0,0,0|2,0,0]=4 7352 B11R0.40 COC(=O)OCOCCCCS 385d9b18da918b0f0f3955a95adbad26 [0,2,0,0,0,0|2,0,0]=4 7353 B11R0.40 COC(=O)OCOCCCSC d075f96e63d65a9fb63b5baec68d4274 [0,2,0,0,0,0|2,0,0]=4 7354 B11R0.40 COCCCCCNC(=O)C=O e15e0757a64893eee88518f1fda4ea7e [0,2,0,0,0,0|1,0,1]=4 7355 B11R0.40 COCCCCCNC(=O)CF 58c05577724475f7a35f76a9992cbd8f [0,2,0,0,0,0|2,0,0]=4 7356 B11R0.40 COCCCCCNC(=O)CO 60d8072e5d6484d79910c980a11ba8d6 [0,2,0,0,0,0|1,0,0]=3 7357 B11R0.40 COCCCCCNC(=O)CS 2428285461875cbb3b6f98e666423f1f [0,2,0,0,0,0|1,1,0]=4 7358 B11R0.40 COCCCCNCC(=O)CO 31d44522c7c4c00441905fa4da232bdc [0,2,0,0,0,0|1,0,0]=3 7359 B11R0.40 COCCCCNCC(=O)NO fd2162f73e9d0d4e3a5103bac2a81c2b [0,2,0,0,0,0|1,0,0]=3 7360 B11R0.40 COCCCCNCC(=O)OC 047baeb57289bf0885885f64979f4866 [0,2,0,0,0,0|1,0,0]=3 7361 B11R0.40 COCCCCOCC(=O)OC 931b9f10ba823e1596417b22b927de75 [0,2,0,0,0,0|1,0,0]=3 7362 B11R0.40 COCCCNCCC(=O)NO c35235a4170548ef0720a7bd9f0f4d9a [0,2,0,0,0,0|1,0,0]=3 7363 B11R0.40 COCCCNCCC(=O)OC e306541eb8340983226a2af15f8dfebb [0,2,0,0,0,0|1,0,0]=3 7364 B11R0.40 COCCCNCOC(=O)OC 2b18f33f90e6c5cc10697137b589f815 [0,2,0,0,0,0|2,0,0]=4 7365 B11R0.40 COCCCOCCC(=O)OC b4f1d1de8127af98e6f242234cd1ea0e [0,2,0,0,0,0|1,0,0]=3 7366 B11R0.40 COCCCOCOC(=O)OC dfb6df9693f75e83ed062be54f66691e [0,2,0,0,0,0|2,0,0]=4 7367 B11R0.40 COCCNCCCC(=O)OC 83cc4d7e4535f097edd93f9c804c386b [0,2,0,0,0,0|1,0,0]=3 7368 B11R0.40 COCCOCCCC(=O)OC 99cf3628ca871405b6cc15b92d3d5b58 [0,2,0,0,0,0|1,0,0]=3 7369 B11R0.40 COCCOCCNC(=O)CO aaadd15e543e97b3bf897ccdb075b841 [0,2,0,0,0,0|2,0,0]=4 7370 B11R0.40 COCCOCCOC(=O)OC 25c20c3eee60a7db8df16c9461ecbcb8 [0,2,0,0,0,0|2,0,0]=4 7371 B11R0.40 COCCOCNCC(=O)NO 3bed89caa244d46b80dab24732fd61cd [0,2,0,0,0,0|2,0,0]=4 7372 B11R0.40 COCCOCNCC(=O)OC ab0f82b071000d64fddbc5cb54fa100c [0,2,0,0,0,0|2,0,0]=4 7373 B11R0.40 COCCOCOCC(=O)OC 44684d1343c616e87fc778e0ebb56e1f [0,2,0,0,0,0|2,0,0]=4 7374 B11R0.40 COCNCCCCC(=O)OC ca301f2e53472380737e2e1a16df5a62 [0,2,0,0,0,0|1,0,0]=3 7375 B11R0.40 COCOCCCCC(=O)OC 46187c7866992bbcae1859b32e6d100b [0,2,0,0,0,0|1,0,0]=3 7376 B11R0.40 COCOCCNCC(=O)NO 9f7a6b55f5c3654d04eea50f0b5f4e74 [0,2,0,0,0,0|2,0,0]=4 7377 B11R0.40 COCOCCNCC(=O)OC 8454ab259ca547f0dbb22448bd7df281 [0,2,0,0,0,0|2,0,0]=4 7378 B11R0.40 COCOCCOCC(=O)OC 82f079e871292a54857bdc4b3014d475 [0,2,0,0,0,0|2,0,0]=4 7379 B11R0.40 CSCCCCNCC(=O)CO f2fd79f1ccfc8ac07d50685faaa51616 [0,2,0,0,0,0|1,0,0]=3 7380 B11R0.40 CSCCCNCCC(=O)NO 2bec89b82578902d80c13d5145e68444 [0,2,0,0,0,0|1,0,0]=3 7381 B11R0.40 N#CCCCCCNC(=O)CO 1fa3ceb13ad13ffac4dc19311aa7593f [0,2,0,0,0,0|1,0,1]=4 7382 B11R0.40 N#CCCCCNCC(=O)CO 165f495c84638a1438821a1b022b3e2d [0,2,0,0,0,0|1,0,1]=4 7383 B11R0.40 N#CCCCCNCC(=O)NO 18acf6602c58a785ac4697b1274fadd2 [0,2,0,0,0,0|1,0,1]=4 7384 B11R0.40 N#CCCCNCCC(=O)NO 0a85c835b16e007b31231ea45a9bc7a9 [0,2,0,0,0,0|1,0,1]=4 7385 B11R0.40 NOCCCCNCC(=O)NO 96ebcdd587276f660c1b7e365b50512b [0,2,0,0,0,0|2,0,0]=4 7386 B11R0.40 O=C(CCNCCCCF)NO 017670fe7ceb2cab251c80df3081b80f [0,2,0,0,0,0|1,0,0]=3 7387 B11R0.40 O=C(CCNCCCCO)NO a88ee6183f2279d0ef7955aee8b5390f [0,2,0,0,0,0|1,0,0]=3 7388 B11R0.40 O=C(CF)NCCCCCCCl 6c13ecc5d5cec8f4dc7cde725f9e60a0 [0,2,0,0,0,0|2,0,0]=4 7389 B11R0.40 O=C(CF)NCCCCCCO 8c114271c45c570e7d1f57d6af9f0d9c [0,2,0,0,0,0|2,0,0]=4 7390 B11R0.40 O=C(CNCCCCCF)NO bb2e68b122e81136ef69349e61ee5e9c [0,2,0,0,0,0|1,0,0]=3 7391 B11R0.40 O=C(CNCCCCCO)NO 147cd889eb10e26d74dc067964e2b2a2 [0,2,0,0,0,0|1,0,0]=3 7392 B11R0.40 O=C(CNCCOCCO)NO 89f88e191565e6cc1340fb6e0e6ffad1 [0,2,0,0,0,0|2,0,0]=4 7393 B11R0.40 O=C(CO)CNCCCCCCl 606a142a4758e981892716dfd004ff3b [0,2,0,0,0,0|1,0,0]=3 7394 B11R0.40 O=C(CO)CNCCCCCO dd2db0edcecc3767d3c9d40443d3d1ae [0,2,0,0,0,0|1,0,0]=3 7395 B11R0.40 O=C(CO)CNCCOCCO 21c87bf6a70a182058f36bcade3939c6 [0,2,0,0,0,0|2,0,0]=4 7396 B11R0.40 O=C(CO)CNCCOCCS 23f7b9bba95c8431edd61867b8c31b03 [0,2,0,0,0,0|2,0,0]=4 7397 B11R0.40 O=C(CO)CNCCSCCO 76565b4c673b8b92052bb8f1b4926ed1 [0,2,0,0,0,0|2,0,0]=4 7398 B11R0.40 O=C(CO)NCCCCCCCl dbfc21936551b9a9fe635f023097f8d4 [0,2,0,0,0,0|1,0,0]=3 7399 B11R0.40 O=C(CO)NCCCCCCO 7bfceec3914389840f05d685c72f8368 [0,2,0,0,0,0|1,0,0]=3 7400 B11R0.40 O=C(CO)NCCCOCCO 84add8aa3fae2f4a90b7821d81dafdbe [0,2,0,0,0,0|2,0,0]=4 7401 B11R0.40 O=C(CO)NCCOCCCO c6dedfc2c323ed2d6523e6392736be15 [0,2,0,0,0,0|2,0,0]=4 7402 B11R0.40 O=C(CS)NCCCCCCCl 21b57b5d4d8534c8a04fe2edacb204e5 [0,2,0,0,0,0|1,1,0]=4 7403 B11R0.40 O=C(CS)NCCCCCCO 5f868e1a513d6d1d3d8daa69afcc9a00 [0,2,0,0,0,0|1,1,0]=4 7404 B11R0.40 O=CC(=O)NCCCCCCCl 3a403b90755b3be5911eb8e8a7550e87 [0,2,0,0,0,0|1,0,1]=4 7405 B11R0.40 O=CC(=O)NCCCCCCO cdb91b423c176ea7dccc98652b87d911 [0,2,0,0,0,0|1,0,1]=4 7406 B11R0.40 O=CCCCCNCC(=O)NO abde188407949f5585ca4d6488af4616 [0,2,0,0,0,0|1,0,1]=4 7407 B11R0.40 O=CCCCNCCC(=O)NO eaee7b65fe0aa1a5da7866d7fcd8e6e9 [0,2,0,0,0,0|1,0,1]=4 7408 B11R0.42 C#CCCCCNC(C)C(=O)O 4f126a52a04118ef77d66647277c59ed [0,2,0,0,0,0|0,0,2]=4 7409 B11R0.42 C#CCCCCNC(O)C(=O)O 2b9ec296efb9e361ddd0f1fb311bc4e9 [0,2,0,0,0,0|0,0,2]=4 7410 B11R0.42 C#CCCCCN[C@@H](C)C(=O)O 4e0ca3d27ae5482d38189a3e438056ac [0,2,0,0,0,0|0,0,2]=4 7411 B11R0.42 C#CCCCCN[C@H](C)C(=O)O 289dbccf844051c2e997ddc5ac3b327d [0,2,0,0,0,0|0,0,2]=4 7412 B11R0.42 C#CCCCCOC(C)C(=O)O 0c39f75fe4227b59815308cded73178b [0,2,0,0,0,0|0,0,2]=4 7413 B11R0.42 C#CCCCCO[C@@H](C)C(=O)O 84fa21f1cc31257fed24e96671910395 [0,2,0,0,0,0|0,0,2]=4 7414 B11R0.42 C#CCCCCO[C@H](C)C(=O)O c37eb500b81678704923b4474ad40e79 [0,2,0,0,0,0|0,0,2]=4 7415 B11R0.42 C#CCCCNCC(C)C(=O)O 49f68c38913057a79cbac6cee2f66567 [0,2,0,0,0,0|0,0,2]=4 7416 B11R0.42 C#CCCCNCC(F)C(=O)O a4bab5630fef22e30f140d6edf52c6ca [0,2,0,0,0,0|0,0,2]=4 7417 B11R0.42 C#CCCCNCC(O)C(=O)O 23767eb9ecf19a04cbbba9f603ee0182 [0,2,0,0,0,0|0,0,2]=4 7418 B11R0.42 C#CCCCNC[C@@H](C)C(=O)O 1271fff1daac6f358f6e0af788602a8d [0,2,0,0,0,0|0,0,2]=4 7419 B11R0.42 C#CCCCNC[C@@H](O)C(=O)O c63dfd58e54361f9e512cd991ca03372 [0,2,0,0,0,0|0,0,2]=4 7420 B11R0.42 C#CCCCNC[C@H](C)C(=O)O 811d96f7c4bbf2581c959becdee83dfb [0,2,0,0,0,0|0,0,2]=4 7421 B11R0.42 C#CCCCNC[C@H](O)C(=O)O a9de5da0835380b891532005b28282e9 [0,2,0,0,0,0|0,0,2]=4 7422 B11R0.42 C#CCCCOCC(C)C(=O)O face421d55f01ce764be2134ac4aa931 [0,2,0,0,0,0|0,0,2]=4 7423 B11R0.42 C#CCCCOC[C@@H](C)C(=O)O 67b1db8d1a315c8bbc8a59a19489647f [0,2,0,0,0,0|0,0,2]=4 7424 B11R0.42 C#CCCCOC[C@H](C)C(=O)O c78d2b3d30fae8c3c48e9a021c190fd3 [0,2,0,0,0,0|0,0,2]=4 7425 B11R0.42 C#CCCNCCC(F)C(=O)O 094a2045c7c12898dd25b20b747db4fe [0,2,0,0,0,0|0,0,2]=4 7426 B11R0.42 C#CCCNCCC(O)C(=O)O b51cdb9972498781b176c7e3a438c679 [0,2,0,0,0,0|0,0,2]=4 7427 B11R0.42 C#CCCNCC[C@H](O)C(=O)O 26dfb12f5d2048b1797d7679edbf52b2 [0,2,0,0,0,0|0,0,2]=4 7428 B11R0.42 C#CCNCCCC(C)C(=O)O d97a4c301334849bd75280a7a4231b1b [0,2,0,0,0,0|0,0,2]=4 7429 B11R0.42 C#CCOCCCC(C)C(=O)O a3717ceb02cdc6d6baa1585e4a41bc9e [0,2,0,0,0,0|0,0,2]=4 7430 B11R0.42 C/C=C/CCCOC(C)C(=O)O a43559789a71a47ad27f044b689b764d [0,2,0,0,0,0|0,0,2]=4 7431 B11R0.42 C/C=C/CCCOC(F)C(=O)O ef46eb1bedb7ba6ced96dc920c2e024a [0,2,0,0,0,0|0,0,2]=4 7432 B11R0.42 C/C=C/CCCO[C@@H](C)C(=O)O 1a82e68af940464ea49ad849222570c1 [0,2,0,0,0,0|0,0,2]=4 7433 B11R0.42 C/C=C/CCCO[C@@H](F)C(=O)O 4feb0996ff63c3d11afefefeb74eb93d [0,2,0,0,0,0|0,0,2]=4 7434 B11R0.42 C/C=C/CCCO[C@H](C)C(=O)O 626dcde4667bfeb9aed10f825c2c017f [0,2,0,0,0,0|0,0,2]=4 7435 B11R0.42 C/C=C/CCOCC(C)C(=O)O 0f8e1e8f02460e37c1ce08d06ff5c8ef [0,2,0,0,0,0|0,0,2]=4 7436 B11R0.42 C/C=C/CNCCC(F)C(=O)O ed37369ff43d5c7dc73bc32403cd3172 [0,2,0,0,0,0|0,0,2]=4 7437 B11R0.42 C/C=C/CNCCC(O)C(=O)O 330d368573b0a16e935f318b0bf29cda [0,2,0,0,0,0|0,0,2]=4 7438 B11R0.42 C/C=C/CNCC[C@H](O)C(=O)O 51663ea5aa777d00512b60c581e8dd62 [0,2,0,0,0,0|0,0,2]=4 7439 B11R0.42 C/C=C\CCCNC(C)C(=O)O f4cacd02f459850ee1968f0932e771bb [0,2,0,0,0,0|0,0,2]=4 7440 B11R0.42 C/C=C\CCCNC(O)C(=O)O f7d148073090716fab5f14edf4d6d64a [0,2,0,0,0,0|0,0,2]=4 7441 B11R0.42 C/C=C\CCCN[C@@H](C)C(=O)O 829a65905d3485076da00972c4a0be65 [0,2,0,0,0,0|0,0,2]=4 7442 B11R0.42 C/C=C\CCCN[C@H](C)C(=O)O a31f0ed6b5cf829abc123b8412b34e24 [0,2,0,0,0,0|0,0,2]=4 7443 B11R0.42 C/C=C\CCCOC(C)C(=O)O e904f2e599d37468abc929583bc75166 [0,2,0,0,0,0|0,0,2]=4 7444 B11R0.42 C/C=C\CCCOC(F)C(=O)O a8adcd833bfc2cdf74ad0ad6419f6c41 [0,2,0,0,0,0|0,0,2]=4 7445 B11R0.42 C/C=C\CCCO[C@@H](C)C(=O)O c0685751511b1d44d33c2e66c7bd423f [0,2,0,0,0,0|0,0,2]=4 7446 B11R0.42 C/C=C\CCCO[C@@H](F)C(=O)O b6ebe1f21d821b4c196c161c196e1e1e [0,2,0,0,0,0|0,0,2]=4 7447 B11R0.42 C/C=C\CCCO[C@H](C)C(=O)O 8e7b3e139ecf7ea1736516773642ba92 [0,2,0,0,0,0|0,0,2]=4 7448 B11R0.42 C/C=C\CNCCC(F)C(=O)O f3226548043207ba4cd9ca4d00bc346f [0,2,0,0,0,0|0,0,2]=4 7449 B11R0.42 C/C=C\CNCCC(O)C(=O)O ef2780f71298643a3e041d1742e14882 [0,2,0,0,0,0|0,0,2]=4 7450 B11R0.42 C/C=C\CNCC[C@H](O)C(=O)O 7f14e271801acd39418b3cddba53dcd0 [0,2,0,0,0,0|0,0,2]=4 7451 B11R0.42 C=C(Br)C(=O)NCCCCCC 83001ce2c67f35747acade3dfa4a8623 [0,2,0,0,0,0|2,0,0]=4 7452 B11R0.42 C=C(C)C(=O)NCCCCCC 68147d1975557dda6de2c0965669be47 [0,2,0,0,0,0|2,0,0]=4 7453 B11R0.42 C=C(CNCCCCC)C(=O)O 3961ad8178fe871479ff4ea92189d193 [0,2,0,0,0,0|0,0,1]=3 7454 B11R0.42 C=C(CNCCCCCl)C(=O)O a0fbb3df1753bde75d99a758d2b5e921 [0,2,0,0,0,0|1,0,1]=4 7455 B11R0.42 C=C(CNCCCCO)C(=O)O ff03823dcd1dee049260f962b5edfdac [0,2,0,0,0,0|1,0,1]=4 7456 B11R0.42 C=C(CNCCCCS)C(=O)O c507696c92cb2e14c58d95ac510225f6 [0,2,0,0,0,0|1,0,1]=4 7457 B11R0.42 C=C(CNCCCOC)C(=O)O 3f176f8e7bfeba9dc7455f8c5fad0b5f [0,2,0,0,0,0|1,0,1]=4 7458 B11R0.42 C=C(CNCCCSC)C(=O)O 33a51d0398e84f2a6b6ff1922f521fa4 [0,2,0,0,0,0|1,0,1]=4 7459 B11R0.42 C=C(CNCCOCC)C(=O)O 653ec02d053197d0f6a6136e38f24442 [0,2,0,0,0,0|1,0,1]=4 7460 B11R0.42 C=C(CNCCSCC)C(=O)O 427e79f967d059bbd6cc31dcd363625d [0,2,0,0,0,0|1,0,1]=4 7461 B11R0.42 C=C(COCCCCC)C(=O)O b11d9270348f2e3567924ca4886b501a [0,2,0,0,0,0|0,0,1]=3 7462 B11R0.42 C=C(COCCCCF)C(=O)O 18a39310a52a27faf25d0ba683c375e7 [0,2,0,0,0,0|1,0,1]=4 7463 B11R0.42 C=C(COCCCCS)C(=O)O 018da2f592a3515a50b3c9b562cd35f7 [0,2,0,0,0,0|1,0,1]=4 7464 B11R0.42 C=C(COCCCOC)C(=O)O 523630dee9a15e88040efc4f9c7fd4f2 [0,2,0,0,0,0|1,0,1]=4 7465 B11R0.42 C=C(COCCCSC)C(=O)O b751c9d9c86b90cca93abab2a104c892 [0,2,0,0,0,0|1,0,1]=4 7466 B11R0.42 C=C(COCCOCC)C(=O)O 4cc9585ba57a55a790c6c9c600569285 [0,2,0,0,0,0|1,0,1]=4 7467 B11R0.42 C=C(COCCSCC)C(=O)O 24506ed05522ebbaaaec137b2a6f314a [0,2,0,0,0,0|1,0,1]=4 7468 B11R0.42 C=C(Cl)C(=O)NCCCCCC 5397766ddce183470ebf8197563210c9 [0,2,0,0,0,0|2,0,0]=4 7469 B11R0.42 C=C(F)C(=O)NCCCCCC 90a5f5b8f5d692528445328f9fa25a09 [0,2,0,0,0,0|2,0,0]=4 7470 B11R0.42 C=C(I)[C@H](C)CNCCCCC 11cf32649f642c3d3f773d09fad5e122 [0,2,0,0,0,0|2,0,0]=4 7471 B11R0.42 C=C(I)[C@H](C)COCCCCC af09ddb52ac189b4899f622b5c1adb9a [0,2,0,0,0,0|2,0,0]=4 7472 B11R0.42 C=CCCCCNC(C)C(=O)O ef3467223fd89dc986b31ceb793c94a2 [0,2,0,0,0,0|0,0,2]=4 7473 B11R0.42 C=CCCCCNC(F)C(=O)O 3eda636dc2e7f28e464cc27fb3c4e67e [0,2,0,0,0,0|0,0,2]=4 7474 B11R0.42 C=CCCCCNC(O)C(=O)O 54ba432986884fa133ea41d4291ad8d5 [0,2,0,0,0,0|0,0,2]=4 7475 B11R0.42 C=CCCCCN[C@@H](C)C(=O)O 11d49dc439a978136fe85f150411ad48 [0,2,0,0,0,0|0,0,2]=4 7476 B11R0.42 C=CCCCCN[C@@H](F)C(=O)O 4cdbd55cc52d3cd606666d598baa041b [0,2,0,0,0,0|0,0,2]=4 7477 B11R0.42 C=CCCCCN[C@H](C)C(=O)O 6336b98519562764364617a0efcdbfe6 [0,2,0,0,0,0|0,0,2]=4 7478 B11R0.42 C=CCCCCOC(C)C(=O)O 268ccf752852c616900da8c671378436 [0,2,0,0,0,0|0,0,2]=4 7479 B11R0.42 C=CCCCCO[C@@H](C)C(=O)O f3df5e1772cb5c7fd174d41c3a0bfeb4 [0,2,0,0,0,0|0,0,2]=4 7480 B11R0.42 C=CCCCCO[C@H](C)C(=O)O f195d31d72ffa962d27a71c5bd633f51 [0,2,0,0,0,0|0,0,2]=4 7481 B11R0.42 C=CCCCNCC(C)C(=O)O 1e4884361eab86fe6bf7c0c8a519b646 [0,2,0,0,0,0|0,0,2]=4 7482 B11R0.42 C=CCCCNCC(F)C(=O)O af62f0f9494ff551fecc11ed7deb1ed6 [0,2,0,0,0,0|0,0,2]=4 7483 B11R0.42 C=CCCCNCC(O)C(=O)O 89410c49f2508ff58f41c21aaf2ae6da [0,2,0,0,0,0|0,0,2]=4 7484 B11R0.42 C=CCCCNC[C@@H](C)C(=O)O a7f30d91285436bedbf627c86d5f64a5 [0,2,0,0,0,0|0,0,2]=4 7485 B11R0.42 C=CCCCNC[C@@H](O)C(=O)O cbf2e1d6be57ddb84a1b507bed63c235 [0,2,0,0,0,0|0,0,2]=4 7486 B11R0.42 C=CCCCNC[C@H](C)C(=O)O c05c60d7e9ff8c7bf06a33f6fd6e61f5 [0,2,0,0,0,0|0,0,2]=4 7487 B11R0.42 C=CCCCNC[C@H](O)C(=O)O 557dbf149aff437149a73fe8fbd6d10e [0,2,0,0,0,0|0,0,2]=4 7488 B11R0.42 C=CCCCOCC(C)C(=O)O 36c19f9573b2538bfd2cd43c5bee8271 [0,2,0,0,0,0|0,0,2]=4 7489 B11R0.42 C=CCCCOC[C@@H](C)C(=O)O 6404390c1ee7719f475d1571d4ef75be [0,2,0,0,0,0|0,0,2]=4 7490 B11R0.42 C=CCCCOC[C@H](C)C(=O)O 76f92d00efbd6193d1df8b4cd4a65219 [0,2,0,0,0,0|0,0,2]=4 7491 B11R0.42 C=CCCNCCC(F)C(=O)O 4e9c7d5fb9363cdd1f63c70b636cb42d [0,2,0,0,0,0|0,0,2]=4 7492 B11R0.42 C=CCCNCCC(O)C(=O)O 81b6345347be5fdcd52775aff9654765 [0,2,0,0,0,0|0,0,2]=4 7493 B11R0.42 C=CCCNCC[C@H](O)C(=O)O 92719c3815d369c232f5c8b9748a3d2f [0,2,0,0,0,0|0,0,2]=4 7494 B11R0.42 CC#CCCCOC(C)C(=O)O 78f5070c71adda08cc68824cf7360d26 [0,2,0,0,0,0|0,0,2]=4 7495 B11R0.42 CC#CCCCOC(F)C(=O)O f8635a9e07c4a091e525aa40e503477d [0,2,0,0,0,0|0,0,2]=4 7496 B11R0.42 CC#CCCCO[C@@H](C)C(=O)O eb1aacc73af31ff5d70cf8528ef6ed75 [0,2,0,0,0,0|0,0,2]=4 7497 B11R0.42 CC#CCCCO[C@@H](F)C(=O)O 296c7e5f37771b31cc126f3c8a15803a [0,2,0,0,0,0|0,0,2]=4 7498 B11R0.42 CC#CCCCO[C@H](C)C(=O)O 0f06e0984724f05960dbe2572c5f437d [0,2,0,0,0,0|0,0,2]=4 7499 B11R0.42 CC#CCCOCC(C)C(=O)O bf6a74f83765352d13cb476acbbb0a7b [0,2,0,0,0,0|0,0,2]=4 7500 B11R0.42 CC(=O)C(C)CCOCCCF 208dba31712eb2c788fb1908cc0c729c [0,2,0,0,0,0|2,0,0]=4 7501 B11R0.42 CC(=O)C(C)COCCCCF 5f4706085ef796aa7f4a8c5a46e0b739 [0,2,0,0,0,0|2,0,0]=4 7502 B11R0.42 CC(=O)C(C)NCCCCCCl ba99f0251c2a3214dc83abef9ad19bb0 [0,2,0,0,0,0|2,0,0]=4 7503 B11R0.42 CC(=O)C(C)NCCCCCO e0cd791d9c9211a9aa1edca165e3647a [0,2,0,0,0,0|2,0,0]=4 7504 B11R0.42 CC(=O)C(C)OCCCCCF 69b02b22a9c77bb9e893a4468e58f16e [0,2,0,0,0,0|2,0,0]=4 7505 B11R0.42 CC(=O)N(C)CCCCCCO 9466e6b59746b4eaf8be2decc47e3ca2 [0,2,0,0,0,0|2,0,0]=4 7506 B11R0.42 CC(CCCNCC#N)C(=O)O 1d409bb783f14c5c66be7015673457c5 [0,2,0,0,0,0|1,0,1]=4 7507 B11R0.42 CC(CCCNCCBr)C(=O)O f993012066c5246b198ccbd0d901dad3 [0,2,0,0,0,0|1,0,0]=3 7508 B11R0.42 CC(CCCNCCF)C(=O)O 0a58968733c5578ba00df270f8b683f9 [0,2,0,0,0,0|1,0,0]=3 7509 B11R0.42 CC(CCCNCCI)C(=O)O 4387609a1933463348bbdedc5c2acb5f [0,2,0,0,0,0|1,0,0]=3 7510 B11R0.42 CC(CCCNCCO)C(=O)O 5399f2a28bf18de06d42c9bec805fd96 [0,2,0,0,0,0|1,0,0]=3 7511 B11R0.42 CC(CCCNCCS)C(=O)O 10670fe7f9f6b8515ea82a6322840ae3 [0,2,0,0,0,0|1,0,0]=3 7512 B11R0.42 CC(CCCOCC#N)C(=O)O a123073f39ee1152ce54c9d50ae7bec0 [0,2,0,0,0,0|1,0,1]=4 7513 B11R0.42 CC(CCCOCCF)C(=O)O 5b703a09be3689cf6d24114b38e7f575 [0,2,0,0,0,0|1,0,0]=3 7514 B11R0.42 CC(CCCOCCS)C(=O)O 0b39aaa3468af1cff8546b1bf363f6ef [0,2,0,0,0,0|1,0,0]=3 7515 B11R0.42 CC(CNCCCC#N)C(=O)O 143616be07f389dffb5e277ba24f004a [0,2,0,0,0,0|1,0,1]=4 7516 B11R0.42 CC(CNCCCC=O)C(=O)O 6e868dd6729be5c6125658bde52ad4fc [0,2,0,0,0,0|1,0,1]=4 7517 B11R0.42 CC(CNCCCCCl)C(=O)O d9a9a3d5798f61652990c93457d2ee04 [0,2,0,0,0,0|1,0,0]=3 7518 B11R0.42 CC(CNCCCCF)C(=O)O ad006fcc6fdb92c3bf8db9ca1c4a4984 [0,2,0,0,0,0|1,0,0]=3 7519 B11R0.42 CC(CNCCCCO)C(=O)O 51dec7e27fa7da6558a4218a5b3c02c0 [0,2,0,0,0,0|1,0,0]=3 7520 B11R0.42 CC(CNCCCCS)C(=O)O fd3127d41f8d19526de4b5cf8d0e9082 [0,2,0,0,0,0|1,0,0]=3 7521 B11R0.42 CC(COCCCC#N)C(=O)O 91a9d16ddc8ac10b022658736519c757 [0,2,0,0,0,0|1,0,1]=4 7522 B11R0.42 CC(COCCCC=O)C(=O)O 7a870e40922d197135c706c34155709d [0,2,0,0,0,0|1,0,1]=4 7523 B11R0.42 CC(COCCCCF)C(=O)O 36e6a15f06e34ceb655797ee41f963d2 [0,2,0,0,0,0|1,0,0]=3 7524 B11R0.42 CC(COCCCCS)C(=O)O 80a102b471ea2a87f600ee611a224060 [0,2,0,0,0,0|1,0,0]=3 7525 B11R0.42 CC(CSCCNCF)C(=O)O 505e1c4bdfc63e5bffa0dc75477e9664 [0,2,0,0,0,0|2,0,0]=4 7526 B11R0.42 CC(CSCCNCO)C(=O)O c76212d18a40decd13e35cf445b50273 [0,2,0,0,0,0|2,0,0]=4 7527 B11R0.42 CC(NCCCCC#N)C(=O)O 2e8754fd76dddbb8058dff3676195c24 [0,2,0,0,0,0|1,0,1]=4 7528 B11R0.42 CC(NCCCCC=O)C(=O)O 72173ef09ef9e352aba21286c12af51e [0,2,0,0,0,0|1,0,1]=4 7529 B11R0.42 CC(NCCCCCCl)C(=O)N 51b7f520bead7eca6e17b6561c952401 [0,2,0,0,0,0|2,0,0]=4 7530 B11R0.42 CC(NCCCCCCl)C(=O)O 367ae711b8cbab97d33b7930fa5b93a4 [0,2,0,0,0,0|1,0,0]=3 7531 B11R0.42 CC(NCCCCCF)C(=O)N f6867023947349f4ceaf3c986497438f [0,2,0,0,0,0|2,0,0]=4 7532 B11R0.42 CC(NCCCCCF)C(=O)O 61170dc10b3ff42752f4221c6fa290bf [0,2,0,0,0,0|1,0,0]=3 7533 B11R0.42 CC(NCCCCCO)C(=O)N d8161c490e18b074159979959d2315a6 [0,2,0,0,0,0|2,0,0]=4 7534 B11R0.42 CC(NCCCCCO)C(=O)O fc4381ef531faf41d073a6c02bce2035 [0,2,0,0,0,0|1,0,0]=3 7535 B11R0.42 CC(NCCCCON)C(=O)O dd1423917766e39ad856f18a9a872870 [0,2,0,0,0,0|2,0,0]=4 7536 B11R0.42 CC(NCCOCCO)C(=O)O f09edff27cc934992bcfaf3a13d445c1 [0,2,0,0,0,0|2,0,0]=4 7537 B11R0.42 CC(NCCSCCO)C(=O)O a1678b7eabaff0f971c04af0bf11515b [0,2,0,0,0,0|2,0,0]=4 7538 B11R0.42 CC(O)C(=O)NCCCCCCl 1d7397d58dff05afba7602fff5a412cc [0,2,0,0,0,0|2,0,0]=4 7539 B11R0.42 CC(O)C(=O)NCCCCCO 9cb0edbf2f795c793c30dd6b720404a3 [0,2,0,0,0,0|2,0,0]=4 7540 B11R0.42 CC(OCCCCC#N)C(=O)O 6ab38aa6594a8da0306d93d6a8dda375 [0,2,0,0,0,0|1,0,1]=4 7541 B11R0.42 CC(OCCCCC=O)C(=O)O 5d6bb8f6e0d8a4c1c99c82e63e5ebd9d [0,2,0,0,0,0|1,0,1]=4 7542 B11R0.42 CC(OCCCCCF)C(=O)N 860cc9142c2b64d77c943e387b9a95bd [0,2,0,0,0,0|2,0,0]=4 7543 B11R0.42 CC(OCCCCCF)C(=O)O 635dad89702c82dc68f6fea8c076366e [0,2,0,0,0,0|1,0,0]=3 7544 B11R0.42 CC(OCCOCCF)C(=O)O 101afbb7fdef8a009821aba323a98608 [0,2,0,0,0,0|2,0,0]=4 7545 B11R0.42 CC(OCCOCCS)C(=O)O 043136cd832858683498aa50348beaae [0,2,0,0,0,0|2,0,0]=4 7546 B11R0.42 CC/C=C/CNCC(C)C(=O)O 55f6bb0a5a730a733ec12f09e4eaadb4 [0,2,0,0,0,0|0,0,2]=4 7547 B11R0.42 CC/C=C/CNCC(F)C(=O)O 85f006b935f5c3a992e5743dbb7bd5dd [0,2,0,0,0,0|0,0,2]=4 7548 B11R0.42 CC/C=C/CNCC(O)C(=O)O 2d8d171918af54e4bf5b4752999c8a47 [0,2,0,0,0,0|0,0,2]=4 7549 B11R0.42 CC/C=C/CNC[C@@H](C)C(=O)O a47582d32f47727125e55194abf1d91b [0,2,0,0,0,0|0,0,2]=4 7550 B11R0.42 CC/C=C/CNC[C@@H](O)C(=O)O 5bd0f1d446a396d0a34f65803556076b [0,2,0,0,0,0|0,0,2]=4 7551 B11R0.42 CC/C=C/CNC[C@H](C)C(=O)O 63dd182aeb30b98da24432e3464712c6 [0,2,0,0,0,0|0,0,2]=4 7552 B11R0.42 CC/C=C/CNC[C@H](O)C(=O)O efbfef123c6edb635b643084933b61c1 [0,2,0,0,0,0|0,0,2]=4 7553 B11R0.42 CC/C=C/COCC(C)C(=O)O ce366801ced5d8c797ac2dc74334e05b [0,2,0,0,0,0|0,0,2]=4 7554 B11R0.42 CC/C=C/COC[C@@H](C)C(=O)O d2d159a1b5a203626be3f798306ba458 [0,2,0,0,0,0|0,0,2]=4 7555 B11R0.42 CC/C=C/COC[C@H](C)C(=O)O 3a9d3fa3b3d879cbd97c9f6b56c1aa5e [0,2,0,0,0,0|0,0,2]=4 7556 B11R0.42 CC/C=C\CCNC(C)C(=O)O 78ad250175c3c9e3703e743fd4d0c567 [0,2,0,0,0,0|0,0,2]=4 7557 B11R0.42 CC/C=C\CCNC(O)C(=O)O 67a0135b175e96240951e14d091d907c [0,2,0,0,0,0|0,0,2]=4 7558 B11R0.42 CC/C=C\CCN[C@@H](C)C(=O)O 3f19ccdee6a48893dc077c80e2bb16d0 [0,2,0,0,0,0|0,0,2]=4 7559 B11R0.42 CC/C=C\CCN[C@H](C)C(=O)O 03623b0b39239501b7e527bed27fc1a4 [0,2,0,0,0,0|0,0,2]=4 7560 B11R0.42 CC/C=C\CCOC(C)C(=O)O b1a7c35d8f842f21b67641c3fc47ab86 [0,2,0,0,0,0|0,0,2]=4 7561 B11R0.42 CC/C=C\CCO[C@@H](C)C(=O)O fbc45bc2ea826aa73989c9b4e8699c07 [0,2,0,0,0,0|0,0,2]=4 7562 B11R0.42 CC/C=C\CCO[C@H](C)C(=O)O e827642083ce9abffb1925297ac02b24 [0,2,0,0,0,0|0,0,2]=4 7563 B11R0.42 CC/C=C\COCC(C)C(=O)O 24cc2330e4263e705797bdbf56d6612a [0,2,0,0,0,0|0,0,2]=4 7564 B11R0.42 CC=CCCCOC(C)C(=O)O 195b30467a968e00b348613294dbf9ca [0,2,0,0,0,0|0,0,2]=4 7565 B11R0.42 CC=CCCCOC(F)C(=O)O a616025dded991f364d223a1ff95a503 [0,2,0,0,0,0|0,0,2]=4 7566 B11R0.42 CC=CCCCO[C@@H](C)C(=O)O d83413a541bd96d81d3229eb48a22c65 [0,2,0,0,0,0|0,0,2]=4 7567 B11R0.42 CC=CCCCO[C@@H](F)C(=O)O f15a98075343f33aa583d6de14968eff [0,2,0,0,0,0|0,0,2]=4 7568 B11R0.42 CC=CCCCO[C@H](C)C(=O)O 6522f4fa705cbe84cf10919848c62eb6 [0,2,0,0,0,0|0,0,2]=4 7569 B11R0.42 CCC#CCOCC(C)C(=O)O fa958c9332c261788f565999635b71ba [0,2,0,0,0,0|0,0,2]=4 7570 B11R0.42 CCC/C=C/CNC(C)C(=O)O 956e100ec4ab12ce0efe57557057ac0e [0,2,0,0,0,0|0,0,2]=4 7571 B11R0.42 CCC/C=C/CNC(O)C(=O)O 6daf72ec2027c6ac3a9cd7c7b657df39 [0,2,0,0,0,0|0,0,2]=4 7572 B11R0.42 CCC/C=C/CN[C@@H](C)C(=O)O 574f6b4e3d7d5e194f920c10551c7acd [0,2,0,0,0,0|0,0,2]=4 7573 B11R0.42 CCC/C=C/CN[C@H](C)C(=O)O 6a06f79e1797c395557e2fd96c5c4126 [0,2,0,0,0,0|0,0,2]=4 7574 B11R0.42 CCC/C=C/COC(C)C(=O)O 8e999b63d9e1481e14133fedfb3058b6 [0,2,0,0,0,0|0,0,2]=4 7575 B11R0.42 CCC/C=C/COC(F)C(=O)O 9f4467540326ce99ea619bcc835d5167 [0,2,0,0,0,0|0,0,2]=4 7576 B11R0.42 CCC/C=C/CO[C@@H](C)C(=O)O b4291b9765faff8bb67e5e525c06b5ef [0,2,0,0,0,0|0,0,2]=4 7577 B11R0.42 CCC/C=C/CO[C@@H](F)C(=O)O fa5e6272c3cf31b994d19af453fe9973 [0,2,0,0,0,0|0,0,2]=4 7578 B11R0.42 CCC/C=C/CO[C@H](C)C(=O)O 65bebb2cf3a14b3da8afc85baf761436 [0,2,0,0,0,0|0,0,2]=4 7579 B11R0.42 CCC/C=C\CNC(C)C(=O)O 291e7691eb197eb96279b8ca9fbc5449 [0,2,0,0,0,0|0,0,2]=4 7580 B11R0.42 CCC/C=C\CNC(O)C(=O)O 36da9758962f951cfc2fc7c2600e699f [0,2,0,0,0,0|0,0,2]=4 7581 B11R0.42 CCC/C=C\CN[C@@H](C)C(=O)O ae6fbf0f788c307d4b34d1ef0e5b2c8a [0,2,0,0,0,0|0,0,2]=4 7582 B11R0.42 CCC/C=C\CN[C@H](C)C(=O)O 26c1160393ffdbc678ad58a62c0b82a2 [0,2,0,0,0,0|0,0,2]=4 7583 B11R0.42 CCC/C=C\COC(C)C(=O)O 39028bdd3b7712ab0ae4e14d40a58880 [0,2,0,0,0,0|0,0,2]=4 7584 B11R0.42 CCC/C=C\COC(F)C(=O)O 66575705db1feb54b80a80555569b31e [0,2,0,0,0,0|0,0,2]=4 7585 B11R0.42 CCC/C=C\CO[C@@H](C)C(=O)O b3e11f7a8fa010f594b8b518d8cb8d1c [0,2,0,0,0,0|0,0,2]=4 7586 B11R0.42 CCC/C=C\CO[C@@H](F)C(=O)O 407931609a8d29d8b682759ab4ad38ed [0,2,0,0,0,0|0,0,2]=4 7587 B11R0.42 CCC/C=C\CO[C@H](C)C(=O)O 497a51af4fa51b3f407e1c483b1d4ea6 [0,2,0,0,0,0|0,0,2]=4 7588 B11R0.42 CCCCCCCN(C)C(=O)C 1f4b637e30d478d227f74fe9a9d54418 [0,2,0,0,0,0|1,0,0]=3 7589 B11R0.42 CCCCCCNC(=O)C(=O)C b07a5b70d65808d226682db1c7b04c9b [0,2,0,0,0,0|1,0,1]=4 7590 B11R0.42 CCCCCCNC(=O)C(=O)N 5dbc13ca445f208f9832b31601bd8cbd [0,2,0,0,0,0|1,0,1]=4 7591 B11R0.42 CCCCCCNC(=O)C(C)F 6879fb44d984d62306eb19467505f520 [0,2,0,0,0,0|2,0,0]=4 7592 B11R0.42 CCCCCCNC(=O)C(C)O c9999e663477499f337d15f0fc5dc538 [0,2,0,0,0,0|1,0,0]=3 7593 B11R0.42 CCCCCCNC(=O)C(C)S dc529f00ff798a00fad813e24d3714d8 [0,2,0,0,0,0|1,1,0]=4 7594 B11R0.42 CCCCCCNC(=O)C(F)F ee460255750ab441c60a530b9ee7a30d [0,2,0,0,0,0|2,0,0]=4 7595 B11R0.42 CCCCCCNC(=O)C(O)O 9ed4e0abdb5f2ef4dbe161c87403fec9 [0,2,0,0,0,0|1,0,0]=3 7596 B11R0.42 CCCCCCNC(=O)[C@@H](C)F c4c684c39982719c5c269be93e10fe82 [0,2,0,0,0,0|2,0,0]=4 7597 B11R0.42 CCCCCCNC(=O)[C@@H](C)O ba2fa53987cf1c1dd463ca418a499b6b [0,2,0,0,0,0|1,0,0]=3 7598 B11R0.42 CCCCCCNC(=O)[C@H](C)F 204d2655ac98577465d8cd3e50ef917b [0,2,0,0,0,0|2,0,0]=4 7599 B11R0.42 CCCCCCNC(=O)[C@H](C)O 74171bc3104db1cb9ab901270291150d [0,2,0,0,0,0|1,0,0]=3 7600 B11R0.42 CCCCCCNC(C)C(=O)C 7e4aea5d747cb726d6c6aeddee61064c [0,2,0,0,0,0|1,0,0]=3 7601 B11R0.42 CCCCCCNC(C)C(=O)N 484037d24d3f5ceff502583ee1a0cbed [0,2,0,0,0,0|1,0,0]=3 7602 B11R0.42 CCCCCCNC(C)C(=O)O 50bfa12bfc8c95b1997dd92553c2e32b [0,2,0,0,0,0|0,0,0]=2 7603 B11R0.42 CCCCCCNC(C)C(C)O bd39996b4afe02000d135ea953aea6b6 [0,2,0,0,0,0|1,0,1]=4 7604 B11R0.42 CCCCCCNC(O)C(=O)O d5631789bd7704646a19262486df8915 [0,2,0,0,0,0|0,0,0]=2 7605 B11R0.42 CCCCCCN[C@@H](C)C(=O)N 7f3c9c3f8b9bf2b3448788715be47164 [0,2,0,0,0,0|1,0,0]=3 7606 B11R0.42 CCCCCCN[C@@H](C)C(=O)O 395de785801e54e5b92d8ae30cfb56de [0,2,0,0,0,0|0,0,0]=2 7607 B11R0.42 CCCCCCN[C@H](C)C(=O)N 548e802d09ec758dd6a4f4b847da2e70 [0,2,0,0,0,0|1,0,0]=3 7608 B11R0.42 CCCCCCN[C@H](C)C(=O)O 49da1238680c9629cec61a676283fa13 [0,2,0,0,0,0|0,0,0]=2 7609 B11R0.42 CCCCCCOC(C)C(=O)C 3bdd6256cac5c3ad22aec5aadbdcce6a [0,2,0,0,0,0|1,0,0]=3 7610 B11R0.42 CCCCCCOC(C)C(=O)N 94ae347361ad2308803adc672c9ae2d7 [0,2,0,0,0,0|1,0,0]=3 7611 B11R0.42 CCCCCCOC(C)C(=O)O ba21e8aa3b32a1583572a63691edc513 [0,2,0,0,0,0|0,0,0]=2 7612 B11R0.42 CCCCCCOC(F)C(=O)N 060c7586a654fa212600a62b52281c38 [0,2,0,0,0,0|1,0,0]=3 7613 B11R0.42 CCCCCCOC(F)C(=O)O 6513d7d3184867dd4d6531ac1435f34c [0,2,0,0,0,0|0,0,0]=2 7614 B11R0.42 CCCCCCO[C@@H](C)C(=O)N 14fa7620d8e265665a9c21bf35a3b0d0 [0,2,0,0,0,0|1,0,0]=3 7615 B11R0.42 CCCCCCO[C@@H](C)C(=O)O 71ae583b09335f51d5b93320f22a9636 [0,2,0,0,0,0|0,0,0]=2 7616 B11R0.42 CCCCCCO[C@@H](F)C(=O)O bc9bab01eee21fa811102268d0d068e6 [0,2,0,0,0,0|0,0,0]=2 7617 B11R0.42 CCCCCCO[C@H](C)C(=O)N cd1fa55577a354aad490c80dbc24b4ac [0,2,0,0,0,0|1,0,0]=3 7618 B11R0.42 CCCCCCO[C@H](C)C(=O)O 30eec93387a99e6543ce01b336b219ad [0,2,0,0,0,0|0,0,0]=2 7619 B11R0.42 CCCCCNCC(=O)C(=O)C 3fd0f918504fc1b0d0ce1bf4d6ea827b [0,2,0,0,0,0|1,0,1]=4 7620 B11R0.42 CCCCCNCC(=O)C(=O)O 334ba3ab0d0b0c071ce9583c7fda34fb [0,2,0,0,0,0|0,0,1]=3 7621 B11R0.42 CCCCCNCC(=O)C(C)C 6848f98519c79609b2c1259a00866e45 [0,2,0,0,0,0|2,0,0]=4 7622 B11R0.42 CCCCCNCC(=O)C(F)F 63b1f5d762fab215135685f84bc4d696 [0,2,0,0,0,0|2,0,0]=4 7623 B11R0.42 CCCCCNCC(=O)N(C)C dc2511a692f088a21467d1f61a7f6d50 [0,2,0,0,0,0|2,0,0]=4 7624 B11R0.42 CCCCCNCC(C)C(=O)O d7ab8a865b04f3ca26ed1bb56f29829b [0,2,0,0,0,0|0,0,0]=2 7625 B11R0.42 CCCCCNCC(F)C(=O)O 6dd9378b212fed9498da6f1ac0af33ab [0,2,0,0,0,0|0,0,0]=2 7626 B11R0.42 CCCCCNCC(O)C(=O)O 4e5cb041e0083e3d17fdc334715c0c74 [0,2,0,0,0,0|0,0,0]=2 7627 B11R0.42 CCCCCNC[C@@H](C)C(=O)O 3e8b2dbf5e151483377f52c4aa7ca0f3 [0,2,0,0,0,0|0,0,0]=2 7628 B11R0.42 CCCCCNC[C@@H](O)C(=O)O 7c3f58b6f5b64e5c04dcd3ba9159f99b [0,2,0,0,0,0|0,0,0]=2 7629 B11R0.42 CCCCCNC[C@H](C)C(=O)O 906bee280cec00a604dd42f884ea0431 [0,2,0,0,0,0|0,0,0]=2 7630 B11R0.42 CCCCCNC[C@H](O)C(=O)O 116e84833776cfa4df322a97659aa73d [0,2,0,0,0,0|0,0,0]=2 7631 B11R0.42 CCCCCOCC(=O)C(=O)C ab756c609cd1243433b3bef61119a1b5 [0,2,0,0,0,0|1,0,1]=4 7632 B11R0.42 CCCCCOCC(=O)C(C)C b927efb7008f6fb8a6ad45044aa549b8 [0,2,0,0,0,0|2,0,0]=4 7633 B11R0.42 CCCCCOCC(=O)C(F)F b732fbf50c083ea5af2c85ce60d65c71 [0,2,0,0,0,0|2,0,0]=4 7634 B11R0.42 CCCCCOCC(=O)N(C)C 6d405b47b99e3c030238a54a241d634b [0,2,0,0,0,0|2,0,0]=4 7635 B11R0.42 CCCCCOCC(C)C(=O)C 07792cad239f223a05f4315ca1c284a9 [0,2,0,0,0,0|1,0,0]=3 7636 B11R0.42 CCCCCOCC(C)C(=O)O abdc6858bb4bef1d08a29ea26aabc6cc [0,2,0,0,0,0|0,0,0]=2 7637 B11R0.42 CCCCCOCC(C)[N+](=O)[O-] fa50f22fbb38b24905202166e994e9e4 [0,2,0,0,0,0|1,0,1]=4 7638 B11R0.42 CCCCCOC[C@@H](C)C(=O)O c0e8d04b997b71c90836c735580fb74d [0,2,0,0,0,0|0,0,0]=2 7639 B11R0.42 CCCCCOC[C@H](C)C(=O)O e68c2b0f49fdf9ce2ac4956f8f5292fa [0,2,0,0,0,0|0,0,0]=2 7640 B11R0.42 CCCCNCCC(=O)N(C)C 01b4c033d61739ecc745fcd05b8408c2 [0,2,0,0,0,0|2,0,0]=4 7641 B11R0.42 CCCCNCCC(F)C(=O)O 8e9109fc2b84600842974fef2be5abe0 [0,2,0,0,0,0|0,0,0]=2 7642 B11R0.42 CCCCNCCC(O)C(=O)O c62833d2767c42162c05c00866c68c67 [0,2,0,0,0,0|0,0,0]=2 7643 B11R0.42 CCCCNCC[C@H](O)C(=O)O b87f453e24319785102f4b7103d302e5 [0,2,0,0,0,0|0,0,0]=2 7644 B11R0.42 CCCCOCCC(=O)N(C)C db843eb1293596755e9a78777a1ee0fb [0,2,0,0,0,0|2,0,0]=4 7645 B11R0.42 CCCCOCCN(C)C(=O)C 0803aa23847a6415ad661b1e3f8aa6a4 [0,2,0,0,0,0|2,0,0]=4 7646 B11R0.42 CCCCOCNC(C)C(=O)N 780c6159e0a566f60d2245aa46bb8381 [0,2,0,0,0,0|2,0,0]=4 7647 B11R0.42 CCCCOCNC(C)C(=O)O dd1c2e6b40df25128237554fe8a11a20 [0,2,0,0,0,0|1,0,0]=3 7648 B11R0.42 CCCCOCNC(O)C(=O)O bec0f288a99288fca8c501ef5a2b1ecb [0,2,0,0,0,0|1,0,0]=3 7649 B11R0.42 CCCCOCN[C@@H](C)C(=O)N fa448573d293b4580c03e7d21aee7ae3 [0,2,0,0,0,0|2,0,0]=4 7650 B11R0.42 CCCCOCN[C@@H](C)C(=O)O f4b674403ef12311704563aca14336c6 [0,2,0,0,0,0|1,0,0]=3 7651 B11R0.42 CCCCOCN[C@H](C)C(=O)N 08009025da33f2db227737ff0191c6d0 [0,2,0,0,0,0|2,0,0]=4 7652 B11R0.42 CCCCOCN[C@H](C)C(=O)O 9a1a825256efd252e655519ec5ea28b4 [0,2,0,0,0,0|1,0,0]=3 7653 B11R0.42 CCCCOCOC(C)C(=O)C 3ddc304c113f47dd2d4453dbeafba946 [0,2,0,0,0,0|2,0,0]=4 7654 B11R0.42 CCCCOCOC(C)C(=O)N 4c411c0993e36870a09c57c14028aef0 [0,2,0,0,0,0|2,0,0]=4 7655 B11R0.42 CCCCOCOC(C)C(=O)O e00b5dbfb824b82703cb60cbf59eb726 [0,2,0,0,0,0|1,0,0]=3 7656 B11R0.42 CCCCOCO[C@@H](C)C(=O)N 7aef38d5e98873cbd60cb44758b958a9 [0,2,0,0,0,0|2,0,0]=4 7657 B11R0.42 CCCCOCO[C@@H](C)C(=O)O 36e4ac67205a23dc06dda7aca96777f3 [0,2,0,0,0,0|1,0,0]=3 7658 B11R0.42 CCCCOCO[C@H](C)C(=O)N f6ac36d6b904fbf387aa215031080521 [0,2,0,0,0,0|2,0,0]=4 7659 B11R0.42 CCCCOCO[C@H](C)C(=O)O 713cbe85378d7893134abd0784f2e7dc [0,2,0,0,0,0|1,0,0]=3 7660 B11R0.42 CCCNCCCC(=O)N(C)C ac817ff6fc4279c6001130c5878cd1c2 [0,2,0,0,0,0|2,0,0]=4 7661 B11R0.42 CCCNCCCC(C)C(=O)O 9a4c115d144a60b49341a6de4b76f6c9 [0,2,0,0,0,0|0,0,0]=2 7662 B11R0.42 CCCOCCCC(=O)N(C)C e44e860c6266acc551625ca7ca79ac86 [0,2,0,0,0,0|2,0,0]=4 7663 B11R0.42 CCCOCCCC(C)C(=O)O 01585b70a1b61ec5a4fd8b0afc139c7c [0,2,0,0,0,0|0,0,0]=2 7664 B11R0.42 CCCOCCNC(=O)C(C)O f6aff21434aaea962861abc3a0e02bda [0,2,0,0,0,0|2,0,0]=4 7665 B11R0.42 CCCOCCNC(=O)C(O)O 788d176b4c6e63f29c1fb2eaabf8145c [0,2,0,0,0,0|2,0,0]=4 7666 B11R0.42 CCCOCCNC(=O)[C@@H](C)O 9ae38f12097083a9fd612ba86af5ea03 [0,2,0,0,0,0|2,0,0]=4 7667 B11R0.42 CCCOCCNC(=O)[C@H](C)O 491620d4f789ce3d0bfa23e27e51ffff [0,2,0,0,0,0|2,0,0]=4 7668 B11R0.42 CCCOCCNC(C)C(=O)C 46ae2c5b818c4b9ba288be0be94148ee [0,2,0,0,0,0|2,0,0]=4 7669 B11R0.42 CCCOCCNC(C)C(=O)N a60bf5912cb266f6b1b933a404a0410a [0,2,0,0,0,0|2,0,0]=4 7670 B11R0.42 CCCOCCNC(C)C(=O)O 8812f31379f9e7713bf49bab75a3cdc1 [0,2,0,0,0,0|1,0,0]=3 7671 B11R0.42 CCCOCCNC(F)C(=O)N 49d61fb211cdbce881871d9f88285989 [0,2,0,0,0,0|2,0,0]=4 7672 B11R0.42 CCCOCCNC(O)C(=O)O 8209e23fd595be82eccb124a5adcf510 [0,2,0,0,0,0|1,0,0]=3 7673 B11R0.42 CCCOCCN[C@@H](C)C(=O)N 8b44f63abbb038c031092770bf370c7b [0,2,0,0,0,0|2,0,0]=4 7674 B11R0.42 CCCOCCN[C@@H](C)C(=O)O 619acb0b7fdaaea81f4f2b00805a6730 [0,2,0,0,0,0|1,0,0]=3 7675 B11R0.42 CCCOCCN[C@H](C)C(=O)N 09826eb7d91aa20b77dd696580ff42cb [0,2,0,0,0,0|2,0,0]=4 7676 B11R0.42 CCCOCCN[C@H](C)C(=O)O 563d0e1cf61c96322f7998d3bfe3525b [0,2,0,0,0,0|1,0,0]=3 7677 B11R0.42 CCCOCCOC(C)C(=O)C e20c874f2c98dbde88b23691e567374f [0,2,0,0,0,0|2,0,0]=4 7678 B11R0.42 CCCOCCOC(C)C(=O)N 98ba33c385dc2d1efd716385f07fcf2c [0,2,0,0,0,0|2,0,0]=4 7679 B11R0.42 CCCOCCOC(C)C(=O)O 27bd20e7861823124435e8f3d7e47b08 [0,2,0,0,0,0|1,0,0]=3 7680 B11R0.42 CCCOCCOC(F)C(=O)N ce493ca20b15743ded165dadcf796250 [0,2,0,0,0,0|2,0,0]=4 7681 B11R0.42 CCCOCCOC(F)C(=O)O be48e54337242fe90dc153c8aacefc14 [0,2,0,0,0,0|1,0,0]=3 7682 B11R0.42 CCCOCCO[C@@H](C)C(=O)N 59808c09db66e5981b94677664a8ac10 [0,2,0,0,0,0|2,0,0]=4 7683 B11R0.42 CCCOCCO[C@@H](C)C(=O)O 99ee572159415168f9c8b34f3d253eb5 [0,2,0,0,0,0|1,0,0]=3 7684 B11R0.42 CCCOCCO[C@@H](F)C(=O)O fab335d12596d3988a79cad82fc09bf8 [0,2,0,0,0,0|1,0,0]=3 7685 B11R0.42 CCCOCCO[C@H](C)C(=O)N e635926a3d9b323a1e87ebc9e8c50d41 [0,2,0,0,0,0|2,0,0]=4 7686 B11R0.42 CCCOCCO[C@H](C)C(=O)O 893bde31e15274035e8abc0064c8eca5 [0,2,0,0,0,0|1,0,0]=3 7687 B11R0.42 CCCSCCOC(C)C(=O)C 3edf1dfccacd029314ee5690457f61e5 [0,2,0,0,0,0|2,0,0]=4 7688 B11R0.42 CCCSCCOC(C)C(=O)N 893b4eedadb7e26fdccedfa582c6f357 [0,2,0,0,0,0|2,0,0]=4 7689 B11R0.42 CCCSCCOC(F)C(=O)N d2044263b8b970dae5ff08842cae68f8 [0,2,0,0,0,0|2,0,0]=4 7690 B11R0.42 CCCSCCO[C@@H](C)C(=O)N 65cb55babf9338885d6a42ca717cd7b6 [0,2,0,0,0,0|2,0,0]=4 7691 B11R0.42 CCCSCCO[C@H](C)C(=O)N 8fe0b2660a40142e7be333988f96b42e [0,2,0,0,0,0|2,0,0]=4 7692 B11R0.42 CCNCCSCC(C)C(=O)O 452176978f69fa0d7e5b6a73b1ca572a [0,2,0,0,0,0|1,0,0]=3 7693 B11R0.42 CCOCCCNC(=O)C(C)O e6a13250a45b79ae2334c507efa3d4a5 [0,2,0,0,0,0|2,0,0]=4 7694 B11R0.42 CCOCCCNC(=O)C(O)O ca4d33b2e3472110358879d278a6298a [0,2,0,0,0,0|2,0,0]=4 7695 B11R0.42 CCOCCCNC(=O)[C@@H](C)O 8d39bd987b81135b29d2694bfea2ac8e [0,2,0,0,0,0|2,0,0]=4 7696 B11R0.42 CCOCCCNC(=O)[C@H](C)O e510e8fddca5a71f6950170ed0eef476 [0,2,0,0,0,0|2,0,0]=4 7697 B11R0.42 CCOCCCNC(C)C(=O)C 7a3311fdb0a267e2f3b031ae78782c8e [0,2,0,0,0,0|2,0,0]=4 7698 B11R0.42 CCOCCCNC(C)C(=O)N 3a333bcf48f67d7346e2ef47e7fd4121 [0,2,0,0,0,0|2,0,0]=4 7699 B11R0.42 CCOCCCNC(C)C(=O)O ea437b1016955596decb70b0fa5de4ac [0,2,0,0,0,0|1,0,0]=3 7700 B11R0.42 CCOCCCNC(F)C(=O)N 5e111bd4480d9663cb3fac739a57f15f [0,2,0,0,0,0|2,0,0]=4 7701 B11R0.42 CCOCCCNC(O)C(=O)O 786cb6f46da4ccb5b109f3a51cacf1ac [0,2,0,0,0,0|1,0,0]=3 7702 B11R0.42 CCOCCCN[C@@H](C)C(=O)N d6e8ac4066a05fdbeabaebe85363e214 [0,2,0,0,0,0|2,0,0]=4 7703 B11R0.42 CCOCCCN[C@@H](C)C(=O)O c46c84723da8cbb70e28953dd8be3ec1 [0,2,0,0,0,0|1,0,0]=3 7704 B11R0.42 CCOCCCN[C@H](C)C(=O)N 44ad7cf9debb812e8dfeb8f6f231e58a [0,2,0,0,0,0|2,0,0]=4 7705 B11R0.42 CCOCCCN[C@H](C)C(=O)O c1ac2c4495025aeaf95b84ff555a7f44 [0,2,0,0,0,0|1,0,0]=3 7706 B11R0.42 CCOCCCOC(C)C(=O)C 50693fd2bc9da5dd1a8f902a1f075ccc [0,2,0,0,0,0|2,0,0]=4 7707 B11R0.42 CCOCCCOC(C)C(=O)N a2b285840a55aadf8f5bf6a449ee0ab5 [0,2,0,0,0,0|2,0,0]=4 7708 B11R0.42 CCOCCCOC(C)C(=O)O d8f78446814d8dfe036a987f6428917f [0,2,0,0,0,0|1,0,0]=3 7709 B11R0.42 CCOCCCOC(F)C(=O)N acc6272c45db8cf12c7869c5e0d3c48f [0,2,0,0,0,0|2,0,0]=4 7710 B11R0.42 CCOCCCOC(F)C(=O)O 97087b4488061dacdc1774c9d7ba100b [0,2,0,0,0,0|1,0,0]=3 7711 B11R0.42 CCOCCCO[C@@H](C)C(=O)N f6fcb16159cc070452fbff2fdbab418d [0,2,0,0,0,0|2,0,0]=4 7712 B11R0.42 CCOCCCO[C@@H](C)C(=O)O dbeb857030fda9dcaf65d75f68c28364 [0,2,0,0,0,0|1,0,0]=3 7713 B11R0.42 CCOCCCO[C@@H](F)C(=O)O 956ebb7669275079117e6ebebed08e1b [0,2,0,0,0,0|1,0,0]=3 7714 B11R0.42 CCOCCCO[C@H](C)C(=O)N d3bdfebb0ed8bba07c458d196d391172 [0,2,0,0,0,0|2,0,0]=4 7715 B11R0.42 CCOCCCO[C@H](C)C(=O)O da27f95b330a599ace12ccee2f4b514f [0,2,0,0,0,0|1,0,0]=3 7716 B11R0.42 CCOCCNCC(=O)C(=O)O a8e7f17dbc367a5091441bf90c6228f8 [0,2,0,0,0,0|1,0,1]=4 7717 B11R0.42 CCOCCNCC(C)C(=O)O ba62020594f8bfe8dc576f6a3c10d854 [0,2,0,0,0,0|1,0,0]=3 7718 B11R0.42 CCOCCNCC(F)C(=O)O 8db88f68b1580bffc6a9d41b33da9665 [0,2,0,0,0,0|1,0,0]=3 7719 B11R0.42 CCOCCNCC(O)C(=O)O 6835b7b605a62cf5036ee3aba8058ce9 [0,2,0,0,0,0|1,0,0]=3 7720 B11R0.42 CCOCCNC[C@@H](C)C(=O)O 4c3c88fbc19ee6fcdf7ddc2e4dc35b05 [0,2,0,0,0,0|1,0,0]=3 7721 B11R0.42 CCOCCNC[C@@H](O)C(=O)O fef4b1ca898c2c1efeb5dae21f830d42 [0,2,0,0,0,0|1,0,0]=3 7722 B11R0.42 CCOCCNC[C@H](C)C(=O)O 7ba2f4861316c3d892d6eb1a4a2f2a7d [0,2,0,0,0,0|1,0,0]=3 7723 B11R0.42 CCOCCNC[C@H](O)C(=O)O 3cf3206adbcff22ac0ef8aaf4985ea86 [0,2,0,0,0,0|1,0,0]=3 7724 B11R0.42 CCOCCOCC(=O)C(=O)O 39592288148a1a111f0a1d90c87afc11 [0,2,0,0,0,0|1,0,1]=4 7725 B11R0.42 CCOCCOCC(C)C(=O)C 5f73348461ca14a455e162f0ee56a348 [0,2,0,0,0,0|2,0,0]=4 7726 B11R0.42 CCOCCOCC(C)C(=O)O 155b2a5823a8f3026945da0792f46932 [0,2,0,0,0,0|1,0,0]=3 7727 B11R0.42 CCOCCOC[C@@H](C)C(=O)O ef2905f75b33faf9aeb7eb45c8b2fb96 [0,2,0,0,0,0|1,0,0]=3 7728 B11R0.42 CCOCCOC[C@H](C)C(=O)O b6ca21952b6835c9c0827ac64e329f63 [0,2,0,0,0,0|1,0,0]=3 7729 B11R0.42 CCOCNCCC(F)C(=O)O 1f43b89032ed04d79bef3c4f8be92567 [0,2,0,0,0,0|1,0,0]=3 7730 B11R0.42 CCOCNCCC(O)C(=O)O b929db6d6ea8904de209975322d72e31 [0,2,0,0,0,0|1,0,0]=3 7731 B11R0.42 CCOCNCC[C@H](O)C(=O)O 791034ba2e2b3d1924e43203dd9c639c [0,2,0,0,0,0|1,0,0]=3 7732 B11R0.42 CCSCCCNC(C)C(=O)N 06527e0ccf3c1db16f38b2f738d9fd2d [0,2,0,0,0,0|2,0,0]=4 7733 B11R0.42 CCSCCCNC(C)C(=O)O a0284e02a0674a75ac3eaaab84e34be8 [0,2,0,0,0,0|1,0,0]=3 7734 B11R0.42 CCSCCCN[C@@H](C)C(=O)N 45baba1b0006c579fa7cf8d5969d6f6c [0,2,0,0,0,0|2,0,0]=4 7735 B11R0.42 CCSCCCN[C@@H](C)C(=O)O 3e3afcff1d0c6a0976e0558fcb42e749 [0,2,0,0,0,0|1,0,0]=3 7736 B11R0.42 CCSCCCN[C@H](C)C(=O)N 7ca1804aed4d0406dde290e9a1be5595 [0,2,0,0,0,0|2,0,0]=4 7737 B11R0.42 CCSCCCN[C@H](C)C(=O)O 0c3c6c27eed19fd9e4ebdd8430777e2b [0,2,0,0,0,0|1,0,0]=3 7738 B11R0.42 CCSCCCOC(C)C(=O)C c49c619782b4dda983de936f10a3b9cc [0,2,0,0,0,0|2,0,0]=4 7739 B11R0.42 CCSCCCOC(C)C(=O)N 23649406e9dedb819bd62a02637cabb2 [0,2,0,0,0,0|2,0,0]=4 7740 B11R0.42 CCSCCCOC(F)C(=O)N 125f9956f61d1b0b9136158e0b5c036e [0,2,0,0,0,0|2,0,0]=4 7741 B11R0.42 CCSCCCOC(F)C(=O)O d8ab0c564c3fae0daec78529eaea0d08 [0,2,0,0,0,0|1,0,0]=3 7742 B11R0.42 CCSCCCO[C@@H](C)C(=O)N dbbce16369ece68a51d57b6b988779e2 [0,2,0,0,0,0|2,0,0]=4 7743 B11R0.42 CCSCCCO[C@@H](F)C(=O)O 174ae2854e683d69ed5185c4c9a10166 [0,2,0,0,0,0|1,0,0]=3 7744 B11R0.42 CCSCCCO[C@H](C)C(=O)N 4a8cf255c56f5c5c9def3a1f425cfda3 [0,2,0,0,0,0|2,0,0]=4 7745 B11R0.42 CCSCCNCC(=O)C(=O)O 7b2f807cbdb0e384ccb88943df9103ad [0,2,0,0,0,0|1,0,1]=4 7746 B11R0.42 CCSCCNCC(C)C(=O)O a168d8ad1cc5a4b07e1c46ffe9cf77c1 [0,2,0,0,0,0|1,0,0]=3 7747 B11R0.42 CCSCCNCC(O)C(=O)O 463a9bfb046b2665a112740d0107f59d [0,2,0,0,0,0|1,0,0]=3 7748 B11R0.42 CCSCCNC[C@@H](C)C(=O)O b21e10c15a3c6964bd5ec91e3a929c8b [0,2,0,0,0,0|1,0,0]=3 7749 B11R0.42 CCSCCNC[C@@H](O)C(=O)O 079d401cbe0c44607dd5b4499348e3f0 [0,2,0,0,0,0|1,0,0]=3 7750 B11R0.42 CCSCCNC[C@H](C)C(=O)O 14bb2966c86914dff37b6d898f8e3f79 [0,2,0,0,0,0|1,0,0]=3 7751 B11R0.42 CCSCCNC[C@H](O)C(=O)O 4d5f6ea994dcd1426abe0f9ff1015da4 [0,2,0,0,0,0|1,0,0]=3 7752 B11R0.42 CCSCCOCC(=O)C(=O)O 0d46e523a48eebf83fcaf6d79b7d9a2f [0,2,0,0,0,0|1,0,1]=4 7753 B11R0.42 CCSCCOCC(C)C(=O)C f59393c48c5e33f62bff7a075b9a75cd [0,2,0,0,0,0|2,0,0]=4 7754 B11R0.42 CCSCCOCC(C)C(=O)O 32b1d30660dbc5987634f8e92aef576c [0,2,0,0,0,0|1,0,0]=3 7755 B11R0.42 CCSCCOC[C@@H](C)C(=O)O 731d7d3a8a81e285bedc64bf5a41f83c [0,2,0,0,0,0|1,0,0]=3 7756 B11R0.42 CCSCCOC[C@H](C)C(=O)O b981ab05eb57c033f56d420dbc083db1 [0,2,0,0,0,0|1,0,0]=3 7757 B11R0.42 COCCCCNC(=O)C(C)O e45349fcb6f60bc705ead075ca1b227a [0,2,0,0,0,0|2,0,0]=4 7758 B11R0.42 COCCCCNC(=O)C(O)O 1adae0627d8059c0695308a0ef92896b [0,2,0,0,0,0|2,0,0]=4 7759 B11R0.42 COCCCCNC(=O)[C@@H](C)O fc8a787a3788fce740b76b256434eaa9 [0,2,0,0,0,0|2,0,0]=4 7760 B11R0.42 COCCCCNC(=O)[C@H](C)O 08ff3b6aa5fa96c5f8ec5e4c846e7829 [0,2,0,0,0,0|2,0,0]=4 7761 B11R0.42 COCCCCNC(C)C(=O)C b07de46984663fb6c9e6953bf97d57ef [0,2,0,0,0,0|2,0,0]=4 7762 B11R0.42 COCCCCNC(C)C(=O)N 7346714f0858aac79fdae3b767455739 [0,2,0,0,0,0|2,0,0]=4 7763 B11R0.42 COCCCCNC(C)C(=O)O 795b835973e09851d1e77160d90df076 [0,2,0,0,0,0|1,0,0]=3 7764 B11R0.42 COCCCCNC(F)C(=O)N 05968cb687f51c1e6071b16cb0626947 [0,2,0,0,0,0|2,0,0]=4 7765 B11R0.42 COCCCCNC(O)C(=O)O 357ae496a9867146d2285273bd8a801a [0,2,0,0,0,0|1,0,0]=3 7766 B11R0.42 COCCCCN[C@@H](C)C(=O)N af30aef1b04ce3eb0126c276ee16b764 [0,2,0,0,0,0|2,0,0]=4 7767 B11R0.42 COCCCCN[C@@H](C)C(=O)O cde845b286112be32cf13ea09a353337 [0,2,0,0,0,0|1,0,0]=3 7768 B11R0.42 COCCCCN[C@H](C)C(=O)N 47d5a49ecc2ccd1adbc94d7d3105b5b2 [0,2,0,0,0,0|2,0,0]=4 7769 B11R0.42 COCCCCN[C@H](C)C(=O)O e42f27da828968aa140138840b221a9b [0,2,0,0,0,0|1,0,0]=3 7770 B11R0.42 COCCCCOC(C)C(=O)C 28335093f421176532d8ecf97b834893 [0,2,0,0,0,0|2,0,0]=4 7771 B11R0.42 COCCCCOC(C)C(=O)N 530353e695d0baacadac7f82bde7cedd [0,2,0,0,0,0|2,0,0]=4 7772 B11R0.42 COCCCCOC(C)C(=O)O b1d42aa6564426514df3b6f43ff0c358 [0,2,0,0,0,0|1,0,0]=3 7773 B11R0.42 COCCCCOC(F)C(=O)N 7c8668e2c9edfdd966cc3788b6c8133f [0,2,0,0,0,0|2,0,0]=4 7774 B11R0.42 COCCCCO[C@@H](C)C(=O)N 53913637f66168abb737c6095d53007e [0,2,0,0,0,0|2,0,0]=4 7775 B11R0.42 COCCCCO[C@@H](C)C(=O)O 8aa9a5cc4dfab598da8180a5288ef73e [0,2,0,0,0,0|1,0,0]=3 7776 B11R0.42 COCCCCO[C@H](C)C(=O)N 9e61ce41cd193fc93c432d0bcf6bdec6 [0,2,0,0,0,0|2,0,0]=4 7777 B11R0.42 COCCCCO[C@H](C)C(=O)O 41dbaf020ee9dbb37f590c108993f007 [0,2,0,0,0,0|1,0,0]=3 7778 B11R0.42 COCCCNCC(=O)C(=O)O 5549583efa2e2c0fc12def5a00256ca2 [0,2,0,0,0,0|1,0,1]=4 7779 B11R0.42 COCCCNCC(C)C(=O)O 3388ea82e39b7432d41f4175d2b2f2ee [0,2,0,0,0,0|1,0,0]=3 7780 B11R0.42 COCCCNCC(F)C(=O)O cba8f7a7b731a9eb6dd1fd4f39f08783 [0,2,0,0,0,0|1,0,0]=3 7781 B11R0.42 COCCCNCC(O)C(=O)O 19d080e0d3cbbaa42b7c6ba56b81128e [0,2,0,0,0,0|1,0,0]=3 7782 B11R0.42 COCCCNC[C@@H](C)C(=O)O 6c824a593f65cdd27264b1588667cd38 [0,2,0,0,0,0|1,0,0]=3 7783 B11R0.42 COCCCNC[C@@H](O)C(=O)O 6a350ee00508814a45aaa2fcc2d87bcd [0,2,0,0,0,0|1,0,0]=3 7784 B11R0.42 COCCCNC[C@H](C)C(=O)O 0473a721fcc4ccd15ba3bf11912c1411 [0,2,0,0,0,0|1,0,0]=3 7785 B11R0.42 COCCCNC[C@H](O)C(=O)O 154c99cf10f86f052fbaa4228cd3fc28 [0,2,0,0,0,0|1,0,0]=3 7786 B11R0.42 COCCCOCC(=O)C(=O)O 0425014788928b80d295f94ab7bd2f8f [0,2,0,0,0,0|1,0,1]=4 7787 B11R0.42 COCCCOCC(C)C(=O)C 32a19b833fea4b19e782727363cb532b [0,2,0,0,0,0|2,0,0]=4 7788 B11R0.42 COCCCOCC(C)C(=O)O 9ae5b5e1cf1c541acb43ca29a0304d10 [0,2,0,0,0,0|1,0,0]=3 7789 B11R0.42 COCCCOC[C@@H](C)C(=O)O 38d352b91c9d6e667ee310443da69588 [0,2,0,0,0,0|1,0,0]=3 7790 B11R0.42 COCCCOC[C@H](C)C(=O)O acb048afeb72f87502227e7bc41c363e [0,2,0,0,0,0|1,0,0]=3 7791 B11R0.42 COCCNCCC(F)C(=O)O 900384e53f5c442345a6637cdd20cb43 [0,2,0,0,0,0|1,0,0]=3 7792 B11R0.42 COCCNCCC(O)C(=O)O 0bf040f190e7553ca9b378c80dd7df11 [0,2,0,0,0,0|1,0,0]=3 7793 B11R0.42 COCCNCC[C@H](O)C(=O)O 0afbdde900ee8924298d7bb9a2d6fb34 [0,2,0,0,0,0|1,0,0]=3 7794 B11R0.42 COCCOCNC(C)C(=O)O bdc228e79705adc223ea11920e91aa2e [0,2,0,0,0,0|2,0,0]=4 7795 B11R0.42 COCCOCNC(O)C(=O)O 2c0b18f913c4fd1c50427d547620b363 [0,2,0,0,0,0|2,0,0]=4 7796 B11R0.42 COCCOCN[C@@H](C)C(=O)O da3fadd67106dd91daa6ca319e35e213 [0,2,0,0,0,0|2,0,0]=4 7797 B11R0.42 COCCOCN[C@H](C)C(=O)O a6995ab86b99e5d46ed9b65b70e5edce [0,2,0,0,0,0|2,0,0]=4 7798 B11R0.42 COCCOCOC(C)C(=O)O 00421917323357087822d194ed1b5f59 [0,2,0,0,0,0|2,0,0]=4 7799 B11R0.42 COCCOCO[C@@H](C)C(=O)O d812afb41e7f85bc2237016be4128211 [0,2,0,0,0,0|2,0,0]=4 7800 B11R0.42 COCCOCO[C@H](C)C(=O)O 1ced99f4eac030a3649a21898768317a [0,2,0,0,0,0|2,0,0]=4 7801 B11R0.42 COCOCCCC(C)C(=O)O ba3042b1b438dfb9777f8f98a224c4a8 [0,2,0,0,0,0|1,0,0]=3 7802 B11R0.42 COCOCCNC(C)C(=O)O 35713b31ef23d61d22f7e58bb953a592 [0,2,0,0,0,0|2,0,0]=4 7803 B11R0.42 COCOCCNC(O)C(=O)O 07778382cf03233a7cb65f7f84df81dc [0,2,0,0,0,0|2,0,0]=4 7804 B11R0.42 COCOCCN[C@@H](C)C(=O)O f988dbafbab45d2749d8e80588d04856 [0,2,0,0,0,0|2,0,0]=4 7805 B11R0.42 COCOCCN[C@H](C)C(=O)O a6f9adb9ee4f1f880a70e58aee26f399 [0,2,0,0,0,0|2,0,0]=4 7806 B11R0.42 COCOCCOC(C)C(=O)O c5441e154ce02a6c982e9208cda28dca [0,2,0,0,0,0|2,0,0]=4 7807 B11R0.42 COCOCCO[C@@H](C)C(=O)O 6e839db2565e9032108b9a7339a90113 [0,2,0,0,0,0|2,0,0]=4 7808 B11R0.42 COCOCCO[C@H](C)C(=O)O cbcf2ac7e6d2d7faacc7221480ca5f22 [0,2,0,0,0,0|2,0,0]=4 7809 B11R0.42 CSCCCCNC(=O)C(C)O d50a75135722d416eaf61eebbf605209 [0,2,0,0,0,0|2,0,0]=4 7810 B11R0.42 CSCCCCNC(=O)C(O)O 34ae4b89250fa89b73f83ecc612c9202 [0,2,0,0,0,0|2,0,0]=4 7811 B11R0.42 CSCCCCNC(=O)[C@@H](C)O e7b7a9c5b4d753f2758bc424d1db6e40 [0,2,0,0,0,0|2,0,0]=4 7812 B11R0.42 CSCCCCNC(=O)[C@H](C)O ef9c01007c956f92bc96b89c3585590e [0,2,0,0,0,0|2,0,0]=4 7813 B11R0.42 CSCCCCNC(C)C(=O)C c7589e5038017bfc5f27e9e0c3b6f6bc [0,2,0,0,0,0|2,0,0]=4 7814 B11R0.42 CSCCCCNC(C)C(=O)N 835514614f4df560d452b916688ba5be [0,2,0,0,0,0|2,0,0]=4 7815 B11R0.42 CSCCCCNC(C)C(=O)O 98b4bbeee5c0eb078f9b09272c7d7bd6 [0,2,0,0,0,0|1,0,0]=3 7816 B11R0.42 CSCCCCNC(F)C(=O)N 672174df896096aacf7853b84120ecf1 [0,2,0,0,0,0|2,0,0]=4 7817 B11R0.42 CSCCCCN[C@@H](C)C(=O)N 5377a9b3ea4eca7d37e3bfd6c2f5771d [0,2,0,0,0,0|2,0,0]=4 7818 B11R0.42 CSCCCCN[C@@H](C)C(=O)O 8c8f52459919f4e05fb2d9c792674bb7 [0,2,0,0,0,0|1,0,0]=3 7819 B11R0.42 CSCCCCN[C@H](C)C(=O)N 34e394fffcb3187ed175599328cafc51 [0,2,0,0,0,0|2,0,0]=4 7820 B11R0.42 CSCCCCN[C@H](C)C(=O)O ec352ad81edbb74eb46d04f5cc35879c [0,2,0,0,0,0|1,0,0]=3 7821 B11R0.42 CSCCCCOC(C)C(=O)C f3efc0df02c98b9137467d6776bbfe26 [0,2,0,0,0,0|2,0,0]=4 7822 B11R0.42 CSCCCCOC(C)C(=O)N db34d9dd5c50684554ce8f45d0a2c7ef [0,2,0,0,0,0|2,0,0]=4 7823 B11R0.42 CSCCCCOC(F)C(=O)N e72712d41d8ea7a5cefc6b2dc4399484 [0,2,0,0,0,0|2,0,0]=4 7824 B11R0.42 CSCCCCO[C@@H](C)C(=O)N 403d6b0d309920dd82fd57591a9dbe8a [0,2,0,0,0,0|2,0,0]=4 7825 B11R0.42 CSCCCCO[C@H](C)C(=O)N 93171975694b3c5ea173229446b55a31 [0,2,0,0,0,0|2,0,0]=4 7826 B11R0.42 CSCCCNCC(=O)C(=O)O c39852428722e250960d204823a244c7 [0,2,0,0,0,0|1,0,1]=4 7827 B11R0.42 CSCCCNCC(C)C(=O)O c00be7767c9c18f1b27709ca240e5e74 [0,2,0,0,0,0|1,0,0]=3 7828 B11R0.42 CSCCCNCC(F)C(=O)O 8ab2e5c6c74946ef335772d15ac74805 [0,2,0,0,0,0|1,0,0]=3 7829 B11R0.42 CSCCCNCC(O)C(=O)O 7ec5092fd20727b5faaae842fa4d0e97 [0,2,0,0,0,0|1,0,0]=3 7830 B11R0.42 CSCCCNC[C@@H](C)C(=O)O 8e37bf59c9c6e3875201ef951a0c1ff1 [0,2,0,0,0,0|1,0,0]=3 7831 B11R0.42 CSCCCNC[C@@H](O)C(=O)O fd8be8a9ff98adab905bf6ca8f247c9f [0,2,0,0,0,0|1,0,0]=3 7832 B11R0.42 CSCCCNC[C@H](C)C(=O)O 3ea8267e8f553011966e3f22026ec54c [0,2,0,0,0,0|1,0,0]=3 7833 B11R0.42 CSCCCNC[C@H](O)C(=O)O 8451b8a066c55338989bcd5840268df3 [0,2,0,0,0,0|1,0,0]=3 7834 B11R0.42 CSCCCOCC(=O)C(=O)O 288c339f74a97430ee7a06ba2b1ed529 [0,2,0,0,0,0|1,0,1]=4 7835 B11R0.42 CSCCCOCC(C)C(=O)C e2004c9ac3b4dd9b8d0d1b3f6a141bc0 [0,2,0,0,0,0|2,0,0]=4 7836 B11R0.42 CSCCCOCC(C)C(=O)O 82401c6ac95b4b4e1234874ad2b94d70 [0,2,0,0,0,0|1,0,0]=3 7837 B11R0.42 CSCCCOC[C@@H](C)C(=O)O 369a6e04dbfd9415630b8ff7d5feb2e1 [0,2,0,0,0,0|1,0,0]=3 7838 B11R0.42 CSCCCOC[C@H](C)C(=O)O 2b720c2c8c33952ed9e2bdbf099b7c4a [0,2,0,0,0,0|1,0,0]=3 7839 B11R0.42 CSCCNCCC(F)C(=O)O b9082c0e66ed5a718c4ec6efd38e2aa6 [0,2,0,0,0,0|1,0,0]=3 7840 B11R0.42 CSCCNCCC(O)C(=O)O bfb322e38ef24575020a0f7724f725e6 [0,2,0,0,0,0|1,0,0]=3 7841 B11R0.42 CSCCNCC[C@H](O)C(=O)O b23734696cd426ac27bddc9e99cc5d1e [0,2,0,0,0,0|1,0,0]=3 7842 B11R0.42 C[C@@H](CNCCCC#N)C(=O)O 57c96253426c371132d40fb59c5d6743 [0,2,0,0,0,0|1,0,1]=4 7843 B11R0.42 C[C@@H](CNCCCC=O)C(=O)O 7dd4600a9bdb1ce82712cbfb25f0c70b [0,2,0,0,0,0|1,0,1]=4 7844 B11R0.42 C[C@@H](CNCCCCF)C(=O)O 8e95ee71746c30b535dbf7275d3d6996 [0,2,0,0,0,0|1,0,0]=3 7845 B11R0.42 C[C@@H](CNCCCCO)C(=O)O 13fb9dad6b986b4529bbd59252d1fb36 [0,2,0,0,0,0|1,0,0]=3 7846 B11R0.42 C[C@@H](COCCCC#N)C(=O)O 949f707b2e3f95c5e721eb72865d258a [0,2,0,0,0,0|1,0,1]=4 7847 B11R0.42 C[C@@H](COCCCC=O)C(=O)O 13382fba44752e9b197e392877bcf908 [0,2,0,0,0,0|1,0,1]=4 7848 B11R0.42 C[C@@H](COCCCCF)C(=O)O ee56b3f59d1599297da33a3c70eb1776 [0,2,0,0,0,0|1,0,0]=3 7849 B11R0.42 C[C@@H](NCCCCC#N)C(=O)O e96d3aadf2f27082a0ac57bc8e3e8121 [0,2,0,0,0,0|1,0,1]=4 7850 B11R0.42 C[C@@H](NCCCCC=O)C(=O)O f7e81257ed402a74e62519079c6b5ca0 [0,2,0,0,0,0|1,0,1]=4 7851 B11R0.42 C[C@@H](NCCCCCCl)C(=O)N fd36e1cdebfd8bb26eede803d6ffee74 [0,2,0,0,0,0|2,0,0]=4 7852 B11R0.42 C[C@@H](NCCCCCCl)C(=O)O 43a549663308329945e14a44007f5f2e [0,2,0,0,0,0|1,0,0]=3 7853 B11R0.42 C[C@@H](NCCCCCF)C(=O)N 3a6977f1fdcfdb14411fb6b13316cd3d [0,2,0,0,0,0|2,0,0]=4 7854 B11R0.42 C[C@@H](NCCCCCF)C(=O)O 133a3ac908b473639816170f249b624f [0,2,0,0,0,0|1,0,0]=3 7855 B11R0.42 C[C@@H](NCCCCCO)C(=O)N 4962944b50c294ad04caa7ff26a5edc6 [0,2,0,0,0,0|2,0,0]=4 7856 B11R0.42 C[C@@H](NCCCCCO)C(=O)O ab537cd2731b5048a8aa82edb106b6d7 [0,2,0,0,0,0|1,0,0]=3 7857 B11R0.42 C[C@@H](NCCCCON)C(=O)O 96a31b86c98cccb47a540f4442acdba0 [0,2,0,0,0,0|2,0,0]=4 7858 B11R0.42 C[C@@H](NCCOCCO)C(=O)O f187b8eed3ad2c6d41efefc50775699f [0,2,0,0,0,0|2,0,0]=4 7859 B11R0.42 C[C@@H](NCCSCCO)C(=O)O 1321b403ca4bd6c5815190b43d247898 [0,2,0,0,0,0|2,0,0]=4 7860 B11R0.42 C[C@@H](O)C(=O)NCCCCCCl ca0478b3ebe4a349053fcf0b233deaa5 [0,2,0,0,0,0|2,0,0]=4 7861 B11R0.42 C[C@@H](O)C(=O)NCCCCCO daff82b7b6a319ea46c4313c28e0b309 [0,2,0,0,0,0|2,0,0]=4 7862 B11R0.42 C[C@@H](OCCCCC#N)C(=O)O e82bec24ce772e52de06018909fa8a50 [0,2,0,0,0,0|1,0,1]=4 7863 B11R0.42 C[C@@H](OCCCCC=O)C(=O)O 1af58ec7938d43a84439caa2dec841c2 [0,2,0,0,0,0|1,0,1]=4 7864 B11R0.42 C[C@@H](OCCCCCF)C(=O)N 929bc31c004568575649141d4a4d025b [0,2,0,0,0,0|2,0,0]=4 7865 B11R0.42 C[C@@H](OCCCCCF)C(=O)O 0dd95bc42b77368a1b2cce3a9036c2a7 [0,2,0,0,0,0|1,0,0]=3 7866 B11R0.42 C[C@@H](OCCOCCF)C(=O)O 05ee3620ccda23b650496aa1ad2c8e71 [0,2,0,0,0,0|2,0,0]=4 7867 B11R0.42 C[C@@H](OCCOCCS)C(=O)O 11e7e3be0e9683771be4c9ae4b159316 [0,2,0,0,0,0|2,0,0]=4 7868 B11R0.42 C[C@H](CNCCCC#N)C(=O)O 25bd22bf0541972a2d73edf68b3b5594 [0,2,0,0,0,0|1,0,1]=4 7869 B11R0.42 C[C@H](CNCCCC=O)C(=O)O bad81203efd443dafc5533b3c057f118 [0,2,0,0,0,0|1,0,1]=4 7870 B11R0.42 C[C@H](CNCCCCF)C(=O)O 45085acdd096c58b06de42f69a74ebdb [0,2,0,0,0,0|1,0,0]=3 7871 B11R0.42 C[C@H](CNCCCCO)C(=O)O 4063dc10fdcd4429e12152c301ba60d8 [0,2,0,0,0,0|1,0,0]=3 7872 B11R0.42 C[C@H](COCCCC#N)C(=O)O 30fd6717054228b9af51e1c814c9482d [0,2,0,0,0,0|1,0,1]=4 7873 B11R0.42 C[C@H](COCCCC=O)C(=O)O e4bbd986f433363496c47ca534a77878 [0,2,0,0,0,0|1,0,1]=4 7874 B11R0.42 C[C@H](COCCCCF)C(=O)O 2418931f9815c40ba60596daeef1f645 [0,2,0,0,0,0|1,0,0]=3 7875 B11R0.42 C[C@H](NCCCCC#N)C(=O)O 75a7f6b5b5276c58a575aea1b60f4a0a [0,2,0,0,0,0|1,0,1]=4 7876 B11R0.42 C[C@H](NCCCCC=O)C(=O)O ff04ef48dcec02d99b54e325d958f6fb [0,2,0,0,0,0|1,0,1]=4 7877 B11R0.42 C[C@H](NCCCCCCl)C(=O)N 09f1dc21042d33c810b5eb120a25448b [0,2,0,0,0,0|2,0,0]=4 7878 B11R0.42 C[C@H](NCCCCCCl)C(=O)O 0d8b3336357ef7a813df2ad1159d8cd8 [0,2,0,0,0,0|1,0,0]=3 7879 B11R0.42 C[C@H](NCCCCCF)C(=O)N 7da2559a3c5cec1d9566d2a015a3b9bb [0,2,0,0,0,0|2,0,0]=4 7880 B11R0.42 C[C@H](NCCCCCF)C(=O)O 1f2ebdd115197ad1180fa4549e438f1c [0,2,0,0,0,0|1,0,0]=3 7881 B11R0.42 C[C@H](NCCCCCO)C(=O)N 4bfb5852f5e791a93e68db8222909154 [0,2,0,0,0,0|2,0,0]=4 7882 B11R0.42 C[C@H](NCCCCCO)C(=O)O 013ac2706385c076dd48e585382b77af [0,2,0,0,0,0|1,0,0]=3 7883 B11R0.42 C[C@H](NCCCCON)C(=O)O 96450705c12b69d2f7f6a5bc71e1ad37 [0,2,0,0,0,0|2,0,0]=4 7884 B11R0.42 C[C@H](NCCOCCO)C(=O)O 4db52bf0b9cc871f9f52c945ffe86021 [0,2,0,0,0,0|2,0,0]=4 7885 B11R0.42 C[C@H](NCCSCCO)C(=O)O fbe83682ebfdaf250fcd4cf218171b65 [0,2,0,0,0,0|2,0,0]=4 7886 B11R0.42 C[C@H](O)C(=O)NCCCCCCl b198c5e593686f57cfe8d8eaca3d63f9 [0,2,0,0,0,0|2,0,0]=4 7887 B11R0.42 C[C@H](O)C(=O)NCCCCCO 2754ab274d78f6b8089b15a04c6351ae [0,2,0,0,0,0|2,0,0]=4 7888 B11R0.42 C[C@H](OCCCCC#N)C(=O)O 5a76c2f42b0f9a52ecfe093e33619f89 [0,2,0,0,0,0|1,0,1]=4 7889 B11R0.42 C[C@H](OCCCCC=O)C(=O)O 111f168da1407d5a38bd3273a0e91acc [0,2,0,0,0,0|1,0,1]=4 7890 B11R0.42 C[C@H](OCCCCCF)C(=O)N b2de42c4e368712c7e36fd16fd85134d [0,2,0,0,0,0|2,0,0]=4 7891 B11R0.42 C[C@H](OCCCCCF)C(=O)O 0a4f02d7c00f4424470149709ff5c13d [0,2,0,0,0,0|1,0,0]=3 7892 B11R0.42 C[C@H](OCCOCCF)C(=O)O 38888c1851fa41cfcfdd3d183233e52a [0,2,0,0,0,0|2,0,0]=4 7893 B11R0.42 C[C@H](OCCOCCS)C(=O)O 7afe4cad3e8c09eb0400df3c4dd04b9e [0,2,0,0,0,0|2,0,0]=4 7894 B11R0.42 N#CCCCCNC(O)C(=O)O c98a58f2d6d40a8c58b4961a2a00193b [0,2,0,0,0,0|1,0,1]=4 7895 B11R0.42 N#CCCCNCC(F)C(=O)O 0db13c3bc68f41bae924be9448c41166 [0,2,0,0,0,0|1,0,1]=4 7896 B11R0.42 N#CCCCNCC(O)C(=O)O 8f05faee21f55c7f63c2c493a78af48b [0,2,0,0,0,0|1,0,1]=4 7897 B11R0.42 N#CCCCNC[C@@H](O)C(=O)O 388de52c067c4ea91541ff81db89d8b1 [0,2,0,0,0,0|1,0,1]=4 7898 B11R0.42 N#CCCCNC[C@H](O)C(=O)O 140bed92cca89b6f1c374c8e83aaf4d2 [0,2,0,0,0,0|1,0,1]=4 7899 B11R0.42 N#CCCNCCC(F)C(=O)O cde1eeb91ae338ac613f49c12148390a [0,2,0,0,0,0|1,0,1]=4 7900 B11R0.42 N#CCCNCCC(O)C(=O)O 8e8a1367949876c6f524d472edaa96c1 [0,2,0,0,0,0|1,0,1]=4 7901 B11R0.42 N#CCCNCC[C@H](O)C(=O)O 739b0581658a5a7fbb8a3c148365b2fb [0,2,0,0,0,0|1,0,1]=4 7902 B11R0.42 NC(=O)C(F)NCCCCCCl 63d80e53b53ff2abd0077bcd31c42841 [0,2,0,0,0,0|2,0,0]=4 7903 B11R0.42 NC(=O)C(F)NCCCCCO 8ec7045bd9595fc351cd8db58c0cefd1 [0,2,0,0,0,0|2,0,0]=4 7904 B11R0.42 NOCCCCNC(O)C(=O)O a549a14c969329e49bbb450d8f44924a [0,2,0,0,0,0|2,0,0]=4 7905 B11R0.42 O=C(NCCCCCCl)C(O)O e9a96bd3e8831a421be67d0fbd22aac6 [0,2,0,0,0,0|2,0,0]=4 7906 B11R0.42 O=C(NCCCCCO)C(O)O 51f183e240d5dc9b6da5a1bca6dd68a5 [0,2,0,0,0,0|2,0,0]=4 7907 B11R0.42 O=C(O)C(=O)CNCCCCCl 2e3e162f132f828033b0e6a3798f915f [0,2,0,0,0,0|1,0,1]=4 7908 B11R0.42 O=C(O)C(=O)CNCCCCO 4da4e863d1b2204c406cea95cacf748b [0,2,0,0,0,0|1,0,1]=4 7909 B11R0.42 O=C(O)C(=O)CNCCCCS 8510dccb78073005c2b1fc5a389d45e4 [0,2,0,0,0,0|1,0,1]=4 7910 B11R0.42 O=C(O)C(=O)COCCCCF dea6e4618aed86ee363af3e9ea3344f6 [0,2,0,0,0,0|1,0,1]=4 7911 B11R0.42 O=C(O)C(=O)COCCCCS c4365b55b35e63b10c3d475fd1cad856 [0,2,0,0,0,0|1,0,1]=4 7912 B11R0.42 O=C(O)C(F)CCNCCCF 20aab4ab1db877e067ca7ce87e5196e4 [0,2,0,0,0,0|1,0,0]=3 7913 B11R0.42 O=C(O)C(F)CCNCCCO 4b202a1b5e3bba575f1a3b2fee92c0ca [0,2,0,0,0,0|1,0,0]=3 7914 B11R0.42 O=C(O)C(F)CCNCCCS 02df3d9fc4e4e92494bf98e252487f42 [0,2,0,0,0,0|1,0,0]=3 7915 B11R0.42 O=C(O)C(F)CNCCCCF 00ee1754ed970571480fdc59e00d294e [0,2,0,0,0,0|1,0,0]=3 7916 B11R0.42 O=C(O)C(F)CNCCCCO 2a84dcc3ad29fe1889989e00f1ccb20d [0,2,0,0,0,0|1,0,0]=3 7917 B11R0.42 O=C(O)C(F)OCCOCCF 3ff76db33068e66461f530b195e46eea [0,2,0,0,0,0|2,0,0]=4 7918 B11R0.42 O=C(O)C(F)OCCOCCS fd54f4b3b8337a33c1500cb2197d5077 [0,2,0,0,0,0|2,0,0]=4 7919 B11R0.42 O=C(O)C(O)CCNCCCF b55a287ddbbb142fafbff5d157ee232b [0,2,0,0,0,0|1,0,0]=3 7920 B11R0.42 O=C(O)C(O)CCNCCCO 73b60751b2b9a82b9883811a26ce210d [0,2,0,0,0,0|1,0,0]=3 7921 B11R0.42 O=C(O)C(O)CNCCCCCl 8f356771434c5c2ff41c5cd1cd50317b [0,2,0,0,0,0|1,0,0]=3 7922 B11R0.42 O=C(O)C(O)CNCCCCF 418dd8c527fffa3fbd0c14c12850dd0a [0,2,0,0,0,0|1,0,0]=3 7923 B11R0.42 O=C(O)C(O)CNCCCCO 145ca259f9416fe00b8d81c2df187cc9 [0,2,0,0,0,0|1,0,0]=3 7924 B11R0.42 O=C(O)C(O)NCCCCCF 7045c79cb8d5343b2fb79526c0352dc2 [0,2,0,0,0,0|1,0,0]=3 7925 B11R0.42 O=C(O)C(O)NCCCCCO 3e6ba4b727c0b43ba4e996e67d3a9fe2 [0,2,0,0,0,0|1,0,0]=3 7926 B11R0.42 O=C(O)C(O)NCCOCCO 9061e8d43a45f260e2438268a19e6abe [0,2,0,0,0,0|2,0,0]=4 7927 B11R0.42 O=C(O)[C@@H](O)CCNCCCF 1da7f3449d95c674941c66cb2b9de388 [0,2,0,0,0,0|1,0,0]=3 7928 B11R0.42 O=C(O)[C@@H](O)CCNCCCO e624afb6aed08fc3dbe024b776bc8a81 [0,2,0,0,0,0|1,0,0]=3 7929 B11R0.42 O=C(O)[C@@H](O)CNCCCCCl 1a5c341d5b32bffa91f14c120b2da658 [0,2,0,0,0,0|1,0,0]=3 7930 B11R0.42 O=C(O)[C@@H](O)CNCCCCF e232a63334cd0cf785988d9303b2bb62 [0,2,0,0,0,0|1,0,0]=3 7931 B11R0.42 O=C(O)[C@@H](O)CNCCCCO 2aa6c41d906977475989cd086090dc11 [0,2,0,0,0,0|1,0,0]=3 7932 B11R0.42 O=C(O)[C@H](F)OCCOCCF 11f122aee10304109fe0acbd54f73066 [0,2,0,0,0,0|2,0,0]=4 7933 B11R0.42 O=C(O)[C@H](F)OCCOCCS fdf7acb9b57e09993edc1d818052cd8a [0,2,0,0,0,0|2,0,0]=4 7934 B11R0.42 O=C(O)[C@H](O)CNCCCCF 4619e327e2e778741d03409e6a3a0b18 [0,2,0,0,0,0|1,0,0]=3 7935 B11R0.42 O=C(O)[C@H](O)CNCCCCO 1412dd69c649025554f5c222fb23c1d9 [0,2,0,0,0,0|1,0,0]=3 7936 B11R0.42 O=CCCCCNC(O)C(=O)O afc8da8d34f792250a02d336469f4e3d [0,2,0,0,0,0|1,0,1]=4 7937 B11R0.42 O=CCCCNCC(F)C(=O)O d55477f78c943c27b1ee0ee149c615c8 [0,2,0,0,0,0|1,0,1]=4 7938 B11R0.42 O=CCCCNCC(O)C(=O)O 7c74ad6f8324920483f94b2b2f42295a [0,2,0,0,0,0|1,0,1]=4 7939 B11R0.42 O=CCCCNC[C@@H](O)C(=O)O 2356c2cf26c733e8e4bdb5fc6068225a [0,2,0,0,0,0|1,0,1]=4 7940 B11R0.42 O=CCCCNC[C@H](O)C(=O)O 01aedf367a69e159822395a8e116621b [0,2,0,0,0,0|1,0,1]=4 7941 B11R0.42 O=CCCNCCC(F)C(=O)O 6de9843c21c071bda69d0b927f690482 [0,2,0,0,0,0|1,0,1]=4 7942 B11R0.42 O=CCCNCCC(O)C(=O)O c36f5564f55a7b226882109711a25c12 [0,2,0,0,0,0|1,0,1]=4 7943 B11R0.42 O=CCCNCC[C@H](O)C(=O)O 131122ed267b64e13a186a5cef1fae6b [0,2,0,0,0,0|1,0,1]=4 7944 B11R0.46 C#CCCCN(C)CCC(=O)O 138664b92ff51003a0aa92a31bc58f52 [0,2,0,0,0,0|0,0,2]=4 7945 B11R0.46 C#CCCNC(C)CCC(=O)O d0ded44d012477f67ee2a0ca262295ba [0,2,0,0,0,0|0,0,2]=4 7946 B11R0.46 C#CCCN[C@@H](C)CCC(=O)O 61358b631e29374bb7412e60117a38f4 [0,2,0,0,0,0|0,0,2]=4 7947 B11R0.46 C#CCCOC(C)CCC(=O)O b42ee39404928ed157fa43378b5deeb2 [0,2,0,0,0,0|0,0,2]=4 7948 B11R0.46 C/C=C/CNC(C)CCC(=O)O 1ebeb5d72e6358f9d1160048ad59ad3d [0,2,0,0,0,0|0,0,2]=4 7949 B11R0.46 C/C=C/CN[C@@H](C)CCC(=O)O c92f6dad4605249433471fe90ac1e8fd [0,2,0,0,0,0|0,0,2]=4 7950 B11R0.46 C/C=C/COC(C)CCC(=O)O 90a124574650ad5c1c3826da45f13c3f [0,2,0,0,0,0|0,0,2]=4 7951 B11R0.46 C/C=C\CNC(C)CCC(=O)O 9539909a941fa61dab2dcff3d2e82ea2 [0,2,0,0,0,0|0,0,2]=4 7952 B11R0.46 C/C=C\CN[C@@H](C)CCC(=O)O f6adfcba17b51287c950e74593cace56 [0,2,0,0,0,0|0,0,2]=4 7953 B11R0.46 C/C=C\COC(C)CCC(=O)O b7e0a1957608f6c84fc659db2a9dcd05 [0,2,0,0,0,0|0,0,2]=4 7954 B11R0.46 C=C(Br)CNC(C)CCCCC 75345f3911cf030e7c3588146f1fd454 [0,2,0,0,0,0|2,0,0]=4 7955 B11R0.46 C=C(Br)CN[C@@H](C)CCCCC 8ee02356f95fad80414228f7f2f3aae9 [0,2,0,0,0,0|2,0,0]=4 7956 B11R0.46 C=C(Br)COC(C)CCCCC ff5f5b4e95e69f787ccfa4a4a6733cf3 [0,2,0,0,0,0|2,0,0]=4 7957 B11R0.46 C=C(Br)CO[C@@H](C)CCCCC d2ff36dc8afca7ad0cacb01072911908 [0,2,0,0,0,0|2,0,0]=4 7958 B11R0.46 C=C(Br)CO[C@H](C)CCCCC ec7f7641dab9b934795bd0cd30adaaf6 [0,2,0,0,0,0|2,0,0]=4 7959 B11R0.46 C=C(C)CCN(C)CCCCC 1912c8981f22a10158c51bfdc9fda78f [0,2,0,0,0,0|2,0,0]=4 7960 B11R0.46 C=C(C)CNC(C)CCCCC 3baa91d72419baeda610ff6dbb108f19 [0,2,0,0,0,0|2,0,0]=4 7961 B11R0.46 C=C(C)CN[C@@H](C)CCCCC e2209b166c184620934c73139ad8b6cc [0,2,0,0,0,0|2,0,0]=4 7962 B11R0.46 C=C(C)COC(C)CCCCC 5f71ffe34a8da49aa1b10660377a3a7b [0,2,0,0,0,0|2,0,0]=4 7963 B11R0.46 C=C(C)CO[C@@H](C)CCCCC 029736e522b1ff54daf75ccd32dc7b1c [0,2,0,0,0,0|2,0,0]=4 7964 B11R0.46 C=C(C)CO[C@H](C)CCCCC 9a8fd0300f8e5446c2402737d59be034 [0,2,0,0,0,0|2,0,0]=4 7965 B11R0.46 C=C(Cl)CNC(C)CCCCC 87faba2cba5782cc0501df949afd4e4a [0,2,0,0,0,0|2,0,0]=4 7966 B11R0.46 C=C(Cl)CN[C@@H](C)CCCCC ed6171805634d7aeba819ee128c6f1fd [0,2,0,0,0,0|2,0,0]=4 7967 B11R0.46 C=C(Cl)COC(C)CCCCC 8842d65b3c617a0a1b56bbecd4b06cbd [0,2,0,0,0,0|2,0,0]=4 7968 B11R0.46 C=C(Cl)CO[C@@H](C)CCCCC 22144338dba876097fa4ce528be51f8e [0,2,0,0,0,0|2,0,0]=4 7969 B11R0.46 C=C(Cl)CO[C@H](C)CCCCC 9402aa1edfa2a0ed89430945a4728279 [0,2,0,0,0,0|2,0,0]=4 7970 B11R0.46 C=C(I)COC(C)CCCCC 2c9c0e24897fe55e0d4305990b03a6fc [0,2,0,0,0,0|2,0,0]=4 7971 B11R0.46 C=C(I)CO[C@@H](C)CCCCC 511754d06f56ba15f39a34e06ec10182 [0,2,0,0,0,0|2,0,0]=4 7972 B11R0.46 C=CCCCN(C)CCC(=O)O bc2e3834d31d71696289cfcfcf3fa0b0 [0,2,0,0,0,0|0,0,2]=4 7973 B11R0.46 C=CCCC[C@H](C)OCC(=O)O 7e08510543e564fde34d2d269f71cb52 [0,2,0,0,0,0|0,0,2]=4 7974 B11R0.46 C=CCCNC(C)CCC(=O)O 7ade98402aaa227191c230c8833a4b5d [0,2,0,0,0,0|0,0,2]=4 7975 B11R0.46 C=CCCN[C@@H](C)CCC(=O)O 65ef9b8a2c46de8ac0057a5941c6b7bd [0,2,0,0,0,0|0,0,2]=4 7976 B11R0.46 C=CCCOC(C)CCC(=O)O 5b27a9accfc034b3ffabfd9fe2c8c595 [0,2,0,0,0,0|0,0,2]=4 7977 B11R0.46 CC(=O)CCN(C)CCCCO 26fd59044ee384e26ead789067f1c51d [0,2,0,0,0,0|2,0,0]=4 7978 B11R0.46 CC(=O)CNC(C)CCCCO 20ffb1fecf7e2a4ccbc35d9b0eb761a2 [0,2,0,0,0,0|2,0,0]=4 7979 B11R0.46 CC(CCC(=O)O)NCCC#N e5d75b095740b4a80b3a149bb0abed05 [0,2,0,0,0,0|1,0,1]=4 7980 B11R0.46 CC(CCC(=O)O)NCCC=O c6e05b069d281f6f0174481b4a43fac7 [0,2,0,0,0,0|1,0,1]=4 7981 B11R0.46 CC(CCC(=O)O)NCCCCl 0c5726326a5ac744389838ca32f33650 [0,2,0,0,0,0|1,0,0]=3 7982 B11R0.46 CC(CCC(=O)O)NCCCF c72d9ab1b6334f56ab15801ac7c5c4eb [0,2,0,0,0,0|1,0,0]=3 7983 B11R0.46 CC(CCC(=O)O)NCCCO 9f474b864a0f9a1d6914b674e5d77698 [0,2,0,0,0,0|1,0,0]=3 7984 B11R0.46 CC(CCC(=O)O)NCCON 0c53791b7b02ec5e3daee639407a0573 [0,2,0,0,0,0|2,0,0]=4 7985 B11R0.46 CC(CCC(=O)O)OCCC#N 707de3566a3a049910dcb55d713aeef2 [0,2,0,0,0,0|1,0,1]=4 7986 B11R0.46 CC(CCC(=O)O)OCCC=O 52fa7656c31b86cc211b5c2e40656d70 [0,2,0,0,0,0|1,0,1]=4 7987 B11R0.46 CC(CCC(=O)O)OCCCF a30a71ea7c3b566a9ad3318917402b5a [0,2,0,0,0,0|1,0,0]=3 7988 B11R0.46 CC(CCC(=O)O)OCCCS 72cf467bc9040fda699004aa4e91ad77 [0,2,0,0,0,0|1,0,0]=3 7989 B11R0.46 CC(CCCCO)NCC(=O)N 6e376cd122c07e1ab62c251139e1f975 [0,2,0,0,0,0|2,0,0]=4 7990 B11R0.46 CC(CCCCO)NCC(=O)O 1e3367a2bce532bdba078601384912b2 [0,2,0,0,0,0|1,0,0]=3 7991 B11R0.46 CC/C=C/CN(C)CCC(=O)O c81a948cbd18937c8f3b740e20719612 [0,2,0,0,0,0|0,0,2]=4 7992 B11R0.46 CC=CCNC(C)CCC(=O)O cca35f31f938cde9f41396688087205c [0,2,0,0,0,0|0,0,2]=4 7993 B11R0.46 CCC#CCC(C)OCC(=O)O a05b2d5db75b275111ae8ab289a542c9 [0,2,0,0,0,0|0,0,2]=4 7994 B11R0.46 CCCCCC(=O)NCC(=O)C af3e7d92608982622598a3f3607f3171 [0,2,0,0,0,0|1,0,1]=4 7995 B11R0.46 CCCCCC(=O)NCC(=O)N 4521510cb11ba808a1551dcba164917e [0,2,0,0,0,0|1,0,1]=4 7996 B11R0.46 CCCCCC(C)NCC(=O)C 3b744ffccb982ef0751d36a0d377f99f [0,2,0,0,0,0|1,0,0]=3 7997 B11R0.46 CCCCCC(C)NCC(=O)N 943aae418b0f98c8aea2bcb180980244 [0,2,0,0,0,0|1,0,0]=3 7998 B11R0.46 CCCCCC(C)NCC(=O)O 1bfdcef2296e34b5c0fe308e42cf1372 [0,2,0,0,0,0|0,0,0]=2 7999 B11R0.46 CCCCCC(C)NCC(C)O 8d096a163ae65b6b7900d3db60d0a95c [0,2,0,0,0,0|1,0,1]=4 8000 B11R0.46 CCCCCC(C)NC[C@@H](C)O 3522d654fea5db0a10b9d40e98d9e7ef [0,2,0,0,0,0|1,0,1]=4 8001 B11R0.46 CCCCCC(C)NC[C@H](C)O 2a4ea60fb83a2255736c97ce0a177f85 [0,2,0,0,0,0|1,0,1]=4 8002 B11R0.46 CCCCCC(C)NC[N+](=O)[O-] e90dd3e87965adae00f3892f96358bfb [0,2,0,0,0,0|1,0,1]=4 8003 B11R0.46 CCCCCC(C)OCC(=O)C f5ec04e321ea7339d1ec164595b99541 [0,2,0,0,0,0|1,0,0]=3 8004 B11R0.46 CCCCCC(C)OCC(=O)N 336ac0942dad4ff0856fcbe92d51fa22 [0,2,0,0,0,0|1,0,0]=3 8005 B11R0.46 CCCCCC(C)OCC(=O)O 57324f0b00c57fa34b0ceda6a018e6d9 [0,2,0,0,0,0|0,0,0]=2 8006 B11R0.46 CCCCCC(C)OCC(=S)N 22c580ab8183fd1ce1ee126a6552bbce [0,2,0,0,0,0|1,1,0]=4 8007 B11R0.46 CCCCCC(C)OCS(=O)O 040abc4b4316bdad6fa921cd79346996 [0,2,0,0,0,0|1,0,0]=3 8008 B11R0.46 CCCCCC(C)OC[N+](=O)[O-] 8ae7ced723e0bbaef0b49ebc733cceca [0,2,0,0,0,0|1,0,1]=4 8009 B11R0.46 CCCCCN(C)CCC(=O)C 276c20c223d691194a14135a8e6444f1 [0,2,0,0,0,0|1,0,0]=3 8010 B11R0.46 CCCCCN(C)CCC(=O)N 815a7e216d799288e2a8d29eb95c2c0f [0,2,0,0,0,0|1,0,0]=3 8011 B11R0.46 CCCCCN(C)CCC(=O)O 099f3f711cc11015825f627121b0638e [0,2,0,0,0,0|0,0,0]=2 8012 B11R0.46 CCCCCN(C)CCC(C)O 6b55c33b8a4ddc6cc04a532cd3352f43 [0,2,0,0,0,0|1,0,1]=4 8013 B11R0.46 CCCCCN(C)CCS(=O)C 40100521aa136426c2e1c4ace0582e71 [0,2,0,0,0,0|2,0,0]=4 8014 B11R0.46 CCCCCN(C)COC(=O)C 7aef0cfad7b1fd0d5c94ec6ad216e34d [0,2,0,0,0,0|2,0,0]=4 8015 B11R0.46 CCCCC[C@@H](C)OCC(=O)N 2a3d91aa30c42ab530bc4dd4180a19b7 [0,2,0,0,0,0|1,0,0]=3 8016 B11R0.46 CCCCC[C@@H](C)OCC(=O)O 977fea29395a7a8bfc512e7fc52361b2 [0,2,0,0,0,0|0,0,0]=2 8017 B11R0.46 CCCCC[C@@H](C)OC[N+](=O)[O-] 73f47ad5cbc64cf3f58b56a3f0db1d5b [0,2,0,0,0,0|1,0,1]=4 8018 B11R0.46 CCCCC[C@H](C)NCC(=O)C 2180a0169e98281e3cac31743e458333 [0,2,0,0,0,0|1,0,0]=3 8019 B11R0.46 CCCCC[C@H](C)NCC(=O)N 07ee3774c382960521b38b9b0d8c3373 [0,2,0,0,0,0|1,0,0]=3 8020 B11R0.46 CCCCC[C@H](C)NCC(=O)O 0380343a2030d4f567471addb377c0f8 [0,2,0,0,0,0|0,0,0]=2 8021 B11R0.46 CCCCC[C@H](C)NCC(C)O ddf4a414a4658112aea39bd574feab88 [0,2,0,0,0,0|1,0,1]=4 8022 B11R0.46 CCCCC[C@H](C)NC[C@@H](C)O 7ac1ea2e7586982ed81575c7feb010c3 [0,2,0,0,0,0|1,0,1]=4 8023 B11R0.46 CCCCC[C@H](C)NC[C@H](C)O 16d154322fca42dff42bdb0ca7037b2d [0,2,0,0,0,0|1,0,1]=4 8024 B11R0.46 CCCCC[C@H](C)NC[N+](=O)[O-] c41d03dd4da9d7947851a781e02ec2ef [0,2,0,0,0,0|1,0,1]=4 8025 B11R0.46 CCCCC[C@H](C)OCC(=O)C 96ee3e27225025e413cc06c320c2b0ba [0,2,0,0,0,0|1,0,0]=3 8026 B11R0.46 CCCCC[C@H](C)OCC(=O)N 89a03e1e6f0b96df48fdb0621fdf4258 [0,2,0,0,0,0|1,0,0]=3 8027 B11R0.46 CCCCC[C@H](C)OCC(=O)O 2b403272079d6041b1d247155ecbff7c [0,2,0,0,0,0|0,0,0]=2 8028 B11R0.46 CCCCC[C@H](C)OCC(=S)N c8d1fb1103f9d5381c217e23f5afa4c7 [0,2,0,0,0,0|1,1,0]=4 8029 B11R0.46 CCCCC[C@H](C)OCS(=O)O 6303c2ae0bf865e5d2b530c2963dda2f [0,2,0,0,0,0|1,0,0]=3 8030 B11R0.46 CCCCC[C@H](C)OC[N+](=O)[O-] 0461fcb9c36d7758dd831d4935357a10 [0,2,0,0,0,0|1,0,1]=4 8031 B11R0.46 CCCCNC(=O)CCC(=O)C 40ef79ea884b1007f68666d5fa1adf9f [0,2,0,0,0,0|1,0,1]=4 8032 B11R0.46 CCCCNC(=O)CCC(=O)N bf242752d739d0d1ef4ebf4bc950f9a4 [0,2,0,0,0,0|1,0,1]=4 8033 B11R0.46 CCCCNC(=O)NCC(=O)O 860de9a76c1efa57f796b8589fcb9ecd [0,2,0,0,0,0|1,0,1]=4 8034 B11R0.46 CCCCNC(=S)NCC(=O)O b927c68434c1ae197f7e06e2667937a7 [0,2,0,0,0,0|1,0,1]=4 8035 B11R0.46 CCCCNC(C)CCC(=O)O 25c90a2485d50f2e9558822a2afe4934 [0,2,0,0,0,0|0,0,0]=2 8036 B11R0.46 CCCCN[C@@H](C)CCC(=O)O 58abdf559e912f346c8193efceaa0201 [0,2,0,0,0,0|0,0,0]=2 8037 B11R0.46 CCCCOC(C)CCC(=O)O 650839c4954f706a638df6d6a91762ae [0,2,0,0,0,0|0,0,0]=2 8038 B11R0.46 CCCCOC(C)CNC(=O)C b006ba6bc87ed72d38af7f6433391dfe [0,2,0,0,0,0|2,0,0]=4 8039 B11R0.46 CCCCOC(C)COC(=O)C e529f8a0c758092e8a3e7cbf9deefcd3 [0,2,0,0,0,0|2,0,0]=4 8040 B11R0.46 CCCNCC(=O)CCC(=O)O 1765e3a9bf2ce3637b61aae0fa4a00d1 [0,2,0,0,0,0|0,0,1]=3 8041 B11R0.46 CCCNCC(=O)NCC(=O)O e22f1d58fcffb729eec9d55a4c49070a [0,2,0,0,0,0|1,0,1]=4 8042 B11R0.46 CCCNCC(C)COC(=O)C bd8960aa2e081cb2ff9fe077094e1214 [0,2,0,0,0,0|2,0,0]=4 8043 B11R0.46 CCCNCC(O)COC(=O)C f5059bec8b149deb7581e329e56bf159 [0,2,0,0,0,0|2,0,0]=4 8044 B11R0.46 CCCOCC(=O)CCC(=O)O 3a0909f84f436e67a4b61ebcb795da2a [0,2,0,0,0,0|0,0,1]=3 8045 B11R0.46 CCCOCC(=O)NCC(=O)O c51dee49f5ed2129862504f79e4a21d1 [0,2,0,0,0,0|1,0,1]=4 8046 B11R0.46 CCCOCC(C)COC(=O)C 92cfd9d356ad0ae9a6cdd4f2ab6bb355 [0,2,0,0,0,0|2,0,0]=4 8047 B11R0.46 CCCOCC(C)OCC(=O)N 13ca9c365d5fc4bdb14e6fb2a6476ec8 [0,2,0,0,0,0|2,0,0]=4 8048 B11R0.46 CCCOCC(C)OCC(=O)O 7c05b556f01122d11e4aa7d51baa1daa [0,2,0,0,0,0|1,0,0]=3 8049 B11R0.46 CCCOC[C@@H](C)COC(=O)C 916cbc264a611d88b2b79485849db793 [0,2,0,0,0,0|2,0,0]=4 8050 B11R0.46 CCNCCN(C)CCC(=O)O 90b07dfd4af59e43b8fddef119cb9f19 [0,2,0,0,0,0|1,0,0]=3 8051 B11R0.46 CCOCCN(C)CCC(=O)C daaeb6034b261574c30e1cb38e703246 [0,2,0,0,0,0|2,0,0]=4 8052 B11R0.46 CCOCCN(C)CCC(=O)N 0eff3512e05b39259fb693dadfacfef5 [0,2,0,0,0,0|2,0,0]=4 8053 B11R0.46 CCOCCN(C)CCC(=O)O 042f34c6daeceb24d6a73ef28f214cd8 [0,2,0,0,0,0|1,0,0]=3 8054 B11R0.46 CCOCNC(C)CCC(=O)O 2d26f6638be4c43c95b6a83698a08e90 [0,2,0,0,0,0|1,0,0]=3 8055 B11R0.46 CCOCN[C@@H](C)CCC(=O)O 733f731cb6a09ccef8fc0efb1dd2b43a [0,2,0,0,0,0|1,0,0]=3 8056 B11R0.46 CCSCCN(C)CCC(=O)N db7b07525f6a4a94c7455e9da9d49cf3 [0,2,0,0,0,0|2,0,0]=4 8057 B11R0.46 CCSCCN(C)CCC(=O)O 34a962da4d1d77f2a7def90e53625083 [0,2,0,0,0,0|1,0,0]=3 8058 B11R0.46 CN(CCCC#N)CCC(=O)O 73bb243272edbd276b697ddca13d504a [0,2,0,0,0,0|1,0,1]=4 8059 B11R0.46 CN(CCCC=O)CCC(=O)O 3f02e5fc36171de11bc4c8d948f5e1a2 [0,2,0,0,0,0|1,0,1]=4 8060 B11R0.46 CN(CCCCF)CCC(=O)N eaf846a9fd112b45baae27fc31b72a3c [0,2,0,0,0,0|2,0,0]=4 8061 B11R0.46 CN(CCCCF)CCC(=O)O 076b63b0e507ace524d2d3a6f1c52c73 [0,2,0,0,0,0|1,0,0]=3 8062 B11R0.46 CN(CCCCO)CCC(=O)N 87834823cd2be9bb31fe698cb93fd937 [0,2,0,0,0,0|2,0,0]=4 8063 B11R0.46 CN(CCCCO)CCC(=O)O 2bc2d7f7b9b8b0c02d377a30bfb30a8f [0,2,0,0,0,0|1,0,0]=3 8064 B11R0.46 CN(CCNCF)CCC(=O)O 80f3a8c32f4574ac89efe9c7b247590b [0,2,0,0,0,0|2,0,0]=4 8065 B11R0.46 CN(CCNCO)CCC(=O)O 91ba9e61a3de2678af2b73c7d46811a4 [0,2,0,0,0,0|2,0,0]=4 8066 B11R0.46 CN(CCOCF)CCC(=O)O 031719b9bf268dc7427ea3f41c9416e7 [0,2,0,0,0,0|2,0,0]=4 8067 B11R0.46 COCCCN(C)CCC(=O)C e1f37886cff4b0e3e81793c2d75afbd4 [0,2,0,0,0,0|2,0,0]=4 8068 B11R0.46 COCCCN(C)CCC(=O)N f926f05dfe4b0f54837d89649c93d3f6 [0,2,0,0,0,0|2,0,0]=4 8069 B11R0.46 COCCCN(C)CCC(=O)O 70b75de4d487adb3824c09f49b969c78 [0,2,0,0,0,0|1,0,0]=3 8070 B11R0.46 COCCNC(C)CCC(=O)O 810e9b3b63316275cb5842194f5daa2a [0,2,0,0,0,0|1,0,0]=3 8071 B11R0.46 COCCN[C@@H](C)CCC(=O)O 0acb23f64b85c0326334b65f05753ca5 [0,2,0,0,0,0|1,0,0]=3 8072 B11R0.46 COCCOC(C)CCC(=O)O 74e8f1c99a2811b17de764a240f30887 [0,2,0,0,0,0|1,0,0]=3 8073 B11R0.46 COCNCC(=O)CCC(=O)O 9451d4c9b347e19996aedc26ccdf3bc6 [0,2,0,0,0,0|1,0,1]=4 8074 B11R0.46 COCOCC(=O)CCC(=O)O 4f0d487a3f0ebda6a68753ea5cbac34d [0,2,0,0,0,0|1,0,1]=4 8075 B11R0.46 CSCCCN(C)CCC(=O)N d0435093bd996563fe3172f85e1c5721 [0,2,0,0,0,0|2,0,0]=4 8076 B11R0.46 CSCCCN(C)CCC(=O)O d98cf54c943d58150a87befbda76ca03 [0,2,0,0,0,0|1,0,0]=3 8077 B11R0.46 CSCCNC(C)CCC(=O)O b842c44677c7d221ed3979bc508d9859 [0,2,0,0,0,0|1,0,0]=3 8078 B11R0.46 CSCCN[C@@H](C)CCC(=O)O 954e936d10c49c910cf5c3b4eb88e15d [0,2,0,0,0,0|1,0,0]=3 8079 B11R0.46 CSCCOC(C)CCC(=O)O b0f83d1fc07a47f796fb6fcafc02fc20 [0,2,0,0,0,0|1,0,0]=3 8080 B11R0.46 CSCNCC(=O)CCC(=O)O b9fb048dbcc78b4afdc78b0f1b81a4a2 [0,2,0,0,0,0|1,0,1]=4 8081 B11R0.46 C[C@@H](CCC(=O)O)NCCC#N 772984d734c7e239e6a3bd6992ad8eba [0,2,0,0,0,0|1,0,1]=4 8082 B11R0.46 C[C@@H](CCC(=O)O)NCCC=O 96a15778e28e2b72456755712ed24172 [0,2,0,0,0,0|1,0,1]=4 8083 B11R0.46 C[C@@H](CCC(=O)O)NCCCF 4c98ba9fbad36ec0b7f799189ec29383 [0,2,0,0,0,0|1,0,0]=3 8084 B11R0.46 C[C@@H](CCC(=O)O)NCCCO 42d62f7c0c1655845a0f648060232319 [0,2,0,0,0,0|1,0,0]=3 8085 B11R0.46 O=C(O)CCC(=O)CNCCBr b4884e049e76af8768b6c4c817ad4ebd [0,2,0,0,0,0|1,0,1]=4 8086 B11R0.46 O=C(O)CCC(=O)CNCCF 672aa5ac3fd68d01da2b736ec50b1ef6 [0,2,0,0,0,0|1,0,1]=4 8087 B11R0.46 O=C(O)CCC(=O)CNCCI 73fa01ef8af84b7f6e1e71092a2944da [0,2,0,0,0,0|1,0,1]=4 8088 B11R0.46 O=C(O)CCC(=O)CNCCO b19e8b06a4c3ca1c60407d0dcb89109a [0,2,0,0,0,0|1,0,1]=4 8089 B11R0.46 O=C(O)CCC(=O)CNCCS 28bb4076de219fbe075b65a6725d9409 [0,2,0,0,0,0|1,0,1]=4 8090 B11R0.46 O=C(O)CCC(=O)COCCS ff22c118d07f7dcbf3fb35069631cefb [0,2,0,0,0,0|1,0,1]=4 8091 B11R0.111 C#CC(C)NCCCCC(=O)C df3ade9a796d495d92d7796920818395 [0,2,0,0,0,0|2,0,0]=4 8092 B11R0.111 C#CC(C)NCCCCC(=O)N 88fd9c658abff3f40b57c6f93cb4c37c [0,2,0,0,0,0|2,0,0]=4 8093 B11R0.111 C#CC(C)NCCCCC(=O)O 9782f38e505cfdfcc40664a7213ce03e [0,2,0,0,0,0|1,0,0]=3 8094 B11R0.111 C#CC(C)NCCOCC(=O)O c9774a7ce73fb33a0efc026863c56aad [0,2,0,0,0,0|2,0,0]=4 8095 B11R0.111 C#CC(C)OCCCCC(=O)C dcab9ecd87b40690a70d13693670df61 [0,2,0,0,0,0|2,0,0]=4 8096 B11R0.111 C#CC(C)OCCCCC(=O)N 2d37a1df608940bbac280f2126683383 [0,2,0,0,0,0|2,0,0]=4 8097 B11R0.111 C#CC(C)OCCOCC(=O)O fe5232d5ceb755665e291936d973ee99 [0,2,0,0,0,0|2,0,0]=4 8098 B11R0.111 C#C[C@@H](C)NCCCCC(=O)C eab7ff8eb7898a8ff905c21d799a6e3c [0,2,0,0,0,0|2,0,0]=4 8099 B11R0.111 C#C[C@@H](C)NCCCCC(=O)N 9f261676c14a21c0ceaecb5f80e97f7a [0,2,0,0,0,0|2,0,0]=4 8100 B11R0.111 C#C[C@@H](C)NCCCCC(=O)O 82355dab04159f35c8c2ce3213a77d19 [0,2,0,0,0,0|1,0,0]=3 8101 B11R0.111 C#C[C@@H](C)NCCOCC(=O)O 93641bc98c4304831c5250f24516d6cc [0,2,0,0,0,0|2,0,0]=4 8102 B11R0.111 C#C[C@@H](C)OCCCCC(=O)C ce487f2e5eb10f19d734347fb7bef0cc [0,2,0,0,0,0|2,0,0]=4 8103 B11R0.111 C#C[C@@H](C)OCCCCC(=O)N 9398f377ce9121a022ddd799b84b9f1d [0,2,0,0,0,0|2,0,0]=4 8104 B11R0.111 C#C[C@@H](C)OCCOCC(=O)O 28d238fad61d27d81e08e13a0b213664 [0,2,0,0,0,0|2,0,0]=4 8105 B11R0.111 C#C[C@H](C)NCCCCC(=O)C e7a8a8edecf665e26a402d7bb65af46c [0,2,0,0,0,0|2,0,0]=4 8106 B11R0.111 C#C[C@H](C)NCCCCC(=O)N d8cb67e04f160404463ef62decdf4c15 [0,2,0,0,0,0|2,0,0]=4 8107 B11R0.111 C#C[C@H](C)NCCCCC(=O)O 708c6326be2a591604f4a66838ea2b24 [0,2,0,0,0,0|1,0,0]=3 8108 B11R0.111 C#C[C@H](C)NCCOCC(=O)O a830f5feeb7cee398dd5536b3635df5f [0,2,0,0,0,0|2,0,0]=4 8109 B11R0.111 C#C[C@H](C)OCCCCC(=O)C 7fdc44c6e00a1647a348e87b2ccc1802 [0,2,0,0,0,0|2,0,0]=4 8110 B11R0.111 C#C[C@H](C)OCCCCC(=O)N d7d33ffe238626ae05e8352f7b2f28bb [0,2,0,0,0,0|2,0,0]=4 8111 B11R0.111 C#C[C@H](C)OCCOCC(=O)O d99c36ac8d687a13a6a45573dd5d134b [0,2,0,0,0,0|2,0,0]=4 8112 B11R0.111 C/C(=C\I)/COCCCC(=O)O a486f9a70c0675b600d1a91e3a33b1c4 [0,2,0,0,0,0|1,0,1]=4 8113 B11R0.111 C=C(Br)CCOCCC(C)CC d70a48341e6b14d9b88863864657e293 [0,2,0,0,0,0|2,0,0]=4 8114 B11R0.111 C=C(Br)COCCCC(C)CC 6d3473c0fecb19a00f5a268348ce3338 [0,2,0,0,0,0|2,0,0]=4 8115 B11R0.111 C=C(Br)COCCC[C@@H](C)CC 4cb7e340fc205961f4970c240c0f5bf8 [0,2,0,0,0,0|2,0,0]=4 8116 B11R0.111 C=C(C)CCCNCC(=O)NO 645614b3bb34d58f20ee487d6398fc30 [0,2,0,0,0,0|1,0,1]=4 8117 B11R0.111 C=C(C)CCCNCC(=O)OC 2823e4de1ba970c7e61a17fff06f4435 [0,2,0,0,0,0|1,0,1]=4 8118 B11R0.111 C=C(C)CCCNCC(C)CC f6994c7ca96db64d276957c9c7f6648e [0,2,0,0,0,0|2,0,0]=4 8119 B11R0.111 C=C(C)CCCNCC(O)CC 958f8579fc67c60be5a4408d084edb1e [0,2,0,0,0,0|2,0,0]=4 8120 B11R0.111 C=C(C)CCCNC[C@@H](C)CC cb47eeade2bda66ee4f9401249a12e73 [0,2,0,0,0,0|2,0,0]=4 8121 B11R0.111 C=C(C)CCCNC[C@H](O)CC 7e4dff5eb38eb174592a3002d19e9842 [0,2,0,0,0,0|2,0,0]=4 8122 B11R0.111 C=C(C)CCCOCC(=O)OC b69b103c15c4a7331e6fa9749cdc4430 [0,2,0,0,0,0|1,0,1]=4 8123 B11R0.111 C=C(C)CCCOCC(C)CC e0aeee5adca2e1d5b81c8d3d607da159 [0,2,0,0,0,0|2,0,0]=4 8124 B11R0.111 C=C(C)CCCOC[C@@H](C)CC 3cc25994e8adae5c387cad627fa643fc [0,2,0,0,0,0|2,0,0]=4 8125 B11R0.111 C=C(C)CCCOC[C@H](C)CC 6b0f5f9708d9ffd627a03700d892d3e4 [0,2,0,0,0,0|2,0,0]=4 8126 B11R0.111 C=C(C)CCNCCC(=O)NO d67cac530214fe8eecd2491d800d20d8 [0,2,0,0,0,0|1,0,1]=4 8127 B11R0.111 C=C(C)CCNCCC(=O)OC b2338a39b81f8ab118314cf7cdfee7b2 [0,2,0,0,0,0|1,0,1]=4 8128 B11R0.111 C=C(C)CCNCCC(C)CC 317cb81be8ec8df436e96838beef43da [0,2,0,0,0,0|2,0,0]=4 8129 B11R0.111 C=C(C)CCOCCC(=O)OC 1e7c4177fa5ff1354bee1394cfee9406 [0,2,0,0,0,0|1,0,1]=4 8130 B11R0.111 C=C(C)CCOCCC(C)CC c0a1a691d461fa0f8fd255f19836dba8 [0,2,0,0,0,0|2,0,0]=4 8131 B11R0.111 C=C(C)CCOCCC(S)CC 77dee2e21e39ba64b3110ba00fa86a97 [0,2,0,0,0,0|2,0,0]=4 8132 B11R0.111 C=C(C)CCOCC[C@@H](C)CC 4c364e4073c93480ecaec240c3647ce8 [0,2,0,0,0,0|2,0,0]=4 8133 B11R0.111 C=C(C)CNCCCC(=O)OC 7b5255baf8f01a26145e30ef972255db [0,2,0,0,0,0|1,0,1]=4 8134 B11R0.111 C=C(C)COCCCC(=O)OC 7d70e25ef161b0a27bb5fb570e223c8d [0,2,0,0,0,0|1,0,1]=4 8135 B11R0.111 C=C(C)COCCCC(C)CC 9326ea44b99a1f6dd28c59016a99bf8d [0,2,0,0,0,0|2,0,0]=4 8136 B11R0.111 C=C(C)COCCC[C@@H](C)CC 60132c2725aa31581eb8b5fbaf687e1e [0,2,0,0,0,0|2,0,0]=4 8137 B11R0.111 C=C(C=O)OCCCCC(C)C 38bfba6bd22e092c60116a21f6fee010 [0,2,0,0,0,0|2,0,0]=4 8138 B11R0.111 C=C(CC)CNCCCC(=O)N d1c1bd8ad53032bf45e57ce26b270562 [0,2,0,0,0,0|1,0,1]=4 8139 B11R0.111 C=C(CC)CNCCCC(=O)O 3d9ff6390601fdebd6691df5b5e00b62 [0,2,0,0,0,0|0,0,1]=3 8140 B11R0.111 C=C(CC)COCCCC(=O)C 6df7ccea2ac98de76d4475324ff71101 [0,2,0,0,0,0|1,0,1]=4 8141 B11R0.111 C=C(CC)COCCCC(=O)N bdd735d0b74ad18e06f468064313641a [0,2,0,0,0,0|1,0,1]=4 8142 B11R0.111 C=C(CNCCCC(=O)O)OC f53a38bad73ddcf59510b81d63eae37c [0,2,0,0,0,0|1,0,1]=4 8143 B11R0.111 C=C(CNCCCC(C)C)OC dc564130dc2a84bf5599acc6142e386b [0,2,0,0,0,0|2,0,0]=4 8144 B11R0.111 C=C(CO)CNCCCC(C)C b1fb695cd620df54c221db375d37ad95 [0,2,0,0,0,0|2,0,0]=4 8145 B11R0.111 C=C(COCCCC(C)C)OC 43615f3e68ebd985436a142611036df9 [0,2,0,0,0,0|2,0,0]=4 8146 B11R0.111 C=C(Cl)COCCCC(C)CC aed318688482f29193d0c5f753341685 [0,2,0,0,0,0|2,0,0]=4 8147 B11R0.111 C=C(Cl)COCCC[C@@H](C)CC 45a23cd720f9402a2c5f3bb947b85d8b [0,2,0,0,0,0|2,0,0]=4 8148 B11R0.111 C=C(F)COCCCC(C)CC 9ef863d4896f83d011d64b51637f53de [0,2,0,0,0,0|2,0,0]=4 8149 B11R0.111 C=C(F)COCCC[C@@H](C)CC 28c4106071885f6962021aa23dfa49cb [0,2,0,0,0,0|2,0,0]=4 8150 B11R0.111 C=CC(=O)CCCNCC(C)C 618f60af6ecfcc304a999837421ada92 [0,2,0,0,0,0|2,0,0]=4 8151 B11R0.111 C=CC(=O)CCCNCC(C)O 3a05b8b1765527fac4936e66fc9a5e67 [0,2,0,0,0,0|2,0,0]=4 8152 B11R0.111 C=CC(=O)CCCNC[C@@H](C)O af5430e730d59f8fb7c2f3135bc63c82 [0,2,0,0,0,0|2,0,0]=4 8153 B11R0.111 C=CC(=O)CCCNC[C@H](C)O 21f4d734cbfc52e003ff73b3326636d2 [0,2,0,0,0,0|2,0,0]=4 8154 B11R0.111 C=CC(=O)CCCOCC(C)C f18a3084c97b01799b040b5371c21862 [0,2,0,0,0,0|2,0,0]=4 8155 B11R0.111 C=CC(=O)CCCOCC(C)F 890adddf18b7b8d3bb788cebb0b556b8 [0,2,0,0,0,0|2,0,0]=4 8156 B11R0.111 C=CC(=O)CCCOCC(C)S 7e6721fd8665509c4f50d700e99e807a [0,2,0,0,0,0|2,0,0]=4 8157 B11R0.111 C=CC(=O)CCCOC[C@@H](C)F 3198ed9251b224bdfa520e4af0c57c51 [0,2,0,0,0,0|2,0,0]=4 8158 B11R0.111 C=CC(=O)CCCOC[C@H](C)F 7c45529c80e7847e472f031dc0f8ec9f [0,2,0,0,0,0|2,0,0]=4 8159 B11R0.111 C=CC(C)COCCCC(=O)C c6c9d8fff020a51ea00570293f9dcc68 [0,2,0,0,0,0|2,0,0]=4 8160 B11R0.111 C=CC(C)COCCCC(=O)N 77c50c2af37056acde10d69d4ffb4ed9 [0,2,0,0,0,0|2,0,0]=4 8161 B11R0.111 C=CC(C)COCCCC(=O)O e009fc86a19e6f6949a7d7d3fb53c9dc [0,2,0,0,0,0|1,0,0]=3 8162 B11R0.111 C=CC(C)NCCCCC(=O)C 36a1f5f288ab7adf7d9663252995c5ca [0,2,0,0,0,0|2,0,0]=4 8163 B11R0.111 C=CC(C)NCCCCC(=O)N 30e33830ff64eec10ee6e8b322e5072f [0,2,0,0,0,0|2,0,0]=4 8164 B11R0.111 C=CC(C)NCCCCC(=O)O e2ba5801a4e2349df0f4e02a951e65e7 [0,2,0,0,0,0|1,0,0]=3 8165 B11R0.111 C=CC(C)NCCOCC(=O)O bc26651a46eb63da79139fdbd35e22d0 [0,2,0,0,0,0|2,0,0]=4 8166 B11R0.111 C=CC(C)NCCSCC(=O)O e6224c565e196187dd6564679b32aa13 [0,2,0,0,0,0|2,0,0]=4 8167 B11R0.111 C=CC(C)OCCCCC(=O)C 1a52154541e8da6c546f0cac9b302ea5 [0,2,0,0,0,0|2,0,0]=4 8168 B11R0.111 C=CC(C)OCCCCC(=O)N c804c87a8b5563e62a7c261d3d83b77a [0,2,0,0,0,0|2,0,0]=4 8169 B11R0.111 C=CC(C)OCCCCC(=O)O d3490ad49368eb16a2cd22ced0979aa3 [0,2,0,0,0,0|1,0,0]=3 8170 B11R0.111 C=CC(C)OCCOCC(=O)O b15bd0ee857ff16d8ca84f7f9fa41d9e [0,2,0,0,0,0|2,0,0]=4 8171 B11R0.111 C=CC(O)CNCCCC(=O)O 4cb85aa7bc7348fef9dbff636ceb2379 [0,2,0,0,0,0|0,0,2]=4 8172 B11R0.111 C=C[C@H](C)OCCCCC(=O)C 1a435d58798cb1f50da405c5b06c5865 [0,2,0,0,0,0|2,0,0]=4 8173 B11R0.111 C=C[C@H](C)OCCCCC(=O)N 0374149342913d3cef15e3a1837528a6 [0,2,0,0,0,0|2,0,0]=4 8174 B11R0.111 C=C[C@H](C)OCCCCC(=O)O df57aa3d35506c1aefdb3a461ef1f3df [0,2,0,0,0,0|1,0,0]=3 8175 B11R0.111 C=C[C@H](C)OCCOCC(=O)O 6bc4c55e7f1b4997c68a5973d5233c84 [0,2,0,0,0,0|2,0,0]=4 8176 B11R0.111 CC(=CI)COCCCC(=O)O 34114578de9ec17d43ff4c7f683654d1 [0,2,0,0,0,0|1,0,1]=4 8177 B11R0.111 CC(=O)CCCCNC(C)C#N 6c81eac1bd56c40232e2912fe51d2bda [0,2,0,0,0,0|2,0,0]=4 8178 B11R0.111 CC(=O)CCCCNC(C)CO 1ceceb529924a19132caed38c234fb02 [0,2,0,0,0,0|2,0,0]=4 8179 B11R0.111 CC(=O)CCCCN[C@@H](C)CO c68e2a79b71bd727562d65dc2c72384b [0,2,0,0,0,0|2,0,0]=4 8180 B11R0.111 CC(=O)CCCCN[C@H](C)CO 6fc0c49a52aacb873019dde7e8aa2e75 [0,2,0,0,0,0|2,0,0]=4 8181 B11R0.111 CC(=O)CCCCOC(C)C=O 14cd2a75128ca861baab335dcb21a726 [0,2,0,0,0,0|2,0,0]=4 8182 B11R0.111 CC(=O)CCCCOC(C)CF ace2d3398b0578e3607e48313411ada2 [0,2,0,0,0,0|2,0,0]=4 8183 B11R0.111 CC(=O)CCCCOC(C)CS e5b01a49135044135ffde47898409047 [0,2,0,0,0,0|2,0,0]=4 8184 B11R0.111 CC(=O)CCCCO[C@H](C)C=O 49473230d5440daeb4f8d58eff230b62 [0,2,0,0,0,0|2,0,0]=4 8185 B11R0.111 CC(=O)CCCCO[C@H](C)CS 7433d0af3d50983fee567bfffef5b06e [0,2,0,0,0,0|2,0,0]=4 8186 B11R0.111 CC(=O)CCCNCC(=O)NO 7febe271720156674fc8272468bea4bc [0,2,0,0,0,0|1,0,1]=4 8187 B11R0.111 CC(=O)CCCNCC(Br)CBr 51a627f15c9daaece27019273777b669 [0,2,0,0,0,0|2,0,0]=4 8188 B11R0.111 CC(=O)CCCNCC(C)C#N 69edcdcedd1a0b3c02ba62bf143c0432 [0,2,0,0,0,0|2,0,0]=4 8189 B11R0.111 CC(=O)CCCNCC(C)CO 84db32839c0887f63a21fb714629fd2c [0,2,0,0,0,0|2,0,0]=4 8190 B11R0.111 CC(=O)CCCNCC(F)CO 8571ce51d969906350a4e421580a32af [0,2,0,0,0,0|2,0,0]=4 8191 B11R0.111 CC(=O)CCCNCC(O)CO b9d27f8d2e25d74aa60270ca124c24c7 [0,2,0,0,0,0|2,0,0]=4 8192 B11R0.111 CC(=O)CCCNC[C@@H](F)CO 3377f290c8acdb3d95a2dee2d35e59ad [0,2,0,0,0,0|2,0,0]=4 8193 B11R0.111 CC(=O)CCCNC[C@@H](O)CO 15f67b77e88426ca0672326a2779c027 [0,2,0,0,0,0|2,0,0]=4 8194 B11R0.111 CC(=O)CCCNC[C@H](C)CO 88ee2f674dc60f86dc097243d21c7e3d [0,2,0,0,0,0|2,0,0]=4 8195 B11R0.111 CC(=O)CCCNC[C@H](F)CO c05c1da0d5033f4ce7bc8204493d4974 [0,2,0,0,0,0|2,0,0]=4 8196 B11R0.111 CC(=O)CCCNC[C@H](O)CO e18c328843a49442e4a629ff21fc1fbb [0,2,0,0,0,0|2,0,0]=4 8197 B11R0.111 CC(=O)CCCOCC(Br)CBr f688bf251b214f2f432578281f3c1ea9 [0,2,0,0,0,0|2,0,0]=4 8198 B11R0.111 CC(=O)CCCOCC(C)C#N 22b353c2e85fe8568221337aef4a8f8c [0,2,0,0,0,0|2,0,0]=4 8199 B11R0.111 CC(=O)CCCOCC(Cl)CCl 2d368d5a2d022eb8dbf8b28eba58e786 [0,2,0,0,0,0|2,0,0]=4 8200 B11R0.111 CC(=O)CCCOCC(O)CO 55b7b959cb16ee7daf52fa45d19fb84b [0,2,0,0,0,0|2,0,0]=4 8201 B11R0.111 CC(=O)CCCOCC(S)CS 6d7b6e41b07251bcac37d0007a8704bd [0,2,0,0,0,0|2,0,0]=4 8202 B11R0.111 CC(=O)CCCOC[C@@H](O)CO db02ed83f28e7407d4a6b33db4d80eb6 [0,2,0,0,0,0|2,0,0]=4 8203 B11R0.111 CC(=O)CCCOC[C@H](O)CO 31de36d01156384364220fae5cb4761b [0,2,0,0,0,0|2,0,0]=4 8204 B11R0.111 CC(=O)CCNCCC(=O)NO 05ac3846e8d8e0ef80c3aa41cfc0ca4a [0,2,0,0,0,0|1,0,1]=4 8205 B11R0.111 CC(=O)CCNCCC(C)CO 5ed938763f1a7e68313fc5676e266a9b [0,2,0,0,0,0|2,0,0]=4 8206 B11R0.111 CC(=O)CCNCCC(O)CO 845baa215ec5bf037821e46519306738 [0,2,0,0,0,0|2,0,0]=4 8207 B11R0.111 CC(=O)CCNCC[C@@H](C)CO 36802622e17c8a02fc6f5dd476539ac5 [0,2,0,0,0,0|2,0,0]=4 8208 B11R0.111 CC(C#N)CNCCCC(=O)N 72747286628ccaa2c3eed8f9fe8f217a [0,2,0,0,0,0|2,0,0]=4 8209 B11R0.111 CC(C#N)CNCCCC(=O)O 49e3d697c6dac6f4369abbffe4e973c1 [0,2,0,0,0,0|1,0,0]=3 8210 B11R0.111 CC(C#N)COCCCC(=O)N 3a6e57a44f544530097ce0274250163d [0,2,0,0,0,0|2,0,0]=4 8211 B11R0.111 CC(C#N)NCCCCC(=O)N 6ebd964a7a59af742911e0878ee63ddc [0,2,0,0,0,0|2,0,0]=4 8212 B11R0.111 CC(C#N)NCCCCC(=O)O 9570b211c162e4306844b70ef2519a06 [0,2,0,0,0,0|1,0,0]=3 8213 B11R0.111 CC(C#N)NCCOCC(=O)O 6386071aa0f11bd58e68b15f789e34c9 [0,2,0,0,0,0|2,0,0]=4 8214 B11R0.111 CC(C#N)OCCNCC(=O)O 2b68555dd65ba9780786b86152a5ce9b [0,2,0,0,0,0|2,0,0]=4 8215 B11R0.111 CC(C#N)OCCOCC(=O)O 87afe91330ffe150dc3803132e4aa15c [0,2,0,0,0,0|2,0,0]=4 8216 B11R0.111 CC(C)CCCNCC(=O)CO dfd838eddbf8ec6324121b1cbec84d54 [0,2,0,0,0,0|1,0,0]=3 8217 B11R0.111 CC(C)CCCNCC(=O)NO 4e0492e13f8881c376c80d1b38710824 [0,2,0,0,0,0|1,0,0]=3 8218 B11R0.111 CC(C)CCNCCC(=O)NO 024db65c354ed31dee2e4a17645e2d74 [0,2,0,0,0,0|1,0,0]=3 8219 B11R0.111 CC(C)OCCCNC(=O)CO 1f92e8f4aaac8b45aa31117edead725f [0,2,0,0,0,0|2,0,0]=4 8220 B11R0.111 CC(C)OCCNCC(=O)CO defadca3238abd371d5a9ae457133319 [0,2,0,0,0,0|2,0,0]=4 8221 B11R0.111 CC(C)OCCNCC(=O)NO ce222a5d039db8b6463b38f68b1be679 [0,2,0,0,0,0|2,0,0]=4 8222 B11R0.111 CC(C)OCNCCC(=O)NO e763a84e38e58584b74d6322dccd74af [0,2,0,0,0,0|2,0,0]=4 8223 B11R0.111 CC(C)SCCCNC(=O)CO 52cf772024f4ba0a27a40dd074f40310 [0,2,0,0,0,0|2,0,0]=4 8224 B11R0.111 CC(C)SCCNCC(=O)NO 8a901d7bfaaacdd84ba4163c046fab8e [0,2,0,0,0,0|2,0,0]=4 8225 B11R0.111 CC(C=O)NCCCCC(=O)N 9289f7228520c5c1404663956c8a77a0 [0,2,0,0,0,0|2,0,0]=4 8226 B11R0.111 CC(C=O)NCCCCC(=O)O af7f8961a4c0836811d4da32e31cae7f [0,2,0,0,0,0|1,0,0]=3 8227 B11R0.111 CC(C=O)NCCOCC(=O)O ea64abe53c0e23afc160280a01c91058 [0,2,0,0,0,0|2,0,0]=4 8228 B11R0.111 CC(C=O)NCCSCC(=O)O 770b45f40c14be575852c41d5c911b09 [0,2,0,0,0,0|2,0,0]=4 8229 B11R0.111 CC(C=O)OCCCCC(=O)N 1083f7ed36c84ed61ea428229a04ae32 [0,2,0,0,0,0|2,0,0]=4 8230 B11R0.111 CC(C=O)OCCCCC(=O)O 15364b586a28a3ed45b87fe27ac885d6 [0,2,0,0,0,0|1,0,0]=3 8231 B11R0.111 CC(C=O)OCCOCC(=O)O 35c816a5c3ee14cd3abf2d0e2e14e2ec [0,2,0,0,0,0|2,0,0]=4 8232 B11R0.111 CC(CF)OCCCCC(=O)N 6fb36fe9dceb04fca397c02b864131b0 [0,2,0,0,0,0|2,0,0]=4 8233 B11R0.111 CC(CF)OCCOCC(=O)O a564d5981c5d70785035c866a0bbf41b [0,2,0,0,0,0|2,0,0]=4 8234 B11R0.111 CC(CO)CCCNCC(=O)N f2554623f1e8b5357d62c94a58954b4c [0,2,0,0,0,0|2,0,0]=4 8235 B11R0.111 CC(CO)CCCNCC(=O)O 1de1fc102d36f3ca60c60feaef5a18df [0,2,0,0,0,0|1,0,0]=3 8236 B11R0.111 CC(CO)CCNCCC(=O)N 7afaf93677f24491eea9f26a57ace27b [0,2,0,0,0,0|2,0,0]=4 8237 B11R0.111 CC(CO)CCNCCC(=O)O c1d6cecf9a207e3fcbb9eb8ac8dc0ed4 [0,2,0,0,0,0|1,0,0]=3 8238 B11R0.111 CC(CO)CCNCCS(=O)O 86e45bdcd919a769b11ea1a770b1942d [0,2,0,0,0,0|2,0,0]=4 8239 B11R0.111 CC(CO)CNCCCC(=O)N 8671e4a546005986a89441102646390f [0,2,0,0,0,0|2,0,0]=4 8240 B11R0.111 CC(CO)CNCCCC(=O)O b1ae6f9c8b7f795e4c4a6b2eb0136324 [0,2,0,0,0,0|1,0,0]=3 8241 B11R0.111 CC(CO)NCCCCC(=O)N a12762d50642d00617a0f1b2ada2456c [0,2,0,0,0,0|2,0,0]=4 8242 B11R0.111 CC(CO)NCCCCC(=O)O 8a44e8d6b033cd0087db382fadbb5769 [0,2,0,0,0,0|1,0,0]=3 8243 B11R0.111 CC(CO)NCCOCC(=O)O f73c324a52ea4be410524413e8774fbf [0,2,0,0,0,0|2,0,0]=4 8244 B11R0.111 CC(CO)NCCSCC(=O)O 2288d77c044c560c37bbf8db44601e25 [0,2,0,0,0,0|2,0,0]=4 8245 B11R0.111 CC(CS)OCCCCC(=O)N 757855ec6b210b339dc6ca6cc54707a9 [0,2,0,0,0,0|2,0,0]=4 8246 B11R0.111 CC(CS)OCCOCC(=O)O 477dce2aee0785e048ba07690921f9de [0,2,0,0,0,0|2,0,0]=4 8247 B11R0.111 CC(O)CCCNCC(=O)NO e503827938faeb4ed34a8955941bdc52 [0,2,0,0,0,0|1,0,0]=3 8248 B11R0.111 CC(O)CCNCCC(=O)NO 2e71ace5eb9b2a72fe4eae0111abd8ce [0,2,0,0,0,0|1,0,0]=3 8249 B11R0.111 CCC(=O)CCCCOC(C)C aa944513daa2afa90a34f9aaee9f9f1e [0,2,0,0,0,0|2,0,0]=4 8250 B11R0.111 CCC(=O)CNCCCC(=O)N d40faf4f39febbaf4031665681c37541 [0,2,0,0,0,0|1,0,1]=4 8251 B11R0.111 CCC(=O)CNCCCC(=O)O 5c5da6aca4a6d2d69f3d2e74fd5f4417 [0,2,0,0,0,0|0,0,1]=3 8252 B11R0.111 CCC(=O)CNCCCC(C)C d83f3b736b480a97f776b16a14dc2edc [0,2,0,0,0,0|2,0,0]=4 8253 B11R0.111 CCC(=O)COCCCC(=O)C aa6d33852d4f18ca58cf8e2fd08cb078 [0,2,0,0,0,0|1,0,1]=4 8254 B11R0.111 CCC(=O)COCCCC(=O)N 188626a4eab92d4a90a4d091340e78de [0,2,0,0,0,0|1,0,1]=4 8255 B11R0.111 CCC(=O)COCCCC(C)C eaf4145611740d85857f72943f0be1cd [0,2,0,0,0,0|2,0,0]=4 8256 B11R0.111 CCC(=O)NCCCCC(=O)N d3d76ab3b8f1269c7894eb24e7d4de7f [0,2,0,0,0,0|1,0,1]=4 8257 B11R0.111 CCC(=O)NCCNCC(=O)O 4f48cd8949b8d1a82afc747b35bdca62 [0,2,0,0,0,0|1,0,1]=4 8258 B11R0.111 CCC(=O)NCCOCC(=O)O 547a0174f9eed0cca8581e22d7de0b65 [0,2,0,0,0,0|1,0,1]=4 8259 B11R0.111 CCC(=O)OCCOCC(=O)O bd48d0d5a66fe1fd9e9928b95efdc691 [0,2,0,0,0,0|1,0,1]=4 8260 B11R0.111 CCC(=O)OCNCCC(=O)O 34a7ea57bcfeba2ff365dcb36293f395 [0,2,0,0,0,0|1,0,1]=4 8261 B11R0.111 CCC(=O)OCOCCC(=O)O 4142a3713a041e920d2c134c0afba26d [0,2,0,0,0,0|1,0,1]=4 8262 B11R0.111 CCC(C)CCCOCC(=O)N 89608c6205c0f174263abd240c4dbad8 [0,2,0,0,0,0|1,0,0]=3 8263 B11R0.111 CCC(C)CCCOCC(=O)O 0499bf36e08b4b6291cbe67911409c42 [0,2,0,0,0,0|0,0,0]=2 8264 B11R0.111 CCC(C)CCCOC[N+](=O)[O-] 34df02e495c098c7ae513d8b119c1370 [0,2,0,0,0,0|1,0,1]=4 8265 B11R0.111 CCC(C)CCNCCC(=O)C 638920a467dc28b39de3c335975a78f2 [0,2,0,0,0,0|1,0,0]=3 8266 B11R0.111 CCC(C)CCNCCC(=O)N dfbf6bf8564620c08329a359d9cba1ee [0,2,0,0,0,0|1,0,0]=3 8267 B11R0.111 CCC(C)CCNCCC(=O)O cec12697eb033e4fbae2a331d12d45c2 [0,2,0,0,0,0|0,0,0]=2 8268 B11R0.111 CCC(C)CCNCCC(=S)N fa90f0aa070660d5454ee1b892f485c1 [0,2,0,0,0,0|1,1,0]=4 8269 B11R0.111 CCC(C)CCNCCC(C)O 28fe7c835603a5542b8975efc21f86a2 [0,2,0,0,0,0|1,0,1]=4 8270 B11R0.111 CCC(C)CCNCCS(=O)C 07ca7f3b68e236ba9dfd56f9095b0972 [0,2,0,0,0,0|2,0,0]=4 8271 B11R0.111 CCC(C)CCNCCS(=O)O e77df2d9b8ae6b052dccf2696ea10298 [0,2,0,0,0,0|1,0,0]=3 8272 B11R0.111 CCC(C)CCNCC[C@@H](C)O 0ffaf6a609db917ef82527f9faf9ee72 [0,2,0,0,0,0|1,0,1]=4 8273 B11R0.111 CCC(C)CCNCC[C@H](C)O bbca6c784494d36de883d3783bf78337 [0,2,0,0,0,0|1,0,1]=4 8274 B11R0.111 CCC(C)CCNCOC(=O)C 3292e19b2b855ee5ea2bf9c2c1826379 [0,2,0,0,0,0|2,0,0]=4 8275 B11R0.111 CCC(C)CCNCSC(=O)N bc62df7b2846de48ac211a85db770f60 [0,2,0,0,0,0|2,0,0]=4 8276 B11R0.111 CCC(C)CCOCCC(=O)C da3a9cc1ef47c6a092452f99753e1cab [0,2,0,0,0,0|1,0,0]=3 8277 B11R0.111 CCC(C)CCOCCC(=O)N 00c6c3d41440eb43b6b21860459b3aaf [0,2,0,0,0,0|1,0,0]=3 8278 B11R0.111 CCC(C)CCOCCC(=O)O 4b77e9d8aa524d45b395588cd9a284ae [0,2,0,0,0,0|0,0,0]=2 8279 B11R0.111 CCC(C)CCOCCS(=O)C 99763d5bc90e8222b55c403fbe684517 [0,2,0,0,0,0|2,0,0]=4 8280 B11R0.111 CCC(C)CCOCC[N+](=O)[O-] 822e10ab6900881369dd638d3a60a3cb [0,2,0,0,0,0|1,0,1]=4 8281 B11R0.111 CCC(C)CCOCNC(=O)C 772c6133e81cc414fb75e4feefd53707 [0,2,0,0,0,0|2,0,0]=4 8282 B11R0.111 CCC(C)CCOCNC(=O)N 5ea9270a9635fec5f8bb654aef5746e0 [0,2,0,0,0,0|2,0,0]=4 8283 B11R0.111 CCC(C)CCOCOC(=O)C df38fedcba4f5485012f6613175d7402 [0,2,0,0,0,0|2,0,0]=4 8284 B11R0.111 CCC(C)CCOCSC(=O)N 8265a98fdbbf25a2f977910a403d7033 [0,2,0,0,0,0|2,0,0]=4 8285 B11R0.111 CCC(C)CNC/C=C/C(=O)O 0255b60ec070d03632a088f8c86b1dfe [0,2,0,0,0,0|0,0,2]=4 8286 B11R0.111 CCC(C)CNCC#CC(=O)O fff9193d071e322ca90592fd8352d155 [0,2,0,0,0,0|0,0,2]=4 8287 B11R0.111 CCC(C)CNCC=CC(=O)O f38167d42e5ca61045151bdcb52bbc8c [0,2,0,0,0,0|0,0,2]=4 8288 B11R0.111 CCC(C)CNCCCC(=O)C 853dfe34c15cd93ef4656bc82c256d5a [0,2,0,0,0,0|1,0,0]=3 8289 B11R0.111 CCC(C)CNCCCC(=O)N b9980b2e9cdf6d013f294e66bf7be314 [0,2,0,0,0,0|1,0,0]=3 8290 B11R0.111 CCC(C)CNCCCC(=O)O 09cbf9bf2923470c1370f970f974ffdd [0,2,0,0,0,0|0,0,0]=2 8291 B11R0.111 CCC(C)CNCCCC(C)O d456cc88b7259e9ad2114e5b960584ea [0,2,0,0,0,0|1,0,1]=4 8292 B11R0.111 CCC(C)CNCCCS(=O)C 30843bb1a820a62ad86e31a53ff1d9a2 [0,2,0,0,0,0|2,0,0]=4 8293 B11R0.111 CCC(C)CNCCC[N+](=O)[O-] 69608d466e26b37fb8c60d1fffa25480 [0,2,0,0,0,0|1,0,1]=4 8294 B11R0.111 CCC(C)CNCCNC(=O)C 0446e98fe474a8d7baa00644805c7b29 [0,2,0,0,0,0|2,0,0]=4 8295 B11R0.111 CCC(C)CNCCNC(=O)N e92ff39e656c7b47749eb54f20f39f4c [0,2,0,0,0,0|2,0,0]=4 8296 B11R0.111 CCC(C)CNCCOC(=O)C d48fd4967dd0b81b7600f485818e9a7f [0,2,0,0,0,0|2,0,0]=4 8297 B11R0.111 CCC(C)CNCCSC(=O)C 54da6db9e14fee05618e76a4f5e344d1 [0,2,0,0,0,0|2,0,0]=4 8298 B11R0.111 CCC(C)COC/C=C/C(=O)O 4c92d47bce625a2c9fce344a06a0ebce [0,2,0,0,0,0|0,0,2]=4 8299 B11R0.111 CCC(C)COCC#CC(=O)O 8b0ed2ff87e7a9365ca91991ee518680 [0,2,0,0,0,0|0,0,2]=4 8300 B11R0.111 CCC(C)COCC=CC(=O)O 26458d91b1882576ae8bf839ba2f705c [0,2,0,0,0,0|0,0,2]=4 8301 B11R0.111 CCC(C)COCCCC(=O)C 95524877262bf2288746bedd3e83a05f [0,2,0,0,0,0|1,0,0]=3 8302 B11R0.111 CCC(C)COCCCC(=O)N 1ae29965bfe3ca235467d6d0fe9ca825 [0,2,0,0,0,0|1,0,0]=3 8303 B11R0.111 CCC(C)COCCC[N+](=O)[O-] 429586796268f28c20ecd26b80029e16 [0,2,0,0,0,0|1,0,1]=4 8304 B11R0.111 CCC(C)COCCNC(=O)C 43f8a45c26b3e8ea54c57ca1d0212794 [0,2,0,0,0,0|2,0,0]=4 8305 B11R0.111 CCC(C)COCCNC(=O)N a67691538374d47290326441096caf70 [0,2,0,0,0,0|2,0,0]=4 8306 B11R0.111 CCC(C)COCCOC(=O)C 4b5c7dcf1be01c6397dc5edf46f1ffd6 [0,2,0,0,0,0|2,0,0]=4 8307 B11R0.111 CCC(C)COCCSC(=O)C 084d039fa00029dc757c299550a79097 [0,2,0,0,0,0|2,0,0]=4 8308 B11R0.111 CCC(C)NCCCCC(=O)C 60648df8dd8dbd5b6956c5fb973e4ac0 [0,2,0,0,0,0|1,0,0]=3 8309 B11R0.111 CCC(C)NCCCCC(=O)N 6d2a650d023a76cdce4d18b7ef659791 [0,2,0,0,0,0|1,0,0]=3 8310 B11R0.111 CCC(C)NCCCCC(=O)O 9c5b51db971f07f8217489ecab23b5ff [0,2,0,0,0,0|0,0,0]=2 8311 B11R0.111 CCC(C)NCCCCC(C)O 4504267d08c37823a7ae522e87aeffd5 [0,2,0,0,0,0|1,0,1]=4 8312 B11R0.111 CCC(C)NCCCC[C@@H](C)O 9dffe1a8e446579ef38f473cac8ae266 [0,2,0,0,0,0|1,0,1]=4 8313 B11R0.111 CCC(C)NCCCNC(=O)C 8b8f910c30c508477987e3dcec2d5698 [0,2,0,0,0,0|2,0,0]=4 8314 B11R0.111 CCC(C)NCCCOC(=O)C ac6ca6a5ac2975e3884ab8052747f2e2 [0,2,0,0,0,0|2,0,0]=4 8315 B11R0.111 CCC(C)NCCCSC(=O)C 11ccfcff73b57fcfbbecd1f6a5dadde4 [0,2,0,0,0,0|2,0,0]=4 8316 B11R0.111 CCC(C)NCCOCC(=O)N 610766c84b44fe47bdabb025be6a60c9 [0,2,0,0,0,0|2,0,0]=4 8317 B11R0.111 CCC(C)NCCOCC(=O)O 50f2d53ff5621af2a8a303b68dc25efb [0,2,0,0,0,0|1,0,0]=3 8318 B11R0.111 CCC(C)NCCSCC(=O)O d4d854c993c6a7e1461f6f1bf5997866 [0,2,0,0,0,0|1,0,0]=3 8319 B11R0.111 CCC(C)OCCC#CC(=O)O 5d00880ed7c7e7ee89b5219d541746b2 [0,2,0,0,0,0|0,0,2]=4 8320 B11R0.111 CCC(C)OCCCCC(=O)C 5ca45f38f33b35896604f0ab32498337 [0,2,0,0,0,0|1,0,0]=3 8321 B11R0.111 CCC(C)OCCCCC(=O)N a3333d9aaa6a2be7aa14510d4132984f [0,2,0,0,0,0|1,0,0]=3 8322 B11R0.111 CCC(C)OCCCCC(=O)O 719924b88b0deb49fa59be4ee32bc9b0 [0,2,0,0,0,0|0,0,0]=2 8323 B11R0.111 CCC(C)OCCCC[N+](=O)[O-] af45bb8a5d6b1cdb087c20d138c984bd [0,2,0,0,0,0|1,0,1]=4 8324 B11R0.111 CCC(C)OCCCNC(=O)C c41e1794e8949f4359c1f3e64352f5ab [0,2,0,0,0,0|2,0,0]=4 8325 B11R0.111 CCC(C)OCCCOC(=O)C bcb20af4b92874cb2fffea6981a17459 [0,2,0,0,0,0|2,0,0]=4 8326 B11R0.111 CCC(C)OCCCSC(=O)C d24098b781058065e62f3af987deb542 [0,2,0,0,0,0|2,0,0]=4 8327 B11R0.111 CCC(C)OCCOCC(=O)N faed9fb6b3776633a6f7be674254edb4 [0,2,0,0,0,0|2,0,0]=4 8328 B11R0.111 CCC(C)OCCOCC(=O)O b60fb6d62737a9750b5d090dbc2e6de4 [0,2,0,0,0,0|1,0,0]=3 8329 B11R0.111 CCC(C)OCCSCC(=O)N 6c1c2759682348338d5f3ab2f886cb0d [0,2,0,0,0,0|2,0,0]=4 8330 B11R0.111 CCC(O)CNC/C=C/C(=O)O 8aeb611295105d615ce56505960fdf7a [0,2,0,0,0,0|0,0,2]=4 8331 B11R0.111 CCC(O)CNCC#CC(=O)O a914f55d2769084b067d43184c1f9691 [0,2,0,0,0,0|0,0,2]=4 8332 B11R0.111 CCC(O)CNCC=CC(=O)O 3ef5cb0e7045d0f90786f1bb803a8b76 [0,2,0,0,0,0|0,0,2]=4 8333 B11R0.111 CCC(O)CNCCCC(=O)C eac8eda898d508c8f6b368c71231fbab [0,2,0,0,0,0|1,0,0]=3 8334 B11R0.111 CCC(O)CNCCCC(=O)N ba9d4d47022f49f563c2c42f84542fa6 [0,2,0,0,0,0|1,0,0]=3 8335 B11R0.111 CCC(O)CNCCCC(=O)O 4758614ea6560ee12ecbdf67b15a3ea9 [0,2,0,0,0,0|0,0,0]=2 8336 B11R0.111 CCC(O)CNCCCC(C)O 429c49dca27f44febb276988f6f1ff8d [0,2,0,0,0,0|1,0,1]=4 8337 B11R0.111 CCC(O)CNCCCS(=O)C b09da539a4684538c4fb7b8eab88ffd0 [0,2,0,0,0,0|2,0,0]=4 8338 B11R0.111 CCC(O)CNCCC[N+](=O)[O-] 94fc29e21f35453801e3c3fd9bf75b26 [0,2,0,0,0,0|1,0,1]=4 8339 B11R0.111 CCC(O)CNCCNC(=O)C 89ca27fbb3238ed86e5593c0f5a92117 [0,2,0,0,0,0|2,0,0]=4 8340 B11R0.111 CCC(O)CNCCNC(=O)N 5dc8cc269bafa207173b0a064ac1e117 [0,2,0,0,0,0|2,0,0]=4 8341 B11R0.111 CCC(O)CNCCOC(=O)C 769fbc852e976902a4f10478f86d94c1 [0,2,0,0,0,0|2,0,0]=4 8342 B11R0.111 CCC(O)CNCCSC(=O)C 7b80b7fd232537ec34e113bc1bb24534 [0,2,0,0,0,0|2,0,0]=4 8343 B11R0.111 CCC(S)CCOCCC(=O)C a50cd37116b3d3a4898e11cabe8e86d0 [0,2,0,0,0,0|1,0,0]=3 8344 B11R0.111 CCC(S)CCOCCC(=O)N 53687be8581a3c2ed6abd6f40ab6a91e [0,2,0,0,0,0|1,0,0]=3 8345 B11R0.111 CCC(S)CCOCCC(=O)O 17852c227724ccb40abd0882458ac146 [0,2,0,0,0,0|0,0,0]=2 8346 B11R0.111 CCC(S)CCOCCS(=O)C b4c610e633a0af4b9320091ceddac9a1 [0,2,0,0,0,0|2,0,0]=4 8347 B11R0.111 CCC(S)CCOCOC(=O)C 9e24b3cd70f0279504d86365d637175e [0,2,0,0,0,0|2,0,0]=4 8348 B11R0.111 CCC(S)CCOCSC(=O)N 36f2ddc17066b3b1eadb66c2b61fda8a [0,2,0,0,0,0|2,0,0]=4 8349 B11R0.111 CCN(C)CCCCCC(=O)C 604ef90374a73c56da1cb19d40b7efb5 [0,2,0,0,0,0|1,0,0]=3 8350 B11R0.111 CCN(C)CCCCCC(=O)N 5c2c6734f1cfe400c769a02d4b9cb061 [0,2,0,0,0,0|1,0,0]=3 8351 B11R0.111 CCN(C)CCCCOC(=O)C e0b9963118727d12f4db42b357402cdc [0,2,0,0,0,0|2,0,0]=4 8352 B11R0.111 CCN(C)CCCCSC(=O)C ca3ccdd677ea809cd88957b2e1bc0d33 [0,2,0,0,0,0|2,0,0]=4 8353 B11R0.111 CCN(C)CCCNCC(=O)N 9fa94a40c1fd264e5135e1c27d6abc69 [0,2,0,0,0,0|2,0,0]=4 8354 B11R0.111 CCN(C)CCCNCC(=O)O d7be00b7d403e390b1ba45600abbd35a [0,2,0,0,0,0|1,0,0]=3 8355 B11R0.111 CCN(C)CCCOCC(=O)N 1da69ddec0088e0bf3b9b63f9531af23 [0,2,0,0,0,0|2,0,0]=4 8356 B11R0.111 CCN(C)CCCOCC(=O)O 96a7f38d6edda2d9492f68ee5ca2c291 [0,2,0,0,0,0|1,0,0]=3 8357 B11R0.111 CCN(C)CCOCCC(=O)O 3ee5dbeb152429c7949da1d6bdfdfe35 [0,2,0,0,0,0|1,0,0]=3 8358 B11R0.111 CCS(=O)CCNCCC(=O)N 83205526c4ca910298965caff082804a [0,2,0,0,0,0|2,0,0]=4 8359 B11R0.111 CCS(=O)CCNCCS(=O)O 43c518e4d97a77e2d7dff0f022207291 [0,2,0,0,0,0|2,0,0]=4 8360 B11R0.111 CCS(=O)CCOCCC(=O)N caf5f0d7071dbf5ff5308b9244d00045 [0,2,0,0,0,0|2,0,0]=4 8361 B11R0.111 CCS(=O)CCOCCC(=O)O dcd6dcf593e3282c8bd4dbbecfdb300f [0,2,0,0,0,0|1,0,0]=3 8362 B11R0.111 CC[C@@H](C)CNC/C=C/C(=O)O 66653f72f10f472206fb8f1215740f20 [0,2,0,0,0,0|0,0,2]=4 8363 B11R0.111 CC[C@@H](C)CNCC#CC(=O)O 0da715f11cd5392ccba55e94d9cbf1ce [0,2,0,0,0,0|0,0,2]=4 8364 B11R0.111 CC[C@@H](C)CNCC=CC(=O)O 4283fc0eb6b53923260f32bffcc3e900 [0,2,0,0,0,0|0,0,2]=4 8365 B11R0.111 CC[C@@H](C)CNCCCC(=O)N 92daced6dd5149bc577c0c01397c6869 [0,2,0,0,0,0|1,0,0]=3 8366 B11R0.111 CC[C@@H](C)CNCCCC(=O)O cbbb4833d76c35ba1c919a574dc3e7a6 [0,2,0,0,0,0|0,0,0]=2 8367 B11R0.111 CC[C@@H](C)CNCCCS(=O)C 063416628572cfa4499dd921f404c230 [0,2,0,0,0,0|2,0,0]=4 8368 B11R0.111 CC[C@@H](C)CNCCNC(=O)C 8ff711bda03cad66a043b0cdd9d0ced1 [0,2,0,0,0,0|2,0,0]=4 8369 B11R0.111 CC[C@@H](C)COC/C=C/C(=O)O 098ee90133b1ace28eda75551862d410 [0,2,0,0,0,0|0,0,2]=4 8370 B11R0.111 CC[C@@H](C)COCC#CC(=O)O 5a22f443bcf108ef809033097e07fe1a [0,2,0,0,0,0|0,0,2]=4 8371 B11R0.111 CC[C@@H](C)COCC=CC(=O)O c315ff68d7e1ea1c6186424e615c29d4 [0,2,0,0,0,0|0,0,2]=4 8372 B11R0.111 CC[C@@H](C)COCCCC(=O)C f31c8875342916c0b22c9342f8ed5ccb [0,2,0,0,0,0|1,0,0]=3 8373 B11R0.111 CC[C@@H](C)COCCCC(=O)N c9db34c2aaaa851e82057b91ab49630b [0,2,0,0,0,0|1,0,0]=3 8374 B11R0.111 CC[C@@H](C)COCCC[N+](=O)[O-] 52df6cfa1659cef02f5502d058597380 [0,2,0,0,0,0|1,0,1]=4 8375 B11R0.111 CC[C@@H](C)COCCNC(=O)C d8bb1d93e8bc95f4ad1b22906e2a38f9 [0,2,0,0,0,0|2,0,0]=4 8376 B11R0.111 CC[C@@H](C)COCCNC(=O)N c859eff943c245d674c2ceae2d488b38 [0,2,0,0,0,0|2,0,0]=4 8377 B11R0.111 CC[C@@H](C)COCCOC(=O)C 96886d8939b8a1b791b91dd2346237bf [0,2,0,0,0,0|2,0,0]=4 8378 B11R0.111 CC[C@@H](C)COCCSC(=O)C 63a6849fd86e7b481b0a365915a33641 [0,2,0,0,0,0|2,0,0]=4 8379 B11R0.111 CC[C@@H](C)NCCCCC(=O)C cf1b65646c3f009f63ff2433ce8b1c45 [0,2,0,0,0,0|1,0,0]=3 8380 B11R0.111 CC[C@@H](C)NCCCCC(=O)N 3fb464e670b5561a99a33c60a0ab5cc3 [0,2,0,0,0,0|1,0,0]=3 8381 B11R0.111 CC[C@@H](C)NCCCCC(C)O 53644b3fd2cc6318ae659bc854603986 [0,2,0,0,0,0|1,0,1]=4 8382 B11R0.111 CC[C@@H](C)NCCCC[C@@H](C)O d57754c5f40699af431389b8b4f2c0c5 [0,2,0,0,0,0|1,0,1]=4 8383 B11R0.111 CC[C@@H](C)NCCCNC(=O)C d2fcbbe57cb6032a644c5d2901067ac5 [0,2,0,0,0,0|2,0,0]=4 8384 B11R0.111 CC[C@@H](C)NCCCOC(=O)C b47e1c76c4b9a112de07b7d7224ae2b7 [0,2,0,0,0,0|2,0,0]=4 8385 B11R0.111 CC[C@@H](C)NCCCSC(=O)C 44098e22bfdc5669be30f30480f90494 [0,2,0,0,0,0|2,0,0]=4 8386 B11R0.111 CC[C@@H](C)NCCOCC(=O)N ea53d8cb7de126193105fd0530ad4028 [0,2,0,0,0,0|2,0,0]=4 8387 B11R0.111 CC[C@@H](C)NCCOCC(=O)O e8ec695ecdf48b9a4e5d5801fec5100b [0,2,0,0,0,0|1,0,0]=3 8388 B11R0.111 CC[C@@H](C)OCCCCC(=O)C 290ecae0017a8c9119dbb791b17e3beb [0,2,0,0,0,0|1,0,0]=3 8389 B11R0.111 CC[C@@H](C)OCCCCC(=O)N fa09aed991b1329e5bfe912a13a024ee [0,2,0,0,0,0|1,0,0]=3 8390 B11R0.111 CC[C@@H](C)OCCCNC(=O)C 2dcbefe9d73a0f00ab2adadcfaaea226 [0,2,0,0,0,0|2,0,0]=4 8391 B11R0.111 CC[C@@H](C)OCCCOC(=O)C 78f0553237aab4f16209eca3510f9875 [0,2,0,0,0,0|2,0,0]=4 8392 B11R0.111 CC[C@@H](C)OCCCSC(=O)C 1c82fd80e8c7e507a64e4e295dfc5131 [0,2,0,0,0,0|2,0,0]=4 8393 B11R0.111 CC[C@@H](C)OCCOCC(=O)N 08d5e5f77cffc1f94817fd134606efcc [0,2,0,0,0,0|2,0,0]=4 8394 B11R0.111 CC[C@@H](C)OCCOCC(=O)O c5de35459fe1c14b7d3415b8f134eb6c [0,2,0,0,0,0|1,0,0]=3 8395 B11R0.111 CC[C@@H](O)CNC/C=C/C(=O)O b97d306281929e83a4cf68b00053347d [0,2,0,0,0,0|0,0,2]=4 8396 B11R0.111 CC[C@@H](O)CNCC=CC(=O)O da1ffd5e72cd7b8fe264fb6cef92a991 [0,2,0,0,0,0|0,0,2]=4 8397 B11R0.111 CC[C@@H](O)CNCCCC(=O)C 8ecd865ddd5c979275e954e008c480a1 [0,2,0,0,0,0|1,0,0]=3 8398 B11R0.111 CC[C@@H](O)CNCCCC(=O)N 090502c9e820d15050bae9a77455ad3c [0,2,0,0,0,0|1,0,0]=3 8399 B11R0.111 CC[C@@H](O)CNCCCC(=O)O f623457a926912731522f7071f5ddda7 [0,2,0,0,0,0|0,0,0]=2 8400 B11R0.111 CC[C@@H](O)CNCCCC(C)O e167fd8c4edcdbe0219a8a0720733332 [0,2,0,0,0,0|1,0,1]=4 8401 B11R0.111 CC[C@@H](O)CNCCC[N+](=O)[O-] be1c4a4b1da24c171d1d63d582fcc6ec [0,2,0,0,0,0|1,0,1]=4 8402 B11R0.111 CC[C@@H](O)CNCCNC(=O)C 8cf3fc09d99b1af58c9098fabc9048b6 [0,2,0,0,0,0|2,0,0]=4 8403 B11R0.111 CC[C@@H](O)CNCCNC(=O)N f094cc642b844b977d6bc956e0f59c0c [0,2,0,0,0,0|2,0,0]=4 8404 B11R0.111 CC[C@@H](O)CNCCOC(=O)C 3d528abb89f4a18f284731db025ff137 [0,2,0,0,0,0|2,0,0]=4 8405 B11R0.111 CC[C@@H](O)CNCCSC(=O)C 86197fe402ecea8395d2997e8274e31e [0,2,0,0,0,0|2,0,0]=4 8406 B11R0.111 CC[C@H](C)CCCOCC(=O)N b568e5a9f8665ddcffb4e14bc9b2d3a7 [0,2,0,0,0,0|1,0,0]=3 8407 B11R0.111 CC[C@H](C)CCCOCC(=O)O 650fab3a57b034a98a3481ab37720e3e [0,2,0,0,0,0|0,0,0]=2 8408 B11R0.111 CC[C@H](C)CCCOC[N+](=O)[O-] 4a8e06fcb1bac75d3bb109c9827a326c [0,2,0,0,0,0|1,0,1]=4 8409 B11R0.111 CC[C@H](C)CCOCCC(=O)C 4be2d65df695f9a7bbadc6bc6a9257ee [0,2,0,0,0,0|1,0,0]=3 8410 B11R0.111 CC[C@H](C)CCOCCC(=O)N 57d3b53410b7100a9ff86f97e7d8eb63 [0,2,0,0,0,0|1,0,0]=3 8411 B11R0.111 CC[C@H](C)CCOCCC(=O)O b62c105d7bb109321d0f567dcae2cb8b [0,2,0,0,0,0|0,0,0]=2 8412 B11R0.111 CC[C@H](C)CCOCCS(=O)C 08f379cce4388de175dfd178c60adbe5 [0,2,0,0,0,0|2,0,0]=4 8413 B11R0.111 CC[C@H](C)CCOCOC(=O)C 198354d85310c24c93f62847ece42d8a [0,2,0,0,0,0|2,0,0]=4 8414 B11R0.111 CC[C@H](C)CCOCSC(=O)N 02eccf503375fc214e0670c3bb649589 [0,2,0,0,0,0|2,0,0]=4 8415 B11R0.111 CC[C@H](C)CNC/C=C/C(=O)O 3b22511fcc3bde06b8edcbb00ae18cd0 [0,2,0,0,0,0|0,0,2]=4 8416 B11R0.111 CC[C@H](C)CNCC#CC(=O)O 1cfe8ea8fbd5887d5cb24430726f24aa [0,2,0,0,0,0|0,0,2]=4 8417 B11R0.111 CC[C@H](C)CNCC=CC(=O)O 274e1879bf1bf0e64414aa40a266cab9 [0,2,0,0,0,0|0,0,2]=4 8418 B11R0.111 CC[C@H](C)CNCCCC(=O)C 23900becd103c16de6f557f5fce812fc [0,2,0,0,0,0|1,0,0]=3 8419 B11R0.111 CC[C@H](C)CNCCCC(=O)N 998ceb7760d20ddd71941a726e58d834 [0,2,0,0,0,0|1,0,0]=3 8420 B11R0.111 CC[C@H](C)CNCCCC(=O)O 581363f28c8dee1645a4a70b50ddfe0e [0,2,0,0,0,0|0,0,0]=2 8421 B11R0.111 CC[C@H](C)CNCCCC(C)O 9f14a9c6b95940309c486882010a5bcd [0,2,0,0,0,0|1,0,1]=4 8422 B11R0.111 CC[C@H](C)CNCCCS(=O)C 23ae8abe58c58bbc6bc140dab2d9cbb1 [0,2,0,0,0,0|2,0,0]=4 8423 B11R0.111 CC[C@H](C)CNCCC[N+](=O)[O-] c940d58615520b256aa1d613c8d0cbb2 [0,2,0,0,0,0|1,0,1]=4 8424 B11R0.111 CC[C@H](C)CNCCNC(=O)C e044f7d306f12c1763c678f0698de7af [0,2,0,0,0,0|2,0,0]=4 8425 B11R0.111 CC[C@H](C)CNCCNC(=O)N 1483e2555a07bd441c7506ad87fde2ee [0,2,0,0,0,0|2,0,0]=4 8426 B11R0.111 CC[C@H](C)CNCCOC(=O)C b0bd54781a1b96427e1545cdb90b9f3f [0,2,0,0,0,0|2,0,0]=4 8427 B11R0.111 CC[C@H](C)CNCCSC(=O)C e2f2e1d0ea10510138476c4e3b1dfa81 [0,2,0,0,0,0|2,0,0]=4 8428 B11R0.111 CC[C@H](C)COC/C=C/C(=O)O c70fa5f6d8f9632923a898fea1c1ed11 [0,2,0,0,0,0|0,0,2]=4 8429 B11R0.111 CC[C@H](C)COCC#CC(=O)O 7c7282d276ac05d7d5f98097ebc4ca65 [0,2,0,0,0,0|0,0,2]=4 8430 B11R0.111 CC[C@H](C)COCC=CC(=O)O fa72e408e4268cb94fdc21f1e4932e24 [0,2,0,0,0,0|0,0,2]=4 8431 B11R0.111 CC[C@H](C)COCCCC(=O)C 2dedac0b35748e7822e92fa08994d1ae [0,2,0,0,0,0|1,0,0]=3 8432 B11R0.111 CC[C@H](C)COCCCC(=O)N cf36cc6d07ac7d1af936ad4900c33ac5 [0,2,0,0,0,0|1,0,0]=3 8433 B11R0.111 CC[C@H](C)COCCC[N+](=O)[O-] 6822a0d5dda7011a47a0c0308e178e01 [0,2,0,0,0,0|1,0,1]=4 8434 B11R0.111 CC[C@H](C)COCCNC(=O)C a2f06d568690ed92fc134fb5f2f4530f [0,2,0,0,0,0|2,0,0]=4 8435 B11R0.111 CC[C@H](C)COCCNC(=O)N ea85ca71ca98c9e7696e93fa951d0e64 [0,2,0,0,0,0|2,0,0]=4 8436 B11R0.111 CC[C@H](C)COCCOC(=O)C baa9d4d57ae4ff0494070b844bf9f9f6 [0,2,0,0,0,0|2,0,0]=4 8437 B11R0.111 CC[C@H](C)COCCSC(=O)C 1fcb2360473dcda4c6efcda6327f8a0c [0,2,0,0,0,0|2,0,0]=4 8438 B11R0.111 CC[C@H](C)NCCCCC(=O)C 68e2c9be04a963688b66c0d8963a2b31 [0,2,0,0,0,0|1,0,0]=3 8439 B11R0.111 CC[C@H](C)NCCCCC(=O)N 50b090b223d574692141806c663df325 [0,2,0,0,0,0|1,0,0]=3 8440 B11R0.111 CC[C@H](C)NCCCCC(C)O 5f5fcaac05780c67c10df853b13d194b [0,2,0,0,0,0|1,0,1]=4 8441 B11R0.111 CC[C@H](C)NCCCC[C@@H](C)O 23f573b65ffc96f7499bd11a86593951 [0,2,0,0,0,0|1,0,1]=4 8442 B11R0.111 CC[C@H](C)NCCCNC(=O)C 1fb0ebdc925f62d4d6c68a92c8150f98 [0,2,0,0,0,0|2,0,0]=4 8443 B11R0.111 CC[C@H](C)NCCCOC(=O)C a7d22fb6e3bcbd7d61ddb13dcfbaf926 [0,2,0,0,0,0|2,0,0]=4 8444 B11R0.111 CC[C@H](C)NCCCSC(=O)C 6ac8fded1707208f9371a6acf65b0d57 [0,2,0,0,0,0|2,0,0]=4 8445 B11R0.111 CC[C@H](C)NCCOCC(=O)N a401788c3d6cdebd041be64679bf30c7 [0,2,0,0,0,0|2,0,0]=4 8446 B11R0.111 CC[C@H](C)NCCOCC(=O)O edb73c59843fa3d36d0e0f0e5c7edd28 [0,2,0,0,0,0|1,0,0]=3 8447 B11R0.111 CC[C@H](C)OCCCCC(=O)C e4870a2bb84c10c8d0c5c1fa6771732f [0,2,0,0,0,0|1,0,0]=3 8448 B11R0.111 CC[C@H](C)OCCCCC(=O)N 8af9c4986bc0391d899d393c47a22073 [0,2,0,0,0,0|1,0,0]=3 8449 B11R0.111 CC[C@H](C)OCCCNC(=O)C d7cc9826d0f85b771e5972710568fd3a [0,2,0,0,0,0|2,0,0]=4 8450 B11R0.111 CC[C@H](C)OCCCOC(=O)C b1b5df571d2c6c19a92dad6f74531cee [0,2,0,0,0,0|2,0,0]=4 8451 B11R0.111 CC[C@H](C)OCCCSC(=O)C 7717c3b182e226326f204107451022bb [0,2,0,0,0,0|2,0,0]=4 8452 B11R0.111 CC[C@H](C)OCCOCC(=O)N 26c7b0eaa7e1c2a1a3e76480b41d0ca1 [0,2,0,0,0,0|2,0,0]=4 8453 B11R0.111 CC[C@H](C)OCCOCC(=O)O 9b120d3f71a25818bcf413a0a70c93ca [0,2,0,0,0,0|1,0,0]=3 8454 B11R0.111 CN(C#N)CCOCCC(=O)O 784f336d2df8549ae469a998592a7256 [0,2,0,0,0,0|2,0,0]=4 8455 B11R0.111 CN(C)CCCCNC(=O)CO b7a68fa745e197c19223afcb28cc0b50 [0,2,0,0,0,0|2,0,0]=4 8456 B11R0.111 CN(C)CCCNCC(=O)CO 7cb12bf28b14e11379ec6065b5535c3f [0,2,0,0,0,0|2,0,0]=4 8457 B11R0.111 CN(C)CCCNCC(=O)NO 450d05402d93708a0df7599dc18c7e50 [0,2,0,0,0,0|2,0,0]=4 8458 B11R0.111 CN(C)CCNCCC(=O)NO 8da5e3469c664a0681ef32ec87a53a1d [0,2,0,0,0,0|2,0,0]=4 8459 B11R0.111 CN(C=O)CCOCCC(=O)O 7cc31df47739d9a36b9a96ed07c61470 [0,2,0,0,0,0|2,0,0]=4 8460 B11R0.111 CN(CF)CCOCCC(=O)O dc80eb12f587d6c36faaf020c95f41ff [0,2,0,0,0,0|2,0,0]=4 8461 B11R0.111 CN(CO)CCOCCC(=O)O 89bfa0abdb27d35b63c1b8aa19a30e61 [0,2,0,0,0,0|2,0,0]=4 8462 B11R0.111 CNC(=O)CCCNCC(=O)O 8a0857e93f01a14926ebecb5b5d3b7c1 [0,2,0,0,0,0|1,0,1]=4 8463 B11R0.111 CNC(=O)CCCNCC(C)C 17fb4ef30662d3651752c26dbff045d3 [0,2,0,0,0,0|2,0,0]=4 8464 B11R0.111 CNC(=O)CCCNCC(C)O d6d045f6f6ccc5c14b6570bdff8e99f8 [0,2,0,0,0,0|2,0,0]=4 8465 B11R0.111 CNC(=O)CCCNC[C@@H](C)O d5a8a0480ff94b723ef01f36a2ebc1af [0,2,0,0,0,0|2,0,0]=4 8466 B11R0.111 CNC(=O)CCCNC[C@H](C)O fc33900f8d2aae35a495fce98488386a [0,2,0,0,0,0|2,0,0]=4 8467 B11R0.111 CNC(=O)CCCOCC(=O)O 23bcc9c715e750431c9e23e705dd6b8f [0,2,0,0,0,0|1,0,1]=4 8468 B11R0.111 CNC(=O)CCCOCC(C)C 6a92831b29999890c0759ea566d3dccf [0,2,0,0,0,0|2,0,0]=4 8469 B11R0.111 CNC(=O)CCCOCC(C)F 276735f132be6d65d9c9074e7d84f54e [0,2,0,0,0,0|2,0,0]=4 8470 B11R0.111 CNC(=O)CCCOCC(C)S d6a90ff4d6573e23cdebcefe263c9282 [0,2,0,0,0,0|2,0,0]=4 8471 B11R0.111 CNC(=O)CCCOC[C@@H](C)F 623d9e8910e8b1134ad48947a21c4c1d [0,2,0,0,0,0|2,0,0]=4 8472 B11R0.111 CNC(=O)CCCOC[C@H](C)F 512665ddb0264cdd7d71c19c1ea3e8e7 [0,2,0,0,0,0|2,0,0]=4 8473 B11R0.111 CNC(=O)CCNCCC(=O)O 81d69568dc70d0505c4dfcdda3d06192 [0,2,0,0,0,0|1,0,1]=4 8474 B11R0.111 CNC(=O)CCNCCC(C)C 9d55f5eeffac79bd786bb14004079da7 [0,2,0,0,0,0|2,0,0]=4 8475 B11R0.111 CNC(=O)CCNCCC(C)O 504914b749a31abbadad44582c978eec [0,2,0,0,0,0|2,0,0]=4 8476 B11R0.111 CNC(=O)CCNCC[C@@H](C)O 9bb73162d0296f64c5493d8ba380ccdd [0,2,0,0,0,0|2,0,0]=4 8477 B11R0.111 CNC(=O)CCNCC[C@H](C)O 949f5e1928debddc0c1e5565e9a68633 [0,2,0,0,0,0|2,0,0]=4 8478 B11R0.111 CNC(=O)CCOCCC(=O)O b99c378872a526001bc5b76d7d4dc3c5 [0,2,0,0,0,0|1,0,1]=4 8479 B11R0.111 CNC(=O)CCOCCC(C)C 3512e45e1aafa21d71f11238b2e6a54a [0,2,0,0,0,0|2,0,0]=4 8480 B11R0.111 CNC(=O)CNCCCC(=O)O cc8f48260bea4264d34064d1f98e3d66 [0,2,0,0,0,0|1,0,1]=4 8481 B11R0.111 CNC(=O)CNCCCC(C)C 914251ee6d04fa9943da2593f0112265 [0,2,0,0,0,0|2,0,0]=4 8482 B11R0.111 CNC(=O)CNCCCC(C)O d7ba0941eeb27bcff9b658f0a0368a11 [0,2,0,0,0,0|2,0,0]=4 8483 B11R0.111 CNC(=O)COCCCC(C)C 19cd6fd652b5bd9d1638e2aa68e403dd [0,2,0,0,0,0|2,0,0]=4 8484 B11R0.111 COC(=O)CCCCNC(=O)C c4666b03a0e99765944ef4bd456b147a [0,2,0,0,0,0|1,0,1]=4 8485 B11R0.111 COC(=O)CCCCNC(C)C beda08c1d079e23b648a5e5484485920 [0,2,0,0,0,0|1,0,0]=3 8486 B11R0.111 COC(=O)CCCCOC(C)C 6c477cf35f18e5c85e3a4970288192ac [0,2,0,0,0,0|1,0,0]=3 8487 B11R0.111 COC(=O)CCCNCC(=O)C 1e20020951bb4f34aeba7718605876ba [0,2,0,0,0,0|1,0,1]=4 8488 B11R0.111 COC(=O)CCCNCC(=O)O d850ffb2534b453bf853ecfe69cc060b [0,2,0,0,0,0|1,0,1]=4 8489 B11R0.111 COC(=O)CCCNCC(C)C 5e67100bd69e03a24cc5b4fbb04f6ea3 [0,2,0,0,0,0|1,0,0]=3 8490 B11R0.111 COC(=O)CCCNCC(C)O 0d8d8237c62f94874c3f837145bd4d38 [0,2,0,0,0,0|1,0,0]=3 8491 B11R0.111 COC(=O)CCCNCC(F)F c19427a06888e43636c73fb3135a531d [0,2,0,0,0,0|2,0,0]=4 8492 B11R0.111 COC(=O)CCCNCN(C)C a3ceca72f8079ec0e254880e29fbafaa [0,2,0,0,0,0|2,0,0]=4 8493 B11R0.111 COC(=O)CCCNC[C@@H](C)O d0226e64972c8f0209f3bd1507216103 [0,2,0,0,0,0|1,0,0]=3 8494 B11R0.111 COC(=O)CCCNC[C@H](C)O 5d38daf8bdb9d1405dfe4d0f5c7ce511 [0,2,0,0,0,0|1,0,0]=3 8495 B11R0.111 COC(=O)CCCOCC(=O)C 4e954e6ab46c5013f79dd113d813b754 [0,2,0,0,0,0|1,0,1]=4 8496 B11R0.111 COC(=O)CCCOCC(=O)O 09765ce8ef59a6bb893de7b83e6969d3 [0,2,0,0,0,0|1,0,1]=4 8497 B11R0.111 COC(=O)CCCOCC(C)C da0ab2a2eb5a7d7593b57e56bc9a7a4d [0,2,0,0,0,0|1,0,0]=3 8498 B11R0.111 COC(=O)CCCOCC(C)F 0384faa71441c661816a188eaf89109d [0,2,0,0,0,0|1,0,0]=3 8499 B11R0.111 COC(=O)CCCOCC(C)S cd9ee67f30b2ddac45fd0cdfb7af51ec [0,2,0,0,0,0|1,0,0]=3 8500 B11R0.111 COC(=O)CCCOCC(F)F 94ed5f6c26a79b4e21d11cdec38746ab [0,2,0,0,0,0|2,0,0]=4 8501 B11R0.111 COC(=O)CCCOC[C@@H](C)F 66d9e6f6e42f9f7a1ae0d759163cbb92 [0,2,0,0,0,0|1,0,0]=3 8502 B11R0.111 COC(=O)CCCOC[C@H](C)F e9161594cead7501de0189b1154e1ca6 [0,2,0,0,0,0|1,0,0]=3 8503 B11R0.111 COC(=O)CCNCCC(=O)C 08b569988b0d407f0be9b8dc2813fbe6 [0,2,0,0,0,0|1,0,1]=4 8504 B11R0.111 COC(=O)CCNCCC(=O)O 04f3bd494b81726b638d3ad34128a834 [0,2,0,0,0,0|1,0,1]=4 8505 B11R0.111 COC(=O)CCNCCC(C)C 6539d24654e24c2bd7e060677574abc1 [0,2,0,0,0,0|1,0,0]=3 8506 B11R0.111 COC(=O)CCNCCC(C)O b5f443cd99dcbaf75e53fea9f42f8d66 [0,2,0,0,0,0|1,0,0]=3 8507 B11R0.111 COC(=O)CCNCCC(F)F 97e9b95cd3997c61fb62a6ff29bad058 [0,2,0,0,0,0|2,0,0]=4 8508 B11R0.111 COC(=O)CCNCCN(C)C f9e022244f4cde6a7970cb2cfb40fce3 [0,2,0,0,0,0|2,0,0]=4 8509 B11R0.111 COC(=O)CCNCCS(=O)C 7074a180909c731995525f4c1e036115 [0,2,0,0,0,0|2,0,0]=4 8510 B11R0.111 COC(=O)CCNCC[C@@H](C)O ca1d9a830b8e27c82a2085e3db57b644 [0,2,0,0,0,0|1,0,0]=3 8511 B11R0.111 COC(=O)CCNCC[C@H](C)O 4b2140454754da707b810b42a441d35a [0,2,0,0,0,0|1,0,0]=3 8512 B11R0.111 COC(=O)CCNCOC(C)C 1c0bc073a04c1ff8993556a96acba5df [0,2,0,0,0,0|2,0,0]=4 8513 B11R0.111 COC(=O)CCOCCC(=O)C 27753ec21d515762a32699694d87928d [0,2,0,0,0,0|1,0,1]=4 8514 B11R0.111 COC(=O)CCOCCC(=O)O a65dcf801bdf56519e451f707668f953 [0,2,0,0,0,0|1,0,1]=4 8515 B11R0.111 COC(=O)CCOCCC(C)C bf9c67a146327f82191c03b418e8ffa0 [0,2,0,0,0,0|1,0,0]=3 8516 B11R0.111 COC(=O)CCOCCC(F)F fb64cd34a672dc91e70b4a0c007072ac [0,2,0,0,0,0|2,0,0]=4 8517 B11R0.111 COC(=O)CCOCCN(C)C 7c4a101ec9cdd23a09216e65036b7382 [0,2,0,0,0,0|2,0,0]=4 8518 B11R0.111 COC(=O)CCOCCS(=O)C cdb5b472784bcbf0cc58f1a0d8d97cdd [0,2,0,0,0,0|2,0,0]=4 8519 B11R0.111 COC(=O)CCOCOC(C)C 9ca78ba11c033e0a051066cf07710c1e [0,2,0,0,0,0|2,0,0]=4 8520 B11R0.111 COC(=O)CNCCCC(=O)C 35c0d9caab46d2e0b712904085708bec [0,2,0,0,0,0|1,0,1]=4 8521 B11R0.111 COC(=O)CNCCCC(=O)O 8110207b8947649633dfe806d8d2e109 [0,2,0,0,0,0|1,0,1]=4 8522 B11R0.111 COC(=O)CNCCCC(C)C b9882d3a2d5dd6634f7d12528bd821ce [0,2,0,0,0,0|1,0,0]=3 8523 B11R0.111 COC(=O)CNCCCC(C)O e12af7d35dfa6838772e5c0dfa273ce7 [0,2,0,0,0,0|1,0,0]=3 8524 B11R0.111 COC(=O)CNCCCN(C)C 2e00863fec5e8425275f326377dfae6c [0,2,0,0,0,0|2,0,0]=4 8525 B11R0.111 COC(=O)CNCCCS(=O)C 6c43341c65260c74de914c4e74ef9ea3 [0,2,0,0,0,0|2,0,0]=4 8526 B11R0.111 COC(=O)CNCCOC(C)C 0a57193747b30093b51fdaee41b3bb81 [0,2,0,0,0,0|2,0,0]=4 8527 B11R0.111 COC(=O)CNCCSC(C)C 683072f536835c00930c10dcee8d0d83 [0,2,0,0,0,0|2,0,0]=4 8528 B11R0.111 COC(=O)COCCCC(=O)C 8932f65dae03ccc0a2fc86d87ddf7913 [0,2,0,0,0,0|1,0,1]=4 8529 B11R0.111 COC(=O)COCCCC(C)C b67746af44a07ea56d6cff22aea1b7b7 [0,2,0,0,0,0|1,0,0]=3 8530 B11R0.111 COC(=O)COCCCN(C)C 74a6ffdc1b0d2118daa911e5545e41b0 [0,2,0,0,0,0|2,0,0]=4 8531 B11R0.111 COC(=O)COCCOC(C)C 9a2b3ea989cd8bd12c965ea81c92770e [0,2,0,0,0,0|2,0,0]=4 8532 B11R0.111 COC(=O)COCCSC(C)C 1dbcec1c975ae41d8bbf6d3c398661e4 [0,2,0,0,0,0|2,0,0]=4 8533 B11R0.111 COC(=O)OCCOCC(C)C c059a298038ebd805d1fbcd46b77f963 [0,2,0,0,0,0|2,0,0]=4 8534 B11R0.111 COC(=O)OCNCCC(C)C afbfab069f26aebc5dadfe3afe6ca70e [0,2,0,0,0,0|2,0,0]=4 8535 B11R0.111 COC(=O)OCNCCC(C)O 93ed9cd7c4dc96cf7a0cae998cccaf83 [0,2,0,0,0,0|2,0,0]=4 8536 B11R0.111 COC(=O)OCNCC[C@@H](C)O 098f810ee0dc57270fd0c04bbf74b980 [0,2,0,0,0,0|2,0,0]=4 8537 B11R0.111 COC(=O)OCNCC[C@H](C)O 44fe14312fae9b263469c03d28c6a2d8 [0,2,0,0,0,0|2,0,0]=4 8538 B11R0.111 COC(=O)OCOCCC(C)C 2fa9d1da67245f659fde69a4176bfc23 [0,2,0,0,0,0|2,0,0]=4 8539 B11R0.111 COC(C)CCOCCC(=O)C 5f8ba7a097195892bf617489ca6ec044 [0,2,0,0,0,0|2,0,0]=4 8540 B11R0.111 COC(C)CCOCCC(=O)N a35a943302b2f20ad5bc914305d3d0bd [0,2,0,0,0,0|2,0,0]=4 8541 B11R0.111 COC(C)CCOCCC(=O)O cf4a524fbb43acdb0b4782442b0967bf [0,2,0,0,0,0|1,0,0]=3 8542 B11R0.111 COC(C)CNCCCC(=O)N da932cb4bfcd22353a87bd6d16526398 [0,2,0,0,0,0|2,0,0]=4 8543 B11R0.111 COC(C)CNCCCC(=O)O 7e0486e4221946dc9a8e8479295687cf [0,2,0,0,0,0|1,0,0]=3 8544 B11R0.111 COC(C)COCCCC(=O)C 2cc845232a0b2e2b1d1c3a9a1c05c398 [0,2,0,0,0,0|2,0,0]=4 8545 B11R0.111 COC(C)COCCCC(=O)N d95322d001c87479cee1e7f1b71e21d1 [0,2,0,0,0,0|2,0,0]=4 8546 B11R0.111 CO[C@@H](C)CNCCCC(=O)C 9e1d47a91f82bfd068a2ae1e1e3ce509 [0,2,0,0,0,0|2,0,0]=4 8547 B11R0.111 CO[C@@H](C)CNCCCC(=O)N b2b7e80a0a31e1bf9808a154ed83a621 [0,2,0,0,0,0|2,0,0]=4 8548 B11R0.111 CO[C@@H](C)CNCCCC(=O)O f7c194a5fd4c216d415142be70b79dfa [0,2,0,0,0,0|1,0,0]=3 8549 B11R0.111 CO[C@@H](C)COCCCC(=O)C 2a614ea303da6e6494132c629af00cb6 [0,2,0,0,0,0|2,0,0]=4 8550 B11R0.111 CO[C@@H](C)COCCCC(=O)N a2cd71965349106547a526cb9318052f [0,2,0,0,0,0|2,0,0]=4 8551 B11R0.111 CO[C@H](C)CNCCCC(=O)C 436a2125594889d1cc2d9b0b8712963c [0,2,0,0,0,0|2,0,0]=4 8552 B11R0.111 CO[C@H](C)CNCCCC(=O)N 10cc32a3b5252167585a75ff95720a3e [0,2,0,0,0,0|2,0,0]=4 8553 B11R0.111 CO[C@H](C)CNCCCC(=O)O 7bd656bf652c6999e3b6b84821ee234f [0,2,0,0,0,0|1,0,0]=3 8554 B11R0.111 CO[C@H](C)COCCCC(=O)C 93615146c150a21dba9f4fe8a570bc97 [0,2,0,0,0,0|2,0,0]=4 8555 B11R0.111 CO[C@H](C)COCCCC(=O)N 80ec33f487e4daf5ff931b87b71730cf [0,2,0,0,0,0|2,0,0]=4 8556 B11R0.111 CS(=O)CCCNCC(=O)CO 071ea00dce05f4cb6d1fe79cdf9f6134 [0,2,0,0,0,0|2,0,0]=4 8557 B11R0.111 CS(=O)CCNCCC(=O)NO 129d69c182a88f84eadad8b708a134ce [0,2,0,0,0,0|2,0,0]=4 8558 B11R0.111 C[C@@H](CO)CCNCCC(=O)N d7194311f202079e48701df728a4357d [0,2,0,0,0,0|2,0,0]=4 8559 B11R0.111 C[C@@H](CO)CCNCCC(=O)O 30a375361b9f4af6db8d2a9012d9a68f [0,2,0,0,0,0|1,0,0]=3 8560 B11R0.111 C[C@@H](CO)CNCCCC(=O)N 5731b9f3bf2b9f36393cbe421bb9f7e1 [0,2,0,0,0,0|2,0,0]=4 8561 B11R0.111 C[C@@H](CO)CNCCCC(=O)O 495a53f1c00368528d8892b9ab51f372 [0,2,0,0,0,0|1,0,0]=3 8562 B11R0.111 C[C@@H](CO)NCCCCC(=O)N 3ba86e323d3fcc63768659e7788f8cd7 [0,2,0,0,0,0|2,0,0]=4 8563 B11R0.111 C[C@@H](CO)NCCCCC(=O)O 79c29743d7d4ad51d55419e583527ba4 [0,2,0,0,0,0|1,0,0]=3 8564 B11R0.111 C[C@@H](CO)NCCOCC(=O)O 5b02d07edb72ea8520d5615753ca59fa [0,2,0,0,0,0|2,0,0]=4 8565 B11R0.111 C[C@@H](CO)NCCSCC(=O)O 2ed37d9c09f638c57c8c8af8c2f4a7d1 [0,2,0,0,0,0|2,0,0]=4 8566 B11R0.111 C[C@H](C=O)NCCCCC(=O)N 2a706e645f41cc6dfff63adcca0215c9 [0,2,0,0,0,0|2,0,0]=4 8567 B11R0.111 C[C@H](C=O)NCCCCC(=O)O 74c777713205aba69e6ac82d0f977dbf [0,2,0,0,0,0|1,0,0]=3 8568 B11R0.111 C[C@H](C=O)NCCOCC(=O)O a7e58f99275ed4f971eef1e7936f0153 [0,2,0,0,0,0|2,0,0]=4 8569 B11R0.111 C[C@H](C=O)NCCSCC(=O)O baf8942eb1929739fa347ffe9cb0703f [0,2,0,0,0,0|2,0,0]=4 8570 B11R0.111 C[C@H](C=O)OCCCCC(=O)N 686e20cc555ceed3baccf1d3dfaaa1f9 [0,2,0,0,0,0|2,0,0]=4 8571 B11R0.111 C[C@H](C=O)OCCCCC(=O)O 2f9e844b1b93833f94223244705c8a50 [0,2,0,0,0,0|1,0,0]=3 8572 B11R0.111 C[C@H](C=O)OCCOCC(=O)O 3018d042071243a6c72184c4b51b2295 [0,2,0,0,0,0|2,0,0]=4 8573 B11R0.111 C[C@H](CO)CNCCCC(=O)N 97c843fb761e8f2091706ffdc9f4d31e [0,2,0,0,0,0|2,0,0]=4 8574 B11R0.111 C[C@H](CO)CNCCCC(=O)O 1a3e02c5e0e49b1c6153afee32ab4d8d [0,2,0,0,0,0|1,0,0]=3 8575 B11R0.111 C[C@H](CO)NCCCCC(=O)N 9430e1a8a07f926fba3ff9b0900d8c76 [0,2,0,0,0,0|2,0,0]=4 8576 B11R0.111 C[C@H](CO)NCCCCC(=O)O e63c72f49e346371737a769985b09cc7 [0,2,0,0,0,0|1,0,0]=3 8577 B11R0.111 C[C@H](CO)NCCOCC(=O)O d1dbb1bef6e77cfe6993ae05f77d3e51 [0,2,0,0,0,0|2,0,0]=4 8578 B11R0.111 C[C@H](CO)NCCSCC(=O)O f8c21fd55625924ae5e085f8d9192624 [0,2,0,0,0,0|2,0,0]=4 8579 B11R0.111 C[C@H](CS)OCCCCC(=O)N e7d3d8823abd61174b78fd7da7df1e59 [0,2,0,0,0,0|2,0,0]=4 8580 B11R0.111 C[C@H](CS)OCCOCC(=O)O 6107fefd918af1cc9d7a6ffe675b4a8b [0,2,0,0,0,0|2,0,0]=4 8581 B11R0.111 NC(=O)CCCNCC(Br)CBr bb13f49ef809f845bb1e10144e91ae90 [0,2,0,0,0,0|2,0,0]=4 8582 B11R0.111 NC(=O)CCCNCC(F)CO 6489462d38d33e394e146f2285a3f685 [0,2,0,0,0,0|2,0,0]=4 8583 B11R0.111 NC(=O)CCCNCC(O)CF 3e892b946bcbcd0333b5fa062b2ed320 [0,2,0,0,0,0|2,0,0]=4 8584 B11R0.111 NC(=O)CCCNCC(O)CO 5ff0fa41d03391e5033487a2c1dbf04e [0,2,0,0,0,0|2,0,0]=4 8585 B11R0.111 NC(=O)CCCNC[C@@H](F)CO 6b4ff405d1fa09d24a69018ebb95e651 [0,2,0,0,0,0|2,0,0]=4 8586 B11R0.111 NC(=O)CCCNC[C@@H](O)CO 6f13c900512087ee7e4029b40084bc73 [0,2,0,0,0,0|2,0,0]=4 8587 B11R0.111 NC(=O)CCCNC[C@H](F)CO 0c268dbfbc124c2ec1f2c6eefa3da22e [0,2,0,0,0,0|2,0,0]=4 8588 B11R0.111 NC(=O)CCCNC[C@H](O)CO 6ae3f64173731d56c434c612c504ac76 [0,2,0,0,0,0|2,0,0]=4 8589 B11R0.111 NC(=O)CCCOCC(Br)CBr 34d874265b7cefd684c56380b8511e5c [0,2,0,0,0,0|2,0,0]=4 8590 B11R0.111 NC(=O)CCCOCC(Cl)CCl 884b1f4b04b914eb8d362aac72723a1b [0,2,0,0,0,0|2,0,0]=4 8591 B11R0.111 NC(=O)CCCOCC(O)CO 961eec111f04be12a6362e2521fe3e07 [0,2,0,0,0,0|2,0,0]=4 8592 B11R0.111 NC(=O)CCCOCC(S)CS 0ded3d46e4f20ccfc9e349a66393775a [0,2,0,0,0,0|2,0,0]=4 8593 B11R0.111 NC(=O)CCCOC[C@@H](O)CO b584f4ec790b4ffddc6aff3303d4ee06 [0,2,0,0,0,0|2,0,0]=4 8594 B11R0.111 NC(=O)CCCOC[C@H](O)CO e1549dd5682e3d795d05615b5582b29f [0,2,0,0,0,0|2,0,0]=4 8595 B11R0.111 NC(=O)CCNCCC(O)CO 872a7996d461b256463a630e641c091e [0,2,0,0,0,0|2,0,0]=4 8596 B11R0.111 O=C(CO)NCCCCC(F)F f872d753b2d2adfedb73fc9756cbe514 [0,2,0,0,0,0|2,0,0]=4 8597 B11R0.111 O=C(O)CCCNCC(=O)CO bbd69e4a45d0cd1c6985d82a95247d82 [0,2,0,0,0,0|1,0,1]=4 8598 B11R0.111 O=C(O)CCCNCC(F)CO e0ce63e5164a9fbab0e64bf81c442e4c [0,2,0,0,0,0|1,0,0]=3 8599 B11R0.111 O=C(O)CCCNCC(O)CF 30209f0d030ba40ef812d525bf05c6ba [0,2,0,0,0,0|1,0,0]=3 8600 B11R0.111 O=C(O)CCCNCC(O)CO ab2951dded088b502e96f7014e2f2d40 [0,2,0,0,0,0|1,0,0]=3 8601 B11R0.111 O=C(O)CCCNC[C@@H](F)CO fbeea5ab965e7a22517422448962c6de [0,2,0,0,0,0|1,0,0]=3 8602 B11R0.111 O=C(O)CCCNC[C@@H](O)CO 8b77ce7807c010d7e4095c355a594d1c [0,2,0,0,0,0|1,0,0]=3 8603 B11R0.111 O=C(O)CCCNC[C@H](F)CO 33364142682d0c2b783a9f7a45cfebb3 [0,2,0,0,0,0|1,0,0]=3 8604 B11R0.111 O=C(O)CCCNC[C@H](O)CO 79e1acfd6bde6efc5b7ae65df1aa4e82 [0,2,0,0,0,0|1,0,0]=3 8605 B11R0.111 O=C(O)CCNCCC(O)CO 915db0b58bf081b309421a3744f3b6e8 [0,2,0,0,0,0|1,0,0]=3 8606 B11R0.148 C#CCCCCCCNC(=O)C 2f413787882fc0e2408467e3c319c32a [0,2,0,0,0,0|1,0,1]=4 8607 B11R0.148 C#CCCCCCNCC(=O)C 50c933acc541586c072dba14dc5d40a1 [0,2,0,0,0,0|1,0,1]=4 8608 B11R0.148 C#CCCCCCNCC(=O)N 322df0ff71cf59e53df921f7ce604a2f [0,2,0,0,0,0|1,0,1]=4 8609 B11R0.148 C#CCCCCCNCC(=O)O b8d00f5834615ef2b8fe58bee713c10a [0,2,0,0,0,0|0,0,1]=3 8610 B11R0.148 C#CCCCCCOCC(=O)C 2d0da561f5d880cce13aa50e01ba3ca6 [0,2,0,0,0,0|1,0,1]=4 8611 B11R0.148 C#CCCCCCOCC(=O)N 37602eb2c9b5f905c84d932a28c16c6d [0,2,0,0,0,0|1,0,1]=4 8612 B11R0.148 C#CCCCCCOCC(=O)O f8df082162972f68c515249933b0b517 [0,2,0,0,0,0|0,0,1]=3 8613 B11R0.148 C#CCCCCCOCS(=O)O 3ec7af7bc01b9c96cfbb3c3476dacd9d [0,2,0,0,0,0|1,0,1]=4 8614 B11R0.148 C#CCCCCNCCC(=O)C af251db10531ad6ec8318c0db73cb5d3 [0,2,0,0,0,0|1,0,1]=4 8615 B11R0.148 C#CCCCCNCCC(=O)N c3b04fedc3fa86c04b1ae0f306d0141e [0,2,0,0,0,0|1,0,1]=4 8616 B11R0.148 C#CCCCCNCCC(=O)O f5c4aa9a1203cd75c987abbc1a7daa61 [0,2,0,0,0,0|0,0,1]=3 8617 B11R0.148 C#CCCCCNCCS(=O)O 1d4e62f97cfa157716dd113fdc9ceac8 [0,2,0,0,0,0|1,0,1]=4 8618 B11R0.148 C#CCCCCOCCC(=O)C 7087135c2f0d3f448e3b8c7de7b3d9d6 [0,2,0,0,0,0|1,0,1]=4 8619 B11R0.148 C#CCCCCOCCC(=O)N a87966ed9508df3b65ab9745530db605 [0,2,0,0,0,0|1,0,1]=4 8620 B11R0.148 C#CCCCCOCCC(=O)O b299e70f8266d037207fed13a9828f50 [0,2,0,0,0,0|0,0,1]=3 8621 B11R0.148 C#CCCCNCCCC(=O)C 241668bdc3f266db30dffdad318670a3 [0,2,0,0,0,0|1,0,1]=4 8622 B11R0.148 C#CCCCNCCCC(=O)N 7e8787f92219f0bb690f3e588ee68c94 [0,2,0,0,0,0|1,0,1]=4 8623 B11R0.148 C#CCCCNCCCC(=O)O cddbbfa1803d94d92ed7c34310a91edf [0,2,0,0,0,0|0,0,1]=3 8624 B11R0.148 C#CCCCOCCCC(=O)C ca7578f8e1b8ac604c52aafd76ae9120 [0,2,0,0,0,0|1,0,1]=4 8625 B11R0.148 C#CCCCOCCCC(=O)N fc4427d2d1c9fb3c827de50ad38f1582 [0,2,0,0,0,0|1,0,1]=4 8626 B11R0.148 C#CCCNCCCCC(=O)C a7a50ff02fbdcf22b0a45093c0853261 [0,2,0,0,0,0|1,0,1]=4 8627 B11R0.148 C#CCCNCCCCC(=O)N 994db737366dfe875d701d1b55a0f739 [0,2,0,0,0,0|1,0,1]=4 8628 B11R0.148 C#CCCNCCCCC(=O)O 415cdd648357f73e51e2be89ff687f62 [0,2,0,0,0,0|0,0,1]=3 8629 B11R0.148 C#CCCNCCOCC(=O)O fed089f463b89cfb4bace74732a09a64 [0,2,0,0,0,0|0,0,2]=4 8630 B11R0.148 C#CCCNCCSCC(=O)O abfbc1158a2cae0bd68fadd33eb0bc62 [0,2,0,0,0,0|0,0,2]=4 8631 B11R0.148 C#CCCOCCCCC(=O)C bbf7a254b5b28a9abe7734544f357e87 [0,2,0,0,0,0|1,0,1]=4 8632 B11R0.148 C#CCCOCCCCC(=O)N 49d55fa8f1767e115c7ebac338786415 [0,2,0,0,0,0|1,0,1]=4 8633 B11R0.148 C#CCCOCCCCC(=O)O 2f31cbf3e0a1651cf68befbe5d3cace0 [0,2,0,0,0,0|0,0,1]=3 8634 B11R0.148 C#CCCOCCOCC(=O)O 6f626fc5c4200557ad82f5f886822f86 [0,2,0,0,0,0|0,0,2]=4 8635 B11R0.148 C#CCNCCCCCC(=O)C 346209ef68873c7b2a240407ba37f9ae [0,2,0,0,0,0|1,0,1]=4 8636 B11R0.148 C#CCNCCCCCC(=O)N 17cb4de4a27f2fd016f47df9c2a3dc71 [0,2,0,0,0,0|1,0,1]=4 8637 B11R0.148 C#CCNCCCCCC(=O)O b6a77b72fdb4a98c953db9f96913b003 [0,2,0,0,0,0|0,0,1]=3 8638 B11R0.148 C#CCNCCCOCC(=O)O 9a4906a4749d191c2a59f4ba1b121086 [0,2,0,0,0,0|0,0,2]=4 8639 B11R0.148 C#CCNCCOCCC(=O)O cd228cd151977c041c034553e683a81d [0,2,0,0,0,0|0,0,2]=4 8640 B11R0.148 C#CCOCCCCCC(=O)C e31fef1b8497c6cd91cc2fb3c177a28d [0,2,0,0,0,0|1,0,1]=4 8641 B11R0.148 C#CCOCCCCCC(=O)N db4ec896036570bde1080d51309244f9 [0,2,0,0,0,0|1,0,1]=4 8642 B11R0.148 C#CCOCCCCCC(=O)O 4c941961acf7cc7fa204034d7821c8e9 [0,2,0,0,0,0|0,0,1]=3 8643 B11R0.148 C#CCOCCCOCC(=O)O 081037bd4e99106fb886a77f4805eea6 [0,2,0,0,0,0|0,0,2]=4 8644 B11R0.148 C#CCOCCNCCC(=O)O 8a53b6d141ab543648f70daf113d22df [0,2,0,0,0,0|0,0,2]=4 8645 B11R0.148 C#CCOCCOCCC(=O)O 4566f0a5a3284180e40935352718bb6f [0,2,0,0,0,0|0,0,2]=4 8646 B11R0.148 C/C=C/CCCOCCC(=O)C 6af31ccb6c5cfbdc31a7ba1d70c26273 [0,2,0,0,0,0|1,0,1]=4 8647 B11R0.148 C/C=C/CCCOCCC(=O)N 7c374036b9aebd774b670515a17c1fea [0,2,0,0,0,0|1,0,1]=4 8648 B11R0.148 C/C=C/CCCOCCC(=O)O 8e44447083573a7f76d126de4f324bf8 [0,2,0,0,0,0|0,0,1]=3 8649 B11R0.148 C/C=C/CCOCCCC(=O)C 0bfc1e16cd242a6ffba7baaeed75a478 [0,2,0,0,0,0|1,0,1]=4 8650 B11R0.148 C/C=C/CCOCCCC(=O)N a69b23d05c409186005f3a6206b5f735 [0,2,0,0,0,0|1,0,1]=4 8651 B11R0.148 C/C=C/CCOCCCC(=O)O 0fe3e2c1f4df0d89a2f94cf732ae3a08 [0,2,0,0,0,0|0,0,1]=3 8652 B11R0.148 C/C=C/CNCCCCC(=O)N 7f308cdd44f31e4b8a86c42660a5bddb [0,2,0,0,0,0|1,0,1]=4 8653 B11R0.148 C/C=C/CNCCCCC(=O)O d1035fd2e4f6859c679e5a8dde788805 [0,2,0,0,0,0|0,0,1]=3 8654 B11R0.148 C/C=C/CNCCOCC(=O)O 2709c3cbebbbb95d5b464c5379763a40 [0,2,0,0,0,0|0,0,2]=4 8655 B11R0.148 C/C=C/CNCCSCC(=O)O 2540268ddbf8c5ebcb5b7e0327e6c447 [0,2,0,0,0,0|0,0,2]=4 8656 B11R0.148 C/C=C/COCCCCC(=O)C bc4770b7051a58da4eb45c98e2b78f18 [0,2,0,0,0,0|1,0,1]=4 8657 B11R0.148 C/C=C/COCCCCC(=O)N 867b5bd722b4a0d1b86b52aeef372da4 [0,2,0,0,0,0|1,0,1]=4 8658 B11R0.148 C/C=C/COCCCCC(=O)O 8ba58a0d822f5cd347860b1afb57ad5d [0,2,0,0,0,0|0,0,1]=3 8659 B11R0.148 C/C=C/COCCOCC(=O)O ea0d2f51923eb64b63b474be64846701 [0,2,0,0,0,0|0,0,2]=4 8660 B11R0.148 C/C=C\CCCNCCC(=O)N 6daf8d163285381ef97e307f41d8f5e2 [0,2,0,0,0,0|1,0,1]=4 8661 B11R0.148 C/C=C\CCCNCCC(=O)O ff8ef7eaad585bf309257812ded95ffa [0,2,0,0,0,0|0,0,1]=3 8662 B11R0.148 C/C=C\CCCNCCS(=O)O 4104229448ff90e809872cf3c6c636c9 [0,2,0,0,0,0|1,0,1]=4 8663 B11R0.148 C/C=C\CCCOCCC(=O)C b4e669a2e0688ef6b804e802906b565b [0,2,0,0,0,0|1,0,1]=4 8664 B11R0.148 C/C=C\CCCOCCC(=O)N ba118ddda27cce7117e5163dbfab9233 [0,2,0,0,0,0|1,0,1]=4 8665 B11R0.148 C/C=C\CCCOCCC(=O)O bf016d443d4be01abd3a3ff616722e9a [0,2,0,0,0,0|0,0,1]=3 8666 B11R0.148 C/C=C\CNCCCCC(=O)N c55cf5e28aef3181a5b0ccec86647829 [0,2,0,0,0,0|1,0,1]=4 8667 B11R0.148 C/C=C\CNCCCCC(=O)O 71a3ba63862a0761a27f94a6a1fc16c6 [0,2,0,0,0,0|0,0,1]=3 8668 B11R0.148 C/C=C\CNCCOCC(=O)O 81d5b6aad6c45f58d73b7ae448203479 [0,2,0,0,0,0|0,0,2]=4 8669 B11R0.148 C/C=C\CNCCSCC(=O)O 771f1481e127c7f5c444bba6222f215a [0,2,0,0,0,0|0,0,2]=4 8670 B11R0.148 C/C=C\COCCCCC(=O)C a0730490237f018f540fe7a7151b7b1f [0,2,0,0,0,0|1,0,1]=4 8671 B11R0.148 C/C=C\COCCCCC(=O)N fff42c66889522a948a1960c8a402a1f [0,2,0,0,0,0|1,0,1]=4 8672 B11R0.148 C/C=C\COCCCCC(=O)O 50f111228924402c0cd8a52b811919f0 [0,2,0,0,0,0|0,0,1]=3 8673 B11R0.148 C/C=C\COCCOCC(=O)O 5b11515edb67ac311f12bac5f945af07 [0,2,0,0,0,0|0,0,2]=4 8674 B11R0.148 C=C(Br)CCOCCCCCC a6f96aa10bef0cb6b12500bf2b506dde [0,2,0,0,0,0|2,0,0]=4 8675 B11R0.148 C=C(Br)CCOCCCCCF 8c34727fcf98bec637ac42dfa05c771f [0,2,0,0,0,0|2,0,0]=4 8676 B11R0.148 C=C(Br)CCOCCCCOC 7cfcfbd71ed92fb26d278d12d3aa0e2f [0,2,0,0,0,0|2,0,0]=4 8677 B11R0.148 C=C(Br)CCOCCCOCC e6e2f9189b1e05561772a9e707b7e6ab [0,2,0,0,0,0|2,0,0]=4 8678 B11R0.148 C=C(Br)CCOCCCSCC be4f2583029b2256250e88917a6320e2 [0,2,0,0,0,0|2,0,0]=4 8679 B11R0.148 C=C(Br)CCOCCOCCC c31025dc181ed42039513b1dc82f08e8 [0,2,0,0,0,0|2,0,0]=4 8680 B11R0.148 C=C(Br)CCOCOCCCC b2674ef293595290f4edc1550cbcc458 [0,2,0,0,0,0|2,0,0]=4 8681 B11R0.148 C=C(Br)CNCCCCCCC a2c5c3a5c8b39ffc6201a20725555b17 [0,2,0,0,0,0|2,0,0]=4 8682 B11R0.148 C=C(Br)CNCCCCCCCl 02913c1a12b2de86b012ca93313a6da9 [0,2,0,0,0,0|2,0,0]=4 8683 B11R0.148 C=C(Br)CNCCCCCCF da4986b0f82eb9d08a0185e447f3314b [0,2,0,0,0,0|2,0,0]=4 8684 B11R0.148 C=C(Br)CNCCCCCCO 9d87c2e953e5f83dbe2ab6fb03cb44af [0,2,0,0,0,0|2,0,0]=4 8685 B11R0.148 C=C(Br)CNCCCCCOC 2508a79bcaa8856b02b8392efaf3be24 [0,2,0,0,0,0|2,0,0]=4 8686 B11R0.148 C=C(Br)CNCCCCSCC 38c1004de344fb4f65a31aad5332449a [0,2,0,0,0,0|2,0,0]=4 8687 B11R0.148 C=C(Br)CNCCCOCCC 5958d79ee001cb61f8424db5ccbb34d8 [0,2,0,0,0,0|2,0,0]=4 8688 B11R0.148 C=C(Br)CNCCOCCCC 90cd6db218dc45d5b525e1ad42612f87 [0,2,0,0,0,0|2,0,0]=4 8689 B11R0.148 C=C(Br)COCCCCCCC 2d3f57176c9c65c11b1e93be7df8b6f4 [0,2,0,0,0,0|2,0,0]=4 8690 B11R0.148 C=C(Br)COCCCCCCF 77ab45830ae1d3dff43a0cd9301b63af [0,2,0,0,0,0|2,0,0]=4 8691 B11R0.148 C=C(Br)COCCCCCCS b4618afefa8c80dbd886ef21ddbec951 [0,2,0,0,0,0|2,0,0]=4 8692 B11R0.148 C=C(Br)COCCCCCOC 37b0377cd4e872d3447b63ec7b9aa638 [0,2,0,0,0,0|2,0,0]=4 8693 B11R0.148 C=C(Br)COCCCOCCC 1ff008d3f4eb277cf267176c9d222856 [0,2,0,0,0,0|2,0,0]=4 8694 B11R0.148 C=C(Br)COCCOCCCC 54d317d51071e7efb0061c7463cd1518 [0,2,0,0,0,0|2,0,0]=4 8695 B11R0.148 C=C(Br)COCCSCCCC 8435bc2c7e6172196edbb8f408e17aea [0,2,0,0,0,0|2,0,0]=4 8696 B11R0.148 C=C(C)CCCNCCCCC 2a61d6a86b53b2d6ed8ca64bfa3ebb10 [0,2,0,0,0,0|2,0,0]=4 8697 B11R0.148 C=C(C)CCCNCCCCCl c8731ba1f70d8bc13a2e4a40391f9ac0 [0,2,0,0,0,0|2,0,0]=4 8698 B11R0.148 C=C(C)CCCNCCCCO 7572f60f6a5b76abf8c2da2af891eb7b [0,2,0,0,0,0|2,0,0]=4 8699 B11R0.148 C=C(C)CCCNCCCCS 0775800d0bad2dccb14d485132f98d28 [0,2,0,0,0,0|2,0,0]=4 8700 B11R0.148 C=C(C)CCCNCCCOC c9150017886d1482c8b895f9303b099d [0,2,0,0,0,0|2,0,0]=4 8701 B11R0.148 C=C(C)CCCNCCCSC a786008002f512f0dfee23897df0246b [0,2,0,0,0,0|2,0,0]=4 8702 B11R0.148 C=C(C)CCCNCCOCC 7d4408525a548f819a4a439218b86c6b [0,2,0,0,0,0|2,0,0]=4 8703 B11R0.148 C=C(C)CCCNCCSCC 5cd28aff6971764f2b140194b2a3898b [0,2,0,0,0,0|2,0,0]=4 8704 B11R0.148 C=C(C)CCCOCCCCC 7ddee3a31fabfc9464b6764c3b9e7cff [0,2,0,0,0,0|2,0,0]=4 8705 B11R0.148 C=C(C)CCCOCCCCF 26b3343d7eb194f86527dbdbaadea1a1 [0,2,0,0,0,0|2,0,0]=4 8706 B11R0.148 C=C(C)CCCOCCCCS 72887831882c777b2d08bdeaee97b3d5 [0,2,0,0,0,0|2,0,0]=4 8707 B11R0.148 C=C(C)CCCOCCCOC cfb76832c98f1b24c2b6910849e874a9 [0,2,0,0,0,0|2,0,0]=4 8708 B11R0.148 C=C(C)CCCOCCCSC f709d11388c937542d3f01d13f28b4bc [0,2,0,0,0,0|2,0,0]=4 8709 B11R0.148 C=C(C)CCCOCCOCC 1f01a8c58a9f41f11eafa6ecde513af8 [0,2,0,0,0,0|2,0,0]=4 8710 B11R0.148 C=C(C)CCCOCCSCC 1d6fc1edadc5e44f2933e7ab7320822b [0,2,0,0,0,0|2,0,0]=4 8711 B11R0.148 C=C(C)CCNCCCCCC 7e6410037cc055178b065ec8aa195598 [0,2,0,0,0,0|2,0,0]=4 8712 B11R0.148 C=C(C)CCNCCCCCCl 48a2f78ae0d81b19e97870726aadd7d2 [0,2,0,0,0,0|2,0,0]=4 8713 B11R0.148 C=C(C)CCNCCCCCF e4049c627170f66e2443e7ae56fc1a31 [0,2,0,0,0,0|2,0,0]=4 8714 B11R0.148 C=C(C)CCNCCCCCO c6f3f71deefab5553eb8df4230d39cdd [0,2,0,0,0,0|2,0,0]=4 8715 B11R0.148 C=C(C)CCNCCCCOC 2374a065e58ae3e114dd815950b6af1b [0,2,0,0,0,0|2,0,0]=4 8716 B11R0.148 C=C(C)CCNCCCCSC 1f14cb8a68c9d13e21b0b4ea6067130e [0,2,0,0,0,0|2,0,0]=4 8717 B11R0.148 C=C(C)CCNCCCOCC ff704d26de364b46d8c436a83f70fd2e [0,2,0,0,0,0|2,0,0]=4 8718 B11R0.148 C=C(C)CCNCCCSCC 8c0505be17453f9c4ddd86b5bdf953e1 [0,2,0,0,0,0|2,0,0]=4 8719 B11R0.148 C=C(C)CCNCCOCCC 38f2e6beb7d9f3f335cd6ec192d47d4f [0,2,0,0,0,0|2,0,0]=4 8720 B11R0.148 C=C(C)CCNCOCCCC 5a2b25e6d30d6eafc145eea57137942d [0,2,0,0,0,0|2,0,0]=4 8721 B11R0.148 C=C(C)CCOCCCCCC f3b42b02f97b5ae546a5d0ce100d5f9b [0,2,0,0,0,0|2,0,0]=4 8722 B11R0.148 C=C(C)CCOCCCCCF 1cd7d278cca05628b6323907ef8139b0 [0,2,0,0,0,0|2,0,0]=4 8723 B11R0.148 C=C(C)CCOCCCCOC 6c68902b59439ef02db1827c81ac86e5 [0,2,0,0,0,0|2,0,0]=4 8724 B11R0.148 C=C(C)CCOCCCCSC f4cc9617da459842d98d117720309ec6 [0,2,0,0,0,0|2,0,0]=4 8725 B11R0.148 C=C(C)CCOCCCOCC 61def538ce613515ea5ce21b11143c01 [0,2,0,0,0,0|2,0,0]=4 8726 B11R0.148 C=C(C)CCOCCCSCC 7397b0b72e3a11c422be6f76310489fe [0,2,0,0,0,0|2,0,0]=4 8727 B11R0.148 C=C(C)CCOCCOCCC cb715321bec56439eb639e3e8e48a990 [0,2,0,0,0,0|2,0,0]=4 8728 B11R0.148 C=C(C)CCOCCSCCC 6071b176c37be307e50540c8a1de3d5a [0,2,0,0,0,0|2,0,0]=4 8729 B11R0.148 C=C(C)CCOCOCCCC 42fd3e6ac5c48ab1e865d86cdea89fe7 [0,2,0,0,0,0|2,0,0]=4 8730 B11R0.148 C=C(C)CNCCCCCCC b09be588b32545d66c354051c751378d [0,2,0,0,0,0|2,0,0]=4 8731 B11R0.148 C=C(C)CNCCCCCCCl 2fdfdf8f4ed56f8465697d9b05e118f7 [0,2,0,0,0,0|2,0,0]=4 8732 B11R0.148 C=C(C)CNCCCCCCF 17fed7ab7f2f7d912fa59394c63a539e [0,2,0,0,0,0|2,0,0]=4 8733 B11R0.148 C=C(C)CNCCCCCCO e3371219b61ce074e30708f3fdbea6a0 [0,2,0,0,0,0|2,0,0]=4 8734 B11R0.148 C=C(C)CNCCCCCOC 29952e825f42e6ab1f39f33dd8b42201 [0,2,0,0,0,0|2,0,0]=4 8735 B11R0.148 C=C(C)CNCCCCSCC c180cc5b9c11b8eacd9459f3bc13ff91 [0,2,0,0,0,0|2,0,0]=4 8736 B11R0.148 C=C(C)CNCCCOCCC cb469497c96d22c2eafd39e21892bf2c [0,2,0,0,0,0|2,0,0]=4 8737 B11R0.148 C=C(C)CNCCOCCCC ae6ee3ea65b0e44b189ffe8a53dab9de [0,2,0,0,0,0|2,0,0]=4 8738 B11R0.148 C=C(C)COCCCCCCC 6e86eb79eebc0414260368e904a927e1 [0,2,0,0,0,0|2,0,0]=4 8739 B11R0.148 C=C(C)COCCCCCCF 380bb7bd21d3f8f1d87af05d88324047 [0,2,0,0,0,0|2,0,0]=4 8740 B11R0.148 C=C(C)COCCCCCCS 3f0f1a29aec0b299137fee03b115444c [0,2,0,0,0,0|2,0,0]=4 8741 B11R0.148 C=C(C)COCCCCCOC ed97d18a550e659e47226632b251e7bb [0,2,0,0,0,0|2,0,0]=4 8742 B11R0.148 C=C(C)COCCCOCCC cf5cc5a18d508235c9f5414fa129b4cf [0,2,0,0,0,0|2,0,0]=4 8743 B11R0.148 C=C(C)COCCOCCCC 01d4de70de3af1ba59b4d422fb0d6d4e [0,2,0,0,0,0|2,0,0]=4 8744 B11R0.148 C=C(C)COCCSCCCC f1e3c253a1b49c4853ab945b5a2eb533 [0,2,0,0,0,0|2,0,0]=4 8745 B11R0.148 C=C(Cl)CNCCCCCCC 7a0fa4242a58853f2d6992ce3c58e601 [0,2,0,0,0,0|2,0,0]=4 8746 B11R0.148 C=C(Cl)CNCCCCCCCl 61feb98f66ac2233b7dbe368029cf8fc [0,2,0,0,0,0|2,0,0]=4 8747 B11R0.148 C=C(Cl)CNCCCCCCO e1873548a3ea821262f4dc7b996b32e6 [0,2,0,0,0,0|2,0,0]=4 8748 B11R0.148 C=C(Cl)CNCCCCCOC 7b32c802fb6aebc54517fcfe1f7af32e [0,2,0,0,0,0|2,0,0]=4 8749 B11R0.148 C=C(Cl)CNCCCCSCC ed9aea2c3677a40ec3ecfd3f9d559aca [0,2,0,0,0,0|2,0,0]=4 8750 B11R0.148 C=C(Cl)CNCCCOCCC ee506418a82e56d3ca9206031fb9e7ac [0,2,0,0,0,0|2,0,0]=4 8751 B11R0.148 C=C(Cl)CNCCOCCCC 55dcad9320cc2e6e5d3def8253a0a808 [0,2,0,0,0,0|2,0,0]=4 8752 B11R0.148 C=C(Cl)COCCCCCCC 2ebbdffeb133533b445815f4f9debd40 [0,2,0,0,0,0|2,0,0]=4 8753 B11R0.148 C=C(Cl)COCCCCCCF 3f60018b58b2492fb8d02d7617bf401c [0,2,0,0,0,0|2,0,0]=4 8754 B11R0.148 C=C(Cl)COCCCCCCS e364d5c276b3d5099f08cf99f4044bc8 [0,2,0,0,0,0|2,0,0]=4 8755 B11R0.148 C=C(Cl)COCCCCCOC 9348980f60fe1952e59a44ab25d81097 [0,2,0,0,0,0|2,0,0]=4 8756 B11R0.148 C=C(Cl)COCCCOCCC f9fb7048f348df1c6ebdd2a8c20a26b0 [0,2,0,0,0,0|2,0,0]=4 8757 B11R0.148 C=C(Cl)COCCOCCCC d3802129f2aa4a7c4a07ecc549c689df [0,2,0,0,0,0|2,0,0]=4 8758 B11R0.148 C=C(Cl)COCCSCCCC c0039600e0515969efffe0ab57d384a9 [0,2,0,0,0,0|2,0,0]=4 8759 B11R0.148 C=C(F)CNCCCCCCC 33b7a963b6b3a4d0ec93076c10be1825 [0,2,0,0,0,0|2,0,0]=4 8760 B11R0.148 C=C(F)CNCCCCCCCl cba2d70f8e7efae7289692837992988c [0,2,0,0,0,0|2,0,0]=4 8761 B11R0.148 C=C(F)CNCCCCCCO 1517966bebfce2d4ef833734df2cf157 [0,2,0,0,0,0|2,0,0]=4 8762 B11R0.148 C=C(F)CNCCCCSCC fe252a4a976dbc52907f913483694103 [0,2,0,0,0,0|2,0,0]=4 8763 B11R0.148 C=C(F)CNCCCOCCC ccf6cff50b5651704c6f34097e0efa7f [0,2,0,0,0,0|2,0,0]=4 8764 B11R0.148 C=C(F)COCCCCCCC 8f56dd536e780ef08f69e4d7538969de [0,2,0,0,0,0|2,0,0]=4 8765 B11R0.148 C=C(F)COCCCCCCF 1ec7e689855b7e109c6fcafd469c4d85 [0,2,0,0,0,0|2,0,0]=4 8766 B11R0.148 C=C(F)COCCCCCCS 4d307b356c81648c526669189cb577f9 [0,2,0,0,0,0|2,0,0]=4 8767 B11R0.148 C=C(F)COCCCCCOC a37e231a29db0d75dba341bc28783e92 [0,2,0,0,0,0|2,0,0]=4 8768 B11R0.148 C=C(F)COCCCOCCC 66754cd763307afb65a810f1993f3bb9 [0,2,0,0,0,0|2,0,0]=4 8769 B11R0.148 C=C(F)COCCOCCCC a79aca5aa785e6d08dc93eb83407644e [0,2,0,0,0,0|2,0,0]=4 8770 B11R0.148 C=C(I)COCCCCCCC 1f40c8fadf0ee0af29c66374f033ff62 [0,2,0,0,0,0|2,0,0]=4 8771 B11R0.148 C=C(I)COCCCCCCF 2e5b78b5f45783514bf1fd8082732f3e [0,2,0,0,0,0|2,0,0]=4 8772 B11R0.148 C=C(I)COCCCCCOC 8a182eab1313e088d37cb79a86db4f42 [0,2,0,0,0,0|2,0,0]=4 8773 B11R0.148 C=C(I)COCCCOCCC 195775eb4b1996b81a9f4f06d32150be [0,2,0,0,0,0|2,0,0]=4 8774 B11R0.148 C=C(I)COCCOCCCC d1f24edc5d923b085c18152641a8ce57 [0,2,0,0,0,0|2,0,0]=4 8775 B11R0.148 C=C=CCCOCCCC(=O)O 5055d94570a6ab55c00286d941bfc0df [0,2,0,0,0,0|0,0,2]=4 8776 B11R0.148 C=CCCCCCNCC(=O)C 9eebcfb67903aeb41ddbb31526bfb0e6 [0,2,0,0,0,0|1,0,1]=4 8777 B11R0.148 C=CCCCCCNCC(=O)N 81686fb645172cfec5b92cfe07daecef [0,2,0,0,0,0|1,0,1]=4 8778 B11R0.148 C=CCCCCCNCC(=O)O 7aa5ba1994425bccb2af733c34b3554f [0,2,0,0,0,0|0,0,1]=3 8779 B11R0.148 C=CCCCCCOCC(=O)C 8b2e388462f74bcd1ee69d7c98e6ef2e [0,2,0,0,0,0|1,0,1]=4 8780 B11R0.148 C=CCCCCCOCC(=O)N e1cbf2bf94edbcb2cf7e31a1e2b1e39b [0,2,0,0,0,0|1,0,1]=4 8781 B11R0.148 C=CCCCCCOCC(=O)O aa84ff8d74f73c4fd8ca277dacee1a87 [0,2,0,0,0,0|0,0,1]=3 8782 B11R0.148 C=CCCCCCOCS(=O)O 93fef0e11c468ebd19f4c3835c139246 [0,2,0,0,0,0|1,0,1]=4 8783 B11R0.148 C=CCCCCNCCC(=O)C 41e3352f4bc375aa540b33871bc5c394 [0,2,0,0,0,0|1,0,1]=4 8784 B11R0.148 C=CCCCCNCCC(=O)N c0fc4fd7e92a5e2788d70098b29063a9 [0,2,0,0,0,0|1,0,1]=4 8785 B11R0.148 C=CCCCCNCCC(=O)O 5a2f9cbe75c0747b5a1ea894792d2069 [0,2,0,0,0,0|0,0,1]=3 8786 B11R0.148 C=CCCCCNCCS(=O)O 28a2d192c2eb322804b26ac7cb5948ed [0,2,0,0,0,0|1,0,1]=4 8787 B11R0.148 C=CCCCCOCCC(=O)C bcdd79d6b67b4a4decd3603bdc2453a0 [0,2,0,0,0,0|1,0,1]=4 8788 B11R0.148 C=CCCCCOCCC(=O)N 63d391a6713496aad5a05f5ec55a3463 [0,2,0,0,0,0|1,0,1]=4 8789 B11R0.148 C=CCCCCOCCC(=O)O a7a5b01680c43cf5e6bb94adfc9266aa [0,2,0,0,0,0|0,0,1]=3 8790 B11R0.148 C=CCCCNCCCC(=O)C f525d35ea9dd7096b9ac5f984e254df9 [0,2,0,0,0,0|1,0,1]=4 8791 B11R0.148 C=CCCCNCCCC(=O)N a85f7ee11f4c1ed21b336ff831637f12 [0,2,0,0,0,0|1,0,1]=4 8792 B11R0.148 C=CCCCNCCCC(=O)O c8121f9b969a048cf549e296df1a24b9 [0,2,0,0,0,0|0,0,1]=3 8793 B11R0.148 C=CCCCOCCCC(=O)C 9e43869cd93b5b6adbf3fc06243b8acf [0,2,0,0,0,0|1,0,1]=4 8794 B11R0.148 C=CCCCOCCCC(=O)N e5ebee136a264bbdf5495128c9b11aed [0,2,0,0,0,0|1,0,1]=4 8795 B11R0.148 C=CCCCOCCCC(=O)O 96ed4fd134ee6879f6f6ab0ad6db26e3 [0,2,0,0,0,0|0,0,1]=3 8796 B11R0.148 C=CCCNCCCCC(=O)C a17ad3270d7b9b7fac3cb4f52a222c99 [0,2,0,0,0,0|1,0,1]=4 8797 B11R0.148 C=CCCNCCCCC(=O)N 2eb5617bb522c8ea45651a137b8a4943 [0,2,0,0,0,0|1,0,1]=4 8798 B11R0.148 C=CCCNCCCCC(=O)O 58a325a172c77f725900372e67e04633 [0,2,0,0,0,0|0,0,1]=3 8799 B11R0.148 C=CCCNCCOCC(=O)O 4722d6788ad26cdf1bbc48220020bc8e [0,2,0,0,0,0|0,0,2]=4 8800 B11R0.148 C=CCCNCCSCC(=O)O cd4316637d4a4b497e413e2155b4a3f6 [0,2,0,0,0,0|0,0,2]=4 8801 B11R0.148 C=CCCOCCCCC(=O)C 05ffe19f846de82006c5eee08e2996e5 [0,2,0,0,0,0|1,0,1]=4 8802 B11R0.148 C=CCCOCCCCC(=O)N b7824d45cb4fb05ef28cd2c70812c4c1 [0,2,0,0,0,0|1,0,1]=4 8803 B11R0.148 C=CCCOCCCCC(=O)O 490d834bae5ffeef13ea31917f780baf [0,2,0,0,0,0|0,0,1]=3 8804 B11R0.148 C=CCCOCCOCC(=O)O c8021bdc03db984b7e788aa556881d06 [0,2,0,0,0,0|0,0,2]=4 8805 B11R0.148 C=CCNCCCCCC(=O)N efdac570934c43a683894828052a8e03 [0,2,0,0,0,0|1,0,1]=4 8806 B11R0.148 C=CCNCCCCCC(=O)O c630c8f69ff59f492c87c3d61ac465be [0,2,0,0,0,0|0,0,1]=3 8807 B11R0.148 C=CCNCCOCCC(=O)O 2fd55b728e84b2f8d3ed934ec82c0b82 [0,2,0,0,0,0|0,0,2]=4 8808 B11R0.148 C=CCOCCCCCC(=O)N 435169c43c3c07b6f70c5c63c1ef2fa9 [0,2,0,0,0,0|1,0,1]=4 8809 B11R0.148 C=CCOCCCCCC(=O)O 44ac25b7127fbe958224eb7f2b32ac63 [0,2,0,0,0,0|0,0,1]=3 8810 B11R0.148 C=CCOCCNCCC(=O)O 1ab64d6d1d5ca15817a42a804b14af2b [0,2,0,0,0,0|0,0,2]=4 8811 B11R0.148 C=CCOCCOCCC(=O)O 7891583d44e90422511e4a7ea11fe3f5 [0,2,0,0,0,0|0,0,2]=4 8812 B11R0.148 C=COCCCCOCC(=O)O 144f099953022520389f8000dbc7df42 [0,2,0,0,0,0|0,0,2]=4 8813 B11R0.148 C=COCCCNCCC(=O)O d500b0e11ed72e2f403aa0ddfb57db2c [0,2,0,0,0,0|0,0,2]=4 8814 B11R0.148 C=COCCNCCCC(=O)O 26e8d6a41f398210080b0de3798ba78f [0,2,0,0,0,0|0,0,2]=4 8815 B11R0.148 C=COCCOCCCC(=O)O e9ab1554f4ab2a4ca16a44bb1135248b [0,2,0,0,0,0|0,0,2]=4 8816 B11R0.148 CC#CCCCOCCC(=O)C a16b08654a60b37a314ffc39791df265 [0,2,0,0,0,0|1,0,1]=4 8817 B11R0.148 CC#CCCCOCCC(=O)N 16d7df5bd6fe3115edb1da9f7a74b495 [0,2,0,0,0,0|1,0,1]=4 8818 B11R0.148 CC#CCCCOCCC(=O)O fe53d8926d6dfaf47d665b485dbbf6da [0,2,0,0,0,0|0,0,1]=3 8819 B11R0.148 CC#CCCOCCCC(=O)C 00e5df88f4496d095de010b96f840b5b [0,2,0,0,0,0|1,0,1]=4 8820 B11R0.148 CC#CCCOCCCC(=O)N 4ea314fce07551c2cd02f3e4be752ace [0,2,0,0,0,0|1,0,1]=4 8821 B11R0.148 CC#CCCOCCCC(=O)O e191b4ef5322f2ff046b4504647b78d6 [0,2,0,0,0,0|0,0,1]=3 8822 B11R0.148 CC#CCNCCCCC(=O)C 330e9a6558ef75a4d365c599326c24d3 [0,2,0,0,0,0|1,0,1]=4 8823 B11R0.148 CC#CCNCCOCC(=O)O 44c8d0a1508df075283d65f0849d6928 [0,2,0,0,0,0|0,0,2]=4 8824 B11R0.148 CC#CCOCCCCC(=O)C e3bbe5e60de214bac384b9cd48db7ad5 [0,2,0,0,0,0|1,0,1]=4 8825 B11R0.148 CC#CCOCCCCC(=O)N cf7fec2c42dc11f45122a97d57fd20a7 [0,2,0,0,0,0|1,0,1]=4 8826 B11R0.148 CC#CCOCCOCC(=O)O 0ed2639996cd2c2981b1780730fc18f4 [0,2,0,0,0,0|0,0,2]=4 8827 B11R0.148 CC(=O)CCCCCNCC#N 785e5e25390295926ee87a643166505f [0,2,0,0,0,0|1,0,1]=4 8828 B11R0.148 CC(=O)CCCCCNCCBr 2814ea2073b8c89939c64a8e09a7e233 [0,2,0,0,0,0|1,0,0]=3 8829 B11R0.148 CC(=O)CCCCCNCCF 265cbbf874da51a095cb484ec0438d5a [0,2,0,0,0,0|1,0,0]=3 8830 B11R0.148 CC(=O)CCCCCNCCI 249e58dc239dab6a72796538d51ba9e8 [0,2,0,0,0,0|1,0,0]=3 8831 B11R0.148 CC(=O)CCCCCNCCO 3e8a33401594d0af1994ed5e283e0ea1 [0,2,0,0,0,0|1,0,0]=3 8832 B11R0.148 CC(=O)CCCCCNCCS 4b42acf5020fe410d7a756528278b61a [0,2,0,0,0,0|1,0,0]=3 8833 B11R0.148 CC(=O)CCCCCOCC#N 697be21066f12f340cb580c950c34f93 [0,2,0,0,0,0|1,0,1]=4 8834 B11R0.148 CC(=O)CCCCCOCCF acfcd3da13be6392ab1838f8edfa9eaf [0,2,0,0,0,0|1,0,0]=3 8835 B11R0.148 CC(=O)CCCCCOCCS ae67aed9b0d9b06fefa17b6ef4dcaef7 [0,2,0,0,0,0|1,0,0]=3 8836 B11R0.148 CC(=O)CCCCNCCC#N d7696c84ff37feed3520e34d4b93889d [0,2,0,0,0,0|1,0,1]=4 8837 B11R0.148 CC(=O)CCCCNCCCCl 7c7b146c40c0acfb48aadb4e09bd4ce6 [0,2,0,0,0,0|1,0,0]=3 8838 B11R0.148 CC(=O)CCCCNCCCO 5a85a5734691c87d84615e5d2effcf14 [0,2,0,0,0,0|1,0,0]=3 8839 B11R0.148 CC(=O)CCCCNCCON d48a84c134d75e2d12afc3071c68f611 [0,2,0,0,0,0|2,0,0]=4 8840 B11R0.148 CC(=O)CCCCOCCC#N ab52fd270045702a1453d24875fb43d3 [0,2,0,0,0,0|1,0,1]=4 8841 B11R0.148 CC(=O)CCCCOCCC=O a1d5774d5e7ba3e60d7a5ab36f55d5ed [0,2,0,0,0,0|1,0,1]=4 8842 B11R0.148 CC(=O)CCCCOCCCF a5a3ce24067ae081ca443bc54de8acf1 [0,2,0,0,0,0|1,0,0]=3 8843 B11R0.148 CC(=O)CCCCOCCCS a7c6975baa6fe8aa2c12bfb3cf806d65 [0,2,0,0,0,0|1,0,0]=3 8844 B11R0.148 CC(=O)CCCNCCCC#N bcace2da3b811c2a71d28a4d70f7fa68 [0,2,0,0,0,0|1,0,1]=4 8845 B11R0.148 CC(=O)CCCNCCCCCl 1c197c6bb43dcf367a806b907cd1775a [0,2,0,0,0,0|1,0,0]=3 8846 B11R0.148 CC(=O)CCCNCCCCO 50b6d540f864c9eb03851c0461d95814 [0,2,0,0,0,0|1,0,0]=3 8847 B11R0.148 CC(=O)CCCNCCCCS 3984288bc637b2b6153052a7460caacb [0,2,0,0,0,0|1,0,0]=3 8848 B11R0.148 CC(=O)CCCOCCCC#N 76f0e519c1863db8f27f5b1697408c8d [0,2,0,0,0,0|1,0,1]=4 8849 B11R0.148 CC(=O)CCCOCCCC=O 6f7237a805ac819f2bc0b5e3560c3209 [0,2,0,0,0,0|1,0,1]=4 8850 B11R0.148 CC(=O)CCCOCCCCF 5c7c199705317ad51fae8cb22f6ec3e8 [0,2,0,0,0,0|1,0,0]=3 8851 B11R0.148 CC(=O)CCCOCCCCS 3689bb9ac1af1c3856b69e96e09668af [0,2,0,0,0,0|1,0,0]=3 8852 B11R0.148 CC(=O)CCNCCCCC#N ec47fa0191b7763aadcab55a1967dd71 [0,2,0,0,0,0|1,0,1]=4 8853 B11R0.148 CC(=O)CCNCCCCCCl 55a8ea3d98c3c99a6dc9bb6e45f49262 [0,2,0,0,0,0|1,0,0]=3 8854 B11R0.148 CC(=O)CCNCCCCCO 3e39b9d8eb28be289794d5a85c7d3904 [0,2,0,0,0,0|1,0,0]=3 8855 B11R0.148 CC(=O)CCNCCOCCO 2f29f579aff1476a34479cff49a2086e [0,2,0,0,0,0|2,0,0]=4 8856 B11R0.148 CC(=O)CCNCCOCCS e673aea06d030cfbb0117753343a3c0c [0,2,0,0,0,0|2,0,0]=4 8857 B11R0.148 CC(=O)CCNCCSCCO b2dec0b24cdd84882e6f3e8b9d47cb2b [0,2,0,0,0,0|2,0,0]=4 8858 B11R0.148 CC(=O)CCOCCCCC#N e81867cf766549649cfe4742e836b071 [0,2,0,0,0,0|1,0,1]=4 8859 B11R0.148 CC(=O)CCOCCCCC=O f319f2a7b0adea4b6f8c0fb2de01c220 [0,2,0,0,0,0|1,0,1]=4 8860 B11R0.148 CC(=O)CCOCCCCCF 6bb0a71e61b30b8b2e877852ef4f0b17 [0,2,0,0,0,0|1,0,0]=3 8861 B11R0.148 CC(=O)CCOCCOCCF ab34abce94df03811e4007fc009d5e35 [0,2,0,0,0,0|2,0,0]=4 8862 B11R0.148 CC(=O)CCOCCOCCS bbdaa234f223187e14df1f2faf250639 [0,2,0,0,0,0|2,0,0]=4 8863 B11R0.148 CC(=O)CNCCCCCC#N 3584b8d1a32b138638b1f0154f68d2e9 [0,2,0,0,0,0|1,0,1]=4 8864 B11R0.148 CC(=O)CNCCCCCC=O dc1d1e49e88a07c8e8480ea556a29f03 [0,2,0,0,0,0|1,0,1]=4 8865 B11R0.148 CC(=O)CNCCCCCCF e5220e4b1eb66b48d5fb2be647d0f093 [0,2,0,0,0,0|1,0,0]=3 8866 B11R0.148 CC(=O)CNCCCCCCO 5ae8b5dcf45a271724ef32cc715e5de7 [0,2,0,0,0,0|1,0,0]=3 8867 B11R0.148 CC(=O)COCCCCCC#N bdfe93c8e754bc393d6bf6add8339888 [0,2,0,0,0,0|1,0,1]=4 8868 B11R0.148 CC(=O)COCCCCCC=O e86395281f8562d92fc2f29edfd19a69 [0,2,0,0,0,0|1,0,1]=4 8869 B11R0.148 CC(=O)COCCCCCCF f9ddf83656d1768dec73eb1308c462ef [0,2,0,0,0,0|1,0,0]=3 8870 B11R0.148 CC(=O)NCCCCCCCO 375247c5b76fff4f96757dfebee6b6e0 [0,2,0,0,0,0|1,0,0]=3 8871 B11R0.148 CC(=O)NCCCCCNCF 0ec7e44245d413f6dacb23155973a48a [0,2,0,0,0,0|2,0,0]=4 8872 B11R0.148 CC(=O)NCCCCCNCO d0cda07e70ce0100ba72433da11fe9b4 [0,2,0,0,0,0|2,0,0]=4 8873 B11R0.148 CC(=O)NCCCCNCCF da645564f958e1b80ae5223968589e71 [0,2,0,0,0,0|2,0,0]=4 8874 B11R0.148 CC(=O)NCCCCNCCO b0133e0c062b2792effc5e470b77362d [0,2,0,0,0,0|2,0,0]=4 8875 B11R0.148 CC(=O)NCCCCNCCS 0993836b41f915bdee741aeb7d437565 [0,2,0,0,0,0|2,0,0]=4 8876 B11R0.148 CC(=O)NCCCCSCCO 338f4652809523a6ff055f93a9dd4f45 [0,2,0,0,0,0|2,0,0]=4 8877 B11R0.148 CC(=O)NCCCNCCCCl 437663a1115ebe9583cd9126d211a763 [0,2,0,0,0,0|2,0,0]=4 8878 B11R0.148 CC(=O)NCCCNCCCF b49e7043069cd0c5afc47258cc5f4db9 [0,2,0,0,0,0|2,0,0]=4 8879 B11R0.148 CC(=O)NCCCNCCCO 87ec8c24f06caf7b3922020e72f322c5 [0,2,0,0,0,0|2,0,0]=4 8880 B11R0.148 CC(=O)NCCCNCCCS 7e1695ce8464d960488acdf38ef681f5 [0,2,0,0,0,0|2,0,0]=4 8881 B11R0.148 CC(=O)NCCCOCCCF 278d1b65ea6e62b561955d314d2d3131 [0,2,0,0,0,0|2,0,0]=4 8882 B11R0.148 CC(=O)NCCCOCCCO a632547a27b42b4b71b8987091d3d020 [0,2,0,0,0,0|2,0,0]=4 8883 B11R0.148 CC(=O)NCCCOCCCS dde76a5453ba702c453d51f5439d0005 [0,2,0,0,0,0|2,0,0]=4 8884 B11R0.148 CC(=O)NCCNCCCCCl 6e009b572ec767f7a62166483fe80455 [0,2,0,0,0,0|2,0,0]=4 8885 B11R0.148 CC(=O)NCCNCCCCF 0725af3ca6010997bd7724510ca7c831 [0,2,0,0,0,0|2,0,0]=4 8886 B11R0.148 CC(=O)NCCNCCCCO e4ea7d954a76e84ddd5e6b0fab30da79 [0,2,0,0,0,0|2,0,0]=4 8887 B11R0.148 CC(=O)NCCNCCCCS 042ff32b134c527f9da62c6bb80ebd8c [0,2,0,0,0,0|2,0,0]=4 8888 B11R0.148 CC(=O)NCCOCCCCF aca675fef24c0464e8f3fb4ca64fc764 [0,2,0,0,0,0|2,0,0]=4 8889 B11R0.148 CC(=O)NCCOCCCCS 89b244d09e75bf13d0a9cfbce7bb2aa8 [0,2,0,0,0,0|2,0,0]=4 8890 B11R0.148 CC(=O)NCOCCCCCF 7262ab8b0e74ab16d468d7f82284020a [0,2,0,0,0,0|2,0,0]=4 8891 B11R0.148 CC(=O)OCCCCNCCBr 09ecad89b3ee7e9b52becf6f3558f5e0 [0,2,0,0,0,0|2,0,0]=4 8892 B11R0.148 CC(=O)OCCCCNCCF 720a832f528ce9b76fe335a3528ab59e [0,2,0,0,0,0|2,0,0]=4 8893 B11R0.148 CC(=O)OCCCCNCCI 3fe30103928ab81df76904d92cfc7a88 [0,2,0,0,0,0|2,0,0]=4 8894 B11R0.148 CC(=O)OCCCCNCCO 5e2d05966d6b72b664f7b20dcf7730a5 [0,2,0,0,0,0|2,0,0]=4 8895 B11R0.148 CC(=O)OCCCCNCCS 88dac4c7b5e146ef8383ce0b84d6fe6b [0,2,0,0,0,0|2,0,0]=4 8896 B11R0.148 CC(=O)OCCCCOCCF e44643877ae1063c27732acf35cca04d [0,2,0,0,0,0|2,0,0]=4 8897 B11R0.148 CC(=O)OCCCCOCCS 76172059d939ddae2a1cd0ccd1e276b8 [0,2,0,0,0,0|2,0,0]=4 8898 B11R0.148 CC(=O)OCCCNCCCCl 82f0c3756008316a59064f1bdd603a39 [0,2,0,0,0,0|2,0,0]=4 8899 B11R0.148 CC(=O)OCCCNCCCO 60ccf7979710a2e215855f8fad0f2eba [0,2,0,0,0,0|2,0,0]=4 8900 B11R0.148 CC(=O)OCCCOCCCF 8b1cd558e148cc295d3e8a96e20fa55c [0,2,0,0,0,0|2,0,0]=4 8901 B11R0.148 CC(=O)OCCCOCCCS 5f956e72e2397816126bfa86c31c25fd [0,2,0,0,0,0|2,0,0]=4 8902 B11R0.148 CC(=O)OCCNCCCCCl c30188f535cc352103ea10ad816eb132 [0,2,0,0,0,0|2,0,0]=4 8903 B11R0.148 CC(=O)OCCNCCCCO 17f1b8ddeeabe6d9ca5ff0692efb74f0 [0,2,0,0,0,0|2,0,0]=4 8904 B11R0.148 CC(=O)OCCNCCCCS b7bb94f35a71ccfd1e46a4669e5a5974 [0,2,0,0,0,0|2,0,0]=4 8905 B11R0.148 CC(=O)OCCOCCCCF bff1e3b045526225b899ac06b3cb1662 [0,2,0,0,0,0|2,0,0]=4 8906 B11R0.148 CC(=O)OCCOCCCCS 320d405252d1a1516c5714b451a24110 [0,2,0,0,0,0|2,0,0]=4 8907 B11R0.148 CC(=O)OCNCCCCCCl efa8e7f23390c387b5ce891373700032 [0,2,0,0,0,0|2,0,0]=4 8908 B11R0.148 CC(=O)OCNCCCCCO 9521e7f1f1ece246870caf29c7064408 [0,2,0,0,0,0|2,0,0]=4 8909 B11R0.148 CC(=O)SCCCCNCCBr a6e15848763adc7fe34ac4c66ea44097 [0,2,0,0,0,0|2,0,0]=4 8910 B11R0.148 CC(=O)SCCCCNCCF c42a5e70d57437d5e637fadaf4145f84 [0,2,0,0,0,0|2,0,0]=4 8911 B11R0.148 CC(=O)SCCCCNCCI ef0ca8f69cbbf70eef9500252f15e4cd [0,2,0,0,0,0|2,0,0]=4 8912 B11R0.148 CC(=O)SCCCCNCCO c071184e831dfca58b9806ee4b93b3be [0,2,0,0,0,0|2,0,0]=4 8913 B11R0.148 CC(=O)SCCCCNCCS d44d9e2425df6321cde325a8ccb51b8f [0,2,0,0,0,0|2,0,0]=4 8914 B11R0.148 CC(=O)SCCCCOCCF 91291fc3f7b4312156d6bb150e55e040 [0,2,0,0,0,0|2,0,0]=4 8915 B11R0.148 CC(=O)SCCCCOCCS a4d431d8fd0003184bd3f00b9da1e465 [0,2,0,0,0,0|2,0,0]=4 8916 B11R0.148 CC(=O)SCCCNCCCCl a23bfa15b7083ca8fb82b13d5213a98f [0,2,0,0,0,0|2,0,0]=4 8917 B11R0.148 CC(=O)SCCCNCCCO cee2e2202c3cdc3625b54956e1acc9a6 [0,2,0,0,0,0|2,0,0]=4 8918 B11R0.148 CC(=O)SCCCOCCCF 0144d578cbf1f108c724d5de5c55c273 [0,2,0,0,0,0|2,0,0]=4 8919 B11R0.148 CC(=O)SCCCOCCCS e37fe0def850dcd6f513ea65295ce5aa [0,2,0,0,0,0|2,0,0]=4 8920 B11R0.148 CC(=O)SCCNCCCCCl 9e064f8fa85476a6895fd9e531e1a2f6 [0,2,0,0,0,0|2,0,0]=4 8921 B11R0.148 CC(=O)SCCNCCCCO 85991f8a0835a90e66205ae00a2e051e [0,2,0,0,0,0|2,0,0]=4 8922 B11R0.148 CC(=O)SCCNCCCCS 36f0e4a8ebfde99ca65d36d639ab1064 [0,2,0,0,0,0|2,0,0]=4 8923 B11R0.148 CC(=O)SCCOCCCCF 1c1a2a12383ed3dcd84c40e96ec17111 [0,2,0,0,0,0|2,0,0]=4 8924 B11R0.148 CC(=O)SCCOCCCCS f297d7f31e4cc35c65649881a1221170 [0,2,0,0,0,0|2,0,0]=4 8925 B11R0.148 CC(O)CCCCNCCCCl 82e45c1ce88e44235d045bdc773fc20d [0,2,0,0,0,0|1,0,1]=4 8926 B11R0.148 CC(O)CCCCNCCCO c21e68376b74a4270591e394eb58b490 [0,2,0,0,0,0|1,0,1]=4 8927 B11R0.148 CC(O)CCCNCCCCCl 0025e61905595b4183c78484c6ac6353 [0,2,0,0,0,0|1,0,1]=4 8928 B11R0.148 CC(O)CCCNCCCCO 3793e3cf16ce7d82568c302cad84803a [0,2,0,0,0,0|1,0,1]=4 8929 B11R0.148 CC(O)CCCNCCCCS 5e9fef9fba36d0d44964e7a251c656af [0,2,0,0,0,0|1,0,1]=4 8930 B11R0.148 CC(O)CCNCCCCCCl af5b3f409236dd9461c4e9723383c715 [0,2,0,0,0,0|1,0,1]=4 8931 B11R0.148 CC(O)CCNCCCCCF c0f7e3239303be23f708ac5238b7ee17 [0,2,0,0,0,0|1,0,1]=4 8932 B11R0.148 CC(O)CCNCCCCCO b1137dcf863a1f0f413c1d6c91a9e0b1 [0,2,0,0,0,0|1,0,1]=4 8933 B11R0.148 CC(O)CNCCCCCCCl ab3a2559e3a1c323e11a57f0e5845650 [0,2,0,0,0,0|1,0,1]=4 8934 B11R0.148 CC(O)CNCCCCCCF 204b7a8ba6869b1a7efa6b88d525a835 [0,2,0,0,0,0|1,0,1]=4 8935 B11R0.148 CC(O)CNCCCCCCO 36eca31e338ce79c2fd6b65828843992 [0,2,0,0,0,0|1,0,1]=4 8936 B11R0.148 CC/C=C/CCOCCC(=O)C c4bfcc2faa6b266f64a44f7a2cea6d9f [0,2,0,0,0,0|1,0,1]=4 8937 B11R0.148 CC/C=C/CCOCCC(=O)N 6a0ac15e817e5f9546c32ba58e961b9b [0,2,0,0,0,0|1,0,1]=4 8938 B11R0.148 CC/C=C/CCOCCC(=O)O bae755ef0769503a1f140d4a8b7bd568 [0,2,0,0,0,0|0,0,1]=3 8939 B11R0.148 CC/C=C/CNCCCC(=O)N ff59a849e23aa06409c1a0357a621bea [0,2,0,0,0,0|1,0,1]=4 8940 B11R0.148 CC/C=C/CNCCCC(=O)O a065d04028750dbc186b5c46e11673c4 [0,2,0,0,0,0|0,0,1]=3 8941 B11R0.148 CC/C=C/COCCCC(=O)C 54c87300b48f9bbe4f4fbe6ed5ac470f [0,2,0,0,0,0|1,0,1]=4 8942 B11R0.148 CC/C=C/COCCCC(=O)N 83e95426496b715f94d5aa8331da551e [0,2,0,0,0,0|1,0,1]=4 8943 B11R0.148 CC/C=C/COCCCC(=O)O 48db06f199b539c0b7eb28feafd2d5a9 [0,2,0,0,0,0|0,0,1]=3 8944 B11R0.148 CC/C=C\CCCOCC(=O)N 8515cdfb735b5d2c4188e4256a1d1206 [0,2,0,0,0,0|1,0,1]=4 8945 B11R0.148 CC/C=C\CCCOCC(=O)O 418107702edcb4b692b364a486645041 [0,2,0,0,0,0|0,0,1]=3 8946 B11R0.148 CC/C=C\CCNCCC(=O)N d0470707249ae306d9adb52b83f5d057 [0,2,0,0,0,0|1,0,1]=4 8947 B11R0.148 CC/C=C\CCNCCC(=O)O 6e7500a6b7562c91ec496e43ffda8475 [0,2,0,0,0,0|0,0,1]=3 8948 B11R0.148 CC/C=C\CCNCCS(=O)O fd11df80911260f1a7cb2d628391b3dd [0,2,0,0,0,0|1,0,1]=4 8949 B11R0.148 CC/C=C\CCOCCC(=O)C 28eb2f180b3260523b6c71f60031cd53 [0,2,0,0,0,0|1,0,1]=4 8950 B11R0.148 CC/C=C\CCOCCC(=O)N 86ac7714f0c376020cc1ee0fadf60ec8 [0,2,0,0,0,0|1,0,1]=4 8951 B11R0.148 CC/C=C\CCOCCC(=O)O abf88814f16276990998bc2a8f870be2 [0,2,0,0,0,0|0,0,1]=3 8952 B11R0.148 CC/C=C\COCCCC(=O)C 77743bb831eabbbe77d42982616b49d5 [0,2,0,0,0,0|1,0,1]=4 8953 B11R0.148 CC/C=C\COCCCC(=O)N 0462ae3592260c918f6deaa9754b6574 [0,2,0,0,0,0|1,0,1]=4 8954 B11R0.148 CC/C=C\COCCCC(=O)O 8ed7618cb12f9a8aeea2647a23d81d61 [0,2,0,0,0,0|0,0,1]=3 8955 B11R0.148 CC=C=CCCOCCC(=O)O ebd277a8b4404033eb4cf443092b6ad2 [0,2,0,0,0,0|0,0,2]=4 8956 B11R0.148 CC=CCCCOCCC(=O)C 50bcf156e2369b18b56816d1805153d2 [0,2,0,0,0,0|1,0,1]=4 8957 B11R0.148 CC=CCCCOCCC(=O)N caf128d8bb004c19da32286310e643da [0,2,0,0,0,0|1,0,1]=4 8958 B11R0.148 CC=CCCCOCCC(=O)O f6f86ced1362c071849b97938ba5204e [0,2,0,0,0,0|0,0,1]=3 8959 B11R0.148 CC=CCNCCCCC(=O)C 296a94e0be62cf093cb8964898119659 [0,2,0,0,0,0|1,0,1]=4 8960 B11R0.148 CC=CCNCCCCC(=O)N fbd97eba57b03ffb9b26e91b0ae74ec9 [0,2,0,0,0,0|1,0,1]=4 8961 B11R0.148 CC=CCNCCCCC(=O)O 48c56966ac4fb3c49c47586f8b97c510 [0,2,0,0,0,0|0,0,1]=3 8962 B11R0.148 CC=CCNCCOCC(=O)O 48d69bff85cccf228060e0dba0fb6ec5 [0,2,0,0,0,0|0,0,2]=4 8963 B11R0.148 CC=CCOCCCCC(=O)C 5c6450f66cf65929f42847c908ea9f53 [0,2,0,0,0,0|1,0,1]=4 8964 B11R0.148 CC=CCOCCCCC(=O)N 64d2f9917c4752e9ddaed48a6c8b5a55 [0,2,0,0,0,0|1,0,1]=4 8965 B11R0.148 CC=CCOCCCCC(=O)O 4f0d283fec8fd62f3e86f4402baea19f [0,2,0,0,0,0|0,0,1]=3 8966 B11R0.148 CC=CCOCCOCC(=O)O e9071827c2b5fa6a2d2620fce082791a [0,2,0,0,0,0|0,0,2]=4 8967 B11R0.148 CCC#CCCOCCC(=O)C 134beb0fd0e90bb7b991b9c0969328dc [0,2,0,0,0,0|1,0,1]=4 8968 B11R0.148 CCC#CCCOCCC(=O)N c15063044c38c4231d8c7b6d51019af2 [0,2,0,0,0,0|1,0,1]=4 8969 B11R0.148 CCC#CCCOCCC(=O)O 407c730437e157643f73fe52113450cd [0,2,0,0,0,0|0,0,1]=3 8970 B11R0.148 CCC#CCOCCCC(=O)C 5308ec2d6b8156346b47089d93b2d77b [0,2,0,0,0,0|1,0,1]=4 8971 B11R0.148 CCC#CCOCCCC(=O)N ea471da0c8bebced02a6ddad56350764 [0,2,0,0,0,0|1,0,1]=4 8972 B11R0.148 CCC/C=C/CNCCC(=O)N c7b89184b22316ba4f0fdeab4850d01e [0,2,0,0,0,0|1,0,1]=4 8973 B11R0.148 CCC/C=C/CNCCC(=O)O 7acc138c125caa3483073b72aeead0f0 [0,2,0,0,0,0|0,0,1]=3 8974 B11R0.148 CCC/C=C/CNCCS(=O)O ccf38e31fa05541a902dbf9c5149391a [0,2,0,0,0,0|1,0,1]=4 8975 B11R0.148 CCC/C=C/COCCC(=O)C 730a817159c6259737b15b14c6084f30 [0,2,0,0,0,0|1,0,1]=4 8976 B11R0.148 CCC/C=C/COCCC(=O)N 43dc066ea5ea8c6cc25cdc9a9b9eb151 [0,2,0,0,0,0|1,0,1]=4 8977 B11R0.148 CCC/C=C/COCCC(=O)O cdf8832bd16061f61af39f147d58392b [0,2,0,0,0,0|0,0,1]=3 8978 B11R0.148 CCC/C=C\CCOCC(=O)N ad1c5724831eb1acfcf7d7236050dc8d [0,2,0,0,0,0|1,0,1]=4 8979 B11R0.148 CCC/C=C\CCOCC(=O)O 7386dcb400fa9a5d7fe9159de9a0f603 [0,2,0,0,0,0|0,0,1]=3 8980 B11R0.148 CCC/C=C\CNCCC(=O)N da20a1389bb8489a6e4ed0f3090aeb5e [0,2,0,0,0,0|1,0,1]=4 8981 B11R0.148 CCC/C=C\CNCCC(=O)O d78dd3b6a65f39ab0590893e69ffddaa [0,2,0,0,0,0|0,0,1]=3 8982 B11R0.148 CCC/C=C\CNCCS(=O)O accee1e154e194c508619ee04568b48e [0,2,0,0,0,0|1,0,1]=4 8983 B11R0.148 CCC/C=C\COCCC(=O)C c68bb835449bc16f8fbfaf4651567962 [0,2,0,0,0,0|1,0,1]=4 8984 B11R0.148 CCC/C=C\COCCC(=O)N c8e155fa13567038ce21e33c5f8ce1b0 [0,2,0,0,0,0|1,0,1]=4 8985 B11R0.148 CCC/C=C\COCCC(=O)O 85e1aafea97e07217acb9c5d7dc9ef11 [0,2,0,0,0,0|0,0,1]=3 8986 B11R0.148 CCCC#CCCOCC(=O)N 65bbb47c6b2351e6d00563ddcc4b0278 [0,2,0,0,0,0|1,0,1]=4 8987 B11R0.148 CCCC#CCCOCC(=O)O af630c364e3283e8eae6d25efda2d4ca [0,2,0,0,0,0|0,0,1]=3 8988 B11R0.148 CCCC#CCOCCC(=O)C 94acf0dc8f087b21a6c41b379fa399c8 [0,2,0,0,0,0|1,0,1]=4 8989 B11R0.148 CCCC#CCOCCC(=O)N 3190814dd927f5adae92dfeed69a33ff [0,2,0,0,0,0|1,0,1]=4 8990 B11R0.148 CCCC#CCOCCC(=O)O aa4d0939892cbb459b635c3f643f0209 [0,2,0,0,0,0|0,0,1]=3 8991 B11R0.148 CCCC/C=C/CNCC(=O)C 859f00af162c1c43a5c50ae06d8f1492 [0,2,0,0,0,0|1,0,1]=4 8992 B11R0.148 CCCC/C=C/CNCC(=O)N fbdd3b848c11a1a1f41244283993b680 [0,2,0,0,0,0|1,0,1]=4 8993 B11R0.148 CCCC/C=C/CNCC(=O)O b3eb0975e1d9d666b5c697b95659a159 [0,2,0,0,0,0|0,0,1]=3 8994 B11R0.148 CCCC/C=C/COCC(=O)C 5aef7b1a2e1e69c6e7289676342831ed [0,2,0,0,0,0|1,0,1]=4 8995 B11R0.148 CCCC/C=C/COCC(=O)N 2028737323acd54e3ffde5ba9e0e35c0 [0,2,0,0,0,0|1,0,1]=4 8996 B11R0.148 CCCC/C=C/COCC(=O)O 077a70f521a7f93e5a874728d5fa9c34 [0,2,0,0,0,0|0,0,1]=3 8997 B11R0.148 CCCC/C=C/COCS(=O)O fde751636257aefbf4f95fd40edbf54a [0,2,0,0,0,0|1,0,1]=4 8998 B11R0.148 CCCC/C=C\CNCC(=O)C 7498599996a57be5a58df94acd270bd3 [0,2,0,0,0,0|1,0,1]=4 8999 B11R0.148 CCCC/C=C\CNCC(=O)N 4fcb4fea1e7d49a1c3bda58caff06eeb [0,2,0,0,0,0|1,0,1]=4 9000 B11R0.148 CCCC/C=C\CNCC(=O)O 3ba6f769e98348afa2826db146631e9b [0,2,0,0,0,0|0,0,1]=3 9001 B11R0.148 CCCC/C=C\COCC(=O)C de0b261daf2e50eeb64342772c9392e1 [0,2,0,0,0,0|1,0,1]=4 9002 B11R0.148 CCCC/C=C\COCC(=O)N 21249ac39354787b34e8d1ccda352180 [0,2,0,0,0,0|1,0,1]=4 9003 B11R0.148 CCCC/C=C\COCC(=O)O 110cbe91fd6acad57de2c910e1b1e5f6 [0,2,0,0,0,0|0,0,1]=3 9004 B11R0.148 CCCC/C=C\COCS(=O)O ded3d1d2273873e720f68d12cc46aa46 [0,2,0,0,0,0|1,0,1]=4 9005 B11R0.148 CCCCC#CCOCC(=O)N 82363db81f32aa164a0b5acf229fdba0 [0,2,0,0,0,0|1,0,1]=4 9006 B11R0.148 CCCCCCCCNC(=O)C 9209ef01a8d3ac54b45708fef3a289cf [0,2,0,0,0,0|1,0,0]=3 9007 B11R0.148 CCCCCCCNCC(=O)C ac5ad78030b2337dde4637cf4e637be8 [0,2,0,0,0,0|1,0,0]=3 9008 B11R0.148 CCCCCCCNCC(=O)N 2fdb0dfccf9f802c713cfdaa07ea8b3d [0,2,0,0,0,0|1,0,0]=3 9009 B11R0.148 CCCCCCCNCC(=O)O 604ac707776db9c80f9dbe81aba07aab [0,2,0,0,0,0|0,0,0]=2 9010 B11R0.148 CCCCCCCNCC(C)O 4ec41632ad94b262d50d201b12eea63c [0,2,0,0,0,0|1,0,1]=4 9011 B11R0.148 CCCCCCCNC[C@@H](C)O 2f370e1df4cf53b1cc448becf8319123 [0,2,0,0,0,0|1,0,1]=4 9012 B11R0.148 CCCCCCCNC[C@H](C)O ffa725a82af0b73a341a438150dba913 [0,2,0,0,0,0|1,0,1]=4 9013 B11R0.148 CCCCCCCNC[N+](=O)[O-] c0679a4f548ff0671049820f57ae631f [0,2,0,0,0,0|1,0,1]=4 9014 B11R0.148 CCCCCCCOCC(=O)C dc592c317774d5dcca7353cd0379c413 [0,2,0,0,0,0|1,0,0]=3 9015 B11R0.148 CCCCCCCOCC(=O)N e5e33b5f144e3b12955641244340651b [0,2,0,0,0,0|1,0,0]=3 9016 B11R0.148 CCCCCCCOCC(=O)O 2e9c1bc97c278d8f4eec0fc057b4f886 [0,2,0,0,0,0|0,0,0]=2 9017 B11R0.148 CCCCCCCOCC(=S)N ea69c6884831d0bc2d9a37abf4288eb5 [0,2,0,0,0,0|1,1,0]=4 9018 B11R0.148 CCCCCCCOCS(=O)O a9e9ed12c8e5ec5a425575bf0efe96a6 [0,2,0,0,0,0|1,0,0]=3 9019 B11R0.148 CCCCCCCOC[N+](=O)[O-] 3f9cbc61a4053c393efda689f3dc606a [0,2,0,0,0,0|1,0,1]=4 9020 B11R0.148 CCCCCCNC/C=C(/C)\I de46a617e926fa7265c7ea6a0d6454b4 [0,2,0,0,0,0|2,0,0]=4 9021 B11R0.148 CCCCCCNC/C=C(\C)/Cl 5e1e5f5c0eae22e6ce2fa87264437d45 [0,2,0,0,0,0|2,0,0]=4 9022 B11R0.148 CCCCCCNCC=C(C)C 268cde1eac403971a29775244b20f6fb [0,2,0,0,0,0|2,0,0]=4 9023 B11R0.148 CCCCCCNCC=C(C)Cl 9b26f9313727dabf75856a169d7d9509 [0,2,0,0,0,0|2,0,0]=4 9024 B11R0.148 CCCCCCNCC=C(C)I 4649296a1e9af8c45e014cea46a02b0d [0,2,0,0,0,0|2,0,0]=4 9025 B11R0.148 CCCCCCNCC=C(Cl)Cl d5e07fcc4c50d4d3f1ace6ae7b997120 [0,2,0,0,0,0|2,0,0]=4 9026 B11R0.148 CCCCCCNCCC(=O)C dae7d5a91b1ed61fc00f967bfae50950 [0,2,0,0,0,0|1,0,0]=3 9027 B11R0.148 CCCCCCNCCC(=O)N 56cad85fb9e1e012d0ba0b01c59f0ee9 [0,2,0,0,0,0|1,0,0]=3 9028 B11R0.148 CCCCCCNCCC(=O)O 8d33e817dab78094c47164cc7392c6c0 [0,2,0,0,0,0|0,0,0]=2 9029 B11R0.148 CCCCCCNCCC(=S)N 0f339dc41df1d7ce9e93328d64a9e97e [0,2,0,0,0,0|1,1,0]=4 9030 B11R0.148 CCCCCCNCCC(C)O b61f5b6cff5c878fd1c98373352f3fc1 [0,2,0,0,0,0|1,0,1]=4 9031 B11R0.148 CCCCCCNCCS(=O)C 475c88c63a6ae669c4c216d277e2870d [0,2,0,0,0,0|2,0,0]=4 9032 B11R0.148 CCCCCCNCCS(=O)O c59e7a819938a1baeb219ab5b5f69d6b [0,2,0,0,0,0|1,0,0]=3 9033 B11R0.148 CCCCCCNCC[C@@H](C)O 5073f91f32a9c4b3d6ac7aff2d46c023 [0,2,0,0,0,0|1,0,1]=4 9034 B11R0.148 CCCCCCNCC[C@H](C)O 87478981820d3d93e2f171457dfcd978 [0,2,0,0,0,0|1,0,1]=4 9035 B11R0.148 CCCCCCNCOC(=O)C 1c1a5627acb6c3fcacc91b183f2cb953 [0,2,0,0,0,0|1,0,0]=3 9036 B11R0.148 CCCCCCNCSC(=O)N a7e650a3db55d02ceb6601bc7a3b629b [0,2,0,0,0,0|1,0,0]=3 9037 B11R0.148 CCCCCCOC/C=C(/C)\Cl 3217da00020186109ac684268f3a4229 [0,2,0,0,0,0|2,0,0]=4 9038 B11R0.148 CCCCCCOC/C=C(/C)\I 42d6eaabbd9ccb5371b986581e746e3c [0,2,0,0,0,0|2,0,0]=4 9039 B11R0.148 CCCCCCOC/C=C(\C)/Cl fe5511dbc0d53edaf2e45e378bf83eb9 [0,2,0,0,0,0|2,0,0]=4 9040 B11R0.148 CCCCCCOCC=C(C)C 01521535f7ea090dd629b3eba93168e9 [0,2,0,0,0,0|2,0,0]=4 9041 B11R0.148 CCCCCCOCC=C(C)Cl 449202f9925926f3cc218782fb7d580a [0,2,0,0,0,0|2,0,0]=4 9042 B11R0.148 CCCCCCOCC=C(C)I 8716b7b87fe38c49ecc86d416f4d13fd [0,2,0,0,0,0|2,0,0]=4 9043 B11R0.148 CCCCCCOCC=C(Cl)Cl 284b7ffbb5033acc6fdf1f25a24db64c [0,2,0,0,0,0|2,0,0]=4 9044 B11R0.148 CCCCCCOCCC(=O)C ba6ca6ffd5fb9c6cc4e8d129cf77ebb5 [0,2,0,0,0,0|1,0,0]=3 9045 B11R0.148 CCCCCCOCCC(=O)N 54320f1e572400bcb39399fa00db0727 [0,2,0,0,0,0|1,0,0]=3 9046 B11R0.148 CCCCCCOCCC(=O)O 4717319825633e38fbcaeec5411785fc [0,2,0,0,0,0|0,0,0]=2 9047 B11R0.148 CCCCCCOCCS(=O)C 48fd1036c35525fa02a6d7c816b35e4a [0,2,0,0,0,0|2,0,0]=4 9048 B11R0.148 CCCCCCOCC[N+](=O)[O-] de5eb72a8a9f184e849a2b75f8c48976 [0,2,0,0,0,0|1,0,1]=4 9049 B11R0.148 CCCCCCOCNC(=O)C 821b7a0837138668b121aff777d67519 [0,2,0,0,0,0|1,0,0]=3 9050 B11R0.148 CCCCCCOCNC(=O)N fed68983f827725d498d5dfb617d4a9b [0,2,0,0,0,0|1,0,0]=3 9051 B11R0.148 CCCCCCOCOC(=O)C 7357a2b41ac7b5a18efb5ca4e2678b36 [0,2,0,0,0,0|1,0,0]=3 9052 B11R0.148 CCCCCCOCSC(=O)N a7299f4ab4ae42885a28e4261898abe6 [0,2,0,0,0,0|1,0,0]=3 9053 B11R0.148 CCCCCNC/C=C/C(=O)O b8046f0d80c9ff3885cdfa6c42d71162 [0,2,0,0,0,0|0,0,1]=3 9054 B11R0.148 CCCCCNCC#CC(=O)N 376dd1e39d87aad7056cf0734caa30f5 [0,2,0,0,0,0|1,0,1]=4 9055 B11R0.148 CCCCCNCC#CC(=O)O aed9235485305f99eb505497ed25180e [0,2,0,0,0,0|0,0,1]=3 9056 B11R0.148 CCCCCNCC=CC(=O)O 58813a84cba492cefaaec0f7c2af3ed6 [0,2,0,0,0,0|0,0,1]=3 9057 B11R0.148 CCCCCNCCC=C(C)C d6637617b4955445c507124ad86b540e [0,2,0,0,0,0|2,0,0]=4 9058 B11R0.148 CCCCCNCCC=C(F)F 12a9b0ffdb638c3ef2d1bbe0b6915112 [0,2,0,0,0,0|2,0,0]=4 9059 B11R0.148 CCCCCNCCCC(=O)C ae79e8ea156a5e770911e0ef57b141fd [0,2,0,0,0,0|1,0,0]=3 9060 B11R0.148 CCCCCNCCCC(=O)N 6cb86dd703d81819cb42e7bbe50cbf67 [0,2,0,0,0,0|1,0,0]=3 9061 B11R0.148 CCCCCNCCCC(=O)O ce92314d02facc18c8164866ccc58acb [0,2,0,0,0,0|0,0,0]=2 9062 B11R0.148 CCCCCNCCCC(C)O 6e88f019848ff48aa5580012b93e4ead [0,2,0,0,0,0|1,0,1]=4 9063 B11R0.148 CCCCCNCCCS(=O)C 987b67a292910faec3dd3726262729bb [0,2,0,0,0,0|2,0,0]=4 9064 B11R0.148 CCCCCNCCC[N+](=O)[O-] 10b9119f7a09d0e3363d31224254b5b4 [0,2,0,0,0,0|1,0,1]=4 9065 B11R0.148 CCCCCNCCNC(=O)C 7ff8c0f5354f73956142fbe6902b9879 [0,2,0,0,0,0|1,0,0]=3 9066 B11R0.148 CCCCCNCCNC(=O)N d933535d3b9427d0f0e56b1ded0a266f [0,2,0,0,0,0|1,0,0]=3 9067 B11R0.148 CCCCCNCCNC(=S)N 2f7ffa6ee90c5a918cbafc95c50fea06 [0,2,0,0,0,0|1,1,0]=4 9068 B11R0.148 CCCCCNCCOC(=O)C 729f700d5178f65d822ba15d79799d97 [0,2,0,0,0,0|1,0,0]=3 9069 B11R0.148 CCCCCNCCSC(=O)C d915aac4f03ed25f4f02a1b6cd47cc5d [0,2,0,0,0,0|1,0,0]=3 9070 B11R0.148 CCCCCOC/C=C/C(=O)O 3d3460a3a6eee12116378f2de4d92d1f [0,2,0,0,0,0|0,0,1]=3 9071 B11R0.148 CCCCCOCC#CC(=O)O 5c208b4c2dc6a197983d39a5def0aeed [0,2,0,0,0,0|0,0,1]=3 9072 B11R0.148 CCCCCOCC=CC(=O)O ac6921bf081433b1f8d6059fbeb527c4 [0,2,0,0,0,0|0,0,1]=3 9073 B11R0.148 CCCCCOCCC=C(C)C 474567c7ad39799d75b5ca9d8bdddc96 [0,2,0,0,0,0|2,0,0]=4 9074 B11R0.148 CCCCCOCCC=C(F)F 4bc2bc592390ae6e531d4933262b3ac3 [0,2,0,0,0,0|2,0,0]=4 9075 B11R0.148 CCCCCOCCCC(=O)C 2d5fb2796be532f83de2b588a833a781 [0,2,0,0,0,0|1,0,0]=3 9076 B11R0.148 CCCCCOCCCC(=O)N 6551ad614f50be62a9bef870153adc2e [0,2,0,0,0,0|1,0,0]=3 9077 B11R0.148 CCCCCOCCC[N+](=O)[O-] 74c985d4dc1007b525e7950e6e4d8fab [0,2,0,0,0,0|1,0,1]=4 9078 B11R0.148 CCCCCOCCNC(=O)C 89e6bc94e5e2df2872af87ea20002aa7 [0,2,0,0,0,0|1,0,0]=3 9079 B11R0.148 CCCCCOCCNC(=O)N 13c3811bac8616ed5cb39b3a52e35835 [0,2,0,0,0,0|1,0,0]=3 9080 B11R0.148 CCCCCOCCNC(=S)N 88d050dc7f8cc439d4cb1e618659a841 [0,2,0,0,0,0|1,1,0]=4 9081 B11R0.148 CCCCCOCCOC(=O)C ce892e28021cd219f16b0c1b93f354de [0,2,0,0,0,0|1,0,0]=3 9082 B11R0.148 CCCCCOCCSC(=O)C 381130fac5641be83bacac00ee2d726c [0,2,0,0,0,0|1,0,0]=3 9083 B11R0.148 CCCCNCCCCC(=O)C 544c9e2e2e33eb4d7d7343bae90cd58e [0,2,0,0,0,0|1,0,0]=3 9084 B11R0.148 CCCCNCCCCC(=O)N 314026e751faa5b11c0ecab80061f9d7 [0,2,0,0,0,0|1,0,0]=3 9085 B11R0.148 CCCCNCCCCC(=O)O db2891a1a49d26c3dd9a356095c13ecb [0,2,0,0,0,0|0,0,0]=2 9086 B11R0.148 CCCCNCCCCC(C)O d25cea83b94c590c11c2a73b0c167344 [0,2,0,0,0,0|1,0,1]=4 9087 B11R0.148 CCCCNCCCC[C@@H](C)O 8b68c1025addda349947f3fed9cd8b0f [0,2,0,0,0,0|1,0,1]=4 9088 B11R0.148 CCCCNCCCNC(=O)C 6d0de7a58670364332bd2c26e8ee7cdd [0,2,0,0,0,0|1,0,0]=3 9089 B11R0.148 CCCCNCCCOC(=O)C 7853525c1345bc50778fe7631411e66c [0,2,0,0,0,0|1,0,0]=3 9090 B11R0.148 CCCCNCCCOC(=S)C 73028220c83de81b0b3e572a11606df7 [0,2,0,0,0,0|1,1,0]=4 9091 B11R0.148 CCCCNCCCSC(=O)C db939ed2d8d03cfa10c8f82ccb5505ff [0,2,0,0,0,0|1,0,0]=3 9092 B11R0.148 CCCCNCCOCC(=O)N 19ec254951a01b30e55b59b666e6f6af [0,2,0,0,0,0|1,0,0]=3 9093 B11R0.148 CCCCNCCOCC(=O)O c3ef0b6e39b500596a34f8201361fc3a [0,2,0,0,0,0|0,0,0]=2 9094 B11R0.148 CCCCNCCSCC(=O)O 19c0aa25c2747ad4736c5abc66ee689c [0,2,0,0,0,0|0,0,0]=2 9095 B11R0.148 CCCCOCCC#CC(=O)O 74d0efe4ad55f9a50fc1408fe4f834e6 [0,2,0,0,0,0|0,0,1]=3 9096 B11R0.148 CCCCOCCCCC(=O)C a62f0819767c2537c037059a9981780c [0,2,0,0,0,0|1,0,0]=3 9097 B11R0.148 CCCCOCCCCC(=O)N cb00e11a7c4db378275f51f63aaca2e7 [0,2,0,0,0,0|1,0,0]=3 9098 B11R0.148 CCCCOCCCCC(=O)O 00e520501e14c3e825ffc7300146a3fe [0,2,0,0,0,0|0,0,0]=2 9099 B11R0.148 CCCCOCCCC[N+](=O)[O-] 945fc8d07071bde3444714f6c7856ad4 [0,2,0,0,0,0|1,0,1]=4 9100 B11R0.148 CCCCOCCCNC(=O)C 14281244af5a76ea832226605fbb85e4 [0,2,0,0,0,0|1,0,0]=3 9101 B11R0.148 CCCCOCCCOC(=O)C 477c462ef377d29beb78f95f82bb25eb [0,2,0,0,0,0|1,0,0]=3 9102 B11R0.148 CCCCOCCCOC(=S)C d7aa2aa09240a85edad907d4be4b954e [0,2,0,0,0,0|1,1,0]=4 9103 B11R0.148 CCCCOCCCO[N+](=O)[O-] 05f28463994a4f289ccb5d72e8b43f61 [0,2,0,0,0,0|1,0,1]=4 9104 B11R0.148 CCCCOCCCSC(=O)C 614b19a166ecdbfad1b2d0cb89ad3484 [0,2,0,0,0,0|1,0,0]=3 9105 B11R0.148 CCCCOCCNCC(=O)C 223e03f8df314d1ffe7fa22f1e699f9f [0,2,0,0,0,0|1,0,0]=3 9106 B11R0.148 CCCCOCCNCC(=O)N d55758adec6732215d7faa76d4932df2 [0,2,0,0,0,0|1,0,0]=3 9107 B11R0.148 CCCCOCCNCC(=O)O 5e535394d6f535f6322b79b8b1a838be [0,2,0,0,0,0|0,0,0]=2 9108 B11R0.148 CCCCOCCNCC(C)O 21638369de26bd8dcdd1ce22cb7c6542 [0,2,0,0,0,0|1,0,1]=4 9109 B11R0.148 CCCCOCCNC[C@@H](C)O 22110216e6ac6ac22cb317487440a16a [0,2,0,0,0,0|1,0,1]=4 9110 B11R0.148 CCCCOCCNC[C@H](C)O 9b5446281ca28925eafc13772c4e97e0 [0,2,0,0,0,0|1,0,1]=4 9111 B11R0.148 CCCCOCCNC[N+](=O)[O-] bece6fa58b9e933099b8a0b888f7f346 [0,2,0,0,0,0|1,0,1]=4 9112 B11R0.148 CCCCOCCOCC(=O)C a1059fc843b2eaa33e87055a6bc4e6be [0,2,0,0,0,0|1,0,0]=3 9113 B11R0.148 CCCCOCCOCC(=O)N de6114605ae237d4b8297b1463cd7bb3 [0,2,0,0,0,0|1,0,0]=3 9114 B11R0.148 CCCCOCCOCC(=O)O f3952d347bddfc2dfd656d051a77ceb9 [0,2,0,0,0,0|0,0,0]=2 9115 B11R0.148 CCCCOCCOCC(=S)N 6186b5f55e9be995b0a2a036c38ad632 [0,2,0,0,0,0|1,1,0]=4 9116 B11R0.148 CCCCOCCOCS(=O)O 33a2fbe99da1dea6ea5418c41ee40add [0,2,0,0,0,0|1,0,0]=3 9117 B11R0.148 CCCCOCCOC[N+](=O)[O-] ebcb308fb830ee97668cfc92b71f433e [0,2,0,0,0,0|1,0,1]=4 9118 B11R0.148 CCCCOCCSCC(=O)N c3e4c14d2608d473c3ff9ff4504d12f1 [0,2,0,0,0,0|1,0,0]=3 9119 B11R0.148 CCCCOCNCCC(=O)N 63106c9421e44307d938df1abc9eec5d [0,2,0,0,0,0|1,0,0]=3 9120 B11R0.148 CCCCOCNCCC(=O)O 59d3523aaed3910cf6d2b55b40981768 [0,2,0,0,0,0|0,0,0]=2 9121 B11R0.148 CCCCOCNCCC(=S)N 65e8aa634c3ef3f77f7b137e5f04c388 [0,2,0,0,0,0|1,1,0]=4 9122 B11R0.148 CCCCOCNCCC(C)O 148db482aa009f71727e8341be3f6b11 [0,2,0,0,0,0|1,0,1]=4 9123 B11R0.148 CCCCOCNCCS(=O)C ffd53be59a1b68f36c155cd13b993a08 [0,2,0,0,0,0|2,0,0]=4 9124 B11R0.148 CCCCOCNCCS(=O)O 922462d2e6d1cea98d0bc53d7075cb06 [0,2,0,0,0,0|1,0,0]=3 9125 B11R0.148 CCCCOCNCC[C@@H](C)O e6c1371cbf0bfa6e9c8730efe0b35016 [0,2,0,0,0,0|1,0,1]=4 9126 B11R0.148 CCCCOCNCC[C@H](C)O 1bad416644b19aecf572e308a0d04d6d [0,2,0,0,0,0|1,0,1]=4 9127 B11R0.148 CCCCOCOCCC(=O)C 42ce30f9bc9443451f7915bee899e3ba [0,2,0,0,0,0|1,0,0]=3 9128 B11R0.148 CCCCOCOCCC(=O)N 043946ddc364602094f988fa5c5ecd02 [0,2,0,0,0,0|1,0,0]=3 9129 B11R0.148 CCCCOCOCCC(=O)O 1fc55cd284db7eca48e94025d087c373 [0,2,0,0,0,0|0,0,0]=2 9130 B11R0.148 CCCCOCOCCS(=O)C 419b0f625e6b8bfb82d349938b2d67c8 [0,2,0,0,0,0|2,0,0]=4 9131 B11R0.148 CCCCOCOCC[N+](=O)[O-] c04485318a7cf403a534c6f15ed3d5d9 [0,2,0,0,0,0|1,0,1]=4 9132 B11R0.148 CCCCOCOCNC(=O)C fe5611e158193767acd492ee37902052 [0,2,0,0,0,0|2,0,0]=4 9133 B11R0.148 CCCCOCOCNC(=O)N f3b8781bdb7072974a663cf3d5f702f3 [0,2,0,0,0,0|2,0,0]=4 9134 B11R0.148 CCCCSCCOCC(=O)N b52a7edd450ff66701eadb26af462853 [0,2,0,0,0,0|1,0,0]=3 9135 B11R0.148 CCCCSCCOCC(=O)O ac797cbb248e6531ce12e2e37d4432b3 [0,2,0,0,0,0|0,0,0]=2 9136 B11R0.148 CCCCSCCOC[N+](=O)[O-] 8e82aea0bf82f07ce9ba61e2e1c92c36 [0,2,0,0,0,0|1,0,1]=4 9137 B11R0.148 CCCNCCCCCC(=O)C 354cff2ef02214f278274b1186349715 [0,2,0,0,0,0|1,0,0]=3 9138 B11R0.148 CCCNCCCCCC(=O)N 2e59cc5df0185c8509f72f74417558d3 [0,2,0,0,0,0|1,0,0]=3 9139 B11R0.148 CCCNCCCCCC(=O)O 040617eb9e641e6c46ed6e1b925655c5 [0,2,0,0,0,0|0,0,0]=2 9140 B11R0.148 CCCNCCCCNC(=O)C afc7cb87fbf2cd12eb8fe76075788aed [0,2,0,0,0,0|1,0,0]=3 9141 B11R0.148 CCCNCCCCOC(=O)C 5de6dd97eb13f02e3674c0a89f759217 [0,2,0,0,0,0|1,0,0]=3 9142 B11R0.148 CCCNCCCCSC(=O)C e67c14e897e8fe6720f2feb7de9105a1 [0,2,0,0,0,0|1,0,0]=3 9143 B11R0.148 CCCNCCCOCC(=O)O 0fe8426b6f63ee30bea77f979722006c [0,2,0,0,0,0|0,0,0]=2 9144 B11R0.148 CCCNCCOCCC(=O)O 1f840a8dfeffea9a17d6831074997663 [0,2,0,0,0,0|0,0,0]=2 9145 B11R0.148 CCCNCOCCOC(=O)C d68af067b97b21e6e41f54397a824b04 [0,2,0,0,0,0|2,0,0]=4 9146 B11R0.148 CCCOCCCCCC(=O)C a9dd639cc488907d7b3255974d45f633 [0,2,0,0,0,0|1,0,0]=3 9147 B11R0.148 CCCOCCCCCC(=O)N c8deadad22ee695447eda984e0e00b27 [0,2,0,0,0,0|1,0,0]=3 9148 B11R0.148 CCCOCCCCCC(=O)O fa333152e0beffd56620c1d14609917b [0,2,0,0,0,0|0,0,0]=2 9149 B11R0.148 CCCOCCCCOC(=O)C 76d456e7ca4c7cd8d390c54bbbefcd78 [0,2,0,0,0,0|1,0,0]=3 9150 B11R0.148 CCCOCCCCSC(=O)C 369c27db8c9be1ed6dd5c9b10da52191 [0,2,0,0,0,0|1,0,0]=3 9151 B11R0.148 CCCOCCCNCC(=O)C 4d98936bd08942b43acf72033a9b2c2f [0,2,0,0,0,0|1,0,0]=3 9152 B11R0.148 CCCOCCCNCC(=O)N 3f6559c926d4446f66c2980ab6a9ed59 [0,2,0,0,0,0|1,0,0]=3 9153 B11R0.148 CCCOCCCNCC(=O)O 295a16ed1d6368a92e0dacd0d6a7c9c0 [0,2,0,0,0,0|0,0,0]=2 9154 B11R0.148 CCCOCCCNCC(C)O d6c82e5b454bd2c3c1ef1a72075342a6 [0,2,0,0,0,0|1,0,1]=4 9155 B11R0.148 CCCOCCCNC[C@@H](C)O 6e88951d00154414b61d7211b634d068 [0,2,0,0,0,0|1,0,1]=4 9156 B11R0.148 CCCOCCCNC[C@H](C)O d00db65afbc8acf57f37b1f7276f5c44 [0,2,0,0,0,0|1,0,1]=4 9157 B11R0.148 CCCOCCCNC[N+](=O)[O-] 50c20fa671e6543eca745862501cbde2 [0,2,0,0,0,0|1,0,1]=4 9158 B11R0.148 CCCOCCCOCC(=O)C 809ccbc1f7a0704a8f6d3af11b40fcaf [0,2,0,0,0,0|1,0,0]=3 9159 B11R0.148 CCCOCCCOCC(=O)N 197dd0390ce26a2b6584122ab22a2235 [0,2,0,0,0,0|1,0,0]=3 9160 B11R0.148 CCCOCCCOCC(=O)O 1f8662db2650bfb91265d5551bc7d84a [0,2,0,0,0,0|0,0,0]=2 9161 B11R0.148 CCCOCCCOCC(=S)N cd9817cd70e4e0ba0b4cefed1748af65 [0,2,0,0,0,0|1,1,0]=4 9162 B11R0.148 CCCOCCCOCS(=O)O 69e55982009fd54d35ebcf71dab401fd [0,2,0,0,0,0|1,0,0]=3 9163 B11R0.148 CCCOCCNCCC(=O)C 27f26296f1d645079891271267b1fb1b [0,2,0,0,0,0|1,0,0]=3 9164 B11R0.148 CCCOCCNCCC(=O)N 147d0212973a9be645b8770a7dbc2926 [0,2,0,0,0,0|1,0,0]=3 9165 B11R0.148 CCCOCCNCCC(=O)O 3216e228b5856edae86b90ecacfcf231 [0,2,0,0,0,0|0,0,0]=2 9166 B11R0.148 CCCOCCNCCC(=S)N 82c1a09da703b5e6f838ed1930118be1 [0,2,0,0,0,0|1,1,0]=4 9167 B11R0.148 CCCOCCNCCC(C)O 9e42e86b2c65219b29026f67ec48a629 [0,2,0,0,0,0|1,0,1]=4 9168 B11R0.148 CCCOCCNCCS(=O)C 4873b7dde81c07f72cc8148db6affdd1 [0,2,0,0,0,0|2,0,0]=4 9169 B11R0.148 CCCOCCNCCS(=O)O 7423dd033d54c3a000a3b2077a569114 [0,2,0,0,0,0|1,0,0]=3 9170 B11R0.148 CCCOCCNCC[C@@H](C)O 4d6f01ae93be492b4114fb6bd706abf7 [0,2,0,0,0,0|1,0,1]=4 9171 B11R0.148 CCCOCCNCC[C@H](C)O aca507be6d5f70b61f2f0120f005d5dc [0,2,0,0,0,0|1,0,1]=4 9172 B11R0.148 CCCOCCNCOC(=O)C 53bfdace8f47c1705f903a1ea9b4b97c [0,2,0,0,0,0|2,0,0]=4 9173 B11R0.148 CCCOCCNCSC(=O)N a7669f5c3797a5800c1d09feb3247c23 [0,2,0,0,0,0|2,0,0]=4 9174 B11R0.148 CCCOCCOCCC(=O)C f9360e39798c51853ea8dd13387b8f0a [0,2,0,0,0,0|1,0,0]=3 9175 B11R0.148 CCCOCCOCCC(=O)N 3273f455bae16f946489f0fece6c2b5d [0,2,0,0,0,0|1,0,0]=3 9176 B11R0.148 CCCOCCOCCC(=O)O 481e9c6b14336445a42a64879cba16db [0,2,0,0,0,0|0,0,0]=2 9177 B11R0.148 CCCOCCOCCS(=O)C 6ea139e69464dc6fd81d92e222cbb550 [0,2,0,0,0,0|2,0,0]=4 9178 B11R0.148 CCCOCCOCC[N+](=O)[O-] 1576b8354fbfebe058713b7519f39121 [0,2,0,0,0,0|1,0,1]=4 9179 B11R0.148 CCCOCCOCNC(=O)C b23ae07fb758e79a0e555882eb4a5259 [0,2,0,0,0,0|2,0,0]=4 9180 B11R0.148 CCCOCCOCNC(=O)N 43a2491876f40a8aaeb65c667958f64d [0,2,0,0,0,0|2,0,0]=4 9181 B11R0.148 CCCOCCOCOC(=O)C b7ccbdf6c032bbd88c5c0f2e9fa4c63c [0,2,0,0,0,0|2,0,0]=4 9182 B11R0.148 CCCOCCOCSC(=O)N a035b9501ad15230cbc3153420b1c21b [0,2,0,0,0,0|2,0,0]=4 9183 B11R0.148 CCCOCOCCOC(=O)C 5e38b62d62f5ae1c5aa251aa72e942f6 [0,2,0,0,0,0|2,0,0]=4 9184 B11R0.148 CCCSCCCCNC(=O)C b995a956a32500c52f19eeccf108b053 [0,2,0,0,0,0|1,0,0]=3 9185 B11R0.148 CCCSCCOCCC(=O)C d89b27589e5966e2907586fbff605623 [0,2,0,0,0,0|1,0,0]=3 9186 B11R0.148 CCCSCCOCCC(=O)N 85b369b81b790676226e5cb1db8ab897 [0,2,0,0,0,0|1,0,0]=3 9187 B11R0.148 CCCSCCOCCC(=O)O 547739abbd1ded8057bcdde3e3594a1e [0,2,0,0,0,0|0,0,0]=2 9188 B11R0.148 CCCSCCOCCS(=O)C 8b99c2b828314be2223ad8dc9b902f58 [0,2,0,0,0,0|2,0,0]=4 9189 B11R0.148 CCCSCCOCOC(=O)C 2ada1b2d1290f60eded3d0d3e4a3e397 [0,2,0,0,0,0|2,0,0]=4 9190 B11R0.148 CCCSCCOCSC(=O)N dc44455a1dedf57e5ae8b31e6ef6199f [0,2,0,0,0,0|2,0,0]=4 9191 B11R0.148 CCNCCCCCCC(=O)O e9a5c8afc11b12a621b1b3a6781fbc3e [0,2,0,0,0,0|0,0,0]=2 9192 B11R0.148 CCNCCCCCNC(=O)C 73d4870ba672365fcc36e846ca9b99bb [0,2,0,0,0,0|1,0,0]=3 9193 B11R0.148 CCNCCCSCCC(=O)N 3b9d810794bbb3a8b1829f65b110481c [0,2,0,0,0,0|1,0,0]=3 9194 B11R0.148 CCOCCCCCCC(=O)N 4309c4ad68143dc07468ec85b2f0df7c [0,2,0,0,0,0|1,0,0]=3 9195 B11R0.148 CCOCCCCCCC(=O)O c60be55443aee57331a1445b50b93edc [0,2,0,0,0,0|0,0,0]=2 9196 B11R0.148 CCOCCCNCCC(=O)C 46f69c4f1f67e6be60c924b9fca5b953 [0,2,0,0,0,0|1,0,0]=3 9197 B11R0.148 CCOCCCNCCC(=O)N fe6219109658eca7fe6cac38be5013c4 [0,2,0,0,0,0|1,0,0]=3 9198 B11R0.148 CCOCCCNCCC(=O)O 2b2f9d5d9072aa622d59e92279d2763e [0,2,0,0,0,0|0,0,0]=2 9199 B11R0.148 CCOCCCNCCC(=S)N 4e3e2fff25d09151bbe61ee0c963f342 [0,2,0,0,0,0|1,1,0]=4 9200 B11R0.148 CCOCCCNCCC(C)O 7a079affb633d4a4d30ae4d44cb9883c [0,2,0,0,0,0|1,0,1]=4 9201 B11R0.148 CCOCCCNCCS(=O)C aa0b4d168bf0e6e6bd10449c35abb418 [0,2,0,0,0,0|2,0,0]=4 9202 B11R0.148 CCOCCCNCCS(=O)O 0c50e1a9960e345eb1009e4ea7070481 [0,2,0,0,0,0|1,0,0]=3 9203 B11R0.148 CCOCCCNCC[C@@H](C)O 41e32664e3186fcfdb192342036e224d [0,2,0,0,0,0|1,0,1]=4 9204 B11R0.148 CCOCCCNCC[C@H](C)O 0e0610f832c96608f36c453a600feca0 [0,2,0,0,0,0|1,0,1]=4 9205 B11R0.148 CCOCCCNCOC(=O)C f72194c18a8ee309612540b87069cbfe [0,2,0,0,0,0|2,0,0]=4 9206 B11R0.148 CCOCCCNCSC(=O)N 67c4993b78d80848c0e24777ee5810e4 [0,2,0,0,0,0|2,0,0]=4 9207 B11R0.148 CCOCCCOCCC(=O)C 4f23c7fb5dd33b6e6621ffd123c50673 [0,2,0,0,0,0|1,0,0]=3 9208 B11R0.148 CCOCCCOCCC(=O)N 1c679141ab0fd8434537f4f151280934 [0,2,0,0,0,0|1,0,0]=3 9209 B11R0.148 CCOCCCOCCC(=O)O 960bfd3fbc61cd9dd8dab5b3be9764c1 [0,2,0,0,0,0|0,0,0]=2 9210 B11R0.148 CCOCCCOCCS(=O)C 1cd30239f5d47d9c2677389593367e40 [0,2,0,0,0,0|2,0,0]=4 9211 B11R0.148 CCOCCCOCC[N+](=O)[O-] f010918cdc1009966f1d46e98ad6210f [0,2,0,0,0,0|1,0,1]=4 9212 B11R0.148 CCOCCCOCNC(=O)C 522dda690b0caffa68ecc452a6925793 [0,2,0,0,0,0|2,0,0]=4 9213 B11R0.148 CCOCCCOCNC(=O)N aaa6dca5b2478094800ad09d3823cef6 [0,2,0,0,0,0|2,0,0]=4 9214 B11R0.148 CCOCCCOCOC(=O)C b5040ccca1022e3efc3c25720f70e2db [0,2,0,0,0,0|2,0,0]=4 9215 B11R0.148 CCOCCCOCSC(=O)N 6ea6ff0e01b9b44eb5ce79604e9892de [0,2,0,0,0,0|2,0,0]=4 9216 B11R0.148 CCOCCNC/C=C/C(=O)O 180e79545ae63835752a114aad6ab053 [0,2,0,0,0,0|0,0,2]=4 9217 B11R0.148 CCOCCNCC#CC(=O)O ab87646df8347e07fb2eddeffc2bc2c6 [0,2,0,0,0,0|0,0,2]=4 9218 B11R0.148 CCOCCNCC=CC(=O)O 7ebe6156c1f494037b0a51305a268124 [0,2,0,0,0,0|0,0,2]=4 9219 B11R0.148 CCOCCNCCCC(=O)C f228f108df37202b13afef73a7689247 [0,2,0,0,0,0|1,0,0]=3 9220 B11R0.148 CCOCCNCCCC(=O)N 81ca3fff0e8df8f95cd35222af260729 [0,2,0,0,0,0|1,0,0]=3 9221 B11R0.148 CCOCCNCCCC(=O)O 8e29492c33ef7432580d9c26f2acb055 [0,2,0,0,0,0|0,0,0]=2 9222 B11R0.148 CCOCCNCCCC(C)O f1c4afa02ff802c760d14d637e7d312c [0,2,0,0,0,0|1,0,1]=4 9223 B11R0.148 CCOCCNCCCS(=O)C d777344ef01a06bdb929427e2ffab303 [0,2,0,0,0,0|2,0,0]=4 9224 B11R0.148 CCOCCNCCC[N+](=O)[O-] f70cd2f1ce06ae83d55cdbfac6a48d56 [0,2,0,0,0,0|1,0,1]=4 9225 B11R0.148 CCOCCNCCNC(=O)C 5f337f4ef9f4a5eaa06c8db14b678f5e [0,2,0,0,0,0|2,0,0]=4 9226 B11R0.148 CCOCCNCCNC(=O)N ea50c00d7f3efee4a4916362850384ee [0,2,0,0,0,0|2,0,0]=4 9227 B11R0.148 CCOCCNCCOC(=O)C d11057c9b53c3feb055142d13a635a39 [0,2,0,0,0,0|2,0,0]=4 9228 B11R0.148 CCOCCNCCSC(=O)C 4592bc61f1358ebe777604ff7b8e824c [0,2,0,0,0,0|2,0,0]=4 9229 B11R0.148 CCOCCOC/C=C/C(=O)O 067f6e854dcca2baddc1da5d8726b400 [0,2,0,0,0,0|0,0,2]=4 9230 B11R0.148 CCOCCOCC#CC(=O)O 1c4e216c7423b8dc47d757c037ff9583 [0,2,0,0,0,0|0,0,2]=4 9231 B11R0.148 CCOCCOCC=CC(=O)O 27fccb562f0bdfd787e2068a9d95027e [0,2,0,0,0,0|0,0,2]=4 9232 B11R0.148 CCOCCOCCCC(=O)C 14a18b63593837505b3352d7193ebabc [0,2,0,0,0,0|1,0,0]=3 9233 B11R0.148 CCOCCOCCCC(=O)N 74091c5652e0a13ebc5b5ac563a78c9d [0,2,0,0,0,0|1,0,0]=3 9234 B11R0.148 CCOCCOCCCC(=O)O 7188f19f71415130253b8f1d4ffb2ebe [0,2,0,0,0,0|0,0,0]=2 9235 B11R0.148 CCOCCOCCC[N+](=O)[O-] b79e936a8ea8688520a6f9f43e71ea41 [0,2,0,0,0,0|1,0,1]=4 9236 B11R0.148 CCOCCOCCNC(=O)C 7604d74605a4378d41bfd856b682739e [0,2,0,0,0,0|2,0,0]=4 9237 B11R0.148 CCOCCOCCNC(=O)N ee97709e164cca41d4c931d124543006 [0,2,0,0,0,0|2,0,0]=4 9238 B11R0.148 CCOCCOCCOC(=O)C dce5b9d243cb4f2475003dba8acbf87a [0,2,0,0,0,0|2,0,0]=4 9239 B11R0.148 CCOCCOCCSC(=O)C 2b905d6662f2c05e631a9f212ca9a0e8 [0,2,0,0,0,0|2,0,0]=4 9240 B11R0.148 CCOCCSSCCC(=O)O a57ae2d39d4c2a3eb820ab839613f0f0 [0,2,0,0,0,0|1,0,0]=3 9241 B11R0.148 CCOCNCCCCC(=O)N afbbbe78a221f9f6fde7f0237c212c79 [0,2,0,0,0,0|1,0,0]=3 9242 B11R0.148 CCOCNCCCCC(=O)O aa1ae81ce73a99ebbf1bd5e7fa2b61d8 [0,2,0,0,0,0|0,0,0]=2 9243 B11R0.148 CCOCNCCCNC(=O)C 442a0dbffefadaedcc20d66b731715b1 [0,2,0,0,0,0|2,0,0]=4 9244 B11R0.148 CCOCNCCOCC(=O)O a33c4a0bbec8fd138b288fbd228c702d [0,2,0,0,0,0|1,0,0]=3 9245 B11R0.148 CCOCOCCC#CC(=O)O 9480244700cd5cbec0d9a69576ca14ca [0,2,0,0,0,0|0,0,2]=4 9246 B11R0.148 CCOCOCCCCC(=O)C 494c300c93d7879b4e62627be935996c [0,2,0,0,0,0|1,0,0]=3 9247 B11R0.148 CCOCOCCCCC(=O)N 9b034d7ab95e332aa1d84237ca556e4d [0,2,0,0,0,0|1,0,0]=3 9248 B11R0.148 CCOCOCCCC[N+](=O)[O-] 6551f2c5713825cdc985a8190bb1d940 [0,2,0,0,0,0|1,0,1]=4 9249 B11R0.148 CCOCOCCCNC(=O)C c04c82b9564ab786b1ac9ab7031322a1 [0,2,0,0,0,0|2,0,0]=4 9250 B11R0.148 CCOCOCCCOC(=O)C 766e50fafcc41d74ca1225e1aae414ec [0,2,0,0,0,0|2,0,0]=4 9251 B11R0.148 CCOCOCCCSC(=O)C 237da1e66471b17bbf1fe6e629c698ce [0,2,0,0,0,0|2,0,0]=4 9252 B11R0.148 CCOCOCCOCC(=O)O 97f4b2f9eafed8e6dc36d723088615dd [0,2,0,0,0,0|1,0,0]=3 9253 B11R0.148 CCOCOCCSCC(=O)N a102fef971ccc97b0472b256bc522189 [0,2,0,0,0,0|2,0,0]=4 9254 B11R0.148 CCSCCCCNCC(=O)N 9c59e81059dfcc95e6ed0cc0af76ab37 [0,2,0,0,0,0|1,0,0]=3 9255 B11R0.148 CCSCCCCNCC(=O)O 48d23c14c94084e7bff45772097aafd6 [0,2,0,0,0,0|0,0,0]=2 9256 B11R0.148 CCSCCCCNCC(C)O 7c3aa50bf4e6e962762981b5339b92ac [0,2,0,0,0,0|1,0,1]=4 9257 B11R0.148 CCSCCCCNC[C@@H](C)O 4f3d3b7cfb78207e6d5945de564823ab [0,2,0,0,0,0|1,0,1]=4 9258 B11R0.148 CCSCCCCNC[C@H](C)O 3bfac6a94d832caf268f359b97cd65af [0,2,0,0,0,0|1,0,1]=4 9259 B11R0.148 CCSCCCCNC[N+](=O)[O-] 1e27db882540f2ae0a546b7300f7963c [0,2,0,0,0,0|1,0,1]=4 9260 B11R0.148 CCSCCCNCCC(=O)N a1abe2a0a680561f84dd9355be022a70 [0,2,0,0,0,0|1,0,0]=3 9261 B11R0.148 CCSCCCNCCC(=S)N 95511848c5bf353272092a091ab42cba [0,2,0,0,0,0|1,1,0]=4 9262 B11R0.148 CCSCCCNCCC(C)O 9937322b8870d6b84770f258dc11e61f [0,2,0,0,0,0|1,0,1]=4 9263 B11R0.148 CCSCCCNCCS(=O)O 26ce23f28bb397f475d4cfe6e6e2aefc [0,2,0,0,0,0|1,0,0]=3 9264 B11R0.148 CCSCCCNCC[C@@H](C)O 673513fce6bf6802e1369b196758fe4a [0,2,0,0,0,0|1,0,1]=4 9265 B11R0.148 CCSCCCNCC[C@H](C)O f83a5da81c822d34f544e69e34cac1c2 [0,2,0,0,0,0|1,0,1]=4 9266 B11R0.148 CCSCCCOCCC(=O)C c42589189df812f9b05f572e4305064f [0,2,0,0,0,0|1,0,0]=3 9267 B11R0.148 CCSCCCOCCC(=O)N 5a0250c5bcfc2bc0c92b12d3be1e42d2 [0,2,0,0,0,0|1,0,0]=3 9268 B11R0.148 CCSCCCOCCC(=O)O 295ed2aed1a2219fd17360210752fa06 [0,2,0,0,0,0|0,0,0]=2 9269 B11R0.148 CCSCCCOCCS(=O)C 9c9aa753dcea3c9876d2be814fa96abc [0,2,0,0,0,0|2,0,0]=4 9270 B11R0.148 CCSCCCOCC[N+](=O)[O-] 8f0c29276bca81a540e0ce510ce47a75 [0,2,0,0,0,0|1,0,1]=4 9271 B11R0.148 CCSCCCOCNC(=O)C 488acf984bf74a6c4bb52c3419cc089a [0,2,0,0,0,0|2,0,0]=4 9272 B11R0.148 CCSCCCOCNC(=O)N cb709ff5ba3bbfcd7a6d35c3f63c08ba [0,2,0,0,0,0|2,0,0]=4 9273 B11R0.148 CCSCCCOCOC(=O)C ba4795a4719fa7e8535dda869fce2e20 [0,2,0,0,0,0|2,0,0]=4 9274 B11R0.148 CCSCCCOCSC(=O)N 83b612e776d4a3a7320c02b5078fd69f [0,2,0,0,0,0|2,0,0]=4 9275 B11R0.148 CCSCCNC/C=C/C(=O)O a6bc3438689a03ce49577c593d432733 [0,2,0,0,0,0|0,0,2]=4 9276 B11R0.148 CCSCCNCC#CC(=O)O 3e57d42b794377aaa7da61034dcd7d0a [0,2,0,0,0,0|0,0,2]=4 9277 B11R0.148 CCSCCNCC=CC(=O)O 2a360c976885c82851dd967ffc9a3f91 [0,2,0,0,0,0|0,0,2]=4 9278 B11R0.148 CCSCCNCCCC(=O)C 064a7ffcceb38b9394777322ebb69ec8 [0,2,0,0,0,0|1,0,0]=3 9279 B11R0.148 CCSCCNCCCC(=O)N 80eb1a1beb57f0b3a6aaac445f0eed57 [0,2,0,0,0,0|1,0,0]=3 9280 B11R0.148 CCSCCNCCCC(=O)O e75265f16a8580bfb93e2109f6957cdc [0,2,0,0,0,0|0,0,0]=2 9281 B11R0.148 CCSCCNCCCC(C)O e6c13131ad4eb421f5fc9a0f72f7aa78 [0,2,0,0,0,0|1,0,1]=4 9282 B11R0.148 CCSCCNCCC[N+](=O)[O-] 5c9533f32225e6827b67a5d5205ff70a [0,2,0,0,0,0|1,0,1]=4 9283 B11R0.148 CCSCCNCCNC(=O)C 61a47ec12d774f62411372a4fab89830 [0,2,0,0,0,0|2,0,0]=4 9284 B11R0.148 CCSCCNCCNC(=O)N e0f7a83b166a9fdac21ea07f8151c589 [0,2,0,0,0,0|2,0,0]=4 9285 B11R0.148 CCSCCNCCOC(=O)C 9d04ef14a4df3832added1f915855d9c [0,2,0,0,0,0|2,0,0]=4 9286 B11R0.148 CCSCCNCCSC(=O)C 7e7df5b64e941e5ce446f9d6500f5d97 [0,2,0,0,0,0|2,0,0]=4 9287 B11R0.148 CCSCCOC/C=C/C(=O)O e95eba37a36db3459c9c81e4d744903c [0,2,0,0,0,0|0,0,2]=4 9288 B11R0.148 CCSCCOCC#CC(=O)O cae7eadf55c734e52922ab8f3a426cb0 [0,2,0,0,0,0|0,0,2]=4 9289 B11R0.148 CCSCCOCC=CC(=O)O e86d5911d8fee7e79b9905a1fae4f02a [0,2,0,0,0,0|0,0,2]=4 9290 B11R0.148 CCSCCOCCCC(=O)C 8f4393f530065181ad15e664abafcbb1 [0,2,0,0,0,0|1,0,0]=3 9291 B11R0.148 CCSCCOCCCC(=O)N de563f12805ec0ab75c1fb290e126e02 [0,2,0,0,0,0|1,0,0]=3 9292 B11R0.148 CCSCCOCCCC(=O)O be81c63483d7f62e89bb00d9826e624f [0,2,0,0,0,0|0,0,0]=2 9293 B11R0.148 CCSCCOCCC[N+](=O)[O-] ff681eca5c595410dd3223a58060c380 [0,2,0,0,0,0|1,0,1]=4 9294 B11R0.148 CCSCCOCCNC(=O)C 11aafb3a03558d452f0d6522813f7536 [0,2,0,0,0,0|2,0,0]=4 9295 B11R0.148 CCSCCOCCNC(=O)N e80dd54b2fa6d9c8324da1b63fa63c07 [0,2,0,0,0,0|2,0,0]=4 9296 B11R0.148 CCSCCOCCOC(=O)C f34f32bb6deb83015d59a8fbed3f2f18 [0,2,0,0,0,0|2,0,0]=4 9297 B11R0.148 CCSCCOCCSC(=O)C e023d1ac61e3852d1c61c248a7150dfe [0,2,0,0,0,0|2,0,0]=4 9298 B11R0.148 COCCCCCNCC(=O)C f14a0e7c6184fb994195ce1a50edd828 [0,2,0,0,0,0|1,0,0]=3 9299 B11R0.148 COCCCCCNCC(=O)N 5e2dc0da8065545854a47ea7255ef805 [0,2,0,0,0,0|1,0,0]=3 9300 B11R0.148 COCCCCCNCC(=O)O e9d365c9b641bfa544654729405f2968 [0,2,0,0,0,0|0,0,0]=2 9301 B11R0.148 COCCCCCNCC(C)O 67657b02b2065cfa1827ce4c8181a02e [0,2,0,0,0,0|1,0,1]=4 9302 B11R0.148 COCCCCCNC[C@@H](C)O 8063e074c1d5e4b68738c6548127369c [0,2,0,0,0,0|1,0,1]=4 9303 B11R0.148 COCCCCCNC[C@H](C)O c8f034cd60e63c96f70e07490a8b848c [0,2,0,0,0,0|1,0,1]=4 9304 B11R0.148 COCCCCCNC[N+](=O)[O-] 93ea570732ce04735969500f0f57dbae [0,2,0,0,0,0|1,0,1]=4 9305 B11R0.148 COCCCCCOCC(=O)C d37277e1c0f5be693f57271e9f1f4394 [0,2,0,0,0,0|1,0,0]=3 9306 B11R0.148 COCCCCCOCC(=O)N 4c7f4bf046a594ea659f3ea364afa19d [0,2,0,0,0,0|1,0,0]=3 9307 B11R0.148 COCCCCCOCC(=O)O 2ece8647978153469dc704b17fef017d [0,2,0,0,0,0|0,0,0]=2 9308 B11R0.148 COCCCCCOCC(=S)N 79ccabd9d76c31a05f7da417cd203db4 [0,2,0,0,0,0|1,1,0]=4 9309 B11R0.148 COCCCCCOCS(=O)O 741a08e6be66276ff6cd81a1454639e7 [0,2,0,0,0,0|1,0,0]=3 9310 B11R0.148 COCCCCNCCC(=O)C 99d64fad0e8afbca73c8d652d21bae31 [0,2,0,0,0,0|1,0,0]=3 9311 B11R0.148 COCCCCNCCC(=O)N 9deedf36132fe49c67ba11317c5d11c3 [0,2,0,0,0,0|1,0,0]=3 9312 B11R0.148 COCCCCNCCC(=O)O d7bbe9fde4ea1411124188ea6025950d [0,2,0,0,0,0|0,0,0]=2 9313 B11R0.148 COCCCCNCCC(=S)N 2609fd7e1322253d622c2df2f1adfca2 [0,2,0,0,0,0|1,1,0]=4 9314 B11R0.148 COCCCCNCCC(C)O cff87372cb5ce90ec34d6c8f1b3b4ffa [0,2,0,0,0,0|1,0,1]=4 9315 B11R0.148 COCCCCNCCS(=O)C 01100a3c56b4407a67a8f49a6ca051f6 [0,2,0,0,0,0|2,0,0]=4 9316 B11R0.148 COCCCCNCCS(=O)O b8dcdd169fa038b597bf1923574605a9 [0,2,0,0,0,0|1,0,0]=3 9317 B11R0.148 COCCCCNCC[C@@H](C)O b20c29a511e2696352a2b4afeee4b6c1 [0,2,0,0,0,0|1,0,1]=4 9318 B11R0.148 COCCCCNCC[C@H](C)O 8377f07ca1a0f446a17f7ab401b962ee [0,2,0,0,0,0|1,0,1]=4 9319 B11R0.148 COCCCCNCOC(=O)C 0d747e46a064d71fc7b6ef2a3d5ee654 [0,2,0,0,0,0|2,0,0]=4 9320 B11R0.148 COCCCCNCSC(=O)N 46d7d9e21bba0577ce280b379eda1b73 [0,2,0,0,0,0|2,0,0]=4 9321 B11R0.148 COCCCCOCCC(=O)C f1c810eb131cc0cf69e918163bd7c135 [0,2,0,0,0,0|1,0,0]=3 9322 B11R0.148 COCCCCOCCC(=O)N 5fb1bb369e75aaf8f9cefa645aa9df3c [0,2,0,0,0,0|1,0,0]=3 9323 B11R0.148 COCCCCOCCC(=O)O a9a7f1dd96d065141ddf56bc5e4dadb6 [0,2,0,0,0,0|0,0,0]=2 9324 B11R0.148 COCCCCOCCS(=O)C 3f5ee43394d09ac425b5e5e4827d415e [0,2,0,0,0,0|2,0,0]=4 9325 B11R0.148 COCCCCOCC[N+](=O)[O-] cbb22d75c86d26f9ba20fff94aeea6c5 [0,2,0,0,0,0|1,0,1]=4 9326 B11R0.148 COCCCCOCNC(=O)C 621807ba34baa7dc8338a762404f5b32 [0,2,0,0,0,0|2,0,0]=4 9327 B11R0.148 COCCCCOCNC(=O)N dfb63e7d18c59af55726e9a2f7d5ce6d [0,2,0,0,0,0|2,0,0]=4 9328 B11R0.148 COCCCCOCOC(=O)C b8c949ce509c96fab217fd6ac0a7706a [0,2,0,0,0,0|2,0,0]=4 9329 B11R0.148 COCCCCOCSC(=O)N ae7fcfa9e2c166c57d9abf92fe6e675c [0,2,0,0,0,0|2,0,0]=4 9330 B11R0.148 COCCCNC/C=C/C(=O)O b9b1ed05b523aa74090b0170ba333231 [0,2,0,0,0,0|0,0,2]=4 9331 B11R0.148 COCCCNCC#CC(=O)O 6e16ba501fada04748f9d21fc0f53edc [0,2,0,0,0,0|0,0,2]=4 9332 B11R0.148 COCCCNCC=CC(=O)O ffe4458a9d773fa0f5805fd16083945f [0,2,0,0,0,0|0,0,2]=4 9333 B11R0.148 COCCCNCCCC(=O)C 4ccb1c720ecdf7e33d7132d28dd2a288 [0,2,0,0,0,0|1,0,0]=3 9334 B11R0.148 COCCCNCCCC(=O)N ff1311ddd2554bd05fa21dab09b80c0c [0,2,0,0,0,0|1,0,0]=3 9335 B11R0.148 COCCCNCCCC(=O)O dfefe79baa8d3de2e2f22b6b63766bcf [0,2,0,0,0,0|0,0,0]=2 9336 B11R0.148 COCCCNCCCC(C)O e82510b018bd3b6724a60d7dd9a8b04d [0,2,0,0,0,0|1,0,1]=4 9337 B11R0.148 COCCCNCCCS(=O)C 05bb3bf5e3fd558971ca7a045248c170 [0,2,0,0,0,0|2,0,0]=4 9338 B11R0.148 COCCCNCCC[N+](=O)[O-] 4e23b442f7056b3551810828865f5e8c [0,2,0,0,0,0|1,0,1]=4 9339 B11R0.148 COCCCNCCNC(=O)C b60609d1b97443e2b41e3989cac096b2 [0,2,0,0,0,0|2,0,0]=4 9340 B11R0.148 COCCCNCCNC(=O)N c9bd4f72f54f66101c574015fca6e9ce [0,2,0,0,0,0|2,0,0]=4 9341 B11R0.148 COCCCNCCOC(=O)C 968c2daa6f0b4681b711adee5c85b35c [0,2,0,0,0,0|2,0,0]=4 9342 B11R0.148 COCCCNCCSC(=O)C 55f4228d11d9e33792523ffe2108d9af [0,2,0,0,0,0|2,0,0]=4 9343 B11R0.148 COCCCOC/C=C/C(=O)O 0805cb03c3c7f2481256c9f7647a4e4f [0,2,0,0,0,0|0,0,2]=4 9344 B11R0.148 COCCCOCC#CC(=O)O 1d5efceab99816318884070aedcd0873 [0,2,0,0,0,0|0,0,2]=4 9345 B11R0.148 COCCCOCC=CC(=O)O c65c2be497ef9593c8bb24cb3e26e54d [0,2,0,0,0,0|0,0,2]=4 9346 B11R0.148 COCCCOCCCC(=O)C 87d421651be24118b98fa50f3606c492 [0,2,0,0,0,0|1,0,0]=3 9347 B11R0.148 COCCCOCCCC(=O)N 570bc79fbc9673c05caf76b7272e29d2 [0,2,0,0,0,0|1,0,0]=3 9348 B11R0.148 COCCCOCCCC(=O)O 49621db20500d04702119d17ede7109b [0,2,0,0,0,0|0,0,0]=2 9349 B11R0.148 COCCCOCCC[N+](=O)[O-] a8bf480117b7b86759d09e767db09697 [0,2,0,0,0,0|1,0,1]=4 9350 B11R0.148 COCCCOCCNC(=O)C facbc361869cdc81ccaebc94ea2d0864 [0,2,0,0,0,0|2,0,0]=4 9351 B11R0.148 COCCCOCCNC(=O)N 8a82fc8d8de30b8dabb18626033968be [0,2,0,0,0,0|2,0,0]=4 9352 B11R0.148 COCCCOCCOC(=O)C 1e478fb35f0795b507776209452aab42 [0,2,0,0,0,0|2,0,0]=4 9353 B11R0.148 COCCCOCCSC(=O)C c611948d98170be4cbfb6850533fdb2f [0,2,0,0,0,0|2,0,0]=4 9354 B11R0.148 COCCNCCCCC(=O)C 5c740e29f6604eaf8ea19cb01cba1f89 [0,2,0,0,0,0|1,0,0]=3 9355 B11R0.148 COCCNCCCCC(=O)N a69178594994fce2b09a3283598a799f [0,2,0,0,0,0|1,0,0]=3 9356 B11R0.148 COCCNCCCCC(=O)O d88042a9f5ae6ecad4def0db5518e485 [0,2,0,0,0,0|0,0,0]=2 9357 B11R0.148 COCCNCCCCC(C)O d7e529905c1e8c926b9971b6a2056c04 [0,2,0,0,0,0|1,0,1]=4 9358 B11R0.148 COCCNCCCC[C@@H](C)O e0146f541928e12747a321e45778da6a [0,2,0,0,0,0|1,0,1]=4 9359 B11R0.148 COCCNCCCNC(=O)C 4ab65adadb0b1b87bfe3d5370bf935f0 [0,2,0,0,0,0|2,0,0]=4 9360 B11R0.148 COCCNCCCOC(=O)C d9c520ba73350cf1259e25a413cd1369 [0,2,0,0,0,0|2,0,0]=4 9361 B11R0.148 COCCNCCCSC(=O)C 1d52c60ad1d6280a5cb4bae035901cf3 [0,2,0,0,0,0|2,0,0]=4 9362 B11R0.148 COCCNCCOCC(=O)N f0123815ab53483dcd06698ef9af9e8f [0,2,0,0,0,0|2,0,0]=4 9363 B11R0.148 COCCNCCOCC(=O)O 15d675cffbe1288665b8934bfa047fb6 [0,2,0,0,0,0|1,0,0]=3 9364 B11R0.148 COCCNCCSCC(=O)O ffd3b5a9d8009e9bff3ba8de7b83a824 [0,2,0,0,0,0|1,0,0]=3 9365 B11R0.148 COCCOCCC#CC(=O)O 10f10eaf86d8fbfa2b9b7c01d60c21f6 [0,2,0,0,0,0|0,0,2]=4 9366 B11R0.148 COCCOCCCCC(=O)C e1bd35f3a7437c78a11075e0c6413b43 [0,2,0,0,0,0|1,0,0]=3 9367 B11R0.148 COCCOCCCCC(=O)N 2ba56663b33293fd90334bbc3ce2783c [0,2,0,0,0,0|1,0,0]=3 9368 B11R0.148 COCCOCCCCC(=O)O 1bfe81f974cd55b00acd5b66b8e21fb5 [0,2,0,0,0,0|0,0,0]=2 9369 B11R0.148 COCCOCCCC[N+](=O)[O-] 5eedb93d6f2527cd5d2620622d65e313 [0,2,0,0,0,0|1,0,1]=4 9370 B11R0.148 COCCOCCCNC(=O)C f9ee75c92d5cd148f854f328d5324833 [0,2,0,0,0,0|2,0,0]=4 9371 B11R0.148 COCCOCCCOC(=O)C 250a651527a6003df2c5e2ab8a7f9b6a [0,2,0,0,0,0|2,0,0]=4 9372 B11R0.148 COCCOCCCSC(=O)C d4e547df7110735ced40ba4178efd15e [0,2,0,0,0,0|2,0,0]=4 9373 B11R0.148 COCCOCCNCC(=O)C e2b13aa960366926172d36f59def4c42 [0,2,0,0,0,0|2,0,0]=4 9374 B11R0.148 COCCOCCNCC(=O)N 470b8ba26f01216e6d2c06fbeb5c3e6a [0,2,0,0,0,0|2,0,0]=4 9375 B11R0.148 COCCOCCNCC(=O)O 4f8ab39ff2e64affe7e41f9cb12fdb1e [0,2,0,0,0,0|1,0,0]=3 9376 B11R0.148 COCCOCCOCC(=O)C 79e4e21a801fa413b2aef56b8645b4c2 [0,2,0,0,0,0|2,0,0]=4 9377 B11R0.148 COCCOCCOCC(=O)N 9fdafc59d0c21de86e0d5974855d5940 [0,2,0,0,0,0|2,0,0]=4 9378 B11R0.148 COCCOCCOCC(=O)O 4b9c2d93a46cacbc0f62960a2df3fdb8 [0,2,0,0,0,0|1,0,0]=3 9379 B11R0.148 COCCOCCOCS(=O)O a0bc3caf3e01107a145c28497dfe4c7f [0,2,0,0,0,0|2,0,0]=4 9380 B11R0.148 COCCOCCSCC(=O)N 684858f80070c9e78204a44f1e101bbf [0,2,0,0,0,0|2,0,0]=4 9381 B11R0.148 COCCOCNCCC(=O)N 56cf92f6f29fae8a24d9e53285da0d97 [0,2,0,0,0,0|2,0,0]=4 9382 B11R0.148 COCCOCNCCC(=O)O bbab7e153f20ab9667338eaaa08e1901 [0,2,0,0,0,0|1,0,0]=3 9383 B11R0.148 COCCOCNCCS(=O)O 3e3a598070363677a17745e6d68030a6 [0,2,0,0,0,0|2,0,0]=4 9384 B11R0.148 COCCOCOCCC(=O)C 02405d31917fb2ad2a69caba85148fc0 [0,2,0,0,0,0|2,0,0]=4 9385 B11R0.148 COCCOCOCCC(=O)N 9a30a93b302ac450eff8fb89d5164642 [0,2,0,0,0,0|2,0,0]=4 9386 B11R0.148 COCCOCOCCC(=O)O 5772da795f93dea9920f6ebf20f57b11 [0,2,0,0,0,0|1,0,0]=3 9387 B11R0.148 COCNCCCCCC(=O)N 3e0d2fc5909731ebfd66c780a541df66 [0,2,0,0,0,0|1,0,0]=3 9388 B11R0.148 COCNCCCCCC(=O)O b84fb7ca56aca6e16d69f0a227ea45a4 [0,2,0,0,0,0|0,0,0]=2 9389 B11R0.148 COCNCCCCNC(=O)C 6c41f33a8a225d8cfddb33222ee23eb6 [0,2,0,0,0,0|2,0,0]=4 9390 B11R0.148 COCNCCOCCC(=O)O be54a5a5d98338d49fd427bec81e53b6 [0,2,0,0,0,0|1,0,0]=3 9391 B11R0.148 COCOCCCCCC(=O)C 8894b132b8e9272b0a87d56a7ee0b630 [0,2,0,0,0,0|1,0,0]=3 9392 B11R0.148 COCOCCCCCC(=O)N 07ed3ae14bcd126283d6dac98a51ed7c [0,2,0,0,0,0|1,0,0]=3 9393 B11R0.148 COCOCCCCCC(=O)O 3afdcf882d4b857d276025b0908b1b82 [0,2,0,0,0,0|0,0,0]=2 9394 B11R0.148 COCOCCCCOC(=O)C 6fdd835d01665c5e6850b1bfca035e21 [0,2,0,0,0,0|2,0,0]=4 9395 B11R0.148 COCOCCCCSC(=O)C e9fd7595bb5c0a66d63ad5a1220056a2 [0,2,0,0,0,0|2,0,0]=4 9396 B11R0.148 COCOCCCOCC(=O)O c8bb76e993d272da528ebe3f15d68bd5 [0,2,0,0,0,0|1,0,0]=3 9397 B11R0.148 COCOCCNCCC(=O)N a3ee4693150690df0af8e9c3df9f8fcd [0,2,0,0,0,0|2,0,0]=4 9398 B11R0.148 COCOCCNCCC(=O)O 6a66c9967cc151f65e8c0d2128356100 [0,2,0,0,0,0|1,0,0]=3 9399 B11R0.148 COCOCCNCCS(=O)O be304999f6dea4f9d9b5042e5720705f [0,2,0,0,0,0|2,0,0]=4 9400 B11R0.148 COCOCCOCCC(=O)C 1d66549ffbaa6776500fb39c5c12b326 [0,2,0,0,0,0|2,0,0]=4 9401 B11R0.148 COCOCCOCCC(=O)N 0447f7c9cdf731172556fa709ade632d [0,2,0,0,0,0|2,0,0]=4 9402 B11R0.148 COCOCCOCCC(=O)O 2ad8c40c4a4ec91bd2a1689455e9cdb7 [0,2,0,0,0,0|1,0,0]=3 9403 B11R0.148 CS(=O)CCCNCCCCF 40299da30668487961f60001a1255368 [0,2,0,0,0,0|2,0,0]=4 9404 B11R0.148 CS(=O)CCCNCCCCO 69593a360094bc482e161e00d0d5933e [0,2,0,0,0,0|2,0,0]=4 9405 B11R0.148 CS(=O)CCNCCCCCCl 19eb2eb3c3648a6201eb963406dabc37 [0,2,0,0,0,0|2,0,0]=4 9406 B11R0.148 CS(=O)CCNCCCCCF bd9c3c8cf93fd414fe0dfb2b1bdacec1 [0,2,0,0,0,0|2,0,0]=4 9407 B11R0.148 CS(=O)CCNCCCCCO e6185785b0222db44e4aec754b1f81b1 [0,2,0,0,0,0|2,0,0]=4 9408 B11R0.148 CS(=O)CCOCCCCCF 4eb7eaf39036813a49075047d0e73c50 [0,2,0,0,0,0|2,0,0]=4 9409 B11R0.148 CSCCCCNCCC(=O)C 1f7db8bdc8277aba598a98a9c4ce4908 [0,2,0,0,0,0|1,0,0]=3 9410 B11R0.148 CSCCCCNCCC(=O)N 4dd0d855e58cae245d159571d6ba86cd [0,2,0,0,0,0|1,0,0]=3 9411 B11R0.148 CSCCCCNCCC(=O)O 9409e81796fd35b2e0b4559edafca006 [0,2,0,0,0,0|0,0,0]=2 9412 B11R0.148 CSCCCCNCCC(C)O a4b41d79bf57e3a71d4b41a1535d977e [0,2,0,0,0,0|1,0,1]=4 9413 B11R0.148 CSCCCCNCCS(=O)C f955e6535dee2a8362199a62879d9a96 [0,2,0,0,0,0|2,0,0]=4 9414 B11R0.148 CSCCCCNCOC(=O)C 0e28146924cc4abbdc42f0857a6317dc [0,2,0,0,0,0|2,0,0]=4 9415 B11R0.148 CSCCCCNCSC(=O)N f6d40d102cceba8e1df2f51e492d5fac [0,2,0,0,0,0|2,0,0]=4 9416 B11R0.148 CSCCCCOCCC(=O)C 9eb1c820143deb28ccbdac5fefd19556 [0,2,0,0,0,0|1,0,0]=3 9417 B11R0.148 CSCCCCOCCC(=O)N dbc3a4092eba73152ad21bef2d70031b [0,2,0,0,0,0|1,0,0]=3 9418 B11R0.148 CSCCCCOCCC(=O)O 098451fe3919d093232420bf266192f1 [0,2,0,0,0,0|0,0,0]=2 9419 B11R0.148 CSCCCCOCCS(=O)C 4c6bbfb9c9065882070b4601908a51d3 [0,2,0,0,0,0|2,0,0]=4 9420 B11R0.148 CSCCCCOCOC(=O)C 11bafcbc086b124dd47336155ed036eb [0,2,0,0,0,0|2,0,0]=4 9421 B11R0.148 CSCCCCOCSC(=O)N 6057c518d609fcdc5d030b0d8298dc12 [0,2,0,0,0,0|2,0,0]=4 9422 B11R0.148 CSCCCNC/C=C/C(=O)O bcbf55149061f62ba5092a3b145b7f09 [0,2,0,0,0,0|0,0,2]=4 9423 B11R0.148 CSCCCNCC#CC(=O)O 18eb40cdd2b3b013a96a5299191fe72d [0,2,0,0,0,0|0,0,2]=4 9424 B11R0.148 CSCCCNCC=CC(=O)O 5b844784e907b9c75f027b3c84adbd0c [0,2,0,0,0,0|0,0,2]=4 9425 B11R0.148 CSCCCNCCCC(=O)C 22c2a84284aa7fbe7690e72ac77f3f99 [0,2,0,0,0,0|1,0,0]=3 9426 B11R0.148 CSCCCNCCCC(=O)N 47d7889b3983591ca5fa6b39511cbc77 [0,2,0,0,0,0|1,0,0]=3 9427 B11R0.148 CSCCCNCCCC(=O)O 8c251662d46bbe64d437e9d1f67bd41a [0,2,0,0,0,0|0,0,0]=2 9428 B11R0.148 CSCCCNCCCC(C)O 0d872fa43229a3d0574f0ec04a5d0878 [0,2,0,0,0,0|1,0,1]=4 9429 B11R0.148 CSCCCNCCCS(=O)C 082e555abb8ee07d45fa041ea7f517d1 [0,2,0,0,0,0|2,0,0]=4 9430 B11R0.148 CSCCCNCCC[N+](=O)[O-] 25b19a5b67633e70e1a670827ae48a01 [0,2,0,0,0,0|1,0,1]=4 9431 B11R0.148 CSCCCNCCNC(=O)C 68a8a5039dfed0a41547b1fa691c6376 [0,2,0,0,0,0|2,0,0]=4 9432 B11R0.148 CSCCCNCCNC(=O)N 5c9852343bb22e13372a4cd6bb35b422 [0,2,0,0,0,0|2,0,0]=4 9433 B11R0.148 CSCCCNCCOC(=O)C 48b9df2f7633fdf8b63c01a70ad418ce [0,2,0,0,0,0|2,0,0]=4 9434 B11R0.148 CSCCCNCCSC(=O)C 4f95310843a94b4bc352019fa97461c1 [0,2,0,0,0,0|2,0,0]=4 9435 B11R0.148 CSCCCOC/C=C/C(=O)O 8a99058dad6da5c274e4fd085728717d [0,2,0,0,0,0|0,0,2]=4 9436 B11R0.148 CSCCCOCC#CC(=O)O a8e5f9e68dcd047543bd2f76486130ee [0,2,0,0,0,0|0,0,2]=4 9437 B11R0.148 CSCCCOCC=CC(=O)O f2fcb73ed65b6922499affeea35fdfd5 [0,2,0,0,0,0|0,0,2]=4 9438 B11R0.148 CSCCCOCCCC(=O)C 5468e78dba08221c943b6f4f7653f163 [0,2,0,0,0,0|1,0,0]=3 9439 B11R0.148 CSCCCOCCCC(=O)N 7d3fb507284e5af4b512ff6e4a524af2 [0,2,0,0,0,0|1,0,0]=3 9440 B11R0.148 CSCCCOCCC[N+](=O)[O-] 542ed4434cef1ca08c5388bf519943da [0,2,0,0,0,0|1,0,1]=4 9441 B11R0.148 CSCCCOCCNC(=O)C ee2c88601162ded3a09b4454af81913d [0,2,0,0,0,0|2,0,0]=4 9442 B11R0.148 CSCCCOCCNC(=O)N da4a8f6b993d6adc8f1803812abf98ae [0,2,0,0,0,0|2,0,0]=4 9443 B11R0.148 CSCCCOCCOC(=O)C c1f4b7e88b1ca776c50b8600e625a794 [0,2,0,0,0,0|2,0,0]=4 9444 B11R0.148 CSCCCOCCSC(=O)C f89a86b1a296d3280e51ad86c4d98254 [0,2,0,0,0,0|2,0,0]=4 9445 B11R0.148 CSCCNCCCCC(=O)C a38fe99fe24381b306612176189b7551 [0,2,0,0,0,0|1,0,0]=3 9446 B11R0.148 CSCCNCCCCC(=O)N 06f3f571524ce4eefb1c87affcec6672 [0,2,0,0,0,0|1,0,0]=3 9447 B11R0.148 CSCCNCCCCC(=O)O 0ac653ab402a0b6c32997eff60de279c [0,2,0,0,0,0|0,0,0]=2 9448 B11R0.148 CSCCNCCCCC(C)O cba11288cf4a8f8c7d5c3a9c35d3039d [0,2,0,0,0,0|1,0,1]=4 9449 B11R0.148 CSCCNCCCC[C@@H](C)O acf1c268ee0508a9d39a2e6344a8070a [0,2,0,0,0,0|1,0,1]=4 9450 B11R0.148 CSCCNCCCNC(=O)C a458659672c61c844a585c9c0b37b38a [0,2,0,0,0,0|2,0,0]=4 9451 B11R0.148 CSCCNCCCOC(=O)C 78cc590e4e3c4c3346ba24307b761e84 [0,2,0,0,0,0|2,0,0]=4 9452 B11R0.148 CSCCNCCCSC(=O)C 32744ef3b25314e4c73ec5478b056f3e [0,2,0,0,0,0|2,0,0]=4 9453 B11R0.148 CSCCNCCOCC(=O)N 10d7267f40571e2eb050257cdbffe68d [0,2,0,0,0,0|2,0,0]=4 9454 B11R0.148 CSCCNCCOCC(=O)O 6c96be9e65b19a58136170da98d1dae9 [0,2,0,0,0,0|1,0,0]=3 9455 B11R0.148 CSCCNCCSCC(=O)O 097c3b582529e35100ba182304150a64 [0,2,0,0,0,0|1,0,0]=3 9456 B11R0.148 CSCCOCCC#CC(=O)O 94754363d9fd2f09828e736e8ba8f23e [0,2,0,0,0,0|0,0,2]=4 9457 B11R0.148 CSCCOCCCCC(=O)C 47a2d2ae2f15bfafe11ae3359b2de694 [0,2,0,0,0,0|1,0,0]=3 9458 B11R0.148 CSCCOCCCCC(=O)N 5f77339468c72b4a2fce895b8fb41a2c [0,2,0,0,0,0|1,0,0]=3 9459 B11R0.148 CSCCOCCCCC(=O)O f3fe1c8d2ae8384b166b285c6df10be0 [0,2,0,0,0,0|0,0,0]=2 9460 B11R0.148 CSCCOCCCC[N+](=O)[O-] 31e8ecc18240d5c3e648a145cd2e1db5 [0,2,0,0,0,0|1,0,1]=4 9461 B11R0.148 CSCCOCCCNC(=O)C d2838451f4b8ca5531a2d6ec811cd0f2 [0,2,0,0,0,0|2,0,0]=4 9462 B11R0.148 CSCCOCCCOC(=O)C cd73c010e4450dd9732fbf95fcfd8359 [0,2,0,0,0,0|2,0,0]=4 9463 B11R0.148 CSCCOCCCSC(=O)C a0d65463038890c0cf07bd27b340d5d7 [0,2,0,0,0,0|2,0,0]=4 9464 B11R0.148 CSCCOCCOCC(=O)N b0a360f7a9ecbeb610429b50afd6a3f3 [0,2,0,0,0,0|2,0,0]=4 9465 B11R0.148 CSCCOCCOCC(=O)O 57299f061059627091b9f9a48ab17d8f [0,2,0,0,0,0|1,0,0]=3 9466 B11R0.148 CSCCOCCSCC(=O)N 3c8a12b4bd92f6dcb375c60e198ca05d [0,2,0,0,0,0|2,0,0]=4 9467 B11R0.148 CSCNCCCCCC(=O)N 00c863b0511ae6d61381c78728bb42eb [0,2,0,0,0,0|1,0,0]=3 9468 B11R0.148 CSCNCCCCCC(=O)O 26d2736a3f2658d831b221671ef27c2e [0,2,0,0,0,0|0,0,0]=2 9469 B11R0.148 CSCNCCCCNC(=O)C e0dcdc458e0437b526bba76300100f9b [0,2,0,0,0,0|2,0,0]=4 9470 B11R0.148 CSCNCCOCCC(=O)O 5fe9043a8395e1eaaf3d18dac6cf4340 [0,2,0,0,0,0|1,0,0]=3 9471 B11R0.148 CSCOCCCCCC(=O)N 6c92460901d402968b41c312d5b4abd4 [0,2,0,0,0,0|1,0,0]=3 9472 B11R0.148 CSCOCCCCCC(=O)O 310637b1b9fac0b1bb35b90b669b7b82 [0,2,0,0,0,0|0,0,0]=2 9473 B11R0.148 CSCOCCCCOC(=O)C 8a6963cffdd58c524de2ea378697a759 [0,2,0,0,0,0|2,0,0]=4 9474 B11R0.148 CSCOCCOCCC(=O)O 923a5b3a9a408bcf0694efdbe730935d [0,2,0,0,0,0|1,0,0]=3 9475 B11R0.148 C[C@@H](O)CCCCNCCCCl f8189c1ec7c682797fb0ab04f549b79c [0,2,0,0,0,0|1,0,1]=4 9476 B11R0.148 C[C@@H](O)CCCCNCCCO 783f0910fd9a7305a3b3999e4f1a242f [0,2,0,0,0,0|1,0,1]=4 9477 B11R0.148 C[C@@H](O)CCNCCCCCF 4838cef28426dd8ec31647e48b9e845e [0,2,0,0,0,0|1,0,1]=4 9478 B11R0.148 C[C@@H](O)CCNCCCCCO b13471bd516df4bd2bedb25c936c8159 [0,2,0,0,0,0|1,0,1]=4 9479 B11R0.148 C[C@@H](O)CNCCCCCCCl 161f5eda601f36af3685ec75b9bde82e [0,2,0,0,0,0|1,0,1]=4 9480 B11R0.148 C[C@@H](O)CNCCCCCCF ecc51158952d06574fe03a76865c685f [0,2,0,0,0,0|1,0,1]=4 9481 B11R0.148 C[C@@H](O)CNCCCCCCO 2408f53f8ed8549405bf9c3a948ce3d5 [0,2,0,0,0,0|1,0,1]=4 9482 B11R0.148 C[C@H](O)CCNCCCCCF 975ab0ec650e5067c586bb3c4060578e [0,2,0,0,0,0|1,0,1]=4 9483 B11R0.148 C[C@H](O)CCNCCCCCO 42357ac6f4fcddf5586a4fd9971d1d01 [0,2,0,0,0,0|1,0,1]=4 9484 B11R0.148 C[C@H](O)CNCCCCCCCl 1d8263afe3616d65467e105439de38a2 [0,2,0,0,0,0|1,0,1]=4 9485 B11R0.148 C[C@H](O)CNCCCCCCF bb876a35baaddf7c75c2f1cb4598af14 [0,2,0,0,0,0|1,0,1]=4 9486 B11R0.148 C[C@H](O)CNCCCCCCO 643e793020ae7e33277250873fb00f80 [0,2,0,0,0,0|1,0,1]=4 9487 B11R0.148 N#CCCCCCNCC(=O)N 19b3bf6f77ad056159c168baf3eebbc9 [0,2,0,0,0,0|1,0,1]=4 9488 B11R0.148 N#CCCCCCNCC(=O)O 1bf499029f5dc5eea2b959a114cd3b1d [0,2,0,0,0,0|0,0,1]=3 9489 B11R0.148 N#CCCCCCOCC(=O)N ff885f87f5695731a8573eb7eea7a498 [0,2,0,0,0,0|1,0,1]=4 9490 B11R0.148 N#CCCCCCOCC(=O)O 679193cfeb5b6c38f78e0c62c7127cef [0,2,0,0,0,0|0,0,1]=3 9491 B11R0.148 N#CCCCCCOCS(=O)O 5cb67f66e43c860e22fd2417a856a4e7 [0,2,0,0,0,0|1,0,1]=4 9492 B11R0.148 N#CCCCCNCCC(=O)N 16a00d42fff9e07f7ecea6aedf72c743 [0,2,0,0,0,0|1,0,1]=4 9493 B11R0.148 N#CCCCCNCCC(=O)O 087ba8fa4230d1b3b3c497e2dc44abae [0,2,0,0,0,0|0,0,1]=3 9494 B11R0.148 N#CCCCCNCCS(=O)O d7e99ff3dd85173b01b5102a9f3f1ffd [0,2,0,0,0,0|1,0,1]=4 9495 B11R0.148 N#CCCCCOCCC(=O)N 8f89376cda5075cb3e67fdffb008d02b [0,2,0,0,0,0|1,0,1]=4 9496 B11R0.148 N#CCCCCOCCC(=O)O 34c54ff37c497a81d69f0b04bf43e644 [0,2,0,0,0,0|0,0,1]=3 9497 B11R0.148 N#CCCCNCCCC(=O)N d5f0c679a75421ea5eff7a1714ffc1b0 [0,2,0,0,0,0|1,0,1]=4 9498 B11R0.148 N#CCCCNCCCC(=O)O 5ed20f59e53452a591e4d29e95b42c6d [0,2,0,0,0,0|0,0,1]=3 9499 B11R0.148 N#CCCCOCCCC(=O)N 2077037452741945c95726d47c9255f5 [0,2,0,0,0,0|1,0,1]=4 9500 B11R0.148 N#CCCNCCCCC(=O)N 3d7baaea045c512d2c314a2b4776b083 [0,2,0,0,0,0|1,0,1]=4 9501 B11R0.148 N#CCCNCCCCC(=O)O e3e746e96d067b4d6657621fc248dbef [0,2,0,0,0,0|0,0,1]=3 9502 B11R0.148 N#CCCNCCOCC(=O)O 751b7abda64e72c20422b5212f6cb8e8 [0,2,0,0,0,0|1,0,1]=4 9503 B11R0.148 N#CCCNCCSCC(=O)O 7b0bf946fc9eb418ed0e3fa593f91f7d [0,2,0,0,0,0|1,0,1]=4 9504 B11R0.148 N#CCCOCCCCC(=O)N 080f32fab30836918d9ae980c3c98962 [0,2,0,0,0,0|1,0,1]=4 9505 B11R0.148 N#CCCOCCCCC(=O)O 37138af8b8fa4f740ccc5bd60e0d9082 [0,2,0,0,0,0|0,0,1]=3 9506 B11R0.148 N#CCCOCCOCC(=O)O 20197720be2a20ae63c59197e524288b [0,2,0,0,0,0|1,0,1]=4 9507 B11R0.148 N#CCNCCCCCC(=O)N a14680dad7e19798aa301699cd1db545 [0,2,0,0,0,0|1,0,1]=4 9508 B11R0.148 N#CCNCCCCCC(=O)O a0b7af87735dcbe4e735980121169cfa [0,2,0,0,0,0|0,0,1]=3 9509 B11R0.148 N#CCNCCCOCC(=O)O 9afbbad47e4c3469031cc922de00456a [0,2,0,0,0,0|1,0,1]=4 9510 B11R0.148 N#CCNCCOCCC(=O)O c0eb2adedae2dc9dc21160eed309691c [0,2,0,0,0,0|1,0,1]=4 9511 B11R0.148 N#CCOCCCCCC(=O)N e969099dea7a81e5f47d54c94ae6eb05 [0,2,0,0,0,0|1,0,1]=4 9512 B11R0.148 N#CCOCCCCCC(=O)O f59c3d9d12d8bb96941eb6884b2ecde7 [0,2,0,0,0,0|0,0,1]=3 9513 B11R0.148 N#CCOCCCOCC(=O)O 602383497d5fed15cc2d6b1626358337 [0,2,0,0,0,0|1,0,1]=4 9514 B11R0.148 N#CCOCCNCCC(=O)O 7b88908ffda447d93a57d2bdb8e4d28a [0,2,0,0,0,0|1,0,1]=4 9515 B11R0.148 N#CCOCCOCCC(=O)O 3e9ad67bc59e60da0d3a23ef72f29ee1 [0,2,0,0,0,0|1,0,1]=4 9516 B11R0.148 N#CSCOCCCCC(=O)O 1f92e38548d85c319d1a8fcbfc5fab88 [0,2,0,0,0,0|1,0,1]=4 9517 B11R0.148 NC(=O)CCCCCCOCF 5912a90813a22a252124d79603e67eeb [0,2,0,0,0,0|1,0,0]=3 9518 B11R0.148 NC(=O)CCCCCNCC=O 433be4a88746ec6b3fd1f3f7186e4d5d [0,2,0,0,0,0|1,0,1]=4 9519 B11R0.148 NC(=O)CCCCCNCCBr 4cc95e8fd24244de2a7953165e679787 [0,2,0,0,0,0|1,0,0]=3 9520 B11R0.148 NC(=O)CCCCCNCCF db1c38623aef4f75b1379fc269f55ba1 [0,2,0,0,0,0|1,0,0]=3 9521 B11R0.148 NC(=O)CCCCCNCCI e88fc17de8fa64897e7b36800caba9d1 [0,2,0,0,0,0|1,0,0]=3 9522 B11R0.148 NC(=O)CCCCCNCCO 676d36a100eb1cca293efa0d8eec14c7 [0,2,0,0,0,0|1,0,0]=3 9523 B11R0.148 NC(=O)CCCCCNCCS 30c087a43e3fe380d6293d406d2c653b [0,2,0,0,0,0|1,0,0]=3 9524 B11R0.148 NC(=O)CCCCCOCC=O 7aefdb55de8dc879f17023eb9ccb8a4d [0,2,0,0,0,0|1,0,1]=4 9525 B11R0.148 NC(=O)CCCCCOCCF 536d6402fa848dd7bc96ccb71d509acf [0,2,0,0,0,0|1,0,0]=3 9526 B11R0.148 NC(=O)CCCCCOCCS 82f2d047583d437871872c1d2f5c5fb7 [0,2,0,0,0,0|1,0,0]=3 9527 B11R0.148 NC(=O)CCCCNCCC=O a914630748fa31f30156146f84c0bce8 [0,2,0,0,0,0|1,0,1]=4 9528 B11R0.148 NC(=O)CCCCNCCCCl c69a6c609e601cc521d945a717421b4f [0,2,0,0,0,0|1,0,0]=3 9529 B11R0.148 NC(=O)CCCCNCCCF f8a64426d37eea6493858e282e42a11c [0,2,0,0,0,0|1,0,0]=3 9530 B11R0.148 NC(=O)CCCCNCCCO 20f2a9509c580205b29d9ee0a7ccb454 [0,2,0,0,0,0|1,0,0]=3 9531 B11R0.148 NC(=O)CCCCNCCCS 546a28f163a4f3de6f5e792c134c5828 [0,2,0,0,0,0|1,0,0]=3 9532 B11R0.148 NC(=O)CCCCOCCC=O a0996701850bae960e53316f644a555f [0,2,0,0,0,0|1,0,1]=4 9533 B11R0.148 NC(=O)CCCCOCCCF 20d052fe0c2ffdfa693ff94ce3087a74 [0,2,0,0,0,0|1,0,0]=3 9534 B11R0.148 NC(=O)CCCCOCCCS 25ace9e1542d548bb5d0d23c164a887a [0,2,0,0,0,0|1,0,0]=3 9535 B11R0.148 NC(=O)CCCNCCCC=O de2f3abd95b16c8552e8a2346aa2a47e [0,2,0,0,0,0|1,0,1]=4 9536 B11R0.148 NC(=O)CCCNCCCCCl fdfb490e683e5bd92dac8295b169f8f5 [0,2,0,0,0,0|1,0,0]=3 9537 B11R0.148 NC(=O)CCCNCCCCF 84c2fc981a0d8c63fb569de5cce6377f [0,2,0,0,0,0|1,0,0]=3 9538 B11R0.148 NC(=O)CCCNCCCCO 8bfcde3cf3cc139a16cdde6d352acb46 [0,2,0,0,0,0|1,0,0]=3 9539 B11R0.148 NC(=O)CCCNCCCCS f0ad94ef0f1d660773bff0d890fbcae6 [0,2,0,0,0,0|1,0,0]=3 9540 B11R0.148 NC(=O)CCCOCCCC=O 7834e9b2e72242ea47febb183ca16422 [0,2,0,0,0,0|1,0,1]=4 9541 B11R0.148 NC(=O)CCCOCCCCF facbf834bb753e13c1cf5d08e0c79d3b [0,2,0,0,0,0|1,0,0]=3 9542 B11R0.148 NC(=O)CCCOCCCCS 015cd073cacedef6f76994cac1ed249b [0,2,0,0,0,0|1,0,0]=3 9543 B11R0.148 NC(=O)CCNCCCCC=O f72150e97344b5481fcfaec7a791a7f1 [0,2,0,0,0,0|1,0,1]=4 9544 B11R0.148 NC(=O)CCNCCCCCCl 7e203effe8696849f54942b2d9c25d40 [0,2,0,0,0,0|1,0,0]=3 9545 B11R0.148 NC(=O)CCNCCCCCF 7a247e3fce618c1e885f2ac4bd736c7f [0,2,0,0,0,0|1,0,0]=3 9546 B11R0.148 NC(=O)CCNCCCCCO d4108848428ef3c6a600ec7dba42db55 [0,2,0,0,0,0|1,0,0]=3 9547 B11R0.148 NC(=O)CCNCCOCCO d3a3fb849d0b2bf68486a7e1a8b6dd4d [0,2,0,0,0,0|2,0,0]=4 9548 B11R0.148 NC(=O)CCNCCOCCS 7722f9e3b4127f6482050f31d943b27d [0,2,0,0,0,0|2,0,0]=4 9549 B11R0.148 NC(=O)CCNCCSCCO 7843f89069a6550d219d3cedff461e71 [0,2,0,0,0,0|2,0,0]=4 9550 B11R0.148 NC(=O)CCOCCCCC=O ff0e9e8d325a3bccf30e38d08cae0026 [0,2,0,0,0,0|1,0,1]=4 9551 B11R0.148 NC(=O)CCOCCCCCF 00a733452876517b4da265e170bc7bbd [0,2,0,0,0,0|1,0,0]=3 9552 B11R0.148 NC(=O)CCOCCOCCF a0d563b14af09dc06e753821ab9a3d46 [0,2,0,0,0,0|2,0,0]=4 9553 B11R0.148 NC(=O)CCOCCOCCS 9fd195d564e26aaf4517a35764e8b823 [0,2,0,0,0,0|2,0,0]=4 9554 B11R0.148 NC(=O)CCSCCCNCF 3969f72b74f3e49e93b54ef6cba348ba [0,2,0,0,0,0|2,0,0]=4 9555 B11R0.148 NC(=O)CCSCCCNCO 503167e9f5ed4d0848fefb762fb82eb9 [0,2,0,0,0,0|2,0,0]=4 9556 B11R0.148 NC(=O)CNCCCCCC=O 56f80da7b354772ffe29a9cee4f3c583 [0,2,0,0,0,0|1,0,1]=4 9557 B11R0.148 NC(=O)CNCCCCCCCl 262e224afd9a8ca40fdeb1d245ad5407 [0,2,0,0,0,0|1,0,0]=3 9558 B11R0.148 NC(=O)CNCCCCCCF 3fa65816c27386354d646980a6113507 [0,2,0,0,0,0|1,0,0]=3 9559 B11R0.148 NC(=O)CNCCCCCCO 6f432ee9a5143b26f833302f9e4d6881 [0,2,0,0,0,0|1,0,0]=3 9560 B11R0.148 NC(=O)CNCCCOCCO e37de4463397f8a203216229e3b38656 [0,2,0,0,0,0|2,0,0]=4 9561 B11R0.148 NC(=O)CNCCOCCCO ec95d841091d9415313633785ed8b048 [0,2,0,0,0,0|2,0,0]=4 9562 B11R0.148 NC(=O)COCCCCCC=O 080ce4e04703a90e38590d017a0db063 [0,2,0,0,0,0|1,0,1]=4 9563 B11R0.148 NC(=O)COCCCCCCF dbced36028a89e27b9638aa57d1b522d [0,2,0,0,0,0|1,0,0]=3 9564 B11R0.148 NC(=O)COCCCCCCS f50384597f9f1096fdb1d0d3409d446b [0,2,0,0,0,0|1,0,0]=3 9565 B11R0.148 NC(=O)COCCNCCCCl 7c674f777bd3d26b236124a59872a6fa [0,2,0,0,0,0|2,0,0]=4 9566 B11R0.148 NC(=O)COCCNCCCO c90ae404518ba2fb4370babaee9b51eb [0,2,0,0,0,0|2,0,0]=4 9567 B11R0.148 NC(=O)COCCOCCCF 7d8afc072eaab446a13af896460cce18 [0,2,0,0,0,0|2,0,0]=4 9568 B11R0.148 NC(=O)COCCOCCCS acd76e95d92d45f976b01b7f49cdd768 [0,2,0,0,0,0|2,0,0]=4 9569 B11R0.148 NC(=O)CSCCOCCCF 92bd8c11e00daac433d291194b5229d4 [0,2,0,0,0,0|2,0,0]=4 9570 B11R0.148 NC(=O)CSCCOCCCS 8631469d4af442fb197fa609450d1a5c [0,2,0,0,0,0|2,0,0]=4 9571 B11R0.148 NC(=O)NCCNCCCCCl a8cf6f7187f0935ac5ecd72ee7a5f770 [0,2,0,0,0,0|2,0,0]=4 9572 B11R0.148 NC(=O)NCCNCCCCO 6facaad14083fbee403bfeef7d701d32 [0,2,0,0,0,0|2,0,0]=4 9573 B11R0.148 NC(=O)NCCNCCCCS a85edbd02c3c0458eb3b596d929b7026 [0,2,0,0,0,0|2,0,0]=4 9574 B11R0.148 NC(=O)NCCOCCCCF 8b4b62202d3b363b72f855df626a3347 [0,2,0,0,0,0|2,0,0]=4 9575 B11R0.148 NC(=O)NCCOCCCCS b88ddaccdde930767cf0c30a5474b9f4 [0,2,0,0,0,0|2,0,0]=4 9576 B11R0.148 NC(=O)NCOCCCCCF c423bcc7d2d9bad3d16f679b26c2485c [0,2,0,0,0,0|2,0,0]=4 9577 B11R0.148 NC(=O)SCNCCCCCCl e59892943b219f605ea289d8ff127d36 [0,2,0,0,0,0|2,0,0]=4 9578 B11R0.148 NC(=O)SCNCCCCCO 9ed8e69459a7f2c32d4f2c2224550603 [0,2,0,0,0,0|2,0,0]=4 9579 B11R0.148 NC(=S)CCNCCCCCF 20e642d965fcd3a8abce22124b74953a [0,2,0,0,0,0|1,1,0]=4 9580 B11R0.148 NC(=S)CCNCCCCCO 1001fce03c4bbf7a5d15fcb27c3a6e9d [0,2,0,0,0,0|1,1,0]=4 9581 B11R0.148 NC(=S)COCCCCCCF feac3f5c133803ba5a8c375f47d77f23 [0,2,0,0,0,0|1,1,0]=4 9582 B11R0.148 NOCCCCNCCC(=O)N 2cbb00a84387ddee41e737834569ea92 [0,2,0,0,0,0|2,0,0]=4 9583 B11R0.148 NOCCCCNCCC(=O)O 5fa440e68fe224bdab95dba0009736ef [0,2,0,0,0,0|1,0,0]=3 9584 B11R0.148 NOCCCCNCCS(=O)O 2b5d2655e48557630fd19ecae2df3d94 [0,2,0,0,0,0|2,0,0]=4 9585 B11R0.148 NOCCNCCCCC(=O)N 79d6510d4108c386accec3bf00f44044 [0,2,0,0,0,0|2,0,0]=4 9586 B11R0.148 NOCCNCCOCC(=O)O b3b8d260485aace14f1fef7c06258753 [0,2,0,0,0,0|2,0,0]=4 9587 B11R0.148 NOCCOCCNCC(=O)O b92b277f6e42120f998ad68674acfad8 [0,2,0,0,0,0|2,0,0]=4 9588 B11R0.148 O=C(O)/C=C/CNCCCCCl 0912bc0773986e5e1969c4a27bfdc07d [0,2,0,0,0,0|0,0,2]=4 9589 B11R0.148 O=C(O)/C=C/CNCCCCF 56f266d3a3f5fc5062552b4562e58214 [0,2,0,0,0,0|0,0,2]=4 9590 B11R0.148 O=C(O)/C=C/CNCCCCO 140b7288993f12dd80a706b21f40cfe1 [0,2,0,0,0,0|0,0,2]=4 9591 B11R0.148 O=C(O)/C=C/CNCCCCS fa83bbbbf41924ec133d28fec3c82b6c [0,2,0,0,0,0|0,0,2]=4 9592 B11R0.148 O=C(O)/C=C/COCCCCF 2a0c15a229f94b052b34765fd25399ce [0,2,0,0,0,0|0,0,2]=4 9593 B11R0.148 O=C(O)/C=C/COCCCCS 7686fa9506a78f47326a649578bd5bdd [0,2,0,0,0,0|0,0,2]=4 9594 B11R0.148 O=C(O)C#CCCOCCCF 09e8201f6a4330ce1d0f6b8c332997ed [0,2,0,0,0,0|0,0,2]=4 9595 B11R0.148 O=C(O)C#CCCOCCCS 5e6ac1a283f31a4fd8181a75ab632281 [0,2,0,0,0,0|0,0,2]=4 9596 B11R0.148 O=C(O)C#CCNCCCCF c1bcb694da981a0c8f70b99a6d94fbb3 [0,2,0,0,0,0|0,0,2]=4 9597 B11R0.148 O=C(O)C#CCNCCCCO 1950808cdbf80c86ca07802118033cb6 [0,2,0,0,0,0|0,0,2]=4 9598 B11R0.148 O=C(O)C#CCOCCCCF 7fb6e349aabdb2cf44121b2c104e0609 [0,2,0,0,0,0|0,0,2]=4 9599 B11R0.148 O=C(O)C=CCNCCCCCl 2297d9d87a648c4f9e8dec1f5784c06e [0,2,0,0,0,0|0,0,2]=4 9600 B11R0.148 O=C(O)C=CCNCCCCF b8af6c31e93fc6a20cd870d2837c5a2e [0,2,0,0,0,0|0,0,2]=4 9601 B11R0.148 O=C(O)C=CCNCCCCO 67026ef18bd90b4ddc10eaf215e2d38e [0,2,0,0,0,0|0,0,2]=4 9602 B11R0.148 O=C(O)C=CCNCCCCS ad2c43b1e490be01d5c3abc384dbbb20 [0,2,0,0,0,0|0,0,2]=4 9603 B11R0.148 O=C(O)C=CCOCCCCF c24ad3c8a0b1dcdb479219d723f0079f [0,2,0,0,0,0|0,0,2]=4 9604 B11R0.148 O=C(O)C=CCOCCCCS 1def563d19219a1128f275fb94d561ac [0,2,0,0,0,0|0,0,2]=4 9605 B11R0.148 O=C(O)CCCCCCNCF f40d7d9383d25faaad314796ef21d5fa [0,2,0,0,0,0|0,0,0]=2 9606 B11R0.148 O=C(O)CCCCCCNCO bb916ffc83ea8180940d031c988dc3e8 [0,2,0,0,0,0|0,0,0]=2 9607 B11R0.148 O=C(O)CCCCCCOCF 34a8de1dbb8755f9b03d4a6b70818343 [0,2,0,0,0,0|0,0,0]=2 9608 B11R0.148 O=C(O)CCCCCNCCF 2d0f7bc155a9f9712fc1930088d2f57c [0,2,0,0,0,0|0,0,0]=2 9609 B11R0.148 O=C(O)CCCCCNCCI 62e1c302fb46da9866e1e9dc257f5926 [0,2,0,0,0,0|0,0,0]=2 9610 B11R0.148 O=C(O)CCCCCNCCO 2f78bb25755cc91c2b83437fc93f8565 [0,2,0,0,0,0|0,0,0]=2 9611 B11R0.148 O=C(O)CCCCCNCCS 55708f3b44e02e5d397a9462463fa60e [0,2,0,0,0,0|0,0,0]=2 9612 B11R0.148 O=C(O)CCCCCOCCF c4ba4a4cd61bb822bfb7152b22c894c0 [0,2,0,0,0,0|0,0,0]=2 9613 B11R0.148 O=C(O)CCCCCOCCS 54daf2b20e1360245c618c055d3b8324 [0,2,0,0,0,0|0,0,0]=2 9614 B11R0.148 O=C(O)CCCCNC/C=C/Cl 09b49ab53889815501a3307629eef197 [0,2,0,0,0,0|0,0,2]=4 9615 B11R0.148 O=C(O)CCCCNC/C=C\Cl 797cc9ca93591484a80a0460ebf54706 [0,2,0,0,0,0|0,0,2]=4 9616 B11R0.148 O=C(O)CCCCNC/C=C\O 47dc84050f8b5898e23101e28c801c4e [0,2,0,0,0,0|0,0,2]=4 9617 B11R0.148 O=C(O)CCCCNCCCCl 7dfa60a025efa69ce573a4155dc51275 [0,2,0,0,0,0|0,0,0]=2 9618 B11R0.148 O=C(O)CCCCNCCCF cb609b243fe2249daace5aa4fc3d5443 [0,2,0,0,0,0|0,0,0]=2 9619 B11R0.148 O=C(O)CCCCNCCCO 9c5f1e63fc23fa4ad8947f4b10a88356 [0,2,0,0,0,0|0,0,0]=2 9620 B11R0.148 O=C(O)CCCCNCCCS 63698fa0bee516f1b0a5a6380ce8c8b9 [0,2,0,0,0,0|0,0,0]=2 9621 B11R0.148 O=C(O)CCCCOC/C=C/Cl ef15a1abb2dc92a870f475cb78adde57 [0,2,0,0,0,0|0,0,2]=4 9622 B11R0.148 O=C(O)CCCCOC/C=C\Cl 83d3ffe29dab5b69e0213bc8661adec5 [0,2,0,0,0,0|0,0,2]=4 9623 B11R0.148 O=C(O)CCCCOCC=CCl 5b1efdc7e9c35bc6f2c53d2f6b43a966 [0,2,0,0,0,0|0,0,2]=4 9624 B11R0.148 O=C(O)CCCCOCCCF c73ed8d5d070d316525e192103423940 [0,2,0,0,0,0|0,0,0]=2 9625 B11R0.148 O=C(O)CCCCOCCCS 5298991ccf9dc6658331de62de34a928 [0,2,0,0,0,0|0,0,0]=2 9626 B11R0.148 O=C(O)CCCNCC#CCO 5f08cf292809d1a209ac2718c4a78859 [0,2,0,0,0,0|0,0,2]=4 9627 B11R0.148 O=C(O)CCCNCCCCF 827217bc28435a5b55a219e4b41c3d32 [0,2,0,0,0,0|0,0,0]=2 9628 B11R0.148 O=C(O)CCCNCCCCO 3332bf77c04e3a57bcdc5c455290d6fd [0,2,0,0,0,0|0,0,0]=2 9629 B11R0.148 O=C(O)CCCOCCCCF 3d954790f2241d94083a955977aa19c2 [0,2,0,0,0,0|0,0,0]=2 9630 B11R0.148 O=C(O)CCNCCCCCCl d3a821819bcc60410809e4904f0f9898 [0,2,0,0,0,0|0,0,0]=2 9631 B11R0.148 O=C(O)CCNCCCCCF 46c6006c92eb32a27375ce34a21f8d22 [0,2,0,0,0,0|0,0,0]=2 9632 B11R0.148 O=C(O)CCNCCCCCO 5a39465ff3cd1d7a23960289cd66f619 [0,2,0,0,0,0|0,0,0]=2 9633 B11R0.148 O=C(O)CCNCCOCCO e67aea402c132c1738b6916d17670ba0 [0,2,0,0,0,0|1,0,0]=3 9634 B11R0.148 O=C(O)CCNCCOCCS 340d291ebde623e06f5960d9a83ab9a9 [0,2,0,0,0,0|1,0,0]=3 9635 B11R0.148 O=C(O)CCNCCSCCO 03b9cfb4968de8b67266a0bea3615534 [0,2,0,0,0,0|1,0,0]=3 9636 B11R0.148 O=C(O)CCOCCCCCF fabc09b462bdbb3b3613f7ec1f025c51 [0,2,0,0,0,0|0,0,0]=2 9637 B11R0.148 O=C(O)CCOCCNCCBr 3ebada56a67a101ed971a67aa6c02876 [0,2,0,0,0,0|1,0,0]=3 9638 B11R0.148 O=C(O)CCOCCNCCF 919b57381aa0ad162a070e908000ec8f [0,2,0,0,0,0|1,0,0]=3 9639 B11R0.148 O=C(O)CCOCCNCCI 6168bf853909f1d16f0f00368121f105 [0,2,0,0,0,0|1,0,0]=3 9640 B11R0.148 O=C(O)CCOCCNCCO b1c2f8d9b609321807385e688471df72 [0,2,0,0,0,0|1,0,0]=3 9641 B11R0.148 O=C(O)CCOCCNCCS 0eaaee8eeded787894f11a9f985c4367 [0,2,0,0,0,0|1,0,0]=3 9642 B11R0.148 O=C(O)CCOCCOCCF 9375477ec897fd524f828cf01c9b7d29 [0,2,0,0,0,0|1,0,0]=3 9643 B11R0.148 O=C(O)CCOCCOCCS 5e23a0ad0f56a017429ecf28dcaae411 [0,2,0,0,0,0|1,0,0]=3 9644 B11R0.148 O=C(O)CCSSCCNCF 760eae2264e78d0b60083cac1a958426 [0,2,0,0,0,0|2,0,0]=4 9645 B11R0.148 O=C(O)CCSSCCOCF aea4cf4784ed98e37633a479da867400 [0,2,0,0,0,0|2,0,0]=4 9646 B11R0.148 O=C(O)CNCCCCCCCl dc32a566986ba7b34107464790e296cc [0,2,0,0,0,0|0,0,0]=2 9647 B11R0.148 O=C(O)CNCCCCCCF bce3f1514075f3d2f8204865ec56aef1 [0,2,0,0,0,0|0,0,0]=2 9648 B11R0.148 O=C(O)CNCCCCCCO d2379b6809e52a0c5093502cf3d19ff8 [0,2,0,0,0,0|0,0,0]=2 9649 B11R0.148 O=C(O)CNCCCOCCO b3ede148a850227f5226acf871ac1005 [0,2,0,0,0,0|1,0,0]=3 9650 B11R0.148 O=C(O)CNCCOCCCO 739078e7a2efb6ef3daf1f3632ad3500 [0,2,0,0,0,0|1,0,0]=3 9651 B11R0.148 O=C(O)COCCCCCCF 225eb71627e39626696c7d9cbf9693d6 [0,2,0,0,0,0|0,0,0]=2 9652 B11R0.148 O=C(O)COCCCCCCS af996bea4ab4a7edbee11c3b6236257b [0,2,0,0,0,0|0,0,0]=2 9653 B11R0.148 O=C(O)COCCCNCCF 8b32e92fa02e7242998c345f7a977b41 [0,2,0,0,0,0|1,0,0]=3 9654 B11R0.148 O=C(O)COCCCNCCI 712e53ef936b52358253288a841bd35d [0,2,0,0,0,0|1,0,0]=3 9655 B11R0.148 O=C(O)COCCCNCCO af1363412898dd45b2ef47663e6192cf [0,2,0,0,0,0|1,0,0]=3 9656 B11R0.148 O=C(O)COCCCNCCS 75e753fe6eb66622fce8a4f43e0e88a7 [0,2,0,0,0,0|1,0,0]=3 9657 B11R0.148 O=C(O)COCCCOCCS 93d40af58ed169db3870b4f7730ba2c7 [0,2,0,0,0,0|1,0,0]=3 9658 B11R0.148 O=C(O)COCCNCCCCl 0806cac4bce43ac96d21219078edc296 [0,2,0,0,0,0|1,0,0]=3 9659 B11R0.148 O=C(O)COCCNCCCF 1b98c3a1b95cab12948cdd38711999fc [0,2,0,0,0,0|1,0,0]=3 9660 B11R0.148 O=C(O)COCCNCCCO ae2b3b43085ac55fbf99ff7706bf9066 [0,2,0,0,0,0|1,0,0]=3 9661 B11R0.148 O=C(O)COCCNCCCS 02ff7e96a3b0b949f29b9f959d11b4d2 [0,2,0,0,0,0|1,0,0]=3 9662 B11R0.148 O=C(O)COCCOCCCF 0e1756a03a0e777e09c442bd8440f846 [0,2,0,0,0,0|1,0,0]=3 9663 B11R0.148 O=C(O)COCCOCCCS 462b0a7ebd80bf497aa7b81df9206aad [0,2,0,0,0,0|1,0,0]=3 9664 B11R0.148 O=C(O)CSCCNCCCF d256aabf54971962af9cee6fb1bcb1f1 [0,2,0,0,0,0|1,0,0]=3 9665 B11R0.148 O=C(O)CSCCNCCCO 27ff6d16ed398227bf4781815176da87 [0,2,0,0,0,0|1,0,0]=3 9666 B11R0.148 O=CCCCCCNCC(=O)O 770cfb45a4f6bd8217e387ab818b844e [0,2,0,0,0,0|0,0,1]=3 9667 B11R0.148 O=CCCCCCOCC(=O)O 11458482d4179b8ff5974303f3937114 [0,2,0,0,0,0|0,0,1]=3 9668 B11R0.148 O=CCCCCCOCS(=O)O b4847dc4f0ee57be3dcb30893570d251 [0,2,0,0,0,0|1,0,1]=4 9669 B11R0.148 O=CCCCCNCCC(=O)O e79be6fb280c5d57d6d66f768499e566 [0,2,0,0,0,0|0,0,1]=3 9670 B11R0.148 O=CCCCCNCCS(=O)O ec0a5aff06f2c67cf4b2a05cb2d1957f [0,2,0,0,0,0|1,0,1]=4 9671 B11R0.148 O=CCCCCOCCC(=O)O fdbc1756579c13345d821e1a19a305b1 [0,2,0,0,0,0|0,0,1]=3 9672 B11R0.148 O=CCCCNCCCC(=O)O 9327c00549b9f681b42fa156980a20cf [0,2,0,0,0,0|0,0,1]=3 9673 B11R0.148 O=CCCCOCCCC(=O)O 9032481d7e21bbaef13ead97e986dff0 [0,2,0,0,0,0|0,0,1]=3 9674 B11R0.148 O=CCCNCCCCC(=O)O abe7ef8e1e977ff781ddd8220eda3a7e [0,2,0,0,0,0|0,0,1]=3 9675 B11R0.148 O=CCCNCCOCC(=O)O 1603ea819c4a4e0aff9495d6b9dd8433 [0,2,0,0,0,0|1,0,1]=4 9676 B11R0.148 O=CCCNCCSCC(=O)O b48f7a83d726cc4813e580b76f666663 [0,2,0,0,0,0|1,0,1]=4 9677 B11R0.148 O=CCCOCCCCC(=O)O b7f88f2cd478c0d77a46e19b7c287aa0 [0,2,0,0,0,0|0,0,1]=3 9678 B11R0.148 O=CCCOCCOCC(=O)O 1ddfe834a8c5223e38f7bd0974b43703 [0,2,0,0,0,0|1,0,1]=4 9679 B11R0.148 O=CCNCCCCCC(=O)O 2bc04200c99baf32b1ec80562574b58a [0,2,0,0,0,0|0,0,1]=3 9680 B11R0.148 O=CCNCCOCCC(=O)O c53334802448afc1826cfde9a3cbe5ab [0,2,0,0,0,0|1,0,1]=4 9681 B11R0.148 O=CCOCCCCCC(=O)O 4d6d28a8ec6f3d1dcc55ef7f71afa697 [0,2,0,0,0,0|0,0,1]=3 9682 B11R0.148 O=CCOCCNCCC(=O)O 35f457d2933876997f7b9c5cae9c8ffa [0,2,0,0,0,0|1,0,1]=4 9683 B11R0.148 O=CCOCCOCCC(=O)O 22951b638d14ddba9463c21e4350db41 [0,2,0,0,0,0|1,0,1]=4 9684 B11R0.148 O=CNCCOCCCC(=O)O 2d917cf6349b13cda36888f2bd0d7ac1 [0,2,0,0,0,0|1,0,1]=4 9685 B11R0.148 O=COCCOCCCC(=O)O 954950e8edda00faa01cde9e8b28443e [0,2,0,0,0,0|1,0,1]=4 9686 B11R0.148 O=S(O)CCNCCCCCF e366fcf006af824b57068d8d8720cc9a [0,2,0,0,0,0|1,0,0]=3 9687 B11R0.148 O=S(O)CCNCCCCCO ce73a3e48c3c84c138670f327c38ec51 [0,2,0,0,0,0|1,0,0]=3 9688 B11R0.148 O=S(O)CCNCCOCCO d8b3f6d863acebd9bff210a49d810916 [0,2,0,0,0,0|2,0,0]=4 9689 B11R0.148 O=S(O)COCCCCCCF 4e5af757d78c76381154134f13443755 [0,2,0,0,0,0|1,0,0]=3 9690 B11R0.148 O=[N+]([O-])CCCCOCCCF 8ef8e11189cf871b8e8634db4778b909 [0,2,0,0,0,0|1,0,1]=4 9691 B11R0.148 O=[N+]([O-])CCCCOCCCS 5e7fe26a4b774243201e7af3e243a142 [0,2,0,0,0,0|1,0,1]=4 9692 B11R0.148 O=[N+]([O-])CCCNCCCCCl 2a06e764342705852f3f0be11c8ba6c6 [0,2,0,0,0,0|1,0,1]=4 9693 B11R0.148 O=[N+]([O-])CCCNCCCCO 8146e99ed51cf199a8ed294f99179c32 [0,2,0,0,0,0|1,0,1]=4 9694 B11R0.148 O=[N+]([O-])CCCNCCCCS c0837ede44ca3452c99a3e3a704ddba0 [0,2,0,0,0,0|1,0,1]=4 9695 B11R0.148 O=[N+]([O-])CCCOCCCCF 37b0e646590060c918b40ada29c8e165 [0,2,0,0,0,0|1,0,1]=4 9696 B11R0.148 O=[N+]([O-])CCCOCCCCS b10bbafb9726e8be7fdf418b2980eb19 [0,2,0,0,0,0|1,0,1]=4 9697 B11R0.148 O=[N+]([O-])CCOCCCCCF 9ce2a7a3224fa5fbab7804603d33681e [0,2,0,0,0,0|1,0,1]=4 9698 B11R0.148 O=[N+]([O-])CNCCCCCCCl f16fab38358c399ff2a3daaa03b981ac [0,2,0,0,0,0|1,0,1]=4 9699 B11R0.148 O=[N+]([O-])CNCCCCCCO 7a8b92baee180f6bff3efd1f597857e0 [0,2,0,0,0,0|1,0,1]=4 9700 B11R0.148 O=[N+]([O-])COCCCCCCF 565293a764bd50fe9b923b1e1db9773f [0,2,0,0,0,0|1,0,1]=4 9701 B11R0.148 O=[N+]([O-])COCCCCCCS e673d6edfbc6e08e0d82d99b29ff40d4 [0,2,0,0,0,0|1,0,1]=4 9702 B11R0.159 CCCCCCNCC(C)(C)O 2aa578fdffe8a98c5a18daa33302c7d4 [0,2,0,0,0,0|1,0,1]=4 9703 B11R0.159 CCCCCCNCS(=O)(=O)C 7af11a04bcf8c5e189293ca380049ef7 [0,2,0,0,0,0|1,0,1]=4 9704 B11R0.159 CCCCCCNCS(=O)(=O)O ce5ed83d6ddc7e2fa47c3ba6426f327c [0,2,0,0,0,0|1,0,0]=3 9705 B11R0.159 CCCCCCOCC(C)(C)O c0362b6df206c60f756983a4e87a83e1 [0,2,0,0,0,0|1,0,1]=4 9706 B11R0.159 CCCCCCOCS(=O)(=O)C 8ba138c49cd4cc19fe69b71971d7f52b [0,2,0,0,0,0|1,0,1]=4 9707 B11R0.159 CCCCCNCCC(C)(C)O 3042b95fe42d3f7092916b2c73621e5b [0,2,0,0,0,0|1,0,1]=4 9708 B11R0.159 CCCCCNCCS(=O)(=O)C 6452203b02812ffdb0382b249ad978dd [0,2,0,0,0,0|1,0,1]=4 9709 B11R0.159 CCCCCNCCS(=O)(=O)N ed20923f533028a15e171862a8894aad [0,2,0,0,0,0|1,0,1]=4 9710 B11R0.159 CCCCCNCCS(=O)(=O)O b650e83234115415b71e75f0f9decbc5 [0,2,0,0,0,0|1,0,0]=3 9711 B11R0.159 CCCCCOCCC(C)(C)O 0278db2b4c87f85e7b53063af5b2967b [0,2,0,0,0,0|1,0,1]=4 9712 B11R0.159 CCCCCOCCS(=N)(=O)C f7f282f0423fd958d79051cc70537fdb [0,2,0,0,0,0|2,0,0]=4 9713 B11R0.159 CCCCCOCCS(=O)(=O)C 2419264a221c51fe3e694a9de805f270 [0,2,0,0,0,0|1,0,1]=4 9714 B11R0.159 CCCCCOCCS(=O)(=O)N c7b69ab2c5fa4832870e147a326f76fb [0,2,0,0,0,0|1,0,1]=4 9715 B11R0.159 CCCCCOCCS(=O)(=O)O 2636fd09442f0930a28022b7027aa46a [0,2,0,0,0,0|1,0,0]=3 9716 B11R0.159 CCCCNCCCC(C)(C)O 9d7ac595c2f0c7b802e9232fb11c92d7 [0,2,0,0,0,0|1,0,1]=4 9717 B11R0.159 CCCCNCCCS(=O)(=O)C 6a58947d46633fca1184eec4ce313bcc [0,2,0,0,0,0|1,0,1]=4 9718 B11R0.159 CCCCNCCCS(=O)(=O)N ec314b3158ad8b3fa300ed0363ae4ada [0,2,0,0,0,0|1,0,1]=4 9719 B11R0.159 CCCCNCCCS(=O)(=O)O 07e9131e63e992163f75eb70ba470334 [0,2,0,0,0,0|1,0,0]=3 9720 B11R0.159 CCCCNCCOS(=O)(=O)O a91cb49afdfe4dbe3661ba9cd2c6054f [0,2,0,0,0,0|2,0,0]=4 9721 B11R0.159 CCCCOCCCC(C)(C)O 44d401817afbf731461e9f1ff64078cd [0,2,0,0,0,0|1,0,1]=4 9722 B11R0.159 CCCCOCCCS(=O)(=O)C 331cf9a65f00fce0dd3ee6ed9cbd0417 [0,2,0,0,0,0|1,0,1]=4 9723 B11R0.159 CCCCOCCCS(=O)(=O)N 0c82024e505acbe19cac5c586d86ad0a [0,2,0,0,0,0|1,0,1]=4 9724 B11R0.159 CCCCOCCCS(=O)(=O)O 7476988f54d525729e24e76098452d00 [0,2,0,0,0,0|1,0,0]=3 9725 B11R0.159 CCCCOCNCS(=O)(=O)O d9e0c12e8cd41c2ffae241aa449110a3 [0,2,0,0,0,0|2,0,0]=4 9726 B11R0.159 CCCNCCCCS(=O)(=O)C 32dd0bc7557de3bad82b4aebdccd1504 [0,2,0,0,0,0|1,0,1]=4 9727 B11R0.159 CCCNCCCCS(=O)(=O)O 74a21255de4d91d86152bad89d211cb1 [0,2,0,0,0,0|1,0,0]=3 9728 B11R0.159 CCCOCCCCS(=O)(=O)C b5daa50e7644e82f3631e6d8d9fd0e5b [0,2,0,0,0,0|1,0,1]=4 9729 B11R0.159 CCCOCCCCS(=O)(=O)O 249347fe4c0bafb0737d12b476bb27b3 [0,2,0,0,0,0|1,0,0]=3 9730 B11R0.159 CCCOCCCNS(=O)(=O)O 4a6c94e5e3b869c5742babf893ea6aa9 [0,2,0,0,0,0|2,0,0]=4 9731 B11R0.159 CCCOCCNCS(=O)(=O)O fc4a71d49c75e55f5abd8eece9fc77c6 [0,2,0,0,0,0|2,0,0]=4 9732 B11R0.159 CCCOCCOCS(=O)(=O)O 95e3648de39750892043f65a5a2d0e8d [0,2,0,0,0,0|2,0,0]=4 9733 B11R0.159 CCNCCCCCS(=O)(=O)O 713c5bee641022ead822049d52fc1759 [0,2,0,0,0,0|1,0,0]=3 9734 B11R0.159 CCOCCCNCS(=O)(=O)O 54de28e4d428f35830a43aab38674147 [0,2,0,0,0,0|2,0,0]=4 9735 B11R0.159 CCOCCNCCS(=O)(=O)O 9f0e383bffecc9e5fb78613588b84c9b [0,2,0,0,0,0|2,0,0]=4 9736 B11R0.159 CCOCCOCCS(=O)(=O)O 8d947dcbf2cee72ce98dd922d642d096 [0,2,0,0,0,0|2,0,0]=4 9737 B11R0.159 CCOCNCCCS(=O)(=O)O 38ce7c0a02a9ddc19b9c346e1d9116d9 [0,2,0,0,0,0|2,0,0]=4 9738 B11R0.159 CCOCOCCCS(=O)(=O)O cfdab02724855e443e01116ec80b8ed8 [0,2,0,0,0,0|2,0,0]=4 9739 B11R0.159 CCSCCCNCS(=O)(=O)O 8c2ca80714faa0a9914fbed2b018a68a [0,2,0,0,0,0|2,0,0]=4 9740 B11R0.159 CCSCCNCCS(=O)(=O)O cc445ea1699af9966461f177dcaf8eeb [0,2,0,0,0,0|2,0,0]=4 9741 B11R0.159 CCSCCOCCS(=O)(=O)O 8e414f40414c86fd3404490be7c0fc00 [0,2,0,0,0,0|2,0,0]=4 9742 B11R0.159 COCCCCNCS(=O)(=O)O 0eba91e619735ad65274d46e194edb2c [0,2,0,0,0,0|2,0,0]=4 9743 B11R0.159 COCCCCOCS(=O)(=O)O 46729c70b931e03cd81aec96762f232b [0,2,0,0,0,0|2,0,0]=4 9744 B11R0.159 COCCCNCCS(=O)(=O)O 82114a684c0b83b586e8cbaa30298524 [0,2,0,0,0,0|2,0,0]=4 9745 B11R0.159 COCCCOCCS(=O)(=O)O 06f4dbdf356651b3f4d78e3f5943b1ba [0,2,0,0,0,0|2,0,0]=4 9746 B11R0.159 COCCNCCCS(=O)(=O)O 097984b9211d282dd4a13b5159192b1a [0,2,0,0,0,0|2,0,0]=4 9747 B11R0.159 COCCOCCCS(=O)(=O)O f1a16f3501e8699242b44050d4b1f92b [0,2,0,0,0,0|2,0,0]=4 9748 B11R0.159 COCOCCCCS(=O)(=O)O cc2df9d066260c8da5ea556b95bae899 [0,2,0,0,0,0|2,0,0]=4 9749 B11R0.159 CSCCCCNCS(=O)(=O)O 56df2e0be8b01194a54b531c4dcfcf36 [0,2,0,0,0,0|2,0,0]=4 9750 B11R0.159 CSCCCCOCS(=O)(=O)O d3bb11c0263d260a5b99de793d41ed58 [0,2,0,0,0,0|2,0,0]=4 9751 B11R0.159 CSCCCNCCS(=O)(=O)O 7603504d73e29fc09451ef0567f6e5e2 [0,2,0,0,0,0|2,0,0]=4 9752 B11R0.159 CSCCCOCCS(=O)(=O)O e8105e8005dd7f73f88ff45cb84274a9 [0,2,0,0,0,0|2,0,0]=4 9753 B11R0.159 CSCCNCCCS(=O)(=O)O c79a82010933cfb90482b340f9c9fb14 [0,2,0,0,0,0|2,0,0]=4 9754 B11R0.159 CSCCOCCCS(=O)(=O)O 9c80785ba88225d8c78878dc7f06fd50 [0,2,0,0,0,0|2,0,0]=4 9755 B11R0.159 CSCOCCCCS(=O)(=O)O eee2b84e161da6100e9bd602f2395804 [0,2,0,0,0,0|2,0,0]=4 9756 B11R0.159 O=S(=O)(O)CCCCCNCF 3750b721758f11ad57d5f8425a00e1d8 [0,2,0,0,0,0|2,0,0]=4 9757 B11R0.159 O=S(=O)(O)CCCCCNCO b32372487bd4f0b0c66d55f5f2bb1931 [0,2,0,0,0,0|2,0,0]=4 9758 B11R0.159 O=S(=O)(O)CCCCNCCBr 9a061d98ae153bdd59dc2106c46e27b1 [0,2,0,0,0,0|2,0,0]=4 9759 B11R0.159 O=S(=O)(O)CCCCNCCF 34a50fe02331e78eef69cd30057bcf6e [0,2,0,0,0,0|2,0,0]=4 9760 B11R0.159 O=S(=O)(O)CCCCNCCI 9012f4a6207180fbf4d6774ca8332321 [0,2,0,0,0,0|2,0,0]=4 9761 B11R0.159 O=S(=O)(O)CCCCNCCO 32f3e9bda169d0a06843234fd46b40a1 [0,2,0,0,0,0|2,0,0]=4 9762 B11R0.159 O=S(=O)(O)CCCCNCCS d02a6522b76c436ed6aff2e95c323bac [0,2,0,0,0,0|2,0,0]=4 9763 B11R0.159 O=S(=O)(O)CCCCOCCF 46385b49a0e27898faa8c1b7733c4000 [0,2,0,0,0,0|2,0,0]=4 9764 B11R0.159 O=S(=O)(O)CCCCOCCS 0cf29bc650d543bb31c604ee72e913fe [0,2,0,0,0,0|2,0,0]=4 9765 B11R0.159 O=S(=O)(O)CCCNCCCCl 26e78c56ad1a6cedbad7dc03f8f7e827 [0,2,0,0,0,0|2,0,0]=4 9766 B11R0.159 O=S(=O)(O)CCCNCCCF fcfbeeefb1b4988d67094d8731beab41 [0,2,0,0,0,0|2,0,0]=4 9767 B11R0.159 O=S(=O)(O)CCCNCCCO 7c0bd1ab8d6cb9476308789915d09451 [0,2,0,0,0,0|2,0,0]=4 9768 B11R0.159 O=S(=O)(O)CCCNCCCS ac767b15f0fa176c6f3a5d1fbf130460 [0,2,0,0,0,0|2,0,0]=4 9769 B11R0.159 O=S(=O)(O)CCCOCCCF a537947074bea7e15f602639b8b8fc45 [0,2,0,0,0,0|2,0,0]=4 9770 B11R0.159 O=S(=O)(O)CCCOCCCS 1222d2cfac093efa96b37f23b1df68cb [0,2,0,0,0,0|2,0,0]=4 9771 B11R0.159 O=S(=O)(O)CCNCCCCCl 9ae0fb05a8987d417aae1eae49e26bf8 [0,2,0,0,0,0|2,0,0]=4 9772 B11R0.159 O=S(=O)(O)CCNCCCCF 25d049148163e69f2c81338289ec37b5 [0,2,0,0,0,0|2,0,0]=4 9773 B11R0.159 O=S(=O)(O)CCNCCCCO 94c8e1dd44b825dbc0353dbad4b5ed12 [0,2,0,0,0,0|2,0,0]=4 9774 B11R0.159 O=S(=O)(O)CCNCCCCS ca4f39ca272198d626af1b5482bb4e93 [0,2,0,0,0,0|2,0,0]=4 9775 B11R0.159 O=S(=O)(O)CCOCCCCF 963eff71f19c137a256d3d035222a868 [0,2,0,0,0,0|2,0,0]=4 9776 B11R0.159 O=S(=O)(O)CCOCCCCS c6f703781e95c7cb77fec45eb3246420 [0,2,0,0,0,0|2,0,0]=4 9777 B11R0.159 O=S(=O)(O)CNCCCCCCl 6004d793a74e36809cac842d91dc9bf3 [0,2,0,0,0,0|2,0,0]=4 9778 B11R0.159 O=S(=O)(O)CNCCCCCF fd096a05ebda8ae0fb12ff7803d5cc7b [0,2,0,0,0,0|2,0,0]=4 9779 B11R0.159 O=S(=O)(O)CNCCCCCO 56b65ff3363e1739e8e3133f94d39894 [0,2,0,0,0,0|2,0,0]=4 9780 B11R0.176 C#CCN(C)CCCCC(=O)O 33ad1bc5d67e870ad7eb00658e3cf045 [0,2,0,0,0,0|0,0,2]=4 9781 B11R0.176 C=C(Br)CCOCC(C)CCC 2a8ac38bc2b158f4441f57e0419f4d80 [0,2,0,0,0,0|2,0,0]=4 9782 B11R0.176 C=C(Br)COCCC(C)CCC 6f427194b4f2c751cd30c0571580c010 [0,2,0,0,0,0|2,0,0]=4 9783 B11R0.176 C=C(Br)COCCC(S)CCC e962216925b3b5a3584d4e644a754bf1 [0,2,0,0,0,0|2,0,0]=4 9784 B11R0.176 C=C(C)CCCNC(C)CCC cf7aa5f43c0d7bb4619e19c9051d5377 [0,2,0,0,0,0|2,0,0]=4 9785 B11R0.176 C=C(C)CCCN[C@@H](C)CCC a79c7f661fefa818b63b147d2bcd080d [0,2,0,0,0,0|2,0,0]=4 9786 B11R0.176 C=C(C)CCCOC(C)CCC 31423e5291d34e19f4f1db5e68755e4f [0,2,0,0,0,0|2,0,0]=4 9787 B11R0.176 C=C(C)CCCO[C@@H](C)CCC b2d4e3ef7f4dd9ea0b8bbe7c43721bbe [0,2,0,0,0,0|2,0,0]=4 9788 B11R0.176 C=C(C)CCCO[C@H](C)CCC feb6b2aaba50419632b041cc12a5e5df [0,2,0,0,0,0|2,0,0]=4 9789 B11R0.176 C=C(C)CCNCC(C)CCC 71ad5e990f7bfdabbbb7f847d010341a [0,2,0,0,0,0|2,0,0]=4 9790 B11R0.176 C=C(C)CCNCC(O)CCC a768b2f6ed0bec373f8b0df4c976d571 [0,2,0,0,0,0|2,0,0]=4 9791 B11R0.176 C=C(C)CCOCC(C)CCC 4d65fbb8ed4026f9a148545372d0d1a1 [0,2,0,0,0,0|2,0,0]=4 9792 B11R0.176 C=C(C)COCCC(C)CCC b77663662cc7f24b849306a2ddf7d74b [0,2,0,0,0,0|2,0,0]=4 9793 B11R0.176 C=C(C)COCCC(S)CCC 66020f11059c6720a96c3fa26a5ec465 [0,2,0,0,0,0|2,0,0]=4 9794 B11R0.176 C=C(Cl)COCCC(C)CCC a855f942f217d7380ed36efb2a692043 [0,2,0,0,0,0|2,0,0]=4 9795 B11R0.176 C=C(Cl)COCCC(S)CCC 59112ecc95e3b8b17e49dd6d0f709292 [0,2,0,0,0,0|2,0,0]=4 9796 B11R0.176 C=C(F)COCCC(C)CCC d27cbba5635037082838844ba50d7331 [0,2,0,0,0,0|2,0,0]=4 9797 B11R0.176 C=C(F)COCCC(S)CCC a26313fc7522af9b695dad9663ab151f [0,2,0,0,0,0|2,0,0]=4 9798 B11R0.176 C=CCC(C)CNCCC(=O)O 1ecd5a2f20e52ea2bfbac226506e06fd [0,2,0,0,0,0|0,0,2]=4 9799 B11R0.176 C=CCC(C)COCCC(=O)O 7da5151627dce117261f03e3872dc554 [0,2,0,0,0,0|0,0,2]=4 9800 B11R0.176 C=CCC(O)CNCCC(=O)O c90f8e08ebb30cb6a2cd4edbc3aea50b [0,2,0,0,0,0|0,0,2]=4 9801 B11R0.176 C=CCN(C)CCCCC(=O)O de26898023e2f0bb52a2587f20c91829 [0,2,0,0,0,0|0,0,2]=4 9802 B11R0.176 CC#CC(C)OCCCC(=O)O 318b4910aa5c194097a5512d9249110b [0,2,0,0,0,0|0,0,2]=4 9803 B11R0.176 CC(=O)CCCCN(C)CCF 6e60fc4df285dc96ea95650a932749e5 [0,2,0,0,0,0|2,0,0]=4 9804 B11R0.176 CC(=O)CCCCN(C)CCO 2694a6a633df30eefd28510e8a4f73cf [0,2,0,0,0,0|2,0,0]=4 9805 B11R0.176 CC(=O)CCCNC(C)CCO 9dbdbc422ca14aafc12f375b4e3a83f2 [0,2,0,0,0,0|2,0,0]=4 9806 B11R0.176 CC(=O)CCCN[C@@H](C)CCO 734256db4b9aa66f28cfd2e6def4651f [0,2,0,0,0,0|2,0,0]=4 9807 B11R0.176 CC(=O)CCCN[C@H](C)CCO 20fbb22da453675d61c94eb4d8badaf7 [0,2,0,0,0,0|2,0,0]=4 9808 B11R0.176 CC(=O)CCNCC(C)CCO 8657136459e47ca17f35a6c13b6e1851 [0,2,0,0,0,0|2,0,0]=4 9809 B11R0.176 CC(=O)CCOC[C@@H](O)CCO b5234aeac1920ed6168dfe4f05a33ad9 [0,2,0,0,0,0|2,0,0]=4 9810 B11R0.176 CC(CC#N)NCCCC(=O)O 47c34186e1060302957350c306b30fc1 [0,2,0,0,0,0|1,0,1]=4 9811 B11R0.176 CC(CCO)CNCCC(=O)N d73024d562dbfc5a85830971bb8cbba6 [0,2,0,0,0,0|2,0,0]=4 9812 B11R0.176 CC(CCO)CNCCC(=O)O 1ab39c4fac67489d41b1d4f91d97f4c7 [0,2,0,0,0,0|1,0,0]=3 9813 B11R0.176 CC(CCO)NCCCC(=O)N 9a9ae85fe0b47477c44125fab3f39a57 [0,2,0,0,0,0|2,0,0]=4 9814 B11R0.176 CC(CCO)NCCCC(=O)O 2ab90a0be5ab9a8c6a31ff20f85d9888 [0,2,0,0,0,0|1,0,0]=3 9815 B11R0.176 CCCC(=O)CNCCC(=O)N db93ff76a4eb2e136d1f26f5b9e59e29 [0,2,0,0,0,0|1,0,1]=4 9816 B11R0.176 CCCC(=O)CNCCC(=O)O 6fc5bffc1a7bceaab37e77d713aebb3a [0,2,0,0,0,0|0,0,1]=3 9817 B11R0.176 CCCC(=O)CNCCS(=O)O f4b7923f85e7ffe1dff9810a9b3a2cba [0,2,0,0,0,0|1,0,1]=4 9818 B11R0.176 CCCC(=O)COCCC(=O)C 30d1f070029befa3b0666b78064dd252 [0,2,0,0,0,0|1,0,1]=4 9819 B11R0.176 CCCC(=O)COCCC(=O)N 2ff9311c22dacffbc1f1917183bc0253 [0,2,0,0,0,0|1,0,1]=4 9820 B11R0.176 CCCC(=O)COCCC(=O)O 70af2b31f7f8df2828edd15acf112909 [0,2,0,0,0,0|0,0,1]=3 9821 B11R0.176 CCCC(=O)NCCCC(=O)N 3691ca77bf51910cfd79cffbf5b43d8e [0,2,0,0,0,0|1,0,1]=4 9822 B11R0.176 CCCC(=O)OCOCC(=O)O 10cb912603c94c204284279a18b3d390 [0,2,0,0,0,0|1,0,1]=4 9823 B11R0.176 CCCC(=S)OCCCC(=O)C ff8c32e800cfc46d63e45dc82c5e6201 [0,2,0,0,0,0|1,0,1]=4 9824 B11R0.176 CCCC(=S)OCCCC(=O)N 0ef97b54f4d5e96b1d5c6e0e9d1093e4 [0,2,0,0,0,0|1,0,1]=4 9825 B11R0.176 CCCC(=S)OCCCC(=O)O 7620919911fa80680af601816fd3c6b5 [0,2,0,0,0,0|0,0,1]=3 9826 B11R0.176 CCCC(C)CCOCC(=O)N 359b6ec6b454c3e91d4247f1c89a2db1 [0,2,0,0,0,0|1,0,0]=3 9827 B11R0.176 CCCC(C)CCOCC(=O)O 58d54a522ab047b6bc16c21f6d8fc26f [0,2,0,0,0,0|0,0,0]=2 9828 B11R0.176 CCCC(C)CCOC[N+](=O)[O-] 5ebbbf0b595ccdb2a73ad0b383e7d5d8 [0,2,0,0,0,0|1,0,1]=4 9829 B11R0.176 CCCC(C)CNCCC(=O)N 91a260e441fe1319ef41b4b565e7d6a5 [0,2,0,0,0,0|1,0,0]=3 9830 B11R0.176 CCCC(C)CNCCC(=O)O 73577dfd03901eef4bbe55dae4ae1fb2 [0,2,0,0,0,0|0,0,0]=2 9831 B11R0.176 CCCC(C)CNCCC(=S)N 9cbc2bff9f9e221695c4a7949096ddd4 [0,2,0,0,0,0|1,1,0]=4 9832 B11R0.176 CCCC(C)CNCCC(C)O ab2f4999a5158b8e897c018cd358cfd8 [0,2,0,0,0,0|1,0,1]=4 9833 B11R0.176 CCCC(C)CNCCS(=O)C 2744cbc6c6b8bde8f030d53a9bce9958 [0,2,0,0,0,0|2,0,0]=4 9834 B11R0.176 CCCC(C)CNCCS(=O)O 3c4cc235b4d21c0f9947b3bab0b8e1b1 [0,2,0,0,0,0|1,0,0]=3 9835 B11R0.176 CCCC(C)CNCC[C@@H](C)O dc89991e487d286fff7953d069965ac5 [0,2,0,0,0,0|1,0,1]=4 9836 B11R0.176 CCCC(C)CNCC[C@H](C)O 174303d10f536105779af286b4fca2ad [0,2,0,0,0,0|1,0,1]=4 9837 B11R0.176 CCCC(C)COCCC(=O)C bd63923e341658bc0c9300990aab97f0 [0,2,0,0,0,0|1,0,0]=3 9838 B11R0.176 CCCC(C)COCCC(=O)N 58b947f8fa61af8147ed00e5f4889046 [0,2,0,0,0,0|1,0,0]=3 9839 B11R0.176 CCCC(C)COCCC(=O)O bd84fe650b47e44f2be6aeb7b4c8bf06 [0,2,0,0,0,0|0,0,0]=2 9840 B11R0.176 CCCC(C)COCCS(=O)C c6851cd8bdfab00ab6105a7622aa0ddf [0,2,0,0,0,0|2,0,0]=4 9841 B11R0.176 CCCC(C)COCC[N+](=O)[O-] b862f24cc51c30980e911247f5282666 [0,2,0,0,0,0|1,0,1]=4 9842 B11R0.176 CCCC(C)COCNC(=O)C 162e1f0126d815e77301ef5132662890 [0,2,0,0,0,0|2,0,0]=4 9843 B11R0.176 CCCC(C)COCNC(=O)N 68f130736c95329b0eef55b611b613f8 [0,2,0,0,0,0|2,0,0]=4 9844 B11R0.176 CCCC(C)COCOC(=O)C 681fff3619a740e736416cd45268b407 [0,2,0,0,0,0|2,0,0]=4 9845 B11R0.176 CCCC(C)COCSC(=O)N 6b58850790d55af5a2b984b6ed924223 [0,2,0,0,0,0|2,0,0]=4 9846 B11R0.176 CCCC(C)NC/C=C/C(=O)O 10a4f4435db3c8e3e1ae7a6f6539d11d [0,2,0,0,0,0|0,0,2]=4 9847 B11R0.176 CCCC(C)NCC#CC(=O)O 64d629a8cb0701d289447f91d8ab2873 [0,2,0,0,0,0|0,0,2]=4 9848 B11R0.176 CCCC(C)NCC=CC(=O)O 3ec30c33745e98890c5f777cff12136e [0,2,0,0,0,0|0,0,2]=4 9849 B11R0.176 CCCC(C)NCCCC(=O)C 79eb50a76b50a71931c0c933e59fcd2f [0,2,0,0,0,0|1,0,0]=3 9850 B11R0.176 CCCC(C)NCCCC(=O)N 9e8b836337adeda77636bae0ad7852aa [0,2,0,0,0,0|1,0,0]=3 9851 B11R0.176 CCCC(C)NCCCC(=O)O 04c4a7a7f4ffa1b1244fa093c18dae54 [0,2,0,0,0,0|0,0,0]=2 9852 B11R0.176 CCCC(C)NCCCC(C)O 631edea0bdce64152542720db6e368b5 [0,2,0,0,0,0|1,0,1]=4 9853 B11R0.176 CCCC(C)NCCCS(=O)C 63b91231e5808b04ac856df739e646ae [0,2,0,0,0,0|2,0,0]=4 9854 B11R0.176 CCCC(C)NCCC[N+](=O)[O-] 22014a5137ee01e67ab6922afd01e0d7 [0,2,0,0,0,0|1,0,1]=4 9855 B11R0.176 CCCC(C)NCCNC(=O)C 9832db5f548a8c1cc07712ca3f74d70f [0,2,0,0,0,0|2,0,0]=4 9856 B11R0.176 CCCC(C)NCCNC(=O)N e765e2f3f06a1581566db4870398d272 [0,2,0,0,0,0|2,0,0]=4 9857 B11R0.176 CCCC(C)NCCOC(=O)C 047951400f94ba5586166080f898d92c [0,2,0,0,0,0|2,0,0]=4 9858 B11R0.176 CCCC(C)NCCSC(=O)C c979dad0947dd60e0bc0ebadfc7c2842 [0,2,0,0,0,0|2,0,0]=4 9859 B11R0.176 CCCC(C)OC/C=C/C(=O)O 3b15f7875b55ec0f4a0da46ef9dccc88 [0,2,0,0,0,0|0,0,2]=4 9860 B11R0.176 CCCC(C)OCC#CC(=O)O 35df26925b2b0374bc80c7b7f8aff49a [0,2,0,0,0,0|0,0,2]=4 9861 B11R0.176 CCCC(C)OCC=CC(=O)O c94595b3bb649127b4f71cd98f8316cc [0,2,0,0,0,0|0,0,2]=4 9862 B11R0.176 CCCC(C)OCCCC(=O)C 96bfe9d58b63417e93594d6565e1abcf [0,2,0,0,0,0|1,0,0]=3 9863 B11R0.176 CCCC(C)OCCCC(=O)N 34f4dda2cc7c092c131b383432741a79 [0,2,0,0,0,0|1,0,0]=3 9864 B11R0.176 CCCC(C)OCCC[N+](=O)[O-] 2da5b12f2574035139400a83068721dc [0,2,0,0,0,0|1,0,1]=4 9865 B11R0.176 CCCC(C)OCCNC(=O)C 884bf69ea6a63bb999ee7e7610f71544 [0,2,0,0,0,0|2,0,0]=4 9866 B11R0.176 CCCC(C)OCCNC(=O)N 38cbef7d2e0b84b558e875fd3440bb91 [0,2,0,0,0,0|2,0,0]=4 9867 B11R0.176 CCCC(C)OCCOC(=O)C 98893700704bcbf0ba604049cd80373b [0,2,0,0,0,0|2,0,0]=4 9868 B11R0.176 CCCC(C)OCCSC(=O)C d3a006225cbc28205024e53379918c52 [0,2,0,0,0,0|2,0,0]=4 9869 B11R0.176 CCCC(O)CNCCC(=O)C e02e86ed7fd6744f57635282519df3e7 [0,2,0,0,0,0|1,0,0]=3 9870 B11R0.176 CCCC(O)CNCCC(=O)N 3cfae3bd5c7a1f07cc4edc83411ad4c9 [0,2,0,0,0,0|1,0,0]=3 9871 B11R0.176 CCCC(O)CNCCC(=O)O 74f98abd31079fd9c6942e28afbcf109 [0,2,0,0,0,0|0,0,0]=2 9872 B11R0.176 CCCC(O)CNCCC(C)O 702fbf0bb40b1da0a84b4de3ca529276 [0,2,0,0,0,0|1,0,1]=4 9873 B11R0.176 CCCC(O)CNCCS(=O)C 3f3601cda17766218328bbe723406dd0 [0,2,0,0,0,0|2,0,0]=4 9874 B11R0.176 CCCC(O)CNCOC(=O)C fac32769e835a8afb5f518720ede5a3f [0,2,0,0,0,0|2,0,0]=4 9875 B11R0.176 CCCC(O)CNCSC(=O)N e388cae623d5d4b62287337a50ea2f2d [0,2,0,0,0,0|2,0,0]=4 9876 B11R0.176 CCCC(S)CCOCC(=O)N 1367eecf0e1959d570e46e5748c2af2b [0,2,0,0,0,0|1,0,0]=3 9877 B11R0.176 CCCC(S)CCOCC(=O)O 82e8413d3a62e6cdf39de4a52bb4d7db [0,2,0,0,0,0|0,0,0]=2 9878 B11R0.176 CCCC(S)CCOC[N+](=O)[O-] 8ca5027db8f9fe83ce93edfc4e586ae8 [0,2,0,0,0,0|1,0,1]=4 9879 B11R0.176 CCCN(C)CCCCC(=O)C 064d9b300dd783383958c1adc14d8e94 [0,2,0,0,0,0|1,0,0]=3 9880 B11R0.176 CCCN(C)CCCCC(=O)N f3e32e305232e922bc56ab9f2e82658a [0,2,0,0,0,0|1,0,0]=3 9881 B11R0.176 CCCN(C)CCCCC(=O)O daac98f71969a61f3a6ff1214645bf8a [0,2,0,0,0,0|0,0,0]=2 9882 B11R0.176 CCCN(C)CCCCC(C)O fd4ed3a5d668a0b7cf3d1160786f2906 [0,2,0,0,0,0|1,0,1]=4 9883 B11R0.176 CCCN(C)CCCC[C@@H](C)O aacd8625fa2314f297b0e0b9dcec693a [0,2,0,0,0,0|1,0,1]=4 9884 B11R0.176 CCCN(C)CCCNC(=O)C 69971c97980bad548d45663c22fa8e10 [0,2,0,0,0,0|2,0,0]=4 9885 B11R0.176 CCCN(C)CCCOC(=O)C 320c7f38077449ca704ca86acd48f0dd [0,2,0,0,0,0|2,0,0]=4 9886 B11R0.176 CCCN(C)CCCSC(=O)C 9c5e5e188d0891dcea34c6b5087bdf04 [0,2,0,0,0,0|2,0,0]=4 9887 B11R0.176 CCCN(C)CCOCC(=O)N 3a1da17b13f92dd0f77cff14387863e5 [0,2,0,0,0,0|2,0,0]=4 9888 B11R0.176 CCCN(C)CCOCC(=O)O debc12ce8355b5b9418a77c113cb3ddd [0,2,0,0,0,0|1,0,0]=3 9889 B11R0.176 CCC[C@@H](C)OC/C=C/C(=O)O 246a71f248af353c44802c0f462d20a4 [0,2,0,0,0,0|0,0,2]=4 9890 B11R0.176 CCC[C@@H](C)OCC=CC(=O)O 077e12004dabb96b9ba8ef1ab6df2688 [0,2,0,0,0,0|0,0,2]=4 9891 B11R0.176 CCC[C@@H](C)OCCCC(=O)C 5c0372cf8436cbcabf8a92bbcecf0d0f [0,2,0,0,0,0|1,0,0]=3 9892 B11R0.176 CCC[C@@H](C)OCCCC(=O)N 066d5263b19b4a986ad51196f09e594b [0,2,0,0,0,0|1,0,0]=3 9893 B11R0.176 CCC[C@@H](C)OCCC[N+](=O)[O-] 7bbade4ef87ed4f1aa160ed19b895adc [0,2,0,0,0,0|1,0,1]=4 9894 B11R0.176 CCC[C@@H](C)OCCNC(=O)C 3b4008718229c3edcb442d20f38e8c3e [0,2,0,0,0,0|2,0,0]=4 9895 B11R0.176 CCC[C@@H](C)OCCNC(=O)N b466fc7f0e77bcf92c8bff4ea31b34d7 [0,2,0,0,0,0|2,0,0]=4 9896 B11R0.176 CCC[C@@H](C)OCCOC(=O)C bc218629d83a67047271ba4fa8d29871 [0,2,0,0,0,0|2,0,0]=4 9897 B11R0.176 CCC[C@@H](C)OCCSC(=O)C 13b61313eb373ae5596edbe6664f292f [0,2,0,0,0,0|2,0,0]=4 9898 B11R0.176 CCC[C@H](C)NC/C=C/C(=O)O fc6efa77992a6f1f40d9d0169c4d668d [0,2,0,0,0,0|0,0,2]=4 9899 B11R0.176 CCC[C@H](C)NCC=CC(=O)O 07a87910c859aa2b7ef92a8b1f794362 [0,2,0,0,0,0|0,0,2]=4 9900 B11R0.176 CCC[C@H](C)NCCCC(=O)C e24e3060e406b1afa25fa4590636f9fd [0,2,0,0,0,0|1,0,0]=3 9901 B11R0.176 CCC[C@H](C)NCCCC(=O)N 5ab6e7ea5573a2fb7b9a9081b714830e [0,2,0,0,0,0|1,0,0]=3 9902 B11R0.176 CCC[C@H](C)NCCCC(=O)O 0524477b3463cafee31b71a289309eed [0,2,0,0,0,0|0,0,0]=2 9903 B11R0.176 CCC[C@H](C)NCCCC(C)O 890848f965f22eb1f5f5fa5a61063d5c [0,2,0,0,0,0|1,0,1]=4 9904 B11R0.176 CCC[C@H](C)NCCC[N+](=O)[O-] 7e621deb552642d3003904f19146e486 [0,2,0,0,0,0|1,0,1]=4 9905 B11R0.176 CCC[C@H](C)NCCNC(=O)C cfb852629b0e069cbb401cb24f4aafa7 [0,2,0,0,0,0|2,0,0]=4 9906 B11R0.176 CCC[C@H](C)NCCNC(=O)N 59dd6c8c20fbd2e5d39a847e26d67191 [0,2,0,0,0,0|2,0,0]=4 9907 B11R0.176 CCC[C@H](C)NCCOC(=O)C 39788264c29bb90c68208f6e45b49bf5 [0,2,0,0,0,0|2,0,0]=4 9908 B11R0.176 CCC[C@H](C)NCCSC(=O)C 7185b65da981b1aee79f1fdfb5fd77be [0,2,0,0,0,0|2,0,0]=4 9909 B11R0.176 CCC[C@H](C)OC/C=C/C(=O)O 15ac7d39373e9494e1746704b756be0a [0,2,0,0,0,0|0,0,2]=4 9910 B11R0.176 CCC[C@H](C)OCC=CC(=O)O 449175fa60695a9cc05227c2001c8870 [0,2,0,0,0,0|0,0,2]=4 9911 B11R0.176 CCC[C@H](C)OCCCC(=O)C 0e20888937b7c12d77484063f65da900 [0,2,0,0,0,0|1,0,0]=3 9912 B11R0.176 CCC[C@H](C)OCCCC(=O)N 05a708350f9e23ed0eb7a85a60327220 [0,2,0,0,0,0|1,0,0]=3 9913 B11R0.176 CCC[C@H](C)OCCC[N+](=O)[O-] ca860951076a79b24bb0935572364b1b [0,2,0,0,0,0|1,0,1]=4 9914 B11R0.176 CCC[C@H](C)OCCNC(=O)C 09d6f0f180a6613840ed59de46df85b9 [0,2,0,0,0,0|2,0,0]=4 9915 B11R0.176 CCC[C@H](C)OCCNC(=O)N 4e5809a1afea3a2ee875f37d77e4246b [0,2,0,0,0,0|2,0,0]=4 9916 B11R0.176 CCC[C@H](C)OCCOC(=O)C 0d9168dc12ec74b0b0b2ff43841faa9a [0,2,0,0,0,0|2,0,0]=4 9917 B11R0.176 CCC[C@H](C)OCCSC(=O)C 6c3cbd4633c298547edd69d82475d241 [0,2,0,0,0,0|2,0,0]=4 9918 B11R0.176 CCNC(=O)CCNCC(=O)O 6bd807948c61bb4c258c2888204871aa [0,2,0,0,0,0|1,0,1]=4 9919 B11R0.176 CCNC(=O)CCOCC(=O)O 3f8169616e0e3f9dfa4b9555e8b33b5c [0,2,0,0,0,0|1,0,1]=4 9920 B11R0.176 CCNC(=O)CNCCC(=O)O ae43ec3cd385763249b4cdd22f141dfd [0,2,0,0,0,0|1,0,1]=4 9921 B11R0.176 CCNC(=O)COCCC(=O)O 1b6ae51128537216b42d31a27642503f [0,2,0,0,0,0|1,0,1]=4 9922 B11R0.176 CCOC(=O)CCNCC(=O)O 177bda5240d3a898e100a4d108de291d [0,2,0,0,0,0|1,0,1]=4 9923 B11R0.176 CCOC(=O)CCOCC(=O)O 676ae5cf1e007c00af194801a52a9559 [0,2,0,0,0,0|1,0,1]=4 9924 B11R0.176 CCOC(=O)CNCCC(=O)O e7bcd3c7dbee697b278498a48ef8aba9 [0,2,0,0,0,0|1,0,1]=4 9925 B11R0.176 CCOC(=O)COCCC(=O)O ee7ea4ecc27c308a2e83c3c710d87b8b [0,2,0,0,0,0|1,0,1]=4 9926 B11R0.176 CCOC(C)CNCCC(=O)C 37bc6caa214ecc695080392aec927554 [0,2,0,0,0,0|2,0,0]=4 9927 B11R0.176 CCOC(C)CNCCC(=O)N 9faf94c80bb35a22d3c2bd9326fcef9f [0,2,0,0,0,0|2,0,0]=4 9928 B11R0.176 CCOC(C)CNCCC(=O)O b16b8805951c8965d58f88c25a1648fa [0,2,0,0,0,0|1,0,0]=3 9929 B11R0.176 CCOC(C)COCCC(=O)C 7a372dae6270d1913fcbbf18cdc7bd62 [0,2,0,0,0,0|2,0,0]=4 9930 B11R0.176 CCOC(C)COCCC(=O)N fea836e14b2cbd3bc391f1d90b32e3c7 [0,2,0,0,0,0|2,0,0]=4 9931 B11R0.176 CCOC(C)COCCC(=O)O 414c28fbf11586ce871a277d75c345c5 [0,2,0,0,0,0|1,0,0]=3 9932 B11R0.176 CN(CC#N)CCCCC(=O)O d4d46b99fa6524fbf49f77824973dad6 [0,2,0,0,0,0|1,0,1]=4 9933 B11R0.176 CN(CC=O)CCCCC(=O)O f2f147fe012603e2b1794a77ead24a28 [0,2,0,0,0,0|1,0,1]=4 9934 B11R0.176 CN(CCF)CCCCC(=O)N 4677afb57b05a8dc70e91fc8a43cf31f [0,2,0,0,0,0|2,0,0]=4 9935 B11R0.176 CN(CCF)CCCCC(=O)O 71a182ebaa7165e270a8035109e56244 [0,2,0,0,0,0|1,0,0]=3 9936 B11R0.176 CN(CCF)CCOCC(=O)O 95563dbb4a4d6fc5cb9ef6246ca143a2 [0,2,0,0,0,0|2,0,0]=4 9937 B11R0.176 CN(CCO)CCCCC(=O)N b2d472c78a4dfd33131dad8d7e0a33cd [0,2,0,0,0,0|2,0,0]=4 9938 B11R0.176 CN(CCO)CCCCC(=O)O d79c655a40001a61187c32d43162451b [0,2,0,0,0,0|1,0,0]=3 9939 B11R0.176 CN(CCO)CCNCC(=O)O 8c9f2f6d84324ab24666eaa18f1dfe18 [0,2,0,0,0,0|2,0,0]=4 9940 B11R0.176 CN(CCO)CCOCC(=O)O b505673c68eb922f316fa8dbe7c2b128 [0,2,0,0,0,0|2,0,0]=4 9941 B11R0.176 CN(CCS)CCCCC(=O)O cce85b55a77bc80c23be6c823ca8ebe7 [0,2,0,0,0,0|1,0,0]=3 9942 B11R0.176 COCC(C)COCCC(=O)C d8021896dfba078b4d0a03fc8c48bba5 [0,2,0,0,0,0|2,0,0]=4 9943 B11R0.176 COCC(C)COCCC(=O)N c7093b660e45f47ca7c6a192fe0eaa71 [0,2,0,0,0,0|2,0,0]=4 9944 B11R0.176 COCC(C)NCCCC(=O)C ed16b70ea5a5fbbdfd44f0720e22405e [0,2,0,0,0,0|2,0,0]=4 9945 B11R0.176 COCC(C)NCCCC(=O)N 013793aa7e48c7ce0b4bb142425a4bd3 [0,2,0,0,0,0|2,0,0]=4 9946 B11R0.176 COCC(C)NCCCC(=O)O cec552d311fa30ce077ddec9d33e1d7c [0,2,0,0,0,0|1,0,0]=3 9947 B11R0.176 COCC(C)OCCCC(=O)C 7acb5c43eca2951defa2edf53a6b884f [0,2,0,0,0,0|2,0,0]=4 9948 B11R0.176 COCC(C)OCCCC(=O)N 78a899c17d8ecefd13a228b7bbabfc31 [0,2,0,0,0,0|2,0,0]=4 9949 B11R0.176 COCC(O)CNCCC(=O)C d35a733464b0f696e8989620b9c3c38f [0,2,0,0,0,0|2,0,0]=4 9950 B11R0.176 COCC(O)CNCCC(=O)N 43ad1e737765d453383fc4a30c163470 [0,2,0,0,0,0|2,0,0]=4 9951 B11R0.176 COCC(O)CNCCC(=O)O 9b0609b81646f0ad37c37539b382eb77 [0,2,0,0,0,0|1,0,0]=3 9952 B11R0.176 COCC(O)CNCCS(=O)O 6d1a058114edab7dfff006d6215b235d [0,2,0,0,0,0|2,0,0]=4 9953 B11R0.176 COCN(C)CCCCC(=O)O 936517f22bdfb59296e2bf7c69aeb6f4 [0,2,0,0,0,0|1,0,0]=3 9954 B11R0.176 COC[C@@H](C)NCCCC(=O)C 667b5626c2f09a5c035e48277eeb2be4 [0,2,0,0,0,0|2,0,0]=4 9955 B11R0.176 COC[C@@H](C)NCCCC(=O)N 3ecc63befaff6af674e71bb6a221ddf1 [0,2,0,0,0,0|2,0,0]=4 9956 B11R0.176 COC[C@@H](C)NCCCC(=O)O 90345be62b0560502ae18dd4c399f9a8 [0,2,0,0,0,0|1,0,0]=3 9957 B11R0.176 COC[C@@H](C)OCCCC(=O)C 056e8a0e71b8ed4612753f66176e372e [0,2,0,0,0,0|2,0,0]=4 9958 B11R0.176 COC[C@@H](C)OCCCC(=O)N ee7af15d284b54441889f06011936373 [0,2,0,0,0,0|2,0,0]=4 9959 B11R0.176 COC[C@@H](O)CNCCC(=O)C d00bfe9a4af6e5b6ca5ce5fe471afd24 [0,2,0,0,0,0|2,0,0]=4 9960 B11R0.176 COC[C@@H](O)CNCCC(=O)N 98dce6978dbc29120390a4646c111c02 [0,2,0,0,0,0|2,0,0]=4 9961 B11R0.176 COC[C@@H](O)CNCCC(=O)O c9f6b7e3665e6cdbbbb2ca8c07638fe9 [0,2,0,0,0,0|1,0,0]=3 9962 B11R0.176 COC[C@H](C)COCCC(=O)C 33abbfa873bf825073cd78005b25f834 [0,2,0,0,0,0|2,0,0]=4 9963 B11R0.176 COC[C@H](C)COCCC(=O)N d648d7992fe6db291b93c2a28463e2ef [0,2,0,0,0,0|2,0,0]=4 9964 B11R0.176 COC[C@H](C)NCCCC(=O)C 32a5de06944345ba060e297a88c2fe6b [0,2,0,0,0,0|2,0,0]=4 9965 B11R0.176 COC[C@H](C)NCCCC(=O)N acbb8d8f260d906473bba1dd657f4acb [0,2,0,0,0,0|2,0,0]=4 9966 B11R0.176 COC[C@H](C)NCCCC(=O)O ab706748835cb9e07c19c5bf84e53bf0 [0,2,0,0,0,0|1,0,0]=3 9967 B11R0.176 COC[C@H](C)OCCCC(=O)C 981f2b7b30e18c9c5b4f387c8eb21a7b [0,2,0,0,0,0|2,0,0]=4 9968 B11R0.176 COC[C@H](C)OCCCC(=O)N 36721162d9540ada04fe47c1061d8bf2 [0,2,0,0,0,0|2,0,0]=4 9969 B11R0.176 CSCC(C)OCCCC(=O)C 6f3bf3a3536529e3c35c793453b3e391 [0,2,0,0,0,0|2,0,0]=4 9970 B11R0.176 CSCC(C)OCCCC(=O)N 56cb41584948b0d7c909979c7d7e8299 [0,2,0,0,0,0|2,0,0]=4 9971 B11R0.176 CSCC(C)OCCCC(=O)O 5915820b4c8522f8ee66e8992417579e [0,2,0,0,0,0|1,0,0]=3 9972 B11R0.176 CSCN(C)CCCCC(=O)O 65b96fd18ddd5ceca7eb99693a511c18 [0,2,0,0,0,0|1,0,0]=3 9973 B11R0.176 C[C@@H](CCO)NCCCC(=O)N 03c32e316a92c9cbbe6f9b2479545c2e [0,2,0,0,0,0|2,0,0]=4 9974 B11R0.176 C[C@@H](CCO)NCCCC(=O)O aa94313cd6d93ff1eae8e62290362358 [0,2,0,0,0,0|1,0,0]=3 9975 B11R0.176 C[C@H](CCO)NCCCC(=O)N b38d5d078f26a9fe1a72bb1e9da4449b [0,2,0,0,0,0|2,0,0]=4 9976 B11R0.176 C[C@H](CCO)NCCCC(=O)O 16c2017fc07560fe8790be04a376de0d [0,2,0,0,0,0|1,0,0]=3 9977 B11R0.176 N#CCC(O)CNCCC(=O)O 73d14659cfa187bf614ef95e00684cd3 [0,2,0,0,0,0|1,0,1]=4 9978 B11R0.176 N#CC[C@@H](O)CNCCC(=O)O 5e85fbb41403eb050358efa46d862680 [0,2,0,0,0,0|1,0,1]=4 9979 B11R0.176 N#CC[C@H](O)CNCCC(=O)O b29d5561d6aaf42847e71f040bbbc18f [0,2,0,0,0,0|1,0,1]=4 9980 B11R0.176 NC(=O)CCOC[C@@H](O)CCO 4e766c7fd1adfc4d4988af32c3a65f81 [0,2,0,0,0,0|2,0,0]=4 9981 B11R0.176 O=C(O)CCOC[C@@H](O)CCO 1943caf4cbf992cc7ad4ec2408f04729 [0,2,0,0,0,0|1,0,0]=3 9982 B11R0.176 O=S(O)CCNC[C@@H](O)CCO 3d7472e441363ade8ad2f7873f989110 [0,2,0,0,0,0|2,0,0]=4 9983 B11R0.68 CC(CC(=O)O)N(C)CCCF 471d1122c5a45aa4e9b883be37185932 [0,2,0,0,0,0|2,0,0]=4 9984 B11R0.68 CC(CC(=O)O)N(C)CCCO 2aee3f5079280d54752dc756e160df18 [0,2,0,0,0,0|2,0,0]=4 9985 B11R0.68 CC(CC(=O)O)N(C)CCCS 3d3e4e877a19de68c14eae91bba781d7 [0,2,0,0,0,0|2,0,0]=4 9986 B11R0.68 CC(CCCO)N(C)CC(=O)O 62ef411d45b5d7ff6fc47292397389de [0,2,0,0,0,0|2,0,0]=4 9987 B11R0.68 CCCCC(C)N(C)CC(=O)N 17f57c8cb0e2ce8e1afc67d0b4d65589 [0,2,0,0,0,0|2,0,0]=4 9988 B11R0.68 CCCCC(C)N(C)CC(=O)O 317d6297cc2a175a3a30abfb22afdb78 [0,2,0,0,0,0|1,0,0]=3 9989 B11R0.68 CCCCN(C)C(C)CC(=O)O d6e8a95253405d99a911681681c184b5 [0,2,0,0,0,0|1,0,0]=3 9990 B11R0.68 CCOCN(C)C(C)CC(=O)O 4bf81982eb79b6914066c398b5e01426 [0,2,0,0,0,0|2,0,0]=4 9991 B11R0.68 COCCN(C)C(C)CC(=O)O bbd347e64e21cd5b4fd089efc9346899 [0,2,0,0,0,0|2,0,0]=4 9992 B11R0.68 CSCCN(C)C(C)CC(=O)O da0a5591de9695ba44bbef1c9918f022 [0,2,0,0,0,0|2,0,0]=4 9993 B11R0.77 CCC(CC(=O)O)NCCCF 8c0b3303f6ca77d7a45ea1c371a5e164 [0,2,0,0,0,0|2,0,0]=4 9994 B11R0.77 CCC(CC(=O)O)NCCCO 56d071cfa8c67e125e7f68ab76459c3f [0,2,0,0,0,0|2,0,0]=4 9995 B11R0.77 CCC(CC(=O)O)NCCCS d819383fa5f09c239bd4d5e41534aed2 [0,2,0,0,0,0|2,0,0]=4 9996 B11R0.77 CCC(CC(=O)O)NCCOC 5186b4c09d011af265001d7ba15ae4e1 [0,2,0,0,0,0|2,0,0]=4 9997 B11R0.77 CCC(CC(=O)O)NCCSC 682440ca2218e8e73440e4d9201b2ac3 [0,2,0,0,0,0|2,0,0]=4 9998 B11R0.77 CCC(CC(=O)O)OCCCF 508854d43ccd86e5a028a9bf1ea1475a [0,2,0,0,0,0|2,0,0]=4 9999 B11R0.77 CCC(CC(=O)O)OCCCS f194529b86e310823c853a7df9171ff7 [0,2,0,0,0,0|2,0,0]=4 10000 B11R0.77 CCC(CC(=O)O)OCCOC b6d3e482d3aaeb063580e11494e8dad4 [0,2,0,0,0,0|2,0,0]=4 10001 B11R0.77 CCC(CC(=O)O)OCCSC 3828f87376da6a70460a570f8b3a3726 [0,2,0,0,0,0|2,0,0]=4 10002 B11R0.77 CCCCCN(C=O)CC(=O)N 18285495a477a2591f4f584d45ce8907 [0,2,0,0,0,0|2,0,0]=4 10003 B11R0.77 CCCCCN(CC)CC(=O)N 429c65343f3a5c47743ce5bcc9b9bfeb [0,2,0,0,0,0|2,0,0]=4 10004 B11R0.77 CCCCCN(CC)CC(=O)O eab17f4c2658f18e5aeae023d3f4b139 [0,2,0,0,0,0|1,0,0]=3 10005 B11R0.77 CCCCCN(CF)CC(=O)N 90c18f01c9be3a7c5a7fed50705f4385 [0,2,0,0,0,0|2,0,0]=4 10006 B11R0.77 CCCCCN(CO)CC(=O)N 34e30ca7fb76c5c7b3a3ef78bd1a6462 [0,2,0,0,0,0|2,0,0]=4 10007 B11R0.77 CCCCNC(CC)CC(=O)O 6678af0e99e2c35122edbd53f3e35605 [0,2,0,0,0,0|1,0,0]=3 10008 B11R0.77 CCCCNC(CO)CC(=O)O 75a86bd5e04d598c2b9404ce7777ada1 [0,2,0,0,0,0|1,0,0]=3 10009 B11R0.77 CCCCN[C@@H](CC)CC(=O)O e9b7b5ee9c8520ad73e4c8d9c0623f20 [0,2,0,0,0,0|1,0,0]=3 10010 B11R0.77 CCCCN[C@@H](CO)CC(=O)O 1c13cf3c93a75f0548135a90cedaa528 [0,2,0,0,0,0|1,0,0]=3 10011 B11R0.77 CCCCN[C@H](CC)CC(=O)O 42b52a9f27bea87707073ba9e909d26c [0,2,0,0,0,0|1,0,0]=3 10012 B11R0.77 CCCCN[C@H](CO)CC(=O)O ab0071a15381303822f5cd84af9309c5 [0,2,0,0,0,0|1,0,0]=3 10013 B11R0.77 CCCCOC(CC)CC(=O)O 5cc4e69f01921f0191adf4adb2c3f9d1 [0,2,0,0,0,0|1,0,0]=3 10014 B11R0.77 CCCCO[C@@H](CC)CC(=O)O c18f872d8dbcb395ca639f808582df7d [0,2,0,0,0,0|1,0,0]=3 10015 B11R0.77 CCCCO[C@H](CC)CC(=O)O f725eb4c8ee14481054b6ac852b5f23e [0,2,0,0,0,0|1,0,0]=3 10016 B11R0.77 CCN(CCCCF)CC(=O)O 570eaf1bc08fee01cdd17ca1d2636635 [0,2,0,0,0,0|2,0,0]=4 10017 B11R0.77 CCN(CCCCO)CC(=O)O 6311fbed972981883395fa879498735a [0,2,0,0,0,0|2,0,0]=4 10018 B11R0.77 CCN(CCCOC)CC(=O)O 370eebd2486bbbdd6d717c9c530937b3 [0,2,0,0,0,0|2,0,0]=4 10019 B11R0.77 CCN(CCCSC)CC(=O)O 3cfcd9f9d78dfae3620e647192d1f0a9 [0,2,0,0,0,0|2,0,0]=4 10020 B11R0.77 CCOCCN(CC)CC(=O)O 85e7261bf1f08b2ba552fbf1553c930a [0,2,0,0,0,0|2,0,0]=4 10021 B11R0.77 CCOCNC(CC)CC(=O)O c3b22b087943abd7b0a1811c2880c9d7 [0,2,0,0,0,0|2,0,0]=4 10022 B11R0.77 CCOCNC(CO)CC(=O)O 770de72dfc721a63cfd39431ae498fe5 [0,2,0,0,0,0|2,0,0]=4 10023 B11R0.77 CCOCN[C@@H](CC)CC(=O)O dcd25b084a5655d000f0fd6bb95bd11f [0,2,0,0,0,0|2,0,0]=4 10024 B11R0.77 CCOCN[C@@H](CO)CC(=O)O 4e7a742d4082bb0239bd9c103449dc72 [0,2,0,0,0,0|2,0,0]=4 10025 B11R0.77 CCOCN[C@H](CC)CC(=O)O 9e78f860d2d0ba595a9d79967dd9ff8f [0,2,0,0,0,0|2,0,0]=4 10026 B11R0.77 CCOCN[C@H](CO)CC(=O)O 91935420890a2eab35631052ad44ef34 [0,2,0,0,0,0|2,0,0]=4 10027 B11R0.77 CCSCCN(CC)CC(=O)O 3e5ed73c6abe5b7d68593f469151ae3d [0,2,0,0,0,0|2,0,0]=4 10028 B11R0.77 CC[C@@H](CC(=O)O)NCCCF 9769c713bc3dc57a01602e079b883e2c [0,2,0,0,0,0|2,0,0]=4 10029 B11R0.77 CC[C@@H](CC(=O)O)NCCCO 8971f31aad9d3b4d49a10f2619abba61 [0,2,0,0,0,0|2,0,0]=4 10030 B11R0.77 CC[C@@H](CC(=O)O)NCCCS 3616b41fbfd303fb99c89727173da89a [0,2,0,0,0,0|2,0,0]=4 10031 B11R0.77 CC[C@@H](CC(=O)O)NCCOC db336a0d05b0c988febadf97e7655845 [0,2,0,0,0,0|2,0,0]=4 10032 B11R0.77 CC[C@@H](CC(=O)O)NCCSC 70ed0f3f8a710111a95c3c4ef1af3ba4 [0,2,0,0,0,0|2,0,0]=4 10033 B11R0.77 CC[C@@H](CC(=O)O)OCCCF e16e3ba3670551f5bb68ff880ce8e654 [0,2,0,0,0,0|2,0,0]=4 10034 B11R0.77 CC[C@@H](CC(=O)O)OCCCS 127cfdefdb654741e626093ff84d23dc [0,2,0,0,0,0|2,0,0]=4 10035 B11R0.77 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B11R0.107 CCC(=O)CN[C@@H](C)CC(=O)O 8df9bdfa3852ba8f10011690dfaa604b [0,2,0,0,0,0|1,0,1]=4 10090 B11R0.107 CCC(=O)CN[C@H](C)CC(=O)O bd9a0f515a3c0a69b686d8d244aa2d62 [0,2,0,0,0,0|1,0,1]=4 10091 B11R0.107 CCC(=O)COC(C)CC(=O)O fdce8321b29b12042e2b99b8b792f4c3 [0,2,0,0,0,0|1,0,1]=4 10092 B11R0.107 CCC(=O)CO[C@@H](C)CC(=O)O a4ef38bf9b4e3f8370b87ee8a80817fa [0,2,0,0,0,0|1,0,1]=4 10093 B11R0.107 CCC(=O)CO[C@H](C)CC(=O)O 304cb1c774efe9fa2f5a365a9773302a [0,2,0,0,0,0|1,0,1]=4 10094 B11R0.107 CCC(C)CCN(C)CC(=O)N 47c8a504cf77e74284effdd226771faa [0,2,0,0,0,0|2,0,0]=4 10095 B11R0.107 CCC(C)CCN(C)CC(=O)O 191696dd4b927380eeca4381e06dced3 [0,2,0,0,0,0|1,0,0]=3 10096 B11R0.107 CCC(C)CNC(C)CC(=O)O 1083d5bf3d9c0e90952fb7047a3fbfac [0,2,0,0,0,0|1,0,0]=3 10097 B11R0.107 CCC(C)CN[C@@H](C)CC(=O)O 3c370dff911573546f99d2bcf325bc06 [0,2,0,0,0,0|1,0,0]=3 10098 B11R0.107 CCC(C)CN[C@H](C)CC(=O)O f669c2a405079c9c16f996873ac006c3 [0,2,0,0,0,0|1,0,0]=3 10099 B11R0.107 CCC(C)COC(C)CC(=O)N 04622d7e3fc5637b070ecbea4fe91480 [0,2,0,0,0,0|2,0,0]=4 10100 B11R0.107 CCC(C)COC(C)CC(=O)O 01c950d718431e203cd46c62851ef93e [0,2,0,0,0,0|1,0,0]=3 10101 B11R0.107 CCC(C)CO[C@@H](C)CC(=O)O 359d594d85df0a47d86a1038743d6a27 [0,2,0,0,0,0|1,0,0]=3 10102 B11R0.107 CCC(C)CO[C@H](C)CC(=O)O 5f0c84b5879b7a3ae51fee835583d987 [0,2,0,0,0,0|1,0,0]=3 10103 B11R0.107 CCC(C)NCC(O)CC(=O)O aa056ed32b2f2b95de59934cf4fd1061 [0,2,0,0,0,0|1,0,0]=3 10104 B11R0.107 CCC(C)NC[C@@H](O)CC(=O)O 53c973b9df3e73057217b45becb2b471 [0,2,0,0,0,0|1,0,0]=3 10105 B11R0.107 CCC(C)NC[C@H](O)CC(=O)O deab26b97c8fe4430fafc196b1b1df14 [0,2,0,0,0,0|1,0,0]=3 10106 B11R0.107 CCC(C)OCC(=O)CC(=O)O 5e0dbab52ee432914e47b0a7f5fc95f2 [0,2,0,0,0,0|1,0,1]=4 10107 B11R0.107 CCC(O)CNC(C)CC(=O)O ff30a7cddf4a2510ae11d268b0c7be50 [0,2,0,0,0,0|1,0,0]=3 10108 B11R0.107 CCC(O)CN[C@@H](C)CC(=O)O 5c3cf045de9a4993864c25c36730fd57 [0,2,0,0,0,0|1,0,0]=3 10109 B11R0.107 CCC(O)CN[C@H](C)CC(=O)O 9ae796309449e31a5d4f336e43ed3f56 [0,2,0,0,0,0|1,0,0]=3 10110 B11R0.107 CCN(C)CCC(C)CC(=O)O 087a0a3588fd8c9886cd0b11f6687c5e [0,2,0,0,0,0|1,0,0]=3 10111 B11R0.107 CCN(C)CCN(C)CC(=O)O d466dec5ce849529c6eda56415951918 [0,2,0,0,0,0|2,0,0]=4 10112 B11R0.107 CCS(=O)CCN(C)CC(=O)O 7e604bfd58a988213ab1a8d793a1099c [0,2,0,0,0,0|2,0,0]=4 10113 B11R0.107 CC[C@@H](C)CNC(C)CC(=O)O 43f86d5473f0696b42f891ea9130da1e [0,2,0,0,0,0|1,0,0]=3 10114 B11R0.107 CC[C@@H](C)CN[C@@H](C)CC(=O)O 3cbc4cb853ead3a07784ac076ce20880 [0,2,0,0,0,0|1,0,0]=3 10115 B11R0.107 CC[C@@H](C)CN[C@H](C)CC(=O)O 0e61551b29e5ff4abd82ff0aa6c5e276 [0,2,0,0,0,0|1,0,0]=3 10116 B11R0.107 CC[C@@H](C)COC(C)CC(=O)N 3574eae46a658cbfbc532dc58ef5e93e [0,2,0,0,0,0|2,0,0]=4 10117 B11R0.107 CC[C@@H](C)COC(C)CC(=O)O 5f50b9a845d16f4e481ae48cb69f4ebc [0,2,0,0,0,0|1,0,0]=3 10118 B11R0.107 CC[C@@H](C)CO[C@@H](C)CC(=O)O 42d718a6d88b343173fd373e1668fec4 [0,2,0,0,0,0|1,0,0]=3 10119 B11R0.107 CC[C@@H](C)CO[C@H](C)CC(=O)O af2822454db5e9e22f1b3edc773ea95a [0,2,0,0,0,0|1,0,0]=3 10120 B11R0.107 CC[C@@H](C)OCC(=O)CC(=O)O dbfdbf01b5f8a9a32a2ee3d537876827 [0,2,0,0,0,0|1,0,1]=4 10121 B11R0.107 CC[C@@H](O)CNC(C)CC(=O)O a9566c0564710c501ab78d96aff9b4a1 [0,2,0,0,0,0|1,0,0]=3 10122 B11R0.107 CC[C@H](C)CNC(C)CC(=O)O 867782cb5471dc75c66d345e277a251e [0,2,0,0,0,0|1,0,0]=3 10123 B11R0.107 CC[C@H](C)CN[C@@H](C)CC(=O)O f93bd695028edbc3f2622b06de4f82ab [0,2,0,0,0,0|1,0,0]=3 10124 B11R0.107 CC[C@H](C)CN[C@H](C)CC(=O)O 165f77f02d3bb4ad84bc4ec8ab2a820b [0,2,0,0,0,0|1,0,0]=3 10125 B11R0.107 CC[C@H](C)COC(C)CC(=O)N 448de3a420fd0a7ccb8e8fb7955e091f [0,2,0,0,0,0|2,0,0]=4 10126 B11R0.107 CC[C@H](C)COC(C)CC(=O)O 111fde1789a72115ed02dc353676c196 [0,2,0,0,0,0|1,0,0]=3 10127 B11R0.107 CC[C@H](C)CO[C@@H](C)CC(=O)O 9bc492625fab8bceb4524d171071ede9 [0,2,0,0,0,0|1,0,0]=3 10128 B11R0.107 CC[C@H](C)CO[C@H](C)CC(=O)O de661a238d0662f6ca21480dd7186546 [0,2,0,0,0,0|1,0,0]=3 10129 B11R0.107 CC[C@H](C)OCC(=O)CC(=O)O c692d49ab1d467089828b950b4354d29 [0,2,0,0,0,0|1,0,1]=4 10130 B11R0.107 COC(C)CNC(C)CC(=O)O 64bee56a34e432c19500785fb3674cdf [0,2,0,0,0,0|2,0,0]=4 10131 B11R0.107 COC(C)CN[C@@H](C)CC(=O)O 7360be2283768e13310d9256f1f80c9b [0,2,0,0,0,0|2,0,0]=4 10132 B11R0.107 COC(C)CN[C@H](C)CC(=O)O 15c16e3e13ff17c90b910e369bfda0f9 [0,2,0,0,0,0|2,0,0]=4 10133 B11R0.107 COC(C)COC(C)CC(=O)O 4c3542a72819b6f3ca99aefcc62132ae [0,2,0,0,0,0|2,0,0]=4 10134 B11R0.107 COC(C)CO[C@@H](C)CC(=O)O b7f96310ffd8c0fb41f24ffcd6d524f0 [0,2,0,0,0,0|2,0,0]=4 10135 B11R0.107 COC(C)CO[C@H](C)CC(=O)O 13e491cd6f8bcb8b204989eb8752ef43 [0,2,0,0,0,0|2,0,0]=4 10136 B11R0.107 CO[C@@H](C)CNC(C)CC(=O)O 65ec16ceb5b22b15175fd6e949395c36 [0,2,0,0,0,0|2,0,0]=4 10137 B11R0.107 CO[C@@H](C)CN[C@@H](C)CC(=O)O f5c9e48bb8cb8a610ca4497f3e299f0a [0,2,0,0,0,0|2,0,0]=4 10138 B11R0.107 CO[C@@H](C)CN[C@H](C)CC(=O)O e5d9ab9d75f12c688cbcbdf3814ca7d0 [0,2,0,0,0,0|2,0,0]=4 10139 B11R0.107 CO[C@@H](C)COC(C)CC(=O)O d90fa5045907d8a83cbabb200c5eb5a1 [0,2,0,0,0,0|2,0,0]=4 10140 B11R0.107 CO[C@@H](C)CO[C@@H](C)CC(=O)O 73c8e0212da3e7332e14a222805a334b [0,2,0,0,0,0|2,0,0]=4 10141 B11R0.107 CO[C@@H](C)CO[C@H](C)CC(=O)O d2054597a0557fec7aa23891e22a5a95 [0,2,0,0,0,0|2,0,0]=4 10142 B11R0.107 CO[C@H](C)CNC(C)CC(=O)O a93bb64f221d34f09e2ab3971a16de76 [0,2,0,0,0,0|2,0,0]=4 10143 B11R0.107 CO[C@H](C)CN[C@@H](C)CC(=O)O 700e168ec20d1b471f5adc7b45671d42 [0,2,0,0,0,0|2,0,0]=4 10144 B11R0.107 CO[C@H](C)CN[C@H](C)CC(=O)O f6083e7600c8f5660642104c9b22f8f7 [0,2,0,0,0,0|2,0,0]=4 10145 B11R0.107 CO[C@H](C)COC(C)CC(=O)O 04bdfa0dc22ffe392dbe8ee7492968d6 [0,2,0,0,0,0|2,0,0]=4 10146 B11R0.107 CO[C@H](C)CO[C@@H](C)CC(=O)O b33fdafaec63f43b8e5134b89a87a0a6 [0,2,0,0,0,0|2,0,0]=4 10147 B11R0.107 CO[C@H](C)CO[C@H](C)CC(=O)O a8dfb5e5845cf56660d0b05bfba3196f [0,2,0,0,0,0|2,0,0]=4 10148 B11R0.107 C[C@@H](CC(=O)O)NCC(O)CF 539be795d01f821f27414a9e0ccd19ba [0,2,0,0,0,0|2,0,0]=4 10149 B11R0.107 C[C@@H](CC(=O)O)NCC(O)CO 858a2d5beb157795381c96ab4cc3c4cc [0,2,0,0,0,0|2,0,0]=4 10150 B11R0.107 C[C@@H](CC(=O)O)NC[C@@H](O)CO ac19805ffc7ffb863428f504a06f5124 [0,2,0,0,0,0|2,0,0]=4 10151 B11R0.107 C[C@@H](CC(=O)O)NC[C@H](O)CO 1a53011e02b2078a5d4c153c1f370e70 [0,2,0,0,0,0|2,0,0]=4 10152 B11R0.107 C[C@@H](CC(=O)O)OCC(O)CO 29ba47b2605bdfd3deeef134acb24510 [0,2,0,0,0,0|2,0,0]=4 10153 B11R0.107 C[C@@H](CC(=O)O)OC[C@@H](O)CO e62e3c00da31578fe1f01fec06ce6587 [0,2,0,0,0,0|2,0,0]=4 10154 B11R0.107 C[C@@H](CC(=O)O)OC[C@H](O)CO af179fefe1fa010676af272d2d95beca [0,2,0,0,0,0|2,0,0]=4 10155 B11R0.107 C[C@@H](CO)CN[C@@H](C)CC(=O)O fdcaadd150b76d81d1421f08109fd55b [0,2,0,0,0,0|2,0,0]=4 10156 B11R0.107 C[C@@H](CO)CN[C@H](C)CC(=O)O 94a84c06fbabeecc22781027c11cd7da [0,2,0,0,0,0|2,0,0]=4 10157 B11R0.107 C[C@@H](CO)NCC(O)CC(=O)O 7de597604521e5f9d58b73e73fd1ef82 [0,2,0,0,0,0|2,0,0]=4 10158 B11R0.107 C[C@@H](CO)NC[C@@H](O)CC(=O)O e6791549c3c4a97dbaad27d156e42be1 [0,2,0,0,0,0|2,0,0]=4 10159 B11R0.107 C[C@@H](CO)NC[C@H](O)CC(=O)O 4982a49fae379e169d7c01709edc98ed [0,2,0,0,0,0|2,0,0]=4 10160 B11R0.107 C[C@H](CC(=O)O)NCC(O)CF e2796b1237e44120fb3ed3f7a8917654 [0,2,0,0,0,0|2,0,0]=4 10161 B11R0.107 C[C@H](CC(=O)O)NCC(O)CO 33e4b7782b55796d8ca53a4da9698180 [0,2,0,0,0,0|2,0,0]=4 10162 B11R0.107 C[C@H](CC(=O)O)NC[C@@H](O)CO 7868ff07c47f3df40df391560d13a161 [0,2,0,0,0,0|2,0,0]=4 10163 B11R0.107 C[C@H](CC(=O)O)NC[C@H](O)CO 616d06af0327b46ab4f8931c8f224a35 [0,2,0,0,0,0|2,0,0]=4 10164 B11R0.107 C[C@H](CC(=O)O)OCC(O)CO 8417154ba7be79b37521b9f1aa341311 [0,2,0,0,0,0|2,0,0]=4 10165 B11R0.107 C[C@H](CC(=O)O)OC[C@@H](O)CO c3d6421a9e1a67e916b6057d84ef0bca [0,2,0,0,0,0|2,0,0]=4 10166 B11R0.107 C[C@H](CC(=O)O)OC[C@H](O)CO ba4b9b2898149dcf5650fe5b366fa6da [0,2,0,0,0,0|2,0,0]=4 10167 B11R0.107 C[C@H](CO)CN[C@@H](C)CC(=O)O f3a3bc3caae11201220d2fd13d93052f [0,2,0,0,0,0|2,0,0]=4 10168 B11R0.107 C[C@H](CO)CN[C@H](C)CC(=O)O 8a075c5d0914e56f359fdbfd4220f2e6 [0,2,0,0,0,0|2,0,0]=4 10169 B11R0.107 C[C@H](CO)NCC(O)CC(=O)O 5cfd5c45771f41f7922a4f7486110cbf [0,2,0,0,0,0|2,0,0]=4 10170 B11R0.107 C[C@H](CO)NC[C@@H](O)CC(=O)O 2631f5a04b48220124e5de982b4cf320 [0,2,0,0,0,0|2,0,0]=4 10171 B11R0.107 C[C@H](CO)NC[C@H](O)CC(=O)O e6a9f18bd0afc97bca35f8a9ea6aff27 [0,2,0,0,0,0|2,0,0]=4 10172 B11R0.139 CC(C(=O)O)N(C)CCCCF e8232f6d3c36257fa24473229f65d15f [0,2,0,0,0,0|2,0,0]=4 10173 B11R0.139 CC(C(=O)O)N(C)CCCCO 3f75aac35787b546c594332cc3b9f2d6 [0,2,0,0,0,0|2,0,0]=4 10174 B11R0.139 CC(OCCCF)C(C)C(=O)O 6ce8bf72e6b5a9c21e4cb3051a169d5f [0,2,0,0,0,0|2,0,0]=4 10175 B11R0.139 CCCCCN(C)C(C)C(=O)C e86c5b62df8521774a8b7f2d7957fb1d [0,2,0,0,0,0|2,0,0]=4 10176 B11R0.139 CCCCCN(C)C(C)C(=O)N cc5c0b6ebf861f55b85132872414ff08 [0,2,0,0,0,0|2,0,0]=4 10177 B11R0.139 CCCCCN(C)C(C)C(=O)O d9ba0c02bc19bf1588370e9ba0d8b77f [0,2,0,0,0,0|1,0,0]=3 10178 B11R0.139 CCCCCN(C)[C@@H](C)C(=O)N b35daae21818d7d6e4d766d2b4df5d2a [0,2,0,0,0,0|2,0,0]=4 10179 B11R0.139 CCCCCN(C)[C@@H](C)C(=O)O 90c2c7f9e8e5fceff77ee6ed928b9ad7 [0,2,0,0,0,0|1,0,0]=3 10180 B11R0.139 CCCCCN(C)[C@H](C)C(=O)N 528ec5597b0cb81174b24578a4112c22 [0,2,0,0,0,0|2,0,0]=4 10181 B11R0.139 CCCCCN(C)[C@H](C)C(=O)O 6481ca4acea9c8f6b84c48cc0a265e55 [0,2,0,0,0,0|1,0,0]=3 10182 B11R0.139 CCCCOC(C)C(C)C(=O)O 18953dcf937c2b14a64a3af9058beb0c [0,2,0,0,0,0|1,0,0]=3 10183 B11R0.139 CCOCCN(C)C(C)C(=O)O 399e87f978b17c27811f4590881c4ee2 [0,2,0,0,0,0|2,0,0]=4 10184 B11R0.139 CCOCCN(C)[C@@H](C)C(=O)O 503240161366654b173151eb7a9347b4 [0,2,0,0,0,0|2,0,0]=4 10185 B11R0.139 CCOCCN(C)[C@H](C)C(=O)O 9d1a0f1bf82cc8511a05f8743a22711e [0,2,0,0,0,0|2,0,0]=4 10186 B11R0.139 CCSCCN(C)C(C)C(=O)O 83220f6b547410744d3c13724ec234b3 [0,2,0,0,0,0|2,0,0]=4 10187 B11R0.139 CCSCCN(C)[C@@H](C)C(=O)O f87c971dd7d870269983b7603eb861af [0,2,0,0,0,0|2,0,0]=4 10188 B11R0.139 CCSCCN(C)[C@H](C)C(=O)O 5a917f8daa311c965c330601e62ea95f [0,2,0,0,0,0|2,0,0]=4 10189 B11R0.139 COCCCN(C)C(C)C(=O)O 8083c6d3f03b484f3b50ee11f66b0368 [0,2,0,0,0,0|2,0,0]=4 10190 B11R0.139 COCCCN(C)[C@@H](C)C(=O)O ee1b92a102ac6e140fd724929c952d42 [0,2,0,0,0,0|2,0,0]=4 10191 B11R0.139 COCCCN(C)[C@H](C)C(=O)O 0e5cc8b2d01407b32a48c5d5b774cefc [0,2,0,0,0,0|2,0,0]=4 10192 B11R0.139 COCCOC(C)C(C)C(=O)O dc933ce6684a6cbd9ecbd35f1a235ecc [0,2,0,0,0,0|2,0,0]=4 10193 B11R0.139 CSCCCN(C)C(C)C(=O)O a4bd28b71115e1dee6e90c8475766107 [0,2,0,0,0,0|2,0,0]=4 10194 B11R0.139 CSCCCN(C)[C@@H](C)C(=O)O 012e61158a5d5db8fb9b6eaa9b8b1a90 [0,2,0,0,0,0|2,0,0]=4 10195 B11R0.139 CSCCCN(C)[C@H](C)C(=O)O 891f1c89f4656c16dc03e7b04ea95c67 [0,2,0,0,0,0|2,0,0]=4 10196 B11R0.139 CSCCOC(C)C(C)C(=O)O 101d11eb17dcff727ab33f266dc477ab [0,2,0,0,0,0|2,0,0]=4 10197 B11R0.139 C[C@@H](C(=O)O)N(C)CCCCF 8e60042b6b0b9cb40f48bb898b14f06a [0,2,0,0,0,0|2,0,0]=4 10198 B11R0.139 C[C@@H](C(=O)O)N(C)CCCCO 256ae7487d744b39fa19a80476418cbd [0,2,0,0,0,0|2,0,0]=4 10199 B11R0.139 C[C@H](C(=O)O)N(C)CCCCF fe4919524bd23c4cfc16f93cb7433fe9 [0,2,0,0,0,0|2,0,0]=4 10200 B11R0.139 C[C@H](C(=O)O)N(C)CCCCO c96fce2992f8233047e19c08de4406e4 [0,2,0,0,0,0|2,0,0]=4 10201 B11R0.154 C#CC(=O)NC(C)CCCCC dc82ff1ffb73e6b5181e1ba37a9f8c7f [0,2,0,0,0,0|2,0,0]=4 10202 B11R0.154 C#CC(=O)N[C@@H](C)CCCCC 1131c3ed2e60dcf1df415b8e3eff3071 [0,2,0,0,0,0|2,0,0]=4 10203 B11R0.154 C=C(C=O)OC(C)CCCCC 9c6daa6ae3111bd0e6968c0a63e1d9c5 [0,2,0,0,0,0|2,0,0]=4 10204 B11R0.154 C=C(C=O)O[C@@H](C)CCCCC dff13c5d9821a55b3279bb9275ac95b4 [0,2,0,0,0,0|2,0,0]=4 10205 B11R0.154 C=C(CN(C)CCCCC)OC 4d30bfa242a68f52fb3a2bd730e32826 [0,2,0,0,0,0|2,0,0]=4 10206 B11R0.154 C=C(CNCCC)CC(=O)OC de629e236d5601a4d987e4dc615a7c61 [0,2,0,0,0,0|1,0,1]=4 10207 B11R0.154 C=C(CO)CN(C)CCCCC fbeebcbd86824c2f3cd372fee456a265 [0,2,0,0,0,0|2,0,0]=4 10208 B11R0.154 C=C(COCCC)CC(=O)OC 00a5f19cde265d05bbde596370a696b5 [0,2,0,0,0,0|1,0,1]=4 10209 B11R0.154 C=CC(=O)NC(C)CCCCC cc4b98c097c17be308c481a8e84daa6b [0,2,0,0,0,0|2,0,0]=4 10210 B11R0.154 C=CC(=O)N[C@@H](C)CCCCC f390db4d8f136ed9aae519167c883720 [0,2,0,0,0,0|2,0,0]=4 10211 B11R0.154 CCCCCC(C)NC(=O)C=O eeebe86885473cb12842964c3f866275 [0,2,0,0,0,0|1,0,1]=4 10212 B11R0.154 CCCCCC(C)NC(=O)CC bc630bcd14906e5f8a25eb9d61b6f9fa [0,2,0,0,0,0|2,0,0]=4 10213 B11R0.154 CCCCCC(C)NC(=O)CF 5d760f69f72cae53987bc26b0b37b616 [0,2,0,0,0,0|2,0,0]=4 10214 B11R0.154 CCCCCC(C)NC(=O)CO b1987e3ffd1256966f5ade2751dbd699 [0,2,0,0,0,0|1,0,0]=3 10215 B11R0.154 CCCCCC(C)NC(=O)CS 0494ab6bbcdac18d08e2a513457ce320 [0,2,0,0,0,0|1,1,0]=4 10216 B11R0.154 CCCCCN(C)CC(=O)CC bc4198bf04991e42a831c18e59480a90 [0,2,0,0,0,0|2,0,0]=4 10217 B11R0.154 CCCCCN(C)CC(=O)CO cead1d91f3733a83aa9cd1cf9caddf58 [0,2,0,0,0,0|1,0,0]=3 10218 B11R0.154 CCCCCN(C)CC(=O)NC 0802e98d8e41379f4d561b84f48f1629 [0,2,0,0,0,0|2,0,0]=4 10219 B11R0.154 CCCCCN(C)CC(=O)OC 9a8201a1e606e55a693bfa48cb6672d4 [0,2,0,0,0,0|1,0,0]=3 10220 B11R0.154 CCCCC[C@H](C)NC(=O)C=O 84b6cc88bae5b3f8d23cc9b9bb4abad1 [0,2,0,0,0,0|1,0,1]=4 10221 B11R0.154 CCCCC[C@H](C)NC(=O)CC 9adb0b9fb15364ba4605e72a32fe384f [0,2,0,0,0,0|2,0,0]=4 10222 B11R0.154 CCCCC[C@H](C)NC(=O)CF 55aba371966eb157b3c40d06f51f13a5 [0,2,0,0,0,0|2,0,0]=4 10223 B11R0.154 CCCCC[C@H](C)NC(=O)CO b98ed524bef49d7d0d8229753e939d41 [0,2,0,0,0,0|1,0,0]=3 10224 B11R0.154 CCCCC[C@H](C)NC(=O)CS 5fcc9d79a53b2ac80766be1d778ec59f [0,2,0,0,0,0|1,1,0]=4 10225 B11R0.154 CCCCNC(=O)CC(=O)OC d7c856bb41edc47794a5068a73ff4ab4 [0,2,0,0,0,0|1,0,1]=4 10226 B11R0.154 CCCCNC(C)CC(=O)OC fa0a764000a9fa6989a18b1eae03a3c4 [0,2,0,0,0,0|1,0,0]=3 10227 B11R0.154 CCCCNC(C)OC(=O)OC ddd35a307d138888f4e47c318dd0505d [0,2,0,0,0,0|2,0,0]=4 10228 B11R0.154 CCCCN[C@@H](C)CC(=O)OC 735f46185c40863ef0fb135ba67d45d5 [0,2,0,0,0,0|1,0,0]=3 10229 B11R0.154 CCCCN[C@H](C)CC(=O)OC 3cc67f4b754a47c9de55b6947d2591a1 [0,2,0,0,0,0|1,0,0]=3 10230 B11R0.154 CCCCOC(C)CC(=O)OC c821b97e61479eeb6f4d3918e3f6be55 [0,2,0,0,0,0|1,0,0]=3 10231 B11R0.154 CCCCOC(C)OC(=O)OC 6a9183201443b2593082d20e0b694152 [0,2,0,0,0,0|2,0,0]=4 10232 B11R0.154 CCCCO[C@@H](C)CC(=O)OC 6e8b570bf6e9c14ee3056bc55e9ea0f8 [0,2,0,0,0,0|1,0,0]=3 10233 B11R0.154 CCCCO[C@H](C)CC(=O)OC e37b033a1d682368876e963f16660675 [0,2,0,0,0,0|1,0,0]=3 10234 B11R0.154 CCCNCC(=O)CC(=O)OC 889928e59d9bde1602fefdcccb29af37 [0,2,0,0,0,0|1,0,1]=4 10235 B11R0.154 CCCNCC(C)CC(=O)OC 873a1d4d7be56471fc5c1c051c144d93 [0,2,0,0,0,0|1,0,0]=3 10236 B11R0.154 CCCNCC(O)CC(=O)OC 4ca6e79ee409bb8cd255af1ff469f21a [0,2,0,0,0,0|1,0,0]=3 10237 B11R0.154 CCCNC[C@@H](O)CC(=O)OC d64043de9b0bee5816ab64db2043bda0 [0,2,0,0,0,0|1,0,0]=3 10238 B11R0.154 CCCNC[C@H](O)CC(=O)OC dd619faf623e53ec29bac530a1d6ebe7 [0,2,0,0,0,0|1,0,0]=3 10239 B11R0.154 CCCOCC(=O)CC(=O)OC ced4a1a872c4212b2244d6ff8e4f0f52 [0,2,0,0,0,0|1,0,1]=4 10240 B11R0.154 CCCOCC(C)CC(=O)OC 2fdc7d4802e83652201ed75663d8570d [0,2,0,0,0,0|1,0,0]=3 10241 B11R0.154 CCOCCC(=O)CC(=O)OC 37bfcffbc5031418091ea574d1964205 [0,2,0,0,0,0|1,0,1]=4 10242 B11R0.154 CCOCCN(C)CC(=O)CO ea0d5b58c68751fe2696607946228329 [0,2,0,0,0,0|2,0,0]=4 10243 B11R0.154 CCOCCN(C)CC(=O)OC 6815599b44a5f47da948da33ca703e96 [0,2,0,0,0,0|2,0,0]=4 10244 B11R0.154 CCSCCN(C)CC(=O)OC 4425615e95007d0829dc6a560326e905 [0,2,0,0,0,0|2,0,0]=4 10245 B11R0.154 CN(CCCCO)CC(=O)CO a0c772d4de10105507f6c3f2164bae42 [0,2,0,0,0,0|2,0,0]=4 10246 B11R0.154 COC(=O)CC(C)CNCCBr 438e825ae240ba93ab449d065c74fddb [0,2,0,0,0,0|2,0,0]=4 10247 B11R0.154 COC(=O)CC(C)CNCCF 4361ca525a77467b23ec124a23fa2b04 [0,2,0,0,0,0|2,0,0]=4 10248 B11R0.154 COC(=O)CC(C)CNCCI 25451758b7f7a7a017605d913cb6bfba [0,2,0,0,0,0|2,0,0]=4 10249 B11R0.154 COC(=O)CC(C)CNCCO 2d0a5a660c6bd28cb6b0da7da6405d81 [0,2,0,0,0,0|2,0,0]=4 10250 B11R0.154 COC(=O)CC(C)CNCCS 8d27ce5274acbd1d462785a6b1c8620c [0,2,0,0,0,0|2,0,0]=4 10251 B11R0.154 COC(=O)CC(C)COCCF 2960e78056043aab0301969e367a2a0f [0,2,0,0,0,0|2,0,0]=4 10252 B11R0.154 COC(=O)CC(C)COCCS 836bb6960511dd5925ab511fbf274a53 [0,2,0,0,0,0|2,0,0]=4 10253 B11R0.154 COC(=O)CC(C)NCCCCl c39c0acf9c12eb81be895dd8ba4ae41c [0,2,0,0,0,0|2,0,0]=4 10254 B11R0.154 COC(=O)CC(C)NCCCF f28dd21388dc1e52c878cb3ba8f41018 [0,2,0,0,0,0|2,0,0]=4 10255 B11R0.154 COC(=O)CC(C)NCCCO 8e5d83ce64ee507caeb112fa66b60289 [0,2,0,0,0,0|2,0,0]=4 10256 B11R0.154 COC(=O)CC(C)NCCCS 14097c19ce1b1896b7a798f29b7d1c28 [0,2,0,0,0,0|2,0,0]=4 10257 B11R0.154 COC(=O)CC(C)NCCSC 0e7882288d868c96c7901a33549775ec [0,2,0,0,0,0|2,0,0]=4 10258 B11R0.154 COC(=O)CC(C)OCCCF 34c93d49e9f906e3b5154b97c40a67fc [0,2,0,0,0,0|2,0,0]=4 10259 B11R0.154 COC(=O)CC(C)OCCCS f8f76699c534c6d89ba831d65208ed16 [0,2,0,0,0,0|2,0,0]=4 10260 B11R0.154 COC(=O)CC(C)OCCSC aaec7ae03e7a5ca738d792e6fd7b328b [0,2,0,0,0,0|2,0,0]=4 10261 B11R0.154 COC(=O)CC(O)CNCCBr ac13b6e62cdd22c561d04fb0b8d77b58 [0,2,0,0,0,0|2,0,0]=4 10262 B11R0.154 COC(=O)CC(O)CNCCF efa0aea30d0480719f87880625828757 [0,2,0,0,0,0|2,0,0]=4 10263 B11R0.154 COC(=O)CC(O)CNCCI ea594172a797acb482ab5554d7c219ea [0,2,0,0,0,0|2,0,0]=4 10264 B11R0.154 COC(=O)CC(O)CNCCO 793d51cde40b426766b66797dc70c9fa [0,2,0,0,0,0|2,0,0]=4 10265 B11R0.154 COC(=O)CC(O)CNCCS 955abec9cca320e96aac57b4332cc5dc [0,2,0,0,0,0|2,0,0]=4 10266 B11R0.154 COC(=O)CN(C)CCCCF d95dfadc123299df8db0ea32e3d8a098 [0,2,0,0,0,0|2,0,0]=4 10267 B11R0.154 COC(=O)CN(C)CCCCO 94620e1aa6efa252accfe2e61ec86fe9 [0,2,0,0,0,0|2,0,0]=4 10268 B11R0.154 COC(=O)CN(C)CCCSC 172eb70d19107ec7d7aebafcd9c02db1 [0,2,0,0,0,0|2,0,0]=4 10269 B11R0.154 COC(=O)C[C@@H](C)NCCCF 1941cf9f7bb04f811faa1db3a29cb2fb [0,2,0,0,0,0|2,0,0]=4 10270 B11R0.154 COC(=O)C[C@@H](C)NCCCO 1f9e8ace343a29dd6040e6772327f575 [0,2,0,0,0,0|2,0,0]=4 10271 B11R0.154 COC(=O)C[C@@H](C)NCCCS ead8a88cd96ed1e90158f66fe212bda5 [0,2,0,0,0,0|2,0,0]=4 10272 B11R0.154 COC(=O)C[C@@H](C)NCCSC 87ce2de4b53897df4ed817c431a98f34 [0,2,0,0,0,0|2,0,0]=4 10273 B11R0.154 COC(=O)C[C@@H](C)OCCCF a091463c765285f1ba7e2fa118dcc058 [0,2,0,0,0,0|2,0,0]=4 10274 B11R0.154 COC(=O)C[C@@H](C)OCCCS f7eba6844e8c403c8974d93dfb33abbe [0,2,0,0,0,0|2,0,0]=4 10275 B11R0.154 COC(=O)C[C@@H](C)OCCSC c9f8b08b0472501ddc17aa294af56e28 [0,2,0,0,0,0|2,0,0]=4 10276 B11R0.154 COC(=O)C[C@@H](O)CNCCBr a83eecaa2c821186790742e37ebc6ccd [0,2,0,0,0,0|2,0,0]=4 10277 B11R0.154 COC(=O)C[C@@H](O)CNCCF 69961ec946325ff56aa8003ddf525ec7 [0,2,0,0,0,0|2,0,0]=4 10278 B11R0.154 COC(=O)C[C@@H](O)CNCCI bf372c7080167cd069581901cce8e0fb [0,2,0,0,0,0|2,0,0]=4 10279 B11R0.154 COC(=O)C[C@@H](O)CNCCO 7ca778c897ce990ed38beb641a553c77 [0,2,0,0,0,0|2,0,0]=4 10280 B11R0.154 COC(=O)C[C@@H](O)CNCCS 79452e5d6343ef098674f89e2efda67d [0,2,0,0,0,0|2,0,0]=4 10281 B11R0.154 COC(=O)C[C@H](C)NCCCCl 8c545144ffc6fb50f8156466cfe19f31 [0,2,0,0,0,0|2,0,0]=4 10282 B11R0.154 COC(=O)C[C@H](C)NCCCF fb9044fded15f2638e4a54d401f4bdf1 [0,2,0,0,0,0|2,0,0]=4 10283 B11R0.154 COC(=O)C[C@H](C)NCCCO e5b28193091b642335e09571dfc0bf7e [0,2,0,0,0,0|2,0,0]=4 10284 B11R0.154 COC(=O)C[C@H](C)NCCCS ca4fb277d2a9f6d8d03b1c46e5214f7a [0,2,0,0,0,0|2,0,0]=4 10285 B11R0.154 COC(=O)C[C@H](C)NCCSC 9c554297fe303fa02b4a4a21e86cdb73 [0,2,0,0,0,0|2,0,0]=4 10286 B11R0.154 COC(=O)C[C@H](C)OCCCF 5ca61e9b4715feb94c71c624956a9c62 [0,2,0,0,0,0|2,0,0]=4 10287 B11R0.154 COC(=O)C[C@H](C)OCCCS ed8b1235aa4a862444222d26a578ad96 [0,2,0,0,0,0|2,0,0]=4 10288 B11R0.154 COC(=O)C[C@H](C)OCCSC e798dd44535ace7d8553cd51c92bed65 [0,2,0,0,0,0|2,0,0]=4 10289 B11R0.154 COC(=O)C[C@H](O)CNCCBr e46238111052bbc84405103ede6be746 [0,2,0,0,0,0|2,0,0]=4 10290 B11R0.154 COC(=O)C[C@H](O)CNCCF b5a5801cd66a09e0538b02d903dd90a9 [0,2,0,0,0,0|2,0,0]=4 10291 B11R0.154 COC(=O)C[C@H](O)CNCCI eeff4e569a92ffebed531a3bd268a6ed [0,2,0,0,0,0|2,0,0]=4 10292 B11R0.154 COC(=O)C[C@H](O)CNCCO 1bc1d4856f929490610905c9e893f64d [0,2,0,0,0,0|2,0,0]=4 10293 B11R0.154 COC(=O)C[C@H](O)CNCCS 56fd96f17022aee828b783a46e3593b4 [0,2,0,0,0,0|2,0,0]=4 10294 B11R0.154 COCCCN(C)CC(=O)CO db50ea57aa5af7de7011ffa8b74d1e2a [0,2,0,0,0,0|2,0,0]=4 10295 B11R0.154 COCCCN(C)CC(=O)OC 1aed9ecc7ceaa1de3cb678aa59f95f7a [0,2,0,0,0,0|2,0,0]=4 10296 B11R0.154 COCCNC(C)CC(=O)OC c0a6dab06a85e3b589ac78375e9a326d [0,2,0,0,0,0|2,0,0]=4 10297 B11R0.154 COCCN[C@@H](C)CC(=O)OC 0495d347438dce734816fba7d616333f [0,2,0,0,0,0|2,0,0]=4 10298 B11R0.154 COCCN[C@H](C)CC(=O)OC 4f2aca352e2cf2f1a80b65b6ab0a3668 [0,2,0,0,0,0|2,0,0]=4 10299 B11R0.154 COCCOC(C)CC(=O)OC 0aedc663c108a8b31f4817aef76eb7f0 [0,2,0,0,0,0|2,0,0]=4 10300 B11R0.154 COCCO[C@@H](C)CC(=O)OC 18aa706d95e3fd68d28de912f3364a15 [0,2,0,0,0,0|2,0,0]=4 10301 B11R0.154 COCCO[C@H](C)CC(=O)OC c3916f099e946b4eafa36a7948e9c4e2 [0,2,0,0,0,0|2,0,0]=4 10302 B11R0.154 COCOCC(C)CC(=O)OC cac81bd21658f318ce97117788aa8205 [0,2,0,0,0,0|2,0,0]=4 10303 B11R0.324 CC(C)(CC(=O)O)NCCCF c4c48b718c9539498d551f5a827c491a [0,2,0,0,0,0|2,0,0]=4 10304 B11R0.324 CC(C)(CC(=O)O)NCCCO 93af6aeb26c210913fa18ca38e3be2a8 [0,2,0,0,0,0|2,0,0]=4 10305 B11R0.324 CC(C)(CC(=O)O)NCCCS 713229d0d729c9b036993b4b677a2bad [0,2,0,0,0,0|2,0,0]=4 10306 B11R0.324 CC(C)(CNCCF)CC(=O)O 6ae41d0a5be2ffbaa7cf233ab43b3d7a [0,2,0,0,0,0|2,0,0]=4 10307 B11R0.324 CC(C)(CNCCO)CC(=O)O c827c100c6b1f0b18379e86e082cb436 [0,2,0,0,0,0|2,0,0]=4 10308 B11R0.324 CC(C)(CNCCS)CC(=O)O d77b48f5eab159fd18ce77aedc628707 [0,2,0,0,0,0|2,0,0]=4 10309 B11R0.324 CCCCNC(C)(C)CC(=O)C 5cd5363f3e60accf2f54a0bf21d318c8 [0,2,0,0,0,0|2,0,0]=4 10310 B11R0.324 CCCCNC(C)(C)CC(=O)N 53d8fb6fe708846047622b5d40614ae3 [0,2,0,0,0,0|2,0,0]=4 10311 B11R0.324 CCCCNC(C)(C)CC(=O)O 9e49e9664334355eb003fd90401641fa [0,2,0,0,0,0|1,0,0]=3 10312 B11R0.324 CCCNCC(C)(C)CC(=O)O 9ffa5362c4b11d40370c7c6d847a0567 [0,2,0,0,0,0|1,0,0]=3 10313 B11R0.324 CCOCNC(C)(C)CC(=O)O 8b5c3a7aa3688e1e1f6376ff1efbf63c [0,2,0,0,0,0|2,0,0]=4 10314 B11R0.324 COCCNC(C)(C)CC(=O)O 6a37e7db3d4ca6cf384c65aa439537be [0,2,0,0,0,0|2,0,0]=4 10315 B11R0.324 COCNCC(C)(C)CC(=O)O 415e290d25c37239f1b40821a0756186 [0,2,0,0,0,0|2,0,0]=4 10316 B11R0.324 CSCCNC(C)(C)CC(=O)O 7742c8dd67918f6f908a53e3a418f9be [0,2,0,0,0,0|2,0,0]=4 10317 B11R0.324 CSCNCC(C)(C)CC(=O)O 9e83c187bd77a2eb6700e39bd8f9feca [0,2,0,0,0,0|2,0,0]=4 10318 B11R0.31 CC(=O)CCCCNC(C)(C)C 9161e770c757428d8b68c67106bd0369 [0,2,0,0,0,0|2,0,0]=4 10319 B11R0.31 CC(=O)CCCNCC(C)(C)C 48d209733caa3e96a78ff14893991ee9 [0,2,0,0,0,0|2,0,0]=4 10320 B11R0.31 CC(=O)CCCNCC(C)(C)O 28f14fa2770c5730d78d1cfa181c0fae [0,2,0,0,0,0|2,0,0]=4 10321 B11R0.31 CC(=O)CCCNCC(C)(F)F df39116720d4a1664b9c1b7e8c065688 [0,2,0,0,0,0|2,0,0]=4 10322 B11R0.31 CC(=O)CCCOCC(C)(C)Br b1158376f2c9b73b2fcb843b5aa19a43 [0,2,0,0,0,0|2,0,0]=4 10323 B11R0.31 CC(=O)CCCOCC(C)(C)C 03dabec929893d211c1eb0e09d08805e [0,2,0,0,0,0|2,0,0]=4 10324 B11R0.31 CC(=O)CCCOCC(C)(C)F 0df02c43d671bb1674ed56d301e65544 [0,2,0,0,0,0|2,0,0]=4 10325 B11R0.31 CC(=O)CCCOCC(C)(C)O 00e534ed604ae16b3c5fc2ab8e9fff7b [0,2,0,0,0,0|2,0,0]=4 10326 B11R0.31 CC(=O)CCCOCC(C)(C)S 79085374a0e5ac13b52e7c0ed89c360c [0,2,0,0,0,0|2,0,0]=4 10327 B11R0.31 CC(=O)CCCOCC(C)(F)F 81f5170554cf493eca02c35414fd5b35 [0,2,0,0,0,0|2,0,0]=4 10328 B11R0.31 CC(=O)CCNCCC(C)(C)C 0368618a4a7b8d3572a584bc50ee541a [0,2,0,0,0,0|2,0,0]=4 10329 B11R0.31 CC(=O)CCNCCC(C)(C)F fe45b0421147c463183eb0d28288128a [0,2,0,0,0,0|2,0,0]=4 10330 B11R0.31 CC(=O)CCNCCC(C)(C)O 5884df4627494a2d1f5b873a1dc4bda7 [0,2,0,0,0,0|2,0,0]=4 10331 B11R0.31 CC(=O)CCOCCC(C)(C)C bb7659f21cd5fbad75e82cdf798916e6 [0,2,0,0,0,0|2,0,0]=4 10332 B11R0.31 CC(=O)CCOCCC(C)(C)O 562787b9a02d9e8bf23ea58e3a6b7d7e [0,2,0,0,0,0|2,0,0]=4 10333 B11R0.31 CC(=O)CCOCCC(C)(C)S f3a4054a9e39ac0de8bc02187487e09b [0,2,0,0,0,0|2,0,0]=4 10334 B11R0.31 CC(=O)CCOCCC(C)(F)F 4f517a2ac762b2c598c4f995b3ed03ca [0,2,0,0,0,0|2,0,0]=4 10335 B11R0.31 CC(=O)CNCCCC(C)(C)O 7eecf0360d7fcac09b5ceb1e855c5134 [0,2,0,0,0,0|2,0,0]=4 10336 B11R0.31 CC(=O)CNCCCC(C)(F)F 2c9fc4056aa4f93338f7ad235f3cb74b [0,2,0,0,0,0|2,0,0]=4 10337 B11R0.31 CC(=O)COCCCC(C)(C)O 0f367fbe7faa7e85d14b6a2f7e3e95b6 [0,2,0,0,0,0|2,0,0]=4 10338 B11R0.31 CC(=O)COCCCC(C)(F)F d09147b78c8b6702755b5a283b416610 [0,2,0,0,0,0|2,0,0]=4 10339 B11R0.31 CC(C)(Br)COCCCC(=O)N 5df682767a397915618c7c4babc5b246 [0,2,0,0,0,0|2,0,0]=4 10340 B11R0.31 CC(C)(C)CCCNCC(=O)N 050111b3e305aeba18f0b5233429b5ac [0,2,0,0,0,0|2,0,0]=4 10341 B11R0.31 CC(C)(C)CCCNCC(=O)O c2d2a0fb229ba3ff656992835229ac8b [0,2,0,0,0,0|1,0,0]=3 10342 B11R0.31 CC(C)(C)CCCOCC(=O)N 6b50417a59bf0844ee4621d94c0a2296 [0,2,0,0,0,0|2,0,0]=4 10343 B11R0.31 CC(C)(C)CCCOCC(=O)O dd1d334f68d719a9b3ff560c8c6f33b1 [0,2,0,0,0,0|1,0,0]=3 10344 B11R0.31 CC(C)(C)CCNCCC(=O)N 79a97e339f4594d93ed220c0bdfef706 [0,2,0,0,0,0|2,0,0]=4 10345 B11R0.31 CC(C)(C)CCNCCC(=O)O e4299f8acbb09079917cab8b63cf8771 [0,2,0,0,0,0|1,0,0]=3 10346 B11R0.31 CC(C)(C)CCNCCS(=O)O 87f83b16af67f8e640f4e2f522dcbb53 [0,2,0,0,0,0|2,0,0]=4 10347 B11R0.31 CC(C)(C)CCOCCC(=O)N 803ea92dc27b13f5e04c98d8be889d60 [0,2,0,0,0,0|2,0,0]=4 10348 B11R0.31 CC(C)(C)CCOCCC(=O)O 6d7c50b17b601192d0381771f866f81b [0,2,0,0,0,0|1,0,0]=3 10349 B11R0.31 CC(C)(C)CNCCCC(=O)N 1b1128e9509c5583dc3dcf5b025f7ac8 [0,2,0,0,0,0|2,0,0]=4 10350 B11R0.31 CC(C)(C)CNCCCC(=O)O e54a6b87b95f43e351fc34e76573a759 [0,2,0,0,0,0|1,0,0]=3 10351 B11R0.31 CC(C)(C)COCCCC(=O)N c4bf6c5908d2453480307b856e633609 [0,2,0,0,0,0|2,0,0]=4 10352 B11R0.31 CC(C)(C)NCCCCC(=O)N e3d56b3e2a4c345c4effeb0747f77d21 [0,2,0,0,0,0|2,0,0]=4 10353 B11R0.31 CC(C)(C)NCCCCC(=O)O 95f4777a2ecb2a3593ab9d0565a1bb63 [0,2,0,0,0,0|1,0,0]=3 10354 B11R0.31 CC(C)(C)NCCOCC(=O)O ab43f73ca852dd9692037710e67d2aec [0,2,0,0,0,0|2,0,0]=4 10355 B11R0.31 CC(C)(C)OCCNCC(=O)O 77bb008d93a2f963a723befe6fc77e75 [0,2,0,0,0,0|2,0,0]=4 10356 B11R0.31 CC(C)(C)OCCOCC(=O)O a0b698daf6a9004941fa5af64c1a9dc9 [0,2,0,0,0,0|2,0,0]=4 10357 B11R0.31 CC(C)(C)SCCNCC(=O)O 16ee9243866f2a18b586d1ed9803cf67 [0,2,0,0,0,0|2,0,0]=4 10358 B11R0.31 CC(C)(C)SCCOCC(=O)O bbb7cccb0334b2835f27d6e4c6e6a4a3 [0,2,0,0,0,0|2,0,0]=4 10359 B11R0.31 CC(C)(F)CCNCCC(=O)N 277b1a8eb9574da5bcf6621e40369cfd [0,2,0,0,0,0|2,0,0]=4 10360 B11R0.31 CC(C)(F)CCNCCC(=O)O 686544fd0da2f37247ba315f645e98f0 [0,2,0,0,0,0|1,0,0]=3 10361 B11R0.31 CC(C)(F)CNCCCC(=O)N f19b7130e8a1d5a0abda259bde1ab5bc [0,2,0,0,0,0|2,0,0]=4 10362 B11R0.31 CC(C)(F)CNCCCC(=O)O ae0b0cf06ad629437d35d0494e16d00d [0,2,0,0,0,0|1,0,0]=3 10363 B11R0.31 CC(C)(F)COCCCC(=O)N 4f6ba01fa9eeab4edc9357e030960bf2 [0,2,0,0,0,0|2,0,0]=4 10364 B11R0.31 CC(C)(O)CCCNCC(=O)N 78728e08934c178de30e72df199fe265 [0,2,0,0,0,0|2,0,0]=4 10365 B11R0.31 CC(C)(O)CCCNCC(=O)O a8b19bb2e41bc75e52719baae09431e5 [0,2,0,0,0,0|1,0,0]=3 10366 B11R0.31 CC(C)(O)CCCOCC(=O)N e9767d976602eb3a33070f0950ca35c9 [0,2,0,0,0,0|2,0,0]=4 10367 B11R0.31 CC(C)(O)CCCOCC(=O)O 51765f5327cc18c637d2ce67551a709b [0,2,0,0,0,0|1,0,0]=3 10368 B11R0.31 CC(C)(O)CCCOCS(=O)O 3552032221011069edd0bd6121943e62 [0,2,0,0,0,0|2,0,0]=4 10369 B11R0.31 CC(C)(O)CCNCCC(=O)N bafabeec0f68baf84a8d12e6bc7f320b [0,2,0,0,0,0|2,0,0]=4 10370 B11R0.31 CC(C)(O)CCNCCC(=O)O c9ab6819a71e8a25320dbe90302fa532 [0,2,0,0,0,0|1,0,0]=3 10371 B11R0.31 CC(C)(O)CCNCCS(=O)O f94db5d24fb8a45b4a00d8ddf1b04abe [0,2,0,0,0,0|2,0,0]=4 10372 B11R0.31 CC(C)(O)CCOCCC(=O)N 7d11029df064debd9666b23df1693dd8 [0,2,0,0,0,0|2,0,0]=4 10373 B11R0.31 CC(C)(O)CCOCCC(=O)O be69ff4565311d31a03ff06e413ce91f [0,2,0,0,0,0|1,0,0]=3 10374 B11R0.31 CC(C)(O)CNCCCC(=O)N cec8a43b26dc292dbc39d9134229b203 [0,2,0,0,0,0|2,0,0]=4 10375 B11R0.31 CC(C)(O)CNCCCC(=O)O 6d360aeb38e1a73298ce81e24a18d8ce [0,2,0,0,0,0|1,0,0]=3 10376 B11R0.31 CC(C)(O)COCCCC(=O)N bf35fe650fe54b59ee3b689e3464b8aa [0,2,0,0,0,0|2,0,0]=4 10377 B11R0.31 CC(C)(S)CCOCCC(=O)N 1dec4ca045765925b365b00d254cc48c [0,2,0,0,0,0|2,0,0]=4 10378 B11R0.31 CC(C)(S)CCOCCC(=O)O 4d3e33e098313efc603bdca9bc3db03f [0,2,0,0,0,0|1,0,0]=3 10379 B11R0.31 CC(C)(S)COCCCC(=O)N 9555ed9301eed33ed064bd413e9e2b98 [0,2,0,0,0,0|2,0,0]=4 10380 B11R0.31 CC(C)CCCNCS(=O)(=O)O a4242c75f720cad21de48f280eb50e89 [0,2,0,0,0,0|2,0,0]=4 10381 B11R0.31 CC(C)CCCOCS(=O)(=O)O 80c9862f14c9540c4f584e72dacd86bf [0,2,0,0,0,0|2,0,0]=4 10382 B11R0.31 CC(C)CCNCCS(=O)(=O)O e8b0a28f30a187466d64a047f35c64c3 [0,2,0,0,0,0|2,0,0]=4 10383 B11R0.31 CC(C)CCOCCS(=O)(=O)O 2d905408bdd2bb0fdd9d99cb15a95d48 [0,2,0,0,0,0|2,0,0]=4 10384 B11R0.31 CC(C)CNCCCS(=O)(=O)O 89bd57bec852ab36b43d72e1a714e1eb [0,2,0,0,0,0|2,0,0]=4 10385 B11R0.31 CC(C)COCCCS(=O)(=O)O b748986e11e4885b2e4c2d22acbccdbe [0,2,0,0,0,0|2,0,0]=4 10386 B11R0.31 CC(C)OCCCCS(=O)(=O)O 32fc9398566c18f07936a3d28de4445b [0,2,0,0,0,0|2,0,0]=4 10387 B11R0.31 CC(F)(F)CCCNCC(=O)N 53c7abcfcac359e403a0715544dddef6 [0,2,0,0,0,0|2,0,0]=4 10388 B11R0.31 CC(F)(F)CCCNCC(=O)O 56a3b3ce18ea4fce30573905cdd6b1e3 [0,2,0,0,0,0|1,0,0]=3 10389 B11R0.31 CC(F)(F)CCCOCC(=O)N d9714307e918353e4e839cf610265cf2 [0,2,0,0,0,0|2,0,0]=4 10390 B11R0.31 CC(F)(F)CCCOCC(=O)O 64730a5ea49ee6ef5616ea524612c47c [0,2,0,0,0,0|1,0,0]=3 10391 B11R0.31 CC(F)(F)CCCOCS(=O)O 333f97b748eb606c3183c4fae2b4de2e [0,2,0,0,0,0|2,0,0]=4 10392 B11R0.31 CC(F)(F)CCNCCC(=O)N 557d3073b3ee3e24598532a3756b08ee [0,2,0,0,0,0|2,0,0]=4 10393 B11R0.31 CC(F)(F)CCNCCC(=O)O e207318f4d2c939e41cece3cca773527 [0,2,0,0,0,0|1,0,0]=3 10394 B11R0.31 CC(F)(F)CCNCCS(=O)O 2387525fb9129491b407ca8e7eb06da8 [0,2,0,0,0,0|2,0,0]=4 10395 B11R0.31 CC(F)(F)CCOCCC(=O)N ce7d2b67e09277382b59e05427e14e82 [0,2,0,0,0,0|2,0,0]=4 10396 B11R0.31 CC(F)(F)CCOCCC(=O)O 62b83105c84e3e9eae6cc89ddc5188e5 [0,2,0,0,0,0|1,0,0]=3 10397 B11R0.31 CC(F)(F)CNCCCC(=O)N 7479c545fc292dca5e912cd3e2c44ed4 [0,2,0,0,0,0|2,0,0]=4 10398 B11R0.31 CC(F)(F)CNCCCC(=O)O 2228728b90b344d152ce75be98326d42 [0,2,0,0,0,0|1,0,0]=3 10399 B11R0.31 CC(F)(F)COCCCC(=O)N 1170fe43387941998a28285959d74952 [0,2,0,0,0,0|2,0,0]=4 10400 B11R0.31 CC(F)COCCCS(=O)(=O)O bf095939e5c86b69d514093c75601d7c [0,2,0,0,0,0|2,0,0]=4 10401 B11R0.31 CC(O)CCCNCS(=O)(=O)O 3c47a96ceafb5d8e8998b68921272a00 [0,2,0,0,0,0|2,0,0]=4 10402 B11R0.31 CC(O)CCNCCS(=O)(=O)O 5cab6b839f09493dd3dbb36b7444e0c4 [0,2,0,0,0,0|2,0,0]=4 10403 B11R0.31 CC(O)CNCCCS(=O)(=O)O 6e0f17bde3c8ccd028f7bd26da726f07 [0,2,0,0,0,0|2,0,0]=4 10404 B11R0.31 CC(S)COCCCS(=O)(=O)O 7c76c11fb0ff5e003b2f09894b455f12 [0,2,0,0,0,0|2,0,0]=4 10405 B11R0.31 CS(=N)(=O)CCOCCC(=O)O 743382c37ad6d1cfc9a56d1eb988a18c [0,2,0,0,0,0|2,0,0]=4 10406 B11R0.31 CS(=O)(=O)CCCNCC(=O)O 74e3aa87879195ee9260dae73bcd34ef [0,2,0,0,0,0|2,0,0]=4 10407 B11R0.31 CS(=O)(=O)CCCOCC(=O)O 2a4eb1aaf9f1023cca16a586871e6caa [0,2,0,0,0,0|2,0,0]=4 10408 B11R0.31 CS(=O)(=O)CCNCCC(=O)O 4da86e36fca39d9509d36582b7fdad85 [0,2,0,0,0,0|2,0,0]=4 10409 B11R0.31 CS(=O)(=O)CCOCCC(=O)O 7b3ef1c619f0f77b064ca9c795200b2a [0,2,0,0,0,0|2,0,0]=4 10410 B11R0.31 C[C@@H](F)COCCCS(=O)(=O)O 94bb19c9195a664911daa6f94bc1c22c [0,2,0,0,0,0|2,0,0]=4 10411 B11R0.31 C[C@@H](O)CCNCCS(=O)(=O)O ad6966d204302692cbbce24331a3de5d [0,2,0,0,0,0|2,0,0]=4 10412 B11R0.31 C[C@@H](O)CNCCCS(=O)(=O)O 486fbdc17af63bcefd0bbefd29658ab7 [0,2,0,0,0,0|2,0,0]=4 10413 B11R0.31 C[C@H](F)COCCCS(=O)(=O)O a051dd1db8b9680119c39bd9afa3553d [0,2,0,0,0,0|2,0,0]=4 10414 B11R0.31 C[C@H](O)CCNCCS(=O)(=O)O 8e6eeeeb587f3f69b98b9f93e6934683 [0,2,0,0,0,0|2,0,0]=4 10415 B11R0.31 C[C@H](O)CNCCCS(=O)(=O)O a34c09b00a1e4238dd7691ca57ab6587 [0,2,0,0,0,0|2,0,0]=4 10416 B11R0.31 O=C(O)CCCNCC(F)(F)F 5383f1c15a11af61044fe8d4f07fe7f6 [0,2,0,0,0,0|2,0,0]=4 10417 B11R0.31 O=C(O)CCNCCC(F)(F)F dbd5f5b0d16cad552c18896726b182be [0,2,0,0,0,0|2,0,0]=4 10418 B11R0.31 O=C(O)CCOCCC(F)(F)F 1a3b813345d00a55255819b8877a445b [0,2,0,0,0,0|2,0,0]=4 10419 B11R0.31 O=C(O)CNCCCC(F)(F)F fde21c229fb56f9da092c7196360966d [0,2,0,0,0,0|2,0,0]=4 10420 B11R0.31 O=C(O)COCCCC(F)(F)F 733b8a384b959b47a41d2fe45694f9e1 [0,2,0,0,0,0|2,0,0]=4 10421 B11R0.49 CCCCOCCS(=O)(=O)OC d8e516db00e564951a14fe015361dcc9 [0,2,0,0,0,0|2,0,0]=4 10422 B11R0.82 CCCCC(C)NCS(=O)(=O)O 63f3c54769f2b1f236d281d49be35b5b [0,2,0,0,0,0|2,0,0]=4 10423 B11R0.82 CCCCN(C)CCS(=O)(=O)O e22439aca0dd87fcf8552364f91bafd5 [0,2,0,0,0,0|2,0,0]=4 10424 B11R0.82 CCCC[C@@H](C)NCS(=O)(=O)O b1c403bd1606a85ef38d97d824940db9 [0,2,0,0,0,0|2,0,0]=4 10425 B11R0.114 CCC(C)CCNCS(=O)(=O)O ef0703df0b80434f2a37597dd158b42e [0,2,0,0,0,0|2,0,0]=4 10426 B11R0.114 CCC(C)CNCCS(=O)(=O)O 5007e654b2496da0b5011fdc5883e0ef [0,2,0,0,0,0|2,0,0]=4 10427 B11R0.114 CCC(C)COCCS(=O)(=O)O f8b96a1ded83a2998a1cdd5e444e58fc [0,2,0,0,0,0|2,0,0]=4 10428 B11R0.114 CCC(C)NCCCS(=O)(=O)O 8e4bdfa44e36ccb1af7afa3dd8bfae1b [0,2,0,0,0,0|2,0,0]=4 10429 B11R0.114 CCC(C)OCCCS(=O)(=O)O 1e270a8af959e7fb6635366301c89f16 [0,2,0,0,0,0|2,0,0]=4 10430 B11R0.114 CCC(O)CNCCS(=O)(=O)O 3b237c4bdd4689a5102030aa15abe111 [0,2,0,0,0,0|2,0,0]=4 10431 B11R0.114 CCC(S)CCOCS(=O)(=O)O 5e3754da85878a6bb4f640f60404a17f [0,2,0,0,0,0|2,0,0]=4 10432 B11R0.114 CCN(C)CCCCS(=O)(=O)O ffe63fccb620892fb9ca6e5f55a25d55 [0,2,0,0,0,0|2,0,0]=4 10433 B11R0.114 CC[C@@H](C)CNCCS(=O)(=O)O ad783343001982f905d45035e19b00b4 [0,2,0,0,0,0|2,0,0]=4 10434 B11R0.114 CC[C@@H](C)COCCS(=O)(=O)O cb922b0f05260f10bb91c7061a1c8706 [0,2,0,0,0,0|2,0,0]=4 10435 B11R0.114 CC[C@@H](C)NCCCS(=O)(=O)O ad280495485176d1ab7c93f74973c909 [0,2,0,0,0,0|2,0,0]=4 10436 B11R0.114 CC[C@@H](C)OCCCS(=O)(=O)O 578031e68cd8e261f17b91f84409d822 [0,2,0,0,0,0|2,0,0]=4 10437 B11R0.114 CC[C@@H](O)CNCCS(=O)(=O)O 7b7cca5d12927d2cdd3655d52874fbbf [0,2,0,0,0,0|2,0,0]=4 10438 B11R0.114 CC[C@H](C)CNCCS(=O)(=O)O 4ef071f2732d13fcbb47a841f2d4a9a1 [0,2,0,0,0,0|2,0,0]=4 10439 B11R0.114 CC[C@H](C)COCCS(=O)(=O)O f3ab43cf292ecf2d7d8f908f43e82e4b [0,2,0,0,0,0|2,0,0]=4 10440 B11R0.114 CC[C@H](C)NCCCS(=O)(=O)O 886248bbb2da0bbae444a9c5cc6ed0f7 [0,2,0,0,0,0|2,0,0]=4 10441 B11R0.114 CC[C@H](C)OCCCS(=O)(=O)O 4b8e5e6b62d9601e466bafed281c6c6a [0,2,0,0,0,0|2,0,0]=4 10442 B11R0.22 C#CC(CC)OCCCC(=O)C 2bc1c4f3c18ef3d1f6e7bbe26b648aaf [0,2,0,0,0,0|2,0,0]=4 10443 B11R0.22 C#CC(CC)OCCCC(=O)N 2ab86919b9f7c5c953d16a3cb39195f4 [0,2,0,0,0,0|2,0,0]=4 10444 B11R0.22 C#CC(CC)OCCCC(=O)O 74ad440588546fc0e38e025d23784b88 [0,2,0,0,0,0|1,0,0]=3 10445 B11R0.22 C=CC(CC)OCCCC(=O)C 72a2fd424275cc32945afb4c0c019852 [0,2,0,0,0,0|2,0,0]=4 10446 B11R0.22 C=CC(CC)OCCCC(=O)N 63d8e288c500cd558ba06b745e5772e3 [0,2,0,0,0,0|2,0,0]=4 10447 B11R0.22 C=CC(CC)OCCCC(=O)O 8e60d2241a9642fd5b31c9a1337470ef [0,2,0,0,0,0|1,0,0]=3 10448 B11R0.22 C=C[C@@H](CO)NCCCC(=O)O c867a81fd313060f5150ade3bb69db07 [0,2,0,0,0,0|2,0,0]=4 10449 B11R0.22 CCC(C#N)OCCCC(=O)C f9dbef04b67aa7dabf93b3037c1d5231 [0,2,0,0,0,0|2,0,0]=4 10450 B11R0.22 CCC(C#N)OCCCC(=O)N bb37ead0181a0466bbeb5f57cad3618f [0,2,0,0,0,0|2,0,0]=4 10451 B11R0.22 CCC(C=O)NCCCC(=O)N b23040133ab8b2f8764ef8f3676913d8 [0,2,0,0,0,0|2,0,0]=4 10452 B11R0.22 CCC(C=O)NCCCC(=O)O b878679ab50af0aee1ddf391ff35ee02 [0,2,0,0,0,0|1,0,0]=3 10453 B11R0.22 CCC(C=O)OCCCC(=O)C 2e38574529201d9f71f55a98712cf36c [0,2,0,0,0,0|2,0,0]=4 10454 B11R0.22 CCC(C=O)OCCCC(=O)N 28392b284c98d45aa19fb64fd0306543 [0,2,0,0,0,0|2,0,0]=4 10455 B11R0.22 CCC(CC)CCNCC(=O)N b4c8942bbe14bc86db734aebf383a781 [0,2,0,0,0,0|2,0,0]=4 10456 B11R0.22 CCC(CC)CCNCC(=O)O f753614ba48da8bc1b0c5f6579e25225 [0,2,0,0,0,0|1,0,0]=3 10457 B11R0.22 CCC(CC)CNCCC(=O)C 6ab5f1a6176f4cabd9d523797f7a850d [0,2,0,0,0,0|2,0,0]=4 10458 B11R0.22 CCC(CC)CNCCC(=O)N b33ff6b1a0b8da0f61a3a0df286c7089 [0,2,0,0,0,0|2,0,0]=4 10459 B11R0.22 CCC(CC)CNCCC(=O)O 5894f59e8e8c17a893f13ba073bf5b5c [0,2,0,0,0,0|1,0,0]=3 10460 B11R0.22 CCC(CC)CNCCS(=O)O ceb3e693164cf4aa2134130802d8906a [0,2,0,0,0,0|2,0,0]=4 10461 B11R0.22 CCC(CC)COCCC(=O)C e615ec902c49c80f14eb54d0662ea46b [0,2,0,0,0,0|2,0,0]=4 10462 B11R0.22 CCC(CC)COCCC(=O)N 30b1be58f6f1db694f181fbfb5d6b4be [0,2,0,0,0,0|2,0,0]=4 10463 B11R0.22 CCC(CC)COCCC(=O)O 9ac4c42b818f646c988707512d0929ee [0,2,0,0,0,0|1,0,0]=3 10464 B11R0.22 CCC(CC)NCCCC(=O)C 26ac1d98a8d6eb2d8aa110a6cecbcf1f [0,2,0,0,0,0|2,0,0]=4 10465 B11R0.22 CCC(CC)NCCCC(=O)N 51506fd4a59cef0bdf8dfb98d93e16d1 [0,2,0,0,0,0|2,0,0]=4 10466 B11R0.22 CCC(CC)NCCCC(=O)O 95561484ca2cfccce11ae5027a7b6008 [0,2,0,0,0,0|1,0,0]=3 10467 B11R0.22 CCC(CC)OCCCC(=O)C e78fd19601652ea7a632b0a852991e4b [0,2,0,0,0,0|2,0,0]=4 10468 B11R0.22 CCC(CC)OCCCC(=O)N 89c9e4654b85cdea0e166bd287f131bf [0,2,0,0,0,0|2,0,0]=4 10469 B11R0.22 CCC(CO)CNCCC(=O)C 0cc266f656be33bbfc79a798de55b79e [0,2,0,0,0,0|2,0,0]=4 10470 B11R0.22 CCC(CO)CNCCC(=O)N 098e1d2965cc118b24f05c69105f09f8 [0,2,0,0,0,0|2,0,0]=4 10471 B11R0.22 CCC(CO)CNCCC(=O)O f68a45fb8c2ee8b67f8a3d73b71bbca9 [0,2,0,0,0,0|1,0,0]=3 10472 B11R0.22 CCC(CO)CNCCS(=O)O 45e66d0dac28dcb13a4e3239dde35cc5 [0,2,0,0,0,0|2,0,0]=4 10473 B11R0.22 CCC(CO)NCCCC(=O)C ff947c17a7be420d3b32d825c2bce175 [0,2,0,0,0,0|2,0,0]=4 10474 B11R0.22 CCC(CO)NCCCC(=O)N 0293b3232ed249df130a50bc68fa0bdb [0,2,0,0,0,0|2,0,0]=4 10475 B11R0.22 CCC(COCCC(=O)C)OC 42f551667e9a45caf92da4517484a068 [0,2,0,0,0,0|2,0,0]=4 10476 B11R0.22 CCC(COCCC(=O)N)OC 523652ffdae7d30383d77e684b0812c7 [0,2,0,0,0,0|2,0,0]=4 10477 B11R0.22 CCC(COCCC(=O)O)OC d9c2a853beb656215cde5075ffd19116 [0,2,0,0,0,0|1,0,0]=3 10478 B11R0.22 CCN(CC)CCNCC(=O)O 7f326baaf12809173052414e13763504 [0,2,0,0,0,0|2,0,0]=4 10479 B11R0.22 CCN(CC)CCOCC(=O)O 3edc1c60e4fb42854d07459931b67fb2 [0,2,0,0,0,0|2,0,0]=4 10480 B11R0.22 CCN(CC)COCCC(=O)O 4b525100c1ac1038435de1d13721fc51 [0,2,0,0,0,0|2,0,0]=4 10481 B11R0.22 CC[C@@H](CO)NCCCC(=O)C 07fd0bb7f42bed7af52c731d3cb99e5b [0,2,0,0,0,0|2,0,0]=4 10482 B11R0.22 CC[C@@H](CO)NCCCC(=O)N f581bf289c4267cf95162c4ed42041c8 [0,2,0,0,0,0|2,0,0]=4 10483 B11R0.22 CC[C@H](CO)NCCCC(=O)C 00fa662a7d3445e81f2e231fcf0cb33c [0,2,0,0,0,0|2,0,0]=4 10484 B11R0.22 CC[C@H](CO)NCCCC(=O)N 1c23c7e42a4eda3e217da7e8300c26e9 [0,2,0,0,0,0|2,0,0]=4 10485 B11R0.22 COC(CCNCC(=O)O)OC 8ff0aabe56685fa2fc0d781fe48be3e3 [0,2,0,0,0,0|2,0,0]=4 10486 B11R0.22 COC(CCOCC(=O)O)OC a1d576edd9322325a9db27f937da210d [0,2,0,0,0,0|2,0,0]=4 10487 B11R0.22 COC(CNCCC(=O)O)OC dccfc12cccf5ed8d0d9660c330b8fe8f [0,2,0,0,0,0|2,0,0]=4 10488 B11R0.22 COC(COCCC(=O)O)OC c5e256d6f26d5f7da0135e10ba2a8f5b [0,2,0,0,0,0|2,0,0]=4 10489 B11R0.22 CO[C@@H](CO)CNCCC(=O)O adc95e4e6d1a2f8bd7d6f5b8ce5cedd2 [0,2,0,0,0,0|2,0,0]=4 10490 B11R0.22 O=C(O)CCCNC(CO)CO b2d64bdceebba83fe3484e04d3ad8b24 [0,2,0,0,0,0|2,0,0]=4 10491 B11R0.22 O=C(O)CCNCC(CO)CO b8d7659974f469c8450658d91553f958 [0,2,0,0,0,0|2,0,0]=4 10492 B11R0.22 O=C(O)CCOCC(CBr)CBr bda0175d70e61f29549e3269999ffa13 [0,2,0,0,0,0|2,0,0]=4 10493 B11R0.22 O=C(O)CNCCC(CO)CO e10470e00abab97e043f82352bf1d33d [0,2,0,0,0,0|2,0,0]=4 10494 B11R0.29 C=C(C)CCCNC(C)C(=O)O fce2db971d82b0f16e89f81426b026eb [0,2,0,0,0,0|1,0,1]=4 10495 B11R0.29 C=C(C)CCCNC(O)C(=O)O a46fda0ff1f297f670fa93c354183b17 [0,2,0,0,0,0|1,0,1]=4 10496 B11R0.29 C=C(C)CCCN[C@@H](C)C(=O)O 3b8df86f3e6021b480c81f3b74d750e0 [0,2,0,0,0,0|1,0,1]=4 10497 B11R0.29 C=C(C)CCCN[C@H](C)C(=O)O b868608da4cc5d33c2eb16bf7ee78c92 [0,2,0,0,0,0|1,0,1]=4 10498 B11R0.29 C=C(C)CCNCC(C)C(=O)O 565fb2da5f7cef0404aa3f2f550607a2 [0,2,0,0,0,0|1,0,1]=4 10499 B11R0.29 C=C(C)CCNCC(F)C(=O)O 3dcff3eb63f93f2067026ffe1029bf82 [0,2,0,0,0,0|1,0,1]=4 10500 B11R0.29 C=C(C)CCNCC(O)C(=O)O 2a2f3e737230da1b8ca7b05cf94eb90c [0,2,0,0,0,0|1,0,1]=4 10501 B11R0.29 C=C(C)CCNC[C@@H](C)C(=O)O fdf4b5ef38b422773bf1762c1ac843bb [0,2,0,0,0,0|1,0,1]=4 10502 B11R0.29 C=C(C)CCNC[C@@H](O)C(=O)O 3ade3b9a075f571eadaa6bb622e49214 [0,2,0,0,0,0|1,0,1]=4 10503 B11R0.29 C=C(C)CCNC[C@H](C)C(=O)O 713a72cabe00f9e1693fa3fe49b14abf [0,2,0,0,0,0|1,0,1]=4 10504 B11R0.29 C=C(C)CCNC[C@H](O)C(=O)O 2219354d0622b1a07c5bbee6970d9d40 [0,2,0,0,0,0|1,0,1]=4 10505 B11R0.29 C=C(C)CCOCC(C)C(=O)O 800cbd8832e677f796eed2b0a867cc5d [0,2,0,0,0,0|1,0,1]=4 10506 B11R0.29 C=C(C)CCOC[C@@H](C)C(=O)O 27bcc99710bc3999b6262ccd9d780f8d [0,2,0,0,0,0|1,0,1]=4 10507 B11R0.29 C=C(C)CCOC[C@H](C)C(=O)O 0b42352ed42b149a6e08c73643a3a314 [0,2,0,0,0,0|1,0,1]=4 10508 B11R0.29 C=C(C)CNCCC(F)C(=O)O de20317bd0d176a6b118a22a7aacec6e [0,2,0,0,0,0|1,0,1]=4 10509 B11R0.29 C=C(C)CNCCC(O)C(=O)O 55576385ac39b05f4f4f1486b0a3f5d3 [0,2,0,0,0,0|1,0,1]=4 10510 B11R0.29 C=C(C)CNCC[C@H](O)C(=O)O e87a17b8a5719088b1cc2e05005acdee [0,2,0,0,0,0|1,0,1]=4 10511 B11R0.29 C=C(CNCCC(C)C)C(=O)O 7ea47b5a015ac235681bd249170451c6 [0,2,0,0,0,0|1,0,1]=4 10512 B11R0.29 C=C(CNCCC(C)O)C(=O)O 03eedb4b95102796968a75309cf9265d [0,2,0,0,0,0|1,0,1]=4 10513 B11R0.29 C=C(CNCC[C@@H](C)O)C(=O)O f1c1d810f067a9c2d356cbe9d1c7df74 [0,2,0,0,0,0|1,0,1]=4 10514 B11R0.29 C=C(CNCC[C@H](C)O)C(=O)O 4500edd9370b51192439d2b36469b495 [0,2,0,0,0,0|1,0,1]=4 10515 B11R0.29 C=C(COCCC(C)C)C(=O)O 9d7b8ce41b42f1de296656b8544e8695 [0,2,0,0,0,0|1,0,1]=4 10516 B11R0.29 CC(=O)C(C)CCNCC(C)O e5a26842f6e288f2a7a4f6d1482515bb [0,2,0,0,0,0|2,0,0]=4 10517 B11R0.29 CC(=O)C(C)CCNC[C@@H](C)O fa564f1a75cb73e616d8a952bda8f70e [0,2,0,0,0,0|2,0,0]=4 10518 B11R0.29 CC(=O)C(C)CCNC[C@H](C)O d0a937abad035d7eeac493cea69723c8 [0,2,0,0,0,0|2,0,0]=4 10519 B11R0.29 CC(=O)C(C)COCCC(=O)O d7bb690ddd9d4c156ec6fd1ac1edd382 [0,2,0,0,0,0|1,0,1]=4 10520 B11R0.29 CC(=O)C(C)COCCC(C)C d7502d2a2851363f668289f13ddf2961 [0,2,0,0,0,0|2,0,0]=4 10521 B11R0.29 CC(=O)C(C)NCCCC(=O)O 33e732cd3469222fe42e56ff8844a182 [0,2,0,0,0,0|1,0,1]=4 10522 B11R0.29 CC(=O)C(C)NCCCC(C)C 85429ac5305b20a07b9d0d11fcb49ced [0,2,0,0,0,0|2,0,0]=4 10523 B11R0.29 CC(=O)C(C)OCCCC(C)C ae9cd0d5e0ed87bae6ac8e0bfe8ec887 [0,2,0,0,0,0|2,0,0]=4 10524 B11R0.29 CC(=O)CCCCN(C)C(C)C 1b21b0af66870b35b2a31aecddab5189 [0,2,0,0,0,0|2,0,0]=4 10525 B11R0.29 CC(=O)CCCNC(C)C(=O)O 9831579a3993f3ca62417de58374484a [0,2,0,0,0,0|1,0,1]=4 10526 B11R0.29 CC(=O)CCCNC(C)C(C)C 74b135a9e04b14a026fbeb123d9219dd [0,2,0,0,0,0|2,0,0]=4 10527 B11R0.29 CC(=O)CCCNC(C)C(C)O 49d7acf0f4f32b57bf6e3cdf2e26436b [0,2,0,0,0,0|2,0,0]=4 10528 B11R0.29 CC(=O)CCCNC(O)C(=O)O 57cb7ad68f37f514ed414cc4f41c9e83 [0,2,0,0,0,0|1,0,1]=4 10529 B11R0.29 CC(=O)CCCN[C@@H](C)C(=O)O 34258a41efe21b8ba029060bb294eb9f [0,2,0,0,0,0|1,0,1]=4 10530 B11R0.29 CC(=O)CCCN[C@@H](C)C(C)C 3e0840dcbf1ba02a517aa17857e8df02 [0,2,0,0,0,0|2,0,0]=4 10531 B11R0.29 CC(=O)CCCN[C@H](C)C(=O)O cd314fa5075b63ee7cf6d912766acfd9 [0,2,0,0,0,0|1,0,1]=4 10532 B11R0.29 CC(=O)CCCN[C@H](C)C(C)C 623fb55c1e5736a8627cf835ccaebe99 [0,2,0,0,0,0|2,0,0]=4 10533 B11R0.29 CC(=O)CCCOC(C)C(=O)O eecfc1c572669d03325b7bc8ba861405 [0,2,0,0,0,0|1,0,1]=4 10534 B11R0.29 CC(=O)CCCOC(C)C(C)C 7ed6a4282b7609a9608df5fd1556e534 [0,2,0,0,0,0|2,0,0]=4 10535 B11R0.29 CC(=O)CCCOC(C)C(C)S 7e93d9a399c669b8f3be7aaa101014c4 [0,2,0,0,0,0|2,0,0]=4 10536 B11R0.29 CC(=O)CCCO[C@@H](C)C(=O)O eecfb50335f373e76f4210a0457fda5a [0,2,0,0,0,0|1,0,1]=4 10537 B11R0.29 CC(=O)CCCO[C@@H](C)C(C)C 0f8dcf7f541a52866d24d2300d8691e2 [0,2,0,0,0,0|2,0,0]=4 10538 B11R0.29 CC(=O)CCCO[C@H](C)C(=O)O 3efb5a5272e647f4507177000ac7cc3f [0,2,0,0,0,0|1,0,1]=4 10539 B11R0.29 CC(=O)CCCO[C@H](C)C(C)C b92abec41cfae132abecd4c07c7255a0 [0,2,0,0,0,0|2,0,0]=4 10540 B11R0.29 CC(=O)CCNCC(C)C(=O)O 438831ba43cb3feb9a6877365b6290ad [0,2,0,0,0,0|1,0,1]=4 10541 B11R0.29 CC(=O)CCNCC(F)C(=O)O 43236598ca66f7431e306b08d42ed061 [0,2,0,0,0,0|1,0,1]=4 10542 B11R0.29 CC(=O)CCNCC(O)C(=O)O 004f7700bd38abc6c7d18240fe784415 [0,2,0,0,0,0|1,0,1]=4 10543 B11R0.29 CC(=O)CCNCC(O)C(C)C f2e7072cdefbc7e22edd8616b2aae06e [0,2,0,0,0,0|2,0,0]=4 10544 B11R0.29 CC(=O)CCNC[C@@H](C)C(=O)O 4ce15038546f5d5f35b2d42a7e3c45cf [0,2,0,0,0,0|1,0,1]=4 10545 B11R0.29 CC(=O)CCNC[C@@H](O)C(=O)O b11e288d618db92a75d0cbf6e9edc072 [0,2,0,0,0,0|1,0,1]=4 10546 B11R0.29 CC(=O)CCNC[C@H](C)C(=O)O aaf3b0fd9dbc4e5668bddd52941e3819 [0,2,0,0,0,0|1,0,1]=4 10547 B11R0.29 CC(=O)CCNC[C@H](O)C(=O)O 0c7e5d2b0f2c56be73f69c8e1807a222 [0,2,0,0,0,0|1,0,1]=4 10548 B11R0.29 CC(=O)CCOCC(C)C(=O)O 705de9dc8a01e9df202cc66942041dd3 [0,2,0,0,0,0|1,0,1]=4 10549 B11R0.29 CC(=O)CCOCC(C)C(C)C 1c6bdfdac2e06b9af5be525909dc57da [0,2,0,0,0,0|2,0,0]=4 10550 B11R0.29 CC(=O)CCOC[C@@H](C)C(=O)O 0e1187eb9f1b9a094ad641932e5a01ab [0,2,0,0,0,0|1,0,1]=4 10551 B11R0.29 CC(=O)CCOC[C@H](C)C(=O)O 5ad032f851260124d875c73fc1ca3e01 [0,2,0,0,0,0|1,0,1]=4 10552 B11R0.29 CC(C)C(=O)CNCCC(=O)O 067161b2da85205f60e9dcd0bbc777d1 [0,2,0,0,0,0|1,0,1]=4 10553 B11R0.29 CC(C)C(=O)COCCC(=O)O 584da16fe72f7040245cd63ee652c7f6 [0,2,0,0,0,0|1,0,1]=4 10554 B11R0.29 CC(C)C(C)CCOCC(=O)N 641472ebb36add568e24bcbe5a37f716 [0,2,0,0,0,0|2,0,0]=4 10555 B11R0.29 CC(C)C(C)CCOCC(=O)O e7aeb86824dde9bd2e010d2ce9b0c0c0 [0,2,0,0,0,0|1,0,0]=3 10556 B11R0.29 CC(C)C(C)CNCCC(=O)N 064cc25de6f76f3eda90900c7ea8aceb [0,2,0,0,0,0|2,0,0]=4 10557 B11R0.29 CC(C)C(C)CNCCC(=O)O e8c5957b3bac0ef038b66a0d42bef0a1 [0,2,0,0,0,0|1,0,0]=3 10558 B11R0.29 CC(C)C(C)CNCCS(=O)O 8ca1c3f3d29f7804823fbd49b3ed23f0 [0,2,0,0,0,0|2,0,0]=4 10559 B11R0.29 CC(C)C(C)COCCC(=O)N 236919cd9407451768ccd4d7d9717221 [0,2,0,0,0,0|2,0,0]=4 10560 B11R0.29 CC(C)C(C)COCCC(=O)O e44f98d08c9fa2dc2b6cf974dbf74c1f [0,2,0,0,0,0|1,0,0]=3 10561 B11R0.29 CC(C)C(C)NCCCC(=O)N 817ff045687bf66feae52d16a08fc9fb [0,2,0,0,0,0|2,0,0]=4 10562 B11R0.29 CC(C)C(C)NCCCC(=O)O efe6c6ba2c8bcfbd67c460a716395108 [0,2,0,0,0,0|1,0,0]=3 10563 B11R0.29 CC(C)C(C)OCCCC(=O)N 8e855012e948fbcd341a6637ab2bfd12 [0,2,0,0,0,0|2,0,0]=4 10564 B11R0.29 CC(C)C(O)CNCCC(=O)N 6e854ca4f1806a9a975b51174b97c764 [0,2,0,0,0,0|2,0,0]=4 10565 B11R0.29 CC(C)C(O)CNCCC(=O)O be1ef0eec8b5adda9a7ef1257e99db12 [0,2,0,0,0,0|1,0,0]=3 10566 B11R0.29 CC(C)CCCNC(C)C(=O)N 354b166b44bfbf02137216d2f205e1ad [0,2,0,0,0,0|2,0,0]=4 10567 B11R0.29 CC(C)CCCNC(C)C(=O)O 60b5a4dbce3395c74b9d6da6401c7862 [0,2,0,0,0,0|1,0,0]=3 10568 B11R0.29 CC(C)CCCNC(F)C(=O)N 74b9b9040d4b0f18a652a3a5ec7f2f05 [0,2,0,0,0,0|2,0,0]=4 10569 B11R0.29 CC(C)CCCNC(O)C(=O)O f1b4ef2a0825e9247abf6872e0e07d8b [0,2,0,0,0,0|1,0,0]=3 10570 B11R0.29 CC(C)CCCN[C@@H](C)C(=O)N aed5969477b5f7e8529f977808b48dea [0,2,0,0,0,0|2,0,0]=4 10571 B11R0.29 CC(C)CCCN[C@@H](C)C(=O)O a99d727ab5806f6b015d1afb227ff7bf [0,2,0,0,0,0|1,0,0]=3 10572 B11R0.29 CC(C)CCCN[C@H](C)C(=O)N b835c2dd1268dd0a8953f99a1e15aafa [0,2,0,0,0,0|2,0,0]=4 10573 B11R0.29 CC(C)CCCN[C@H](C)C(=O)O cdde59eee8e6761ba74273f5394e560e [0,2,0,0,0,0|1,0,0]=3 10574 B11R0.29 CC(C)CCCOC(C)C(=O)N 1c9b0ee3ff616693875df78e5206a114 [0,2,0,0,0,0|2,0,0]=4 10575 B11R0.29 CC(C)CCCOC(C)C(=O)O 718c76e06566bdb82c95ae87f70256db [0,2,0,0,0,0|1,0,0]=3 10576 B11R0.29 CC(C)CCCOC(F)C(=O)N 9e24a346f5e41745b6b2b17a4e645177 [0,2,0,0,0,0|2,0,0]=4 10577 B11R0.29 CC(C)CCCO[C@@H](C)C(=O)N b7e006873c59a7ae8dfe0b799fc01e29 [0,2,0,0,0,0|2,0,0]=4 10578 B11R0.29 CC(C)CCCO[C@@H](C)C(=O)O 25ff4d13c775b33bca24e0a1ed72839b [0,2,0,0,0,0|1,0,0]=3 10579 B11R0.29 CC(C)CCCO[C@H](C)C(=O)N 62de4d6360881ef3ac3089d9ac8b9e7e [0,2,0,0,0,0|2,0,0]=4 10580 B11R0.29 CC(C)CCCO[C@H](C)C(=O)O d430685e4496dac470417251d21b2d75 [0,2,0,0,0,0|1,0,0]=3 10581 B11R0.29 CC(C)CCNCC(=O)C(=O)O 9f3a5db9c11dba511d6421d2cdc148ee [0,2,0,0,0,0|1,0,1]=4 10582 B11R0.29 CC(C)CCNCC(C)C(=O)O 73167b4eb0bafc9f7f56ef8809491ab2 [0,2,0,0,0,0|1,0,0]=3 10583 B11R0.29 CC(C)CCNCC(F)C(=O)O 0e5d6ace13322764b7ac1c92d5a148d8 [0,2,0,0,0,0|1,0,0]=3 10584 B11R0.29 CC(C)CCNCC(O)C(=O)O b8155f4bd2c73f1b5e699189f5e1452c [0,2,0,0,0,0|1,0,0]=3 10585 B11R0.29 CC(C)CCNC[C@@H](C)C(=O)O e86adcf9c3d6f72001d3c44a367e8486 [0,2,0,0,0,0|1,0,0]=3 10586 B11R0.29 CC(C)CCNC[C@@H](O)C(=O)O 5ab64c5bf0ddb04b814db56ed418a46e [0,2,0,0,0,0|1,0,0]=3 10587 B11R0.29 CC(C)CCNC[C@H](C)C(=O)O 92217d51f01f81ab666dad3d5dabc34f [0,2,0,0,0,0|1,0,0]=3 10588 B11R0.29 CC(C)CCNC[C@H](O)C(=O)O 7f15bc0fc37d68583056aec6d6d0c51d [0,2,0,0,0,0|1,0,0]=3 10589 B11R0.29 CC(C)CCOCC(=O)C(=O)O cbf0ecf89e6f283f626c39157869fe66 [0,2,0,0,0,0|1,0,1]=4 10590 B11R0.29 CC(C)CCOCC(C)C(=O)O c9eddbc80fa52d4950e66411ab4e1da2 [0,2,0,0,0,0|1,0,0]=3 10591 B11R0.29 CC(C)CCOC[C@@H](C)C(=O)O 14df7f9db4da1e737b280d1bc1816247 [0,2,0,0,0,0|1,0,0]=3 10592 B11R0.29 CC(C)CCOC[C@H](C)C(=O)O 8ae08b1bbad4f6def841c091065fb379 [0,2,0,0,0,0|1,0,0]=3 10593 B11R0.29 CC(C)CNCCC(F)C(=O)O 568bbf7a7e8b421491400503237985c0 [0,2,0,0,0,0|1,0,0]=3 10594 B11R0.29 CC(C)CNCCC(O)C(=O)O cf36799583d0c318c575f6d688b6f27c [0,2,0,0,0,0|1,0,0]=3 10595 B11R0.29 CC(C)CNCC[C@H](O)C(=O)O 3c6ba9daa0544c22d21b120c41e9486f [0,2,0,0,0,0|1,0,0]=3 10596 B11R0.29 CC(C)N(C)CCCCC(=O)O c2416fd3af0e35f62f074b30aa5b0857 [0,2,0,0,0,0|1,0,0]=3 10597 B11R0.29 CC(C)N(C)CCNCC(=O)O 849edb73fa91675f48a5823e73b80277 [0,2,0,0,0,0|2,0,0]=4 10598 B11R0.29 CC(C)OCCCC(C)C(=O)O b3f67a43d07d3ba6b4302373eb6c51c3 [0,2,0,0,0,0|1,0,0]=3 10599 B11R0.29 CC(C)OCCNC(C)C(=O)O 70f87e0ed5aa362d56fe85b47f1ad804 [0,2,0,0,0,0|2,0,0]=4 10600 B11R0.29 CC(C)OCCNC(F)C(=O)O 9bdf0816c09cb5a2363bfbace7a3d025 [0,2,0,0,0,0|2,0,0]=4 10601 B11R0.29 CC(C)OCCNC(O)C(=O)O 1bbf3aa1b3f45b00beba9627a85e542b [0,2,0,0,0,0|2,0,0]=4 10602 B11R0.29 CC(C)OCCN[C@@H](C)C(=O)O 59b3aa6eaaa9402b3f82063ca5378674 [0,2,0,0,0,0|2,0,0]=4 10603 B11R0.29 CC(C)OCCN[C@@H](F)C(=O)O 8ee3713a340fbad545e9eb79ae27938c [0,2,0,0,0,0|2,0,0]=4 10604 B11R0.29 CC(C)OCCN[C@H](C)C(=O)O 4ccd32acf84b3bd2e35e6e8f0538c505 [0,2,0,0,0,0|2,0,0]=4 10605 B11R0.29 CC(C)OCCOC(C)C(=O)O 9cf92358e02d1654172ceeb802193d2a [0,2,0,0,0,0|2,0,0]=4 10606 B11R0.29 CC(C)OCCO[C@@H](C)C(=O)O 11dadf01098710f7793cbee0aee4b3a6 [0,2,0,0,0,0|2,0,0]=4 10607 B11R0.29 CC(C)OCCO[C@H](C)C(=O)O e687224226257d32d825f4ced8555648 [0,2,0,0,0,0|2,0,0]=4 10608 B11R0.29 CC(C)OCNCC(C)C(=O)O fe1ac30dfbd1137a4665b5f0a7bf053d [0,2,0,0,0,0|2,0,0]=4 10609 B11R0.29 CC(C)OCNCC(F)C(=O)O 6a603b3d8f54b18e37b4ee06c3acdab0 [0,2,0,0,0,0|2,0,0]=4 10610 B11R0.29 CC(C)OCNCC(O)C(=O)O 9c1199d505a1780b8bec2f553ed00c22 [0,2,0,0,0,0|2,0,0]=4 10611 B11R0.29 CC(C)OCNC[C@@H](C)C(=O)O 92a1421a82602ce6349545d50717fa60 [0,2,0,0,0,0|2,0,0]=4 10612 B11R0.29 CC(C)OCNC[C@@H](O)C(=O)O 061572c5e37f80d786d80e1d1d56fd8c [0,2,0,0,0,0|2,0,0]=4 10613 B11R0.29 CC(C)OCNC[C@H](C)C(=O)O 1bfe426233b373515de438459c5e8977 [0,2,0,0,0,0|2,0,0]=4 10614 B11R0.29 CC(C)OCNC[C@H](O)C(=O)O eb72ee5efe3812fa911aa8847c19ee71 [0,2,0,0,0,0|2,0,0]=4 10615 B11R0.29 CC(C)OCOCC(C)C(=O)O 8c37935d34818e916b80a196fe4336da [0,2,0,0,0,0|2,0,0]=4 10616 B11R0.29 CC(C)OCOC[C@@H](C)C(=O)O 73dda516bd25d01afb2cf1286145af74 [0,2,0,0,0,0|2,0,0]=4 10617 B11R0.29 CC(C)OCOC[C@H](C)C(=O)O 4ee50663265438ba1fc8803d00b45871 [0,2,0,0,0,0|2,0,0]=4 10618 B11R0.29 CC(C)SCCNC(C)C(=O)O c6a6316d2df51648751a0b1f297367fc [0,2,0,0,0,0|2,0,0]=4 10619 B11R0.29 CC(C)SCCNC(O)C(=O)O 551dc834c33fff6a446e98bb85297150 [0,2,0,0,0,0|2,0,0]=4 10620 B11R0.29 CC(C)SCCN[C@@H](C)C(=O)O 2a5b30fdc46c10da52601a724842db1b [0,2,0,0,0,0|2,0,0]=4 10621 B11R0.29 CC(C)SCCN[C@H](C)C(=O)O 4017e1b042025aae5196a682dc0dae78 [0,2,0,0,0,0|2,0,0]=4 10622 B11R0.29 CC(C)SCCOC(C)C(=O)O 47b547a824b205b77a1e3be325ae4765 [0,2,0,0,0,0|2,0,0]=4 10623 B11R0.29 CC(C)SCCOC(F)C(=O)O 21be7f950c787a70f45f965ecd9e8737 [0,2,0,0,0,0|2,0,0]=4 10624 B11R0.29 CC(C)SCCO[C@@H](C)C(=O)O 99a0832ea8cc965bf8bb77cf01e6bdb7 [0,2,0,0,0,0|2,0,0]=4 10625 B11R0.29 CC(C)SCCO[C@@H](F)C(=O)O 60f3e74131439336c3fb11dcb3c56feb [0,2,0,0,0,0|2,0,0]=4 10626 B11R0.29 CC(C)SCCO[C@H](C)C(=O)O a6126db8ee82800358bebe6fd5cda89f [0,2,0,0,0,0|2,0,0]=4 10627 B11R0.29 CC(C)[C@@H](C)NCCCC(=O)N 84945bc33c2bb73deb28b53fcee1b66c [0,2,0,0,0,0|2,0,0]=4 10628 B11R0.29 CC(C)[C@@H](C)NCCCC(=O)O 8eeb52f5956c6f8804062a573cfcc192 [0,2,0,0,0,0|1,0,0]=3 10629 B11R0.29 CC(C)[C@@H](C)OCCCC(=O)N ad5f8cd0d3011067e22422e44b30ef70 [0,2,0,0,0,0|2,0,0]=4 10630 B11R0.29 CC(C)[C@H](C)NCCCC(=O)N 3bcfbcb074250a0565812a8e75a07e51 [0,2,0,0,0,0|2,0,0]=4 10631 B11R0.29 CC(C)[C@H](C)NCCCC(=O)O 9843cb9fe5999b9549f0db203c954e31 [0,2,0,0,0,0|1,0,0]=3 10632 B11R0.29 CC(C)[C@H](C)OCCCC(=O)N 3a0193d5dc384fd147a7d18b3fe40c3f [0,2,0,0,0,0|2,0,0]=4 10633 B11R0.29 CC(CCNCC(=O)O)N(C)C 4c97d00ea0c8fea22a45143deccda657 [0,2,0,0,0,0|2,0,0]=4 10634 B11R0.29 CC(CCOCC(=O)O)N(C)C 7b03a0a593335352bf34c24071778b8f [0,2,0,0,0,0|2,0,0]=4 10635 B11R0.29 CC(CNCCC(=O)O)N(C)C bd9e64bebc8ee9fe4b88f1ee286038a4 [0,2,0,0,0,0|2,0,0]=4 10636 B11R0.29 CC(CNCCC(F)F)C(=O)O 65ce9a70f9c325b128833adcbf31f401 [0,2,0,0,0,0|2,0,0]=4 10637 B11R0.29 CC(CNCCN(C)C)C(=O)O 64ac3ceba38eded8c3210ad9c1741847 [0,2,0,0,0,0|2,0,0]=4 10638 B11R0.29 CC(CNCCS(=O)C)C(=O)O 773f5be456a664732c62841c8a41a300 [0,2,0,0,0,0|2,0,0]=4 10639 B11R0.29 CC(CNCC[C@@H](C)O)C(=O)O 646466bf5ab74a747fb584d7f4cd3db4 [0,2,0,0,0,0|1,0,0]=3 10640 B11R0.29 CC(CNCC[C@H](C)O)C(=O)O 18e071cf5e984211c05ca689651d2eee [0,2,0,0,0,0|1,0,0]=3 10641 B11R0.29 CC(COCCC(=O)O)N(C)C 584560f25872bfd50a6ed8c68f69b879 [0,2,0,0,0,0|2,0,0]=4 10642 B11R0.29 CC(COCCC(F)F)C(=O)O 67a1b327968e4b5fb5739a2ff8bd6f11 [0,2,0,0,0,0|2,0,0]=4 10643 B11R0.29 CC(COCCN(C)C)C(=O)O 42499b2454a5c5308017f436bb7c5691 [0,2,0,0,0,0|2,0,0]=4 10644 B11R0.29 CC(COCCS(=O)C)C(=O)O 0611fbbb30a37392e214e4fa02178765 [0,2,0,0,0,0|2,0,0]=4 10645 B11R0.29 CC(NCCCN(C)C)C(=O)O bcb38676de0cb3ff53d2f5b2a3075512 [0,2,0,0,0,0|2,0,0]=4 10646 B11R0.29 CC(O)C(C)NCCCC(=O)N f0b6829bd4510806b50202857aee8fb5 [0,2,0,0,0,0|2,0,0]=4 10647 B11R0.29 CC(O)C(C)NCCCC(=O)O 51ddf21f4416c40207fe1142dec24441 [0,2,0,0,0,0|1,0,0]=3 10648 B11R0.29 CC(O)CCCNC(C)C(=O)N 69533d9d546b9b44fd93e2898eaa68e4 [0,2,0,0,0,0|2,0,0]=4 10649 B11R0.29 CC(O)CCCNC(C)C(=O)O 2daebbacc15ca3b09b7f5e541a17e8f0 [0,2,0,0,0,0|1,0,0]=3 10650 B11R0.29 CC(O)CCCNC(O)C(=O)O 41661cfe10a49e9dc2e28de529439ee0 [0,2,0,0,0,0|1,0,0]=3 10651 B11R0.29 CC(O)CCCN[C@@H](C)C(=O)N 87ba46efa255b0a2dceeac14f2111791 [0,2,0,0,0,0|2,0,0]=4 10652 B11R0.29 CC(O)CCCN[C@@H](C)C(=O)O 3f2aec308bb6e56ff02245004463826d [0,2,0,0,0,0|1,0,0]=3 10653 B11R0.29 CC(O)CCCN[C@H](C)C(=O)N 89a91ce593bc37bbeb4ff1c7cfc9e16e [0,2,0,0,0,0|2,0,0]=4 10654 B11R0.29 CC(O)CCCN[C@H](C)C(=O)O 3bd696fb1b9d593e47651406c586fcfb [0,2,0,0,0,0|1,0,0]=3 10655 B11R0.29 CC(O)CCNCC(=O)C(=O)O 95adcb5c0580d1d52b75b4f840761038 [0,2,0,0,0,0|1,0,1]=4 10656 B11R0.29 CC(O)CCNCC(C)C(=O)O 4297df989c7baa7545b1a70e6db36600 [0,2,0,0,0,0|1,0,0]=3 10657 B11R0.29 CC(O)CCNCC(F)C(=O)O a40a4bae2b6c82b47ecadaf0ad148116 [0,2,0,0,0,0|1,0,0]=3 10658 B11R0.29 CC(O)CCNCC(O)C(=O)O ebcca83717f20345bd6aba55f5738b71 [0,2,0,0,0,0|1,0,0]=3 10659 B11R0.29 CC(O)CCNC[C@@H](C)C(=O)O 275af171ca298f58f6a848c2bca347fe [0,2,0,0,0,0|1,0,0]=3 10660 B11R0.29 CC(O)CCNC[C@@H](O)C(=O)O 2362a3d9a6b97cbbbea6109c87380c5b [0,2,0,0,0,0|1,0,0]=3 10661 B11R0.29 CC(O)CCNC[C@H](C)C(=O)O ac55e19f71ad5de176d2a169c1fbd8cd [0,2,0,0,0,0|1,0,0]=3 10662 B11R0.29 CC(O)CCNC[C@H](O)C(=O)O 39839c16eb481eb6595e23e08ece7855 [0,2,0,0,0,0|1,0,0]=3 10663 B11R0.29 CC(O)CNCCC(F)C(=O)O 8ffc94c5b8c9067a93580f0d8a0d3516 [0,2,0,0,0,0|1,0,0]=3 10664 B11R0.29 CC(O)CNCCC(O)C(=O)O 38a67eb932dea32c4ab9b09593d98107 [0,2,0,0,0,0|1,0,0]=3 10665 B11R0.29 CC(O)CNCC[C@H](O)C(=O)O 8fb3f1e47ed7d2195bb939e63116631e [0,2,0,0,0,0|1,0,0]=3 10666 B11R0.29 CC(OCCCN(C)C)C(=O)O 9499e31f0f1146decadbf988afd23c47 [0,2,0,0,0,0|2,0,0]=4 10667 B11R0.29 CC(S)C(C)OCCCC(=O)N 6499ac01b2dd067fd6dfaa4d92d2f138 [0,2,0,0,0,0|2,0,0]=4 10668 B11R0.29 CN(C)CCCNC(O)C(=O)O f6a900196420fdccd48f8a68469bb4c5 [0,2,0,0,0,0|2,0,0]=4 10669 B11R0.29 CN(C)CCNCC(F)C(=O)O 6dea67190c8669bd72fe6551c6124e71 [0,2,0,0,0,0|2,0,0]=4 10670 B11R0.29 CN(C)CCNCC(O)C(=O)O 99250b62908ce1501bd1c3e753728b2c [0,2,0,0,0,0|2,0,0]=4 10671 B11R0.29 CN(C)CCNC[C@@H](O)C(=O)O dd9095654ee319101ea60a285d99a7d6 [0,2,0,0,0,0|2,0,0]=4 10672 B11R0.29 CN(C)CCNC[C@H](O)C(=O)O b63337c393a8f461acf8e4ff958d7589 [0,2,0,0,0,0|2,0,0]=4 10673 B11R0.29 CN(C)CNCCC(F)C(=O)O d6f1ffa9521896d9dcb4031f163e6bdf [0,2,0,0,0,0|2,0,0]=4 10674 B11R0.29 CN(C)CNCCC(O)C(=O)O 236386d0a9b4c61f1ad32bb90599738d [0,2,0,0,0,0|2,0,0]=4 10675 B11R0.29 CN(C)CNCC[C@H](O)C(=O)O 9d95782dfb3035f5c3738e629a2acbb9 [0,2,0,0,0,0|2,0,0]=4 10676 B11R0.29 CS(=O)CCNCC(F)C(=O)O 6c849abf2bce70a1df414cd70b4bc121 [0,2,0,0,0,0|2,0,0]=4 10677 B11R0.29 CS(=O)CCNCC(O)C(=O)O a34c12af10bf85d7cc06eeb1b5ca690d [0,2,0,0,0,0|2,0,0]=4 10678 B11R0.29 CS(=O)CCNC[C@@H](O)C(=O)O 4a8f77df54b3560bbbbee6af0c300544 [0,2,0,0,0,0|2,0,0]=4 10679 B11R0.29 CS(=O)CCNC[C@H](O)C(=O)O ebd4646b8ee452a85680bdf1c407c568 [0,2,0,0,0,0|2,0,0]=4 10680 B11R0.29 C[C@@H](CCNCC(=O)O)N(C)C 9c1c05559ac99494dd831063c4612743 [0,2,0,0,0,0|2,0,0]=4 10681 B11R0.29 C[C@@H](CNCCN(C)C)C(=O)O 5ba875497b9504c26ae2eba1c01e3561 [0,2,0,0,0,0|2,0,0]=4 10682 B11R0.29 C[C@@H](CNCCS(=O)C)C(=O)O bc8955a605f6bf99b6b97731cf617b24 [0,2,0,0,0,0|2,0,0]=4 10683 B11R0.29 C[C@@H](COCCC(=O)O)N(C)C ad0b336d2857e10a5da8ba43d986cab8 [0,2,0,0,0,0|2,0,0]=4 10684 B11R0.29 C[C@@H](COCCN(C)C)C(=O)O aa61615b672c33755045e6b7b8ca5459 [0,2,0,0,0,0|2,0,0]=4 10685 B11R0.29 C[C@@H](COCCS(=O)C)C(=O)O ef9e3c8752fab9a96ae08c9337d9dbf7 [0,2,0,0,0,0|2,0,0]=4 10686 B11R0.29 C[C@@H](NCCCC(=O)O)C(F)F 8d7fd3928f12caa03fc3eb0cbfcbd3f4 [0,2,0,0,0,0|2,0,0]=4 10687 B11R0.29 C[C@@H](NCCCN(C)C)C(=O)O d38ce54c7292e829693d5b0f36ea3bb1 [0,2,0,0,0,0|2,0,0]=4 10688 B11R0.29 C[C@@H](O)CCNCC(=O)C(=O)O 76aa9bfb091ce18b656b9765d45a43cf [0,2,0,0,0,0|1,0,1]=4 10689 B11R0.29 C[C@@H](O)CCNCC(O)C(=O)O 4a69a92b427268b4518734ba3719f5b8 [0,2,0,0,0,0|1,0,0]=3 10690 B11R0.29 C[C@@H](O)CCNC[C@H](O)C(=O)O 775d67d99f5fad64b6012767a289724c [0,2,0,0,0,0|1,0,0]=3 10691 B11R0.29 C[C@@H](O)CNCCC(F)C(=O)O 654e26cd88bf877e1f8f9a82e8c83188 [0,2,0,0,0,0|1,0,0]=3 10692 B11R0.29 C[C@@H](O)CNCCC(O)C(=O)O 3142f88326128ddb16cb240676d7d644 [0,2,0,0,0,0|1,0,0]=3 10693 B11R0.29 C[C@@H](O)CNCC[C@H](O)C(=O)O b434f6eae0ee1587cdb61f27ec240636 [0,2,0,0,0,0|1,0,0]=3 10694 B11R0.29 C[C@@H](OCCCN(C)C)C(=O)O 9190fceee81725e697bebde4da5ac48e [0,2,0,0,0,0|2,0,0]=4 10695 B11R0.29 C[C@H](CCNCC(=O)O)N(C)C 2191a639bc979b46fdc0793a0e47601c [0,2,0,0,0,0|2,0,0]=4 10696 B11R0.29 C[C@H](CNCCN(C)C)C(=O)O 9940e4e8310e4828f05ed4885fd50743 [0,2,0,0,0,0|2,0,0]=4 10697 B11R0.29 C[C@H](CNCCS(=O)C)C(=O)O 848fe208dc376ee34c1233e326539d39 [0,2,0,0,0,0|2,0,0]=4 10698 B11R0.29 C[C@H](COCCC(=O)O)N(C)C 9694efc15f468e3513e65f8820a77a95 [0,2,0,0,0,0|2,0,0]=4 10699 B11R0.29 C[C@H](COCCN(C)C)C(=O)O 98a7e3bbbef8ad048ef1881404e0ae1f [0,2,0,0,0,0|2,0,0]=4 10700 B11R0.29 C[C@H](COCCS(=O)C)C(=O)O 9855040d2c9db26feabecde0bcc4ec36 [0,2,0,0,0,0|2,0,0]=4 10701 B11R0.29 C[C@H](NCCCC(=O)O)C(F)F 6832dd5929bd11871c3968538b6a052e [0,2,0,0,0,0|2,0,0]=4 10702 B11R0.29 C[C@H](NCCCN(C)C)C(=O)O e595f0c43deaec57c67d860d1bd7e273 [0,2,0,0,0,0|2,0,0]=4 10703 B11R0.29 C[C@H](O)CCNCC(=O)C(=O)O 62ac7b9722b1efcd113b3399cfb092f8 [0,2,0,0,0,0|1,0,1]=4 10704 B11R0.29 C[C@H](O)CCNCC(O)C(=O)O bee60d9f7e4b3851cef9d1f862567a8d [0,2,0,0,0,0|1,0,0]=3 10705 B11R0.29 C[C@H](O)CCNC[C@H](O)C(=O)O 7549d77931e0f99acf80c74e0819dcd6 [0,2,0,0,0,0|1,0,0]=3 10706 B11R0.29 C[C@H](O)CNCCC(F)C(=O)O 6a05f259b7427c46a5667a757a3dd72f [0,2,0,0,0,0|1,0,0]=3 10707 B11R0.29 C[C@H](O)CNCCC(O)C(=O)O 799e7b16e2195f0b1999701b8663c4b0 [0,2,0,0,0,0|1,0,0]=3 10708 B11R0.29 C[C@H](O)CNCC[C@H](O)C(=O)O 87a6fbc389852f999e117c13eeb7b9e8 [0,2,0,0,0,0|1,0,0]=3 10709 B11R0.29 C[C@H](OCCCN(C)C)C(=O)O 69c8959347f60c7463b0d35c13cc37a7 [0,2,0,0,0,0|2,0,0]=4 10710 B11R0.29 O=C(O)C(F)CCNCC(F)F 7e473807a32a46668b5712112615d203 [0,2,0,0,0,0|2,0,0]=4 10711 B11R0.29 O=C(O)C(O)CCNCC(F)F a41dd8a470217e4af9df43fc80391000 [0,2,0,0,0,0|2,0,0]=4 10712 B11R0.29 O=C(O)CCNCC(O)C(F)F 3b40564edd1b0725bf26682882859c46 [0,2,0,0,0,0|2,0,0]=4 10713 B11R0.29 O=C(O)[C@@H](O)CCNCC(F)F 52eadcb6f851a8a5012345b1190abb8a [0,2,0,0,0,0|2,0,0]=4 10714 B11R0.93 C=C(CC)CN(C)CCC(=O)O 97e0afb1b4743d8c0fb3c11f99c6a75c [0,2,0,0,0,0|1,0,1]=4 10715 B11R0.93 CC(CCC(=O)O)N[C@@H](C)CO 53fb0045b2984088de7704edb6aeaf81 [0,2,0,0,0,0|2,0,0]=4 10716 B11R0.93 CC(CCC(=O)O)N[C@H](C)CO 86413d74c31714c15dbf76dca7536653 [0,2,0,0,0,0|2,0,0]=4 10717 B11R0.93 CC(CO)CN(C)CCC(=O)O 767ee051f8e7c775e6a57eeb8e641661 [0,2,0,0,0,0|2,0,0]=4 10718 B11R0.93 CC(CO)NC(C)CCC(=O)O 29aaa2db934732a238a689f6acf7e5f1 [0,2,0,0,0,0|2,0,0]=4 10719 B11R0.93 CC(CO)N[C@@H](C)CCC(=O)O d16c6e303f3b7b9cc230c93b6e5c2cec [0,2,0,0,0,0|2,0,0]=4 10720 B11R0.93 CCC(=O)CN(C)CCC(=O)O 845c0bed7c5e1e6cc29f679c13d54482 [0,2,0,0,0,0|1,0,1]=4 10721 B11R0.93 CCC(C)CC(C)NCC(=O)N 28b87fde61ad4fc84f5fff5a42be9b58 [0,2,0,0,0,0|2,0,0]=4 10722 B11R0.93 CCC(C)CC(C)NCC(=O)O 99245d4cb6eba394b062ff83d6199d2c [0,2,0,0,0,0|1,0,0]=3 10723 B11R0.93 CCC(C)CN(C)CCC(=O)N 090144bb20b5f09e826db3c46aa1c5d1 [0,2,0,0,0,0|2,0,0]=4 10724 B11R0.93 CCC(C)CN(C)CCC(=O)O 9a514751cccb1cb201f29f1f55657437 [0,2,0,0,0,0|1,0,0]=3 10725 B11R0.93 CCC(C)NC(C)CCC(=O)O a41c5f1130520b069d8bdfe6f32a314e [0,2,0,0,0,0|1,0,0]=3 10726 B11R0.93 CCC(C)N[C@@H](C)CCC(=O)O b6a47b2e8167bd27a77356cc6a9cb8a3 [0,2,0,0,0,0|1,0,0]=3 10727 B11R0.93 CCC(C)OC(C)CCC(=O)O 3c24dde73b980ee2acf3bd2d01c50deb [0,2,0,0,0,0|1,0,0]=3 10728 B11R0.93 CCC(O)CN(C)CCC(=O)C 4868d92d2d0619d02f1b83aa00c92b8f [0,2,0,0,0,0|2,0,0]=4 10729 B11R0.93 CCC(O)CN(C)CCC(=O)N 347f92957f63e3d824612f3831439b85 [0,2,0,0,0,0|2,0,0]=4 10730 B11R0.93 CCC(O)CN(C)CCC(=O)O 04bf288c916614f7bacdcf5c0d4d7224 [0,2,0,0,0,0|1,0,0]=3 10731 B11R0.93 CCN(C)CC(=O)CCC(=O)O 5c7da4feb598cef3249ef7189c328163 [0,2,0,0,0,0|1,0,1]=4 10732 B11R0.93 CC[C@@H](C)CN(C)CCC(=O)N 0bc4ee38b8c798f2209a56ddfc42982f [0,2,0,0,0,0|2,0,0]=4 10733 B11R0.93 CC[C@@H](C)CN(C)CCC(=O)O 0f7f78ec335346ae33746b0958ddd3b8 [0,2,0,0,0,0|1,0,0]=3 10734 B11R0.93 CC[C@@H](C)OC(C)CCC(=O)O 56fa53b2a73b31d3e5be4d8e27ebb332 [0,2,0,0,0,0|1,0,0]=3 10735 B11R0.93 CC[C@H](C)CN(C)CCC(=O)N b1f61db4c309123540585a154ba3b127 [0,2,0,0,0,0|2,0,0]=4 10736 B11R0.93 CC[C@H](C)CN(C)CCC(=O)O 80229bc7fa403ff42b5e1529f0b21bc7 [0,2,0,0,0,0|1,0,0]=3 10737 B11R0.93 CC[C@H](C)OC(C)CCC(=O)O 35d0bac6a65ceaa7b24472c43d8cb73e [0,2,0,0,0,0|1,0,0]=3 10738 B11R0.93 CN(CCC(=O)O)CC(O)CF 07b69fdfd27b942bad213a440e5c91be [0,2,0,0,0,0|2,0,0]=4 10739 B11R0.93 CN(CCC(=O)O)CC(O)CO 0dfe1e18e258d4d0001e2dd1c3deb075 [0,2,0,0,0,0|2,0,0]=4 10740 B11R0.93 CN(CCC(=O)O)C[C@@H](O)CO 2683a043e3d8778f92b1ec0658ec49a6 [0,2,0,0,0,0|2,0,0]=4 10741 B11R0.93 CN(CCC(=O)O)C[C@H](O)CO 85f9bfb8f7726b631f56a55245818a73 [0,2,0,0,0,0|2,0,0]=4 10742 B11R0.93 COC(C)CC(C)OCC(=O)O 86ada5fae4e63134f20a71e99bb2f762 [0,2,0,0,0,0|2,0,0]=4 10743 B11R0.93 COC(C)CN(C)CCC(=O)O 3fe4dcada5937198c2078db4e3c4ed19 [0,2,0,0,0,0|2,0,0]=4 10744 B11R0.93 CO[C@@H](C)CN(C)CCC(=O)O 92c28282f21faa53b7580bcb3dc1edf6 [0,2,0,0,0,0|2,0,0]=4 10745 B11R0.93 CO[C@H](C)CN(C)CCC(=O)O f7b383951353fb64263d6f18cf685433 [0,2,0,0,0,0|2,0,0]=4 10746 B11R0.93 C[C@@H](CO)CN(C)CCC(=O)O 0211683056632d44828ccb38db76f49d [0,2,0,0,0,0|2,0,0]=4 10747 B11R0.93 C[C@@H](CO)N[C@@H](C)CCC(=O)O 5321e28207974a7451bb31fa8450ac24 [0,2,0,0,0,0|2,0,0]=4 10748 B11R0.93 C[C@H](CO)CN(C)CCC(=O)O 5283606017e4fce8198f93a3ac5850e3 [0,2,0,0,0,0|2,0,0]=4 10749 B11R0.93 C[C@H](CO)N[C@@H](C)CCC(=O)O 8d91ee694c9632e68f406dba36b6aa1a [0,2,0,0,0,0|2,0,0]=4 10750 B11R0.106 C=C(CC)CNCCC(=O)NO 8c85bdc395a57a9244cdeb587631eeb7 [0,2,0,0,0,0|1,0,1]=4 10751 B11R0.106 C=C(CC)CNCCC(=O)OC acdbdc004c1baa5c4af65a4b7606aab3 [0,2,0,0,0,0|1,0,1]=4 10752 B11R0.106 C=C(CC)COCCC(=O)OC 9fe0233c3deba1eda82c25e00ea05fd0 [0,2,0,0,0,0|1,0,1]=4 10753 B11R0.106 C=C(CNCCC(C)CC)OC c75f7d8f07458294389551b11dd8fb96 [0,2,0,0,0,0|2,0,0]=4 10754 B11R0.106 C=C(CO)CNCCC(C)CC dc8726d116bf724181ca5e076281430d [0,2,0,0,0,0|2,0,0]=4 10755 B11R0.106 C=C(COCCC(C)CC)OC 90805e633c13c2254dd6e7123656733c [0,2,0,0,0,0|2,0,0]=4 10756 B11R0.106 C=C(COCCC(S)CC)OC 48dc93592a36d9c1162927df8ab17a19 [0,2,0,0,0,0|2,0,0]=4 10757 B11R0.106 C=C(COCC[C@@H](C)CC)OC 088da90646a1258629c6e41ed1deefc7 [0,2,0,0,0,0|2,0,0]=4 10758 B11R0.106 C=CC(=O)CCCNC(C)CC 9c26639c3d6fafbb66c002d3c59d1c27 [0,2,0,0,0,0|2,0,0]=4 10759 B11R0.106 C=CC(=O)CCCN[C@@H](C)CC c5fa34f38188f54ddd8f3b7160259822 [0,2,0,0,0,0|2,0,0]=4 10760 B11R0.106 C=CC(=O)CCCN[C@H](C)CC 6706918da125f95fcb2905b2f8139146 [0,2,0,0,0,0|2,0,0]=4 10761 B11R0.106 C=CC(=O)CCCOC(C)CC 3bf2265c900f3632d001eab1f85c6cbb [0,2,0,0,0,0|2,0,0]=4 10762 B11R0.106 C=CC(=O)CCCO[C@@H](C)CC 3e3748ab740c36336803111e0ba5baf0 [0,2,0,0,0,0|2,0,0]=4 10763 B11R0.106 C=CC(=O)CCCO[C@H](C)CC 25170d09784b50bcebe84fd29b5c77dd [0,2,0,0,0,0|2,0,0]=4 10764 B11R0.106 CC(CO)CCCNC(=O)CO 4fd5aa4b80b612cd5f45925631ff504c [0,2,0,0,0,0|2,0,0]=4 10765 B11R0.106 CC(CO)CCNCC(=O)CO d8bfb21742ce4a7b4a38233535e384c7 [0,2,0,0,0,0|2,0,0]=4 10766 B11R0.106 CC(CO)CCNCC(=O)NO 9d1b4b7faecfce2975d181d3d308f22d [0,2,0,0,0,0|2,0,0]=4 10767 B11R0.106 CC(CO)CNCCC(=O)NO 38ef761da0b528e42e93d1097d61144d [0,2,0,0,0,0|2,0,0]=4 10768 B11R0.106 CCC(=O)CCCCN(C)CC 2b370bfdb5d5de00c92602244680674b [0,2,0,0,0,0|2,0,0]=4 10769 B11R0.106 CCC(=O)CNCCC(=O)NO 71efd8153bcf3d4a7af4addbfd58bab9 [0,2,0,0,0,0|1,0,1]=4 10770 B11R0.106 CCC(=O)CNCCC(=O)OC a1859409ae3cae66b02296aa35465362 [0,2,0,0,0,0|1,0,1]=4 10771 B11R0.106 CCC(=O)CNCCC(C)CC 106100361898872279c972f823771d98 [0,2,0,0,0,0|2,0,0]=4 10772 B11R0.106 CCC(=O)COCCC(=O)OC a93f5bc1dc7cf93ec3f49e0ac91c35f2 [0,2,0,0,0,0|1,0,1]=4 10773 B11R0.106 CCC(=O)COCCC(C)CC 345bfda05f7e751c0fc12f2e90b906d2 [0,2,0,0,0,0|2,0,0]=4 10774 B11R0.106 CCC(=O)COCCC(S)CC b6366a82ee5d59706166c23a6d1c64f2 [0,2,0,0,0,0|2,0,0]=4 10775 B11R0.106 CCC(=O)COCC[C@@H](C)CC 332a7d1082fc27f1a46b7b5a5dcf9383 [0,2,0,0,0,0|2,0,0]=4 10776 B11R0.106 CCC(=O)NCCCC(=O)OC 2bd7aaab7c60df4067f99866a5dc4ea0 [0,2,0,0,0,0|1,0,1]=4 10777 B11R0.106 CCC(C)CCNCC(=O)CO 9b6e868cfe204ef1bcdc76a7185f9ea4 [0,2,0,0,0,0|1,0,0]=3 10778 B11R0.106 CCC(C)CCNCC(=O)NC ef5f7dedd5f922c79d78477d2a113b0e [0,2,0,0,0,0|2,0,0]=4 10779 B11R0.106 CCC(C)CCNCC(=O)NO bb76f17ae5328a0d77f52fc0293ab918 [0,2,0,0,0,0|1,0,0]=3 10780 B11R0.106 CCC(C)CCNCC(=O)OC 55546b48ad802d407e44efd0891c77f0 [0,2,0,0,0,0|1,0,0]=3 10781 B11R0.106 CCC(C)CCOCC(=O)NC 9de44f3d77d326dd42098d35eae5fb1e [0,2,0,0,0,0|2,0,0]=4 10782 B11R0.106 CCC(C)CCOCC(=O)OC 04047e6aa53caf612115bdc052389946 [0,2,0,0,0,0|1,0,0]=3 10783 B11R0.106 CCC(C)CNCCC(=O)NC 61d6f4badefa152e09fb128b718d00d1 [0,2,0,0,0,0|2,0,0]=4 10784 B11R0.106 CCC(C)CNCCC(=O)NO 4bcdaaf6e05b42b2ffdcc8a3ed82d951 [0,2,0,0,0,0|1,0,0]=3 10785 B11R0.106 CCC(C)CNCCC(=O)OC abb2e914f35de9229c3647dd0ab6e8e1 [0,2,0,0,0,0|1,0,0]=3 10786 B11R0.106 CCC(C)CNCOC(=O)OC 1b5b4f97764d129d74a4b3c8fd6c387b [0,2,0,0,0,0|2,0,0]=4 10787 B11R0.106 CCC(C)COCCC(=O)NC 46a2e65416989752518f13b2daec28ca [0,2,0,0,0,0|2,0,0]=4 10788 B11R0.106 CCC(C)COCCC(=O)OC 90b61ecf8b1a10b5e1864fc256b29965 [0,2,0,0,0,0|1,0,0]=3 10789 B11R0.106 CCC(C)COCOC(=O)OC 2bd8b4d2ed4c7f583c2eddbba855b125 [0,2,0,0,0,0|2,0,0]=4 10790 B11R0.106 CCC(C)NCCCC(=O)NC 78569babf6e407ae4cb0ad7e9203ef09 [0,2,0,0,0,0|2,0,0]=4 10791 B11R0.106 CCC(C)NCCCC(=O)OC d3018845f5d5d1bc753f56bd7f86b645 [0,2,0,0,0,0|1,0,0]=3 10792 B11R0.106 CCC(C)OCCCC(=O)NC 3d3e5ede5e8c790869c978f84d4c7698 [0,2,0,0,0,0|2,0,0]=4 10793 B11R0.106 CCC(C)OCCCC(=O)OC 73c7d02713528c817e16ae2787ad1215 [0,2,0,0,0,0|1,0,0]=3 10794 B11R0.106 CCC(C)OCCOC(=O)OC a61ba394d28b03b1b7a19d066f8dfa4b [0,2,0,0,0,0|2,0,0]=4 10795 B11R0.106 CCC(O)CNCCC(=O)NC 8570724d0c31b0ce766247f501e3c15d [0,2,0,0,0,0|2,0,0]=4 10796 B11R0.106 CCC(O)CNCCC(=O)NO 209eb984a178eea751e743d73f0f59e1 [0,2,0,0,0,0|1,0,0]=3 10797 B11R0.106 CCC(O)CNCCC(=O)OC b38b6679c77734006520557e7c6ace4e [0,2,0,0,0,0|1,0,0]=3 10798 B11R0.106 CCC(O)CNCOC(=O)OC ce4ae85bbfc243148577b25bcaa909b0 [0,2,0,0,0,0|2,0,0]=4 10799 B11R0.106 CCC(S)CCOCC(=O)NC baa03b2365ea6d494a1e0a6e2c9caae6 [0,2,0,0,0,0|2,0,0]=4 10800 B11R0.106 CCC(S)CCOCC(=O)OC b15bbffda571936636baf3572a7482de [0,2,0,0,0,0|1,0,0]=3 10801 B11R0.106 CCN(C)CCCCC(=O)OC 52951c911bfbe4f74e1d442046d437c9 [0,2,0,0,0,0|1,0,0]=3 10802 B11R0.106 CCN(C)CCCNC(=O)CO a251a077c69d5e98a1f812087c4e6648 [0,2,0,0,0,0|2,0,0]=4 10803 B11R0.106 CCN(C)CCOCC(=O)OC c4efbf84929615212a88b4619ff85add [0,2,0,0,0,0|2,0,0]=4 10804 B11R0.106 CCS(=O)CCOCC(=O)OC 7f4a77deba805b446bde6bc176a573f8 [0,2,0,0,0,0|2,0,0]=4 10805 B11R0.106 CC[C@@H](C)CNCCC(=O)NC 62a5b40d72e6a4bb116da39010890f0a [0,2,0,0,0,0|2,0,0]=4 10806 B11R0.106 CC[C@@H](C)CNCCC(=O)NO 7872db1c9900d0391f064ac3312e9895 [0,2,0,0,0,0|1,0,0]=3 10807 B11R0.106 CC[C@@H](C)CNCCC(=O)OC ec64ec2d2e85b9c539660c4fc4513db1 [0,2,0,0,0,0|1,0,0]=3 10808 B11R0.106 CC[C@@H](C)COCCC(=O)NC a5e10290581ede549fe1360ad5edbb11 [0,2,0,0,0,0|2,0,0]=4 10809 B11R0.106 CC[C@@H](C)COCCC(=O)OC 6ff164d42b9941a665594c3d04a64d46 [0,2,0,0,0,0|1,0,0]=3 10810 B11R0.106 CC[C@@H](C)COCOC(=O)OC 18a298c9654de34ee80c48d13a4e3aba [0,2,0,0,0,0|2,0,0]=4 10811 B11R0.106 CC[C@@H](C)NCCCC(=O)NC c123f393948533f836e32f7fb0000b86 [0,2,0,0,0,0|2,0,0]=4 10812 B11R0.106 CC[C@@H](C)NCCCC(=O)OC c5ab184a1828ac00951b4d5083f06f45 [0,2,0,0,0,0|1,0,0]=3 10813 B11R0.106 CC[C@@H](C)OCCCC(=O)NC ded55f681798d1e5fe0f3edbd3e0796a [0,2,0,0,0,0|2,0,0]=4 10814 B11R0.106 CC[C@@H](C)OCCCC(=O)OC 20116c6b5ae76c3d034784de4d52563a [0,2,0,0,0,0|1,0,0]=3 10815 B11R0.106 CC[C@@H](O)CNCCC(=O)NC eccc216483dcd2fa6e7b3d4a127997fb [0,2,0,0,0,0|2,0,0]=4 10816 B11R0.106 CC[C@@H](O)CNCCC(=O)OC 2b9a1efddd0dfd6840a473b5cd7841e2 [0,2,0,0,0,0|1,0,0]=3 10817 B11R0.106 CC[C@@H](O)CNCOC(=O)OC 0969d147c74c9771132277dcbe54766f [0,2,0,0,0,0|2,0,0]=4 10818 B11R0.106 CC[C@H](C)CCOCC(=O)NC 5f0d20f039508d83d27e225c7c3ff549 [0,2,0,0,0,0|2,0,0]=4 10819 B11R0.106 CC[C@H](C)CCOCC(=O)OC bb5d1b620636b82254ccbb745e5db12b [0,2,0,0,0,0|1,0,0]=3 10820 B11R0.106 CC[C@H](C)CNCCC(=O)NC 6854b4cadcdef1c373636f1ab571ffef [0,2,0,0,0,0|2,0,0]=4 10821 B11R0.106 CC[C@H](C)CNCCC(=O)NO d552f0dbe2267bed05d08c80db5abb63 [0,2,0,0,0,0|1,0,0]=3 10822 B11R0.106 CC[C@H](C)CNCCC(=O)OC 84a33ab53460ddd972a70034900a1ff5 [0,2,0,0,0,0|1,0,0]=3 10823 B11R0.106 CC[C@H](C)CNCOC(=O)OC 44ea9c74081a990712c8b549cd09454b [0,2,0,0,0,0|2,0,0]=4 10824 B11R0.106 CC[C@H](C)COCCC(=O)NC 6cc7cc398f2addbba6e4032ac10db506 [0,2,0,0,0,0|2,0,0]=4 10825 B11R0.106 CC[C@H](C)COCCC(=O)OC 26dc8fd9b69a8d4a68fc0b44e6101e06 [0,2,0,0,0,0|1,0,0]=3 10826 B11R0.106 CC[C@H](C)COCOC(=O)OC 280b327297b86b841ec4cc1075740686 [0,2,0,0,0,0|2,0,0]=4 10827 B11R0.106 CC[C@H](C)NCCCC(=O)NC ea946323e7839ae900f7350c340ad187 [0,2,0,0,0,0|2,0,0]=4 10828 B11R0.106 CC[C@H](C)NCCCC(=O)OC 0d31d63cb2fa99d2857eb1759def4d2d [0,2,0,0,0,0|1,0,0]=3 10829 B11R0.106 CC[C@H](C)OCCCC(=O)NC baa577cdd8f609816df37c2bc6f399c8 [0,2,0,0,0,0|2,0,0]=4 10830 B11R0.106 CC[C@H](C)OCCCC(=O)OC e611334dbefda70672866dae633c5dd0 [0,2,0,0,0,0|1,0,0]=3 10831 B11R0.106 COC(=O)CCCNC(C)CO d7643bd71ea9710c8e96faf914da6342 [0,2,0,0,0,0|2,0,0]=4 10832 B11R0.106 COC(=O)CCCN[C@@H](C)CO 0f87ba5891505b6fae174a49cd75edb2 [0,2,0,0,0,0|2,0,0]=4 10833 B11R0.106 COC(=O)CCCN[C@H](C)CO 20be15a551bb3ddde1521434a493d1ff [0,2,0,0,0,0|2,0,0]=4 10834 B11R0.106 COC(=O)CCCOC(C)CF c42089be77f51cc29b434d53478f1ffd [0,2,0,0,0,0|2,0,0]=4 10835 B11R0.106 COC(=O)CCCOC(C)CS 97c12310e5243119cbf29e63de6e2fdb [0,2,0,0,0,0|2,0,0]=4 10836 B11R0.106 COC(=O)CCCO[C@H](C)CS 762e834d3f78d447058cb6a7d6fc63de [0,2,0,0,0,0|2,0,0]=4 10837 B11R0.106 COC(=O)CCNCC(Br)CBr 65ca6720fcbaa3155feec679df605fcd [0,2,0,0,0,0|2,0,0]=4 10838 B11R0.106 COC(=O)CCNCC(C)CO 31828cfa79d6535531b38b87362941c8 [0,2,0,0,0,0|2,0,0]=4 10839 B11R0.106 COC(=O)CCNCC(C)OC 4e6d8a97f5e378f641ded8c255bca74b [0,2,0,0,0,0|2,0,0]=4 10840 B11R0.106 COC(=O)CCNCC(F)CO b47fec0ffa3e71f1411fc58a78ab97e6 [0,2,0,0,0,0|2,0,0]=4 10841 B11R0.106 COC(=O)CCNCC(O)CF 88d9faaebbceea61a3ce31610277911f [0,2,0,0,0,0|2,0,0]=4 10842 B11R0.106 COC(=O)CCNCC(O)CO d50aa910b75cbb9057d1e5707c96989f [0,2,0,0,0,0|2,0,0]=4 10843 B11R0.106 COC(=O)CCNC[C@@H](C)CO fbd90a40dbc6a13d9c3591b07730c3b8 [0,2,0,0,0,0|2,0,0]=4 10844 B11R0.106 COC(=O)CCNC[C@@H](C)OC 8ff663efa1b150738f74f2d0562e9368 [0,2,0,0,0,0|2,0,0]=4 10845 B11R0.106 COC(=O)CCNC[C@@H](F)CO d2630ef1824d69e358abfa26e9eeb806 [0,2,0,0,0,0|2,0,0]=4 10846 B11R0.106 COC(=O)CCNC[C@@H](O)CO 17d62371a2878ffa894bec3311f17e65 [0,2,0,0,0,0|2,0,0]=4 10847 B11R0.106 COC(=O)CCNC[C@H](C)CO 7c2cf12ee5aa6fdbb59a80b968c47b66 [0,2,0,0,0,0|2,0,0]=4 10848 B11R0.106 COC(=O)CCNC[C@H](C)OC 14cd4937f977c1b0ea35405e6b285bdb [0,2,0,0,0,0|2,0,0]=4 10849 B11R0.106 COC(=O)CCNC[C@H](F)CO 2c63f16b6be3cc7ab96f8d007665cf24 [0,2,0,0,0,0|2,0,0]=4 10850 B11R0.106 COC(=O)CCNC[C@H](O)CO 3b7d26e75619d8c82af57e6653e53ff9 [0,2,0,0,0,0|2,0,0]=4 10851 B11R0.106 COC(=O)CCOCC(Br)CBr 3bc6ba38c49b1abff4999b1f1949e666 [0,2,0,0,0,0|2,0,0]=4 10852 B11R0.106 COC(=O)CCOCC(C)OC e324d17a6ee5c029427afc9d07ee286f [0,2,0,0,0,0|2,0,0]=4 10853 B11R0.106 COC(=O)CCOCC(Cl)CCl b5fae9a47c441c6a52a364bd7adc9411 [0,2,0,0,0,0|2,0,0]=4 10854 B11R0.106 COC(=O)CCOCC(O)CO 2fa64389d33ade8abd0f76121ab2feda [0,2,0,0,0,0|2,0,0]=4 10855 B11R0.106 COC(=O)CCOCC(S)CS 0f111f681cb12c1aecac0093e83cf3a5 [0,2,0,0,0,0|2,0,0]=4 10856 B11R0.106 COC(=O)CCOC[C@@H](C)OC 9dee85fb1ce18bb17a3a3980ac7b75fd [0,2,0,0,0,0|2,0,0]=4 10857 B11R0.106 COC(=O)CCOC[C@@H](O)CO 91602169a2889f40da54226a89ec5b7b [0,2,0,0,0,0|2,0,0]=4 10858 B11R0.106 COC(=O)CCOC[C@H](C)OC 394f9891d5c57ea123ec8dfe72c28ca0 [0,2,0,0,0,0|2,0,0]=4 10859 B11R0.106 COC(=O)CCOC[C@H](O)CO 8d6b17733a7e6f04bde4f7f61317f574 [0,2,0,0,0,0|2,0,0]=4 10860 B11R0.106 COC(=O)CNCCC(C)CO 29b8cc1b56b337c508ca0a6b890556fd [0,2,0,0,0,0|2,0,0]=4 10861 B11R0.106 COC(=O)CNCCC(O)CO 56fdfe24e05ebfea561985b948ad9c7a [0,2,0,0,0,0|2,0,0]=4 10862 B11R0.106 COC(=O)CNCC[C@@H](C)CO f67b20852da4c7aae9f3fc495c841879 [0,2,0,0,0,0|2,0,0]=4 10863 B11R0.106 COC(=O)COCCC(C)OC 0e6ca6817686cbc099edec733ce6bb66 [0,2,0,0,0,0|2,0,0]=4 10864 B11R0.106 COC(C)CNCCC(=O)NO 22e566961ed20a29001a1900fd8266df [0,2,0,0,0,0|2,0,0]=4 10865 B11R0.106 CO[C@@H](C)CNCCC(=O)NO aee26539989eae998225433a8b6eac4c [0,2,0,0,0,0|2,0,0]=4 10866 B11R0.106 CO[C@H](C)CNCCC(=O)NO 10e1d79561e089cde52ca9ad9779fee4 [0,2,0,0,0,0|2,0,0]=4 10867 B11R0.106 C[C@@H](CO)CCNCC(=O)CO 8fdfe9ddb31098baf2e48fd727faae81 [0,2,0,0,0,0|2,0,0]=4 10868 B11R0.106 C[C@@H](CO)CNCCC(=O)NO 1b175acce63bae2cf5fbbb028f2dea2f [0,2,0,0,0,0|2,0,0]=4 10869 B11R0.106 C[C@H](CO)CNCCC(=O)NO 0057bf4c0cb1cdaadfa4c79ae6abb065 [0,2,0,0,0,0|2,0,0]=4 10870 B11R0.106 O=C(CCNCC(O)CF)NO 4b7639b81ffd93eaaed043bbdb47380b [0,2,0,0,0,0|2,0,0]=4 10871 B11R0.106 O=C(CCNCC(O)CO)NO 61b8715adbe2e857cefb33c9507bd325 [0,2,0,0,0,0|2,0,0]=4 10872 B11R0.106 O=C(CCNC[C@@H](O)CO)NO f92f0af9871c3625c1dd9809cded0c3f [0,2,0,0,0,0|2,0,0]=4 10873 B11R0.106 O=C(CCNC[C@H](O)CO)NO 763136c44adda71d86ae0ada3f9ed6ac [0,2,0,0,0,0|2,0,0]=4 10874 B11R0.106 O=C(CO)CNCCC(O)CO c7eda88a3fb098da286a25cce58d1324 [0,2,0,0,0,0|2,0,0]=4 10875 B11R0.109 C=C(CC)CNCC(C)C(=O)O 7850d378a547ff56dcbb18aae16ecc6f [0,2,0,0,0,0|1,0,1]=4 10876 B11R0.109 C=C(CC)CNCC(F)C(=O)O c4743fd6185da8d18a390b52c2e3327c [0,2,0,0,0,0|1,0,1]=4 10877 B11R0.109 C=C(CC)CNCC(O)C(=O)O 6aa56d80037ad374469be02149561dfb [0,2,0,0,0,0|1,0,1]=4 10878 B11R0.109 C=C(CC)CNC[C@@H](C)C(=O)O 4890b5df034c04f260210207248e4712 [0,2,0,0,0,0|1,0,1]=4 10879 B11R0.109 C=C(CC)CNC[C@@H](O)C(=O)O b3b7a938f3a5c3544505df9b8271dabe [0,2,0,0,0,0|1,0,1]=4 10880 B11R0.109 C=C(CC)CNC[C@H](C)C(=O)O 8498875fad34db99230067efb6b92e76 [0,2,0,0,0,0|1,0,1]=4 10881 B11R0.109 C=C(CC)CNC[C@H](O)C(=O)O 457b41ffc95a957024f398d3d1f4c8b0 [0,2,0,0,0,0|1,0,1]=4 10882 B11R0.109 C=C(CC)COCC(C)C(=O)O 207ec9253dbbcd8baf9e8ea9deb6dc50 [0,2,0,0,0,0|1,0,1]=4 10883 B11R0.109 C=C(CC)COC[C@@H](C)C(=O)O ce73f707c909703ec56f75d022fc573f [0,2,0,0,0,0|1,0,1]=4 10884 B11R0.109 C=C(CC)COC[C@H](C)C(=O)O 4ea4049f19bec992cc82a3b56394bade [0,2,0,0,0,0|1,0,1]=4 10885 B11R0.109 C=C(CNCC(C)CC)C(=O)O 9ef387352a99de27eaebd6ddc608c694 [0,2,0,0,0,0|1,0,1]=4 10886 B11R0.109 C=C(CNCC(O)CC)C(=O)O 132afc1f8964e9c866fb10b4b90d65a4 [0,2,0,0,0,0|1,0,1]=4 10887 B11R0.109 C=C(CNC[C@@H](C)CC)C(=O)O 161bbb7eedc7ed71f600ffb585f263ab [0,2,0,0,0,0|1,0,1]=4 10888 B11R0.109 C=C(CNC[C@H](O)CC)C(=O)O 1abcfa50a1f7d4fa70d91402f5e80ad4 [0,2,0,0,0,0|1,0,1]=4 10889 B11R0.109 C=C(COCC(C)CC)C(=O)O 6dc0e250f316a38f74e1fd7361b97588 [0,2,0,0,0,0|1,0,1]=4 10890 B11R0.109 C=C(COC[C@@H](C)CC)C(=O)O 2240a152c8b9b144bba459446b83993f [0,2,0,0,0,0|1,0,1]=4 10891 B11R0.109 C=C(COC[C@H](C)CC)C(=O)O 9d0cb8b8d5a5cbfb2e2b339b580fd383 [0,2,0,0,0,0|1,0,1]=4 10892 B11R0.109 CC(CNCC(Br)CBr)C(=O)O d5a33992a6030a458612716d47f88b19 [0,2,0,0,0,0|2,0,0]=4 10893 B11R0.109 CC(CNCC(F)CO)C(=O)O 1b33bb6991fe0720a122769dcf99d814 [0,2,0,0,0,0|2,0,0]=4 10894 B11R0.109 CC(CNCC(O)CF)C(=O)O e074337b2ff1f052f692b3763201dc52 [0,2,0,0,0,0|2,0,0]=4 10895 B11R0.109 CC(CNCC(O)CO)C(=O)O 1bb8ee96215c7a4e9257de241c9fd862 [0,2,0,0,0,0|2,0,0]=4 10896 B11R0.109 CC(CNC[C@@H](C)CO)C(=O)O 4c8a3c5420d197dffb3e6c6bb04e8783 [0,2,0,0,0,0|2,0,0]=4 10897 B11R0.109 CC(CNC[C@@H](F)CO)C(=O)O f7cac399aa5fa95aa9d46dcfc7cf4628 [0,2,0,0,0,0|2,0,0]=4 10898 B11R0.109 CC(CNC[C@@H](O)CO)C(=O)O f897a82baa5a8239d8891b166f40003e [0,2,0,0,0,0|2,0,0]=4 10899 B11R0.109 CC(CNC[C@H](C)CO)C(=O)O 1239af101d764a31ebe501438fe8f460 [0,2,0,0,0,0|2,0,0]=4 10900 B11R0.109 CC(CNC[C@H](F)CO)C(=O)O 0f3372d2394126283d6c12b25ad4dcf9 [0,2,0,0,0,0|2,0,0]=4 10901 B11R0.109 CC(CNC[C@H](O)CO)C(=O)O e8c7a688369a3dd713bca969f6bc81b4 [0,2,0,0,0,0|2,0,0]=4 10902 B11R0.109 CC(CO)CCNC(C)C(=O)O 7d559caa5c1d1dd693775be5c0f6f13a [0,2,0,0,0,0|2,0,0]=4 10903 B11R0.109 CC(CO)CCNC(O)C(=O)O 7f2163e8ecea27bf5463b1bedc0b73d4 [0,2,0,0,0,0|2,0,0]=4 10904 B11R0.109 CC(CO)CCN[C@@H](C)C(=O)O 11805c1c00f57f356db017912bf40571 [0,2,0,0,0,0|2,0,0]=4 10905 B11R0.109 CC(CO)CCN[C@H](C)C(=O)O fffe778266b9e8c0624ed64d5432cced [0,2,0,0,0,0|2,0,0]=4 10906 B11R0.109 CC(CO)CNCC(C)C(=O)O 9e9490c7b4e0329535344ff8810231c0 [0,2,0,0,0,0|2,0,0]=4 10907 B11R0.109 CC(CO)CNCC(F)C(=O)O 636c26d385dc0a87288b5f75b45e258e [0,2,0,0,0,0|2,0,0]=4 10908 B11R0.109 CC(CO)CNCC(O)C(=O)O dcf6e2b4954bfaa6637fb9eedd69b565 [0,2,0,0,0,0|2,0,0]=4 10909 B11R0.109 CC(CO)CNC[C@@H](C)C(=O)O 49fd2103cf94683a2ff3e0b3b040dd5d [0,2,0,0,0,0|2,0,0]=4 10910 B11R0.109 CC(CO)CNC[C@@H](O)C(=O)O 573e8ef48531ea51a381d4698c7d4e5b [0,2,0,0,0,0|2,0,0]=4 10911 B11R0.109 CC(CO)CNC[C@H](C)C(=O)O 62f16f1fe3136b95321fa269b4e845ba [0,2,0,0,0,0|2,0,0]=4 10912 B11R0.109 CC(CO)CNC[C@H](O)C(=O)O c61b2c400d73c6af80ac0d7625af32a2 [0,2,0,0,0,0|2,0,0]=4 10913 B11R0.109 CC(CO)NCCC(F)C(=O)O 1387d26a1e09cb9c3c5b0774e5ead13d [0,2,0,0,0,0|2,0,0]=4 10914 B11R0.109 CC(CO)NCCC(O)C(=O)O 2abd7b25b13b6197a6ca7732f7d31de7 [0,2,0,0,0,0|2,0,0]=4 10915 B11R0.109 CC(CO)NCC[C@H](O)C(=O)O e297d10adb686a170f2307a3d867cae7 [0,2,0,0,0,0|2,0,0]=4 10916 B11R0.109 CC(COCC(Cl)CCl)C(=O)O 751dbba740222521987f2226535cebfe [0,2,0,0,0,0|2,0,0]=4 10917 B11R0.109 CC(COCC(O)CO)C(=O)O 484c50be890826bf4535e685610779de [0,2,0,0,0,0|2,0,0]=4 10918 B11R0.109 CC(COCC(S)CS)C(=O)O 3810d11d66b3fe145488c3a85d28cd90 [0,2,0,0,0,0|2,0,0]=4 10919 B11R0.109 CC(COC[C@@H](O)CO)C(=O)O 97b9954ccb49a1c8471760324b4ea84e [0,2,0,0,0,0|2,0,0]=4 10920 B11R0.109 CC(COC[C@H](O)CO)C(=O)O 33600283407e33373b83fd36341d366a [0,2,0,0,0,0|2,0,0]=4 10921 B11R0.109 CC(NCCC(O)CO)C(=O)O da2db0df27b3011b52d8d0d3df1439fa [0,2,0,0,0,0|2,0,0]=4 10922 B11R0.109 CC(NCC[C@@H](C)CO)C(=O)O 952fd5486e4fca5c0a8069ed0137e931 [0,2,0,0,0,0|2,0,0]=4 10923 B11R0.109 CCC(=O)CNCC(C)C(=O)O 85ec01ff277edcb3b31903f48deb94c8 [0,2,0,0,0,0|1,0,1]=4 10924 B11R0.109 CCC(=O)CNCC(F)C(=O)O 116247e99367ab5d57f6162abbfda131 [0,2,0,0,0,0|1,0,1]=4 10925 B11R0.109 CCC(=O)CNCC(O)C(=O)O 3ab0f4ef5e6103deeb535fb1f0e149c3 [0,2,0,0,0,0|1,0,1]=4 10926 B11R0.109 CCC(=O)CNC[C@@H](C)C(=O)O 72630aee5ba884e196b5756ef12b97c9 [0,2,0,0,0,0|1,0,1]=4 10927 B11R0.109 CCC(=O)CNC[C@@H](O)C(=O)O 540dbbbee4f37dd4ab275cf5fda5d9f0 [0,2,0,0,0,0|1,0,1]=4 10928 B11R0.109 CCC(=O)CNC[C@H](C)C(=O)O 20402b721da721a088563a5b42a4b5ae [0,2,0,0,0,0|1,0,1]=4 10929 B11R0.109 CCC(=O)CNC[C@H](O)C(=O)O 60bc37c0715c6923e23a7a478398a9f5 [0,2,0,0,0,0|1,0,1]=4 10930 B11R0.109 CCC(=O)COCC(C)C(=O)O f5a04a30bfe936de299fc1d459ae6f80 [0,2,0,0,0,0|1,0,1]=4 10931 B11R0.109 CCC(=O)COC[C@@H](C)C(=O)O b598fb6119cb095f0cec74c3e125ea4b [0,2,0,0,0,0|1,0,1]=4 10932 B11R0.109 CCC(=O)COC[C@H](C)C(=O)O 56f6e698c6d1f2195b4b2f374d9da2ed [0,2,0,0,0,0|1,0,1]=4 10933 B11R0.109 CCC(C)CCNC(C)C(=O)C 9f5a9d85ebc33b2c89b5d619f5c5d394 [0,2,0,0,0,0|2,0,0]=4 10934 B11R0.109 CCC(C)CCNC(C)C(=O)N aadbe97299e2ab52d378a5e78684bb43 [0,2,0,0,0,0|2,0,0]=4 10935 B11R0.109 CCC(C)CCNC(C)C(=O)O 6131f230f7db1b2da78223e5e1b5329b [0,2,0,0,0,0|1,0,0]=3 10936 B11R0.109 CCC(C)CCNC(O)C(=O)O ee02b45a4c484e4fc6127c38d3b6fc3e [0,2,0,0,0,0|1,0,0]=3 10937 B11R0.109 CCC(C)CCN[C@@H](C)C(=O)N cbb8892a497aebc3c2797503e5b6df76 [0,2,0,0,0,0|2,0,0]=4 10938 B11R0.109 CCC(C)CCN[C@@H](C)C(=O)O 22d34f7816548d0b9584fa3407f3cbfa [0,2,0,0,0,0|1,0,0]=3 10939 B11R0.109 CCC(C)CCN[C@H](C)C(=O)N 922839e28571acd65b2e54d2a6064991 [0,2,0,0,0,0|2,0,0]=4 10940 B11R0.109 CCC(C)CCN[C@H](C)C(=O)O 1c6037a3d69c397d075a27439ed75bf6 [0,2,0,0,0,0|1,0,0]=3 10941 B11R0.109 CCC(C)CCOC(C)C(=O)C 079e55ca8f4b59babdb0c400d6ce46b0 [0,2,0,0,0,0|2,0,0]=4 10942 B11R0.109 CCC(C)CCOC(C)C(=O)N 18a83543e048e1e5180bf22390783e87 [0,2,0,0,0,0|2,0,0]=4 10943 B11R0.109 CCC(C)CCOC(C)C(=O)O 706a7f78d50bc3355ad18842c25e8eef [0,2,0,0,0,0|1,0,0]=3 10944 B11R0.109 CCC(C)CCOC(F)C(=O)N 1d297567c5fa57b995ca15fdc6735629 [0,2,0,0,0,0|2,0,0]=4 10945 B11R0.109 CCC(C)CCO[C@@H](C)C(=O)N c930ff2e5b8735d042450590cbb77cab [0,2,0,0,0,0|2,0,0]=4 10946 B11R0.109 CCC(C)CCO[C@@H](C)C(=O)O 82dd2b248fcc3e67d9a413b1c6bc3d56 [0,2,0,0,0,0|1,0,0]=3 10947 B11R0.109 CCC(C)CCO[C@H](C)C(=O)N 96734ec54d3a9b1ec91718cdef54f451 [0,2,0,0,0,0|2,0,0]=4 10948 B11R0.109 CCC(C)CCO[C@H](C)C(=O)O 00c11270135d9ec48b9bdb207bb65725 [0,2,0,0,0,0|1,0,0]=3 10949 B11R0.109 CCC(C)CNCC(=O)C(=O)O 7f0b47b19ffc90fdd602066489476fac [0,2,0,0,0,0|1,0,1]=4 10950 B11R0.109 CCC(C)CNCC(C)C(=O)O 565a174ad82f967264d98cd75d9fd033 [0,2,0,0,0,0|1,0,0]=3 10951 B11R0.109 CCC(C)CNCC(F)C(=O)O c06bb4bb69ec56a9cb42b09ac6bdf58d [0,2,0,0,0,0|1,0,0]=3 10952 B11R0.109 CCC(C)CNCC(O)C(=O)O 60a84200e7b7635db8f812e77c522fbc [0,2,0,0,0,0|1,0,0]=3 10953 B11R0.109 CCC(C)CNC[C@@H](C)C(=O)O 6f6ffb173c374a51c11634d545abf76d [0,2,0,0,0,0|1,0,0]=3 10954 B11R0.109 CCC(C)CNC[C@@H](O)C(=O)O 1ff04882ee6c8bab600863982e3a716c [0,2,0,0,0,0|1,0,0]=3 10955 B11R0.109 CCC(C)CNC[C@H](C)C(=O)O 7897e6cdb77651e9e530298087ce7e42 [0,2,0,0,0,0|1,0,0]=3 10956 B11R0.109 CCC(C)CNC[C@H](O)C(=O)O 5f74c3cef19bc7b0223392815dd853b4 [0,2,0,0,0,0|1,0,0]=3 10957 B11R0.109 CCC(C)COCC(=O)C(=O)O 21b1fa065af63c5fc7345875c0fafddd [0,2,0,0,0,0|1,0,1]=4 10958 B11R0.109 CCC(C)COCC(C)C(=O)C 33d6f87d70240ca12783c755c9656445 [0,2,0,0,0,0|2,0,0]=4 10959 B11R0.109 CCC(C)COCC(C)C(=O)O b68c78e3f7863c4dd391a1b39e48733e [0,2,0,0,0,0|1,0,0]=3 10960 B11R0.109 CCC(C)COC[C@@H](C)C(=O)O adbd5eb803e5574337ed7cf5f2eab743 [0,2,0,0,0,0|1,0,0]=3 10961 B11R0.109 CCC(C)COC[C@H](C)C(=O)O c7c54378eabf2b5977cb915ff052c28e [0,2,0,0,0,0|1,0,0]=3 10962 B11R0.109 CCC(C)NCCC(F)C(=O)O 277148b277b8462a36452b66b4c5a887 [0,2,0,0,0,0|1,0,0]=3 10963 B11R0.109 CCC(C)NCCC(O)C(=O)O 006fd3a5863eabe3fc40ae5186e29197 [0,2,0,0,0,0|1,0,0]=3 10964 B11R0.109 CCC(C)NCC[C@H](O)C(=O)O af269cf13653b8a67928277180b61f2e [0,2,0,0,0,0|1,0,0]=3 10965 B11R0.109 CCC(O)CNCC(=O)C(=O)O c752e3b4ccf6ede02d23427c36c91d4f [0,2,0,0,0,0|1,0,1]=4 10966 B11R0.109 CCC(O)CNCC(C)C(=O)O ee5ef98dded67d16cdd3f5c8d41d1379 [0,2,0,0,0,0|1,0,0]=3 10967 B11R0.109 CCC(O)CNCC(F)C(=O)O 94e15b3c689e9bb3b470728beb4f93dc [0,2,0,0,0,0|1,0,0]=3 10968 B11R0.109 CCC(O)CNCC(O)C(=O)O cad5904429d86f803a4d82076a66d18e [0,2,0,0,0,0|1,0,0]=3 10969 B11R0.109 CCC(O)CNC[C@@H](C)C(=O)O f19ba391f9fae91d5006bdc6bc2c744f [0,2,0,0,0,0|1,0,0]=3 10970 B11R0.109 CCC(O)CNC[C@@H](O)C(=O)O 6afdf13cde7898eb9a4a0722abfaba92 [0,2,0,0,0,0|1,0,0]=3 10971 B11R0.109 CCC(O)CNC[C@H](C)C(=O)O bd282dd747ca7e56b4a22f0c6b06fbc5 [0,2,0,0,0,0|1,0,0]=3 10972 B11R0.109 CCC(O)CNC[C@H](O)C(=O)O 84123aaddcaa62810472549478f7fd31 [0,2,0,0,0,0|1,0,0]=3 10973 B11R0.109 CCC(S)CCOC(C)C(=O)C 6c3c22037cbad1f61f2e3c7632a1ac7b [0,2,0,0,0,0|2,0,0]=4 10974 B11R0.109 CCC(S)CCOC(C)C(=O)N 718d8a5fafd05220fe666d816b6a6c4e [0,2,0,0,0,0|2,0,0]=4 10975 B11R0.109 CCC(S)CCOC(F)C(=O)N 6e97fd601dc2be2fb4a458198879d913 [0,2,0,0,0,0|2,0,0]=4 10976 B11R0.109 CCC(S)CCO[C@@H](C)C(=O)N 5732719c87f194875e43d00375df7a20 [0,2,0,0,0,0|2,0,0]=4 10977 B11R0.109 CCC(S)CCO[C@H](C)C(=O)N cf5c8d76d4e8bdf67f222e8fe3d0d36f [0,2,0,0,0,0|2,0,0]=4 10978 B11R0.109 CCN(C)CCCC(C)C(=O)O 2d610f4fcb11004226bf804ef5336bf1 [0,2,0,0,0,0|1,0,0]=3 10979 B11R0.109 CCS(=O)CCNC(O)C(=O)O 0ea73b5c93cea530ce15bc45712cdc08 [0,2,0,0,0,0|2,0,0]=4 10980 B11R0.109 CC[C@@H](C)CNCC(C)C(=O)O 4495f035333bc29fe3b8eb77da8392da [0,2,0,0,0,0|1,0,0]=3 10981 B11R0.109 CC[C@@H](C)CNCC(F)C(=O)O 2f9a0d0f233a8eef37b54a7fd38e317d [0,2,0,0,0,0|1,0,0]=3 10982 B11R0.109 CC[C@@H](C)CNCC(O)C(=O)O bcc02a8aa460faa704630f06e0907d06 [0,2,0,0,0,0|1,0,0]=3 10983 B11R0.109 CC[C@@H](C)CNC[C@@H](C)C(=O)O 64bed9c48c0e6d5ed69239fc86d67adc [0,2,0,0,0,0|1,0,0]=3 10984 B11R0.109 CC[C@@H](C)CNC[C@@H](O)C(=O)O 782f06072b3cfde20700e43f7676f416 [0,2,0,0,0,0|1,0,0]=3 10985 B11R0.109 CC[C@@H](C)CNC[C@H](C)C(=O)O b91139084aac47efa035886afc827cb2 [0,2,0,0,0,0|1,0,0]=3 10986 B11R0.109 CC[C@@H](C)CNC[C@H](O)C(=O)O ba45bef64e698bf4f2a0d6d1676f219b [0,2,0,0,0,0|1,0,0]=3 10987 B11R0.109 CC[C@@H](C)COCC(=O)C(=O)O ec6cb1132726857da1892d948a586817 [0,2,0,0,0,0|1,0,1]=4 10988 B11R0.109 CC[C@@H](C)COCC(C)C(=O)C 483e564cc1de52fb1cb62d4187c4cc12 [0,2,0,0,0,0|2,0,0]=4 10989 B11R0.109 CC[C@@H](C)COCC(C)C(=O)O 1fda6c646112c9a95b29381ce4a39f9c [0,2,0,0,0,0|1,0,0]=3 10990 B11R0.109 CC[C@@H](C)COC[C@@H](C)C(=O)O 223f63ce28cb3863669abac662f9751e [0,2,0,0,0,0|1,0,0]=3 10991 B11R0.109 CC[C@@H](C)COC[C@H](C)C(=O)O bfb6b6ba2a236831547d6a2dc058370d [0,2,0,0,0,0|1,0,0]=3 10992 B11R0.109 CC[C@@H](O)CNCC(=O)C(=O)O 8116f6cda1d864fc70b9344360887a3f [0,2,0,0,0,0|1,0,1]=4 10993 B11R0.109 CC[C@@H](O)CNCC(C)C(=O)O a278f622e61f88e0470ee61999ef9fb6 [0,2,0,0,0,0|1,0,0]=3 10994 B11R0.109 CC[C@@H](O)CNCC(O)C(=O)O a68f99255e37d9c02b4fce1401a9e645 [0,2,0,0,0,0|1,0,0]=3 10995 B11R0.109 CC[C@@H](O)CNC[C@H](O)C(=O)O 5e89442e633e258b328c09016e61037c [0,2,0,0,0,0|1,0,0]=3 10996 B11R0.109 CC[C@H](C)CCOC(C)C(=O)C 4844ba72a6dfca0dc82ff61c6018cbb3 [0,2,0,0,0,0|2,0,0]=4 10997 B11R0.109 CC[C@H](C)CCOC(C)C(=O)N f6cc5b2f8832c621d0aa7ca236c1ff69 [0,2,0,0,0,0|2,0,0]=4 10998 B11R0.109 CC[C@H](C)CCOC(F)C(=O)N 1e548e4093295a9c4a652662ea38a468 [0,2,0,0,0,0|2,0,0]=4 10999 B11R0.109 CC[C@H](C)CCO[C@@H](C)C(=O)N 8d1a874071a3adfbe00b614b975a20e1 [0,2,0,0,0,0|2,0,0]=4 11000 B11R0.109 CC[C@H](C)CCO[C@H](C)C(=O)N 9da093fca2f27f8df94c952ccec24972 [0,2,0,0,0,0|2,0,0]=4 11001 B11R0.109 CC[C@H](C)CNCC(=O)C(=O)O 3969971cf9ad4f65927af75f9f973a5c [0,2,0,0,0,0|1,0,1]=4 11002 B11R0.109 CC[C@H](C)CNCC(C)C(=O)O 8d283cb933c8e28b97e00a949aee0c6b [0,2,0,0,0,0|1,0,0]=3 11003 B11R0.109 CC[C@H](C)CNCC(F)C(=O)O 62943e73d7b2817acbfbccb7fbcd0ce0 [0,2,0,0,0,0|1,0,0]=3 11004 B11R0.109 CC[C@H](C)CNCC(O)C(=O)O 9a15e22bfc06d1f9c6a88ff7c40457ef [0,2,0,0,0,0|1,0,0]=3 11005 B11R0.109 CC[C@H](C)CNC[C@@H](C)C(=O)O 23ca213f42ae44da64a620a97d9babc9 [0,2,0,0,0,0|1,0,0]=3 11006 B11R0.109 CC[C@H](C)CNC[C@@H](O)C(=O)O 06ada8664483c77c637cccfb4aeb32a9 [0,2,0,0,0,0|1,0,0]=3 11007 B11R0.109 CC[C@H](C)CNC[C@H](C)C(=O)O 9034e123267ad4dba0091ab43645e0c8 [0,2,0,0,0,0|1,0,0]=3 11008 B11R0.109 CC[C@H](C)CNC[C@H](O)C(=O)O c27b940e13c4ffef687801011e54ab7e [0,2,0,0,0,0|1,0,0]=3 11009 B11R0.109 CC[C@H](C)COCC(=O)C(=O)O 867d59397f504a52a4a08caa4b87965c [0,2,0,0,0,0|1,0,1]=4 11010 B11R0.109 CC[C@H](C)COCC(C)C(=O)C d9f34b5b6d2a5fc3065bcbb1cea10cf8 [0,2,0,0,0,0|2,0,0]=4 11011 B11R0.109 CC[C@H](C)COCC(C)C(=O)O 90f564598d2f9ddf8760d0bf6e684a85 [0,2,0,0,0,0|1,0,0]=3 11012 B11R0.109 CC[C@H](C)COC[C@@H](C)C(=O)O 774c459cfcb0827f604fb998d36bb67f [0,2,0,0,0,0|1,0,0]=3 11013 B11R0.109 CC[C@H](C)COC[C@H](C)C(=O)O 8afcfaa8e5b54d3e5a63eb776126b21e [0,2,0,0,0,0|1,0,0]=3 11014 B11R0.109 COC(C)CNCC(C)C(=O)O 1c376536455cc06b1fb1f40bcbb05c6e [0,2,0,0,0,0|2,0,0]=4 11015 B11R0.109 COC(C)CNCC(F)C(=O)O f2c4e40e77807bc31612a307274a4962 [0,2,0,0,0,0|2,0,0]=4 11016 B11R0.109 COC(C)CNCC(O)C(=O)O a003bb02f3e9f7025255702d705e2b5a [0,2,0,0,0,0|2,0,0]=4 11017 B11R0.109 COC(C)CNC[C@@H](C)C(=O)O b1c1be1c30dabe634635215d9ae36bb6 [0,2,0,0,0,0|2,0,0]=4 11018 B11R0.109 COC(C)CNC[C@@H](O)C(=O)O 8762a32346314c07ee7d3ded2beda7d8 [0,2,0,0,0,0|2,0,0]=4 11019 B11R0.109 COC(C)CNC[C@H](C)C(=O)O 8e10dc738759730235f1eb4a2068d809 [0,2,0,0,0,0|2,0,0]=4 11020 B11R0.109 COC(C)CNC[C@H](O)C(=O)O 95197cc4c8228ea68d025dc8df840044 [0,2,0,0,0,0|2,0,0]=4 11021 B11R0.109 COC(C)COCC(C)C(=O)O 221774e1fc35fadc00bf2c6d333bfc7f [0,2,0,0,0,0|2,0,0]=4 11022 B11R0.109 COC(C)COC[C@@H](C)C(=O)O 8bb5ded424fad789f7a48c66b466aab5 [0,2,0,0,0,0|2,0,0]=4 11023 B11R0.109 COC(C)COC[C@H](C)C(=O)O 8b236097d3dae55c223fbb0a5d6d6f2d [0,2,0,0,0,0|2,0,0]=4 11024 B11R0.109 CO[C@@H](C)CNCC(C)C(=O)O ed81fad1f5516b9de8657282069d3477 [0,2,0,0,0,0|2,0,0]=4 11025 B11R0.109 CO[C@@H](C)CNCC(F)C(=O)O 118bf4c253055c532793745016bc84af [0,2,0,0,0,0|2,0,0]=4 11026 B11R0.109 CO[C@@H](C)CNCC(O)C(=O)O a10f03e3d7e98ecd2c62ab262599bbb4 [0,2,0,0,0,0|2,0,0]=4 11027 B11R0.109 CO[C@@H](C)CNC[C@@H](C)C(=O)O 328777ddfeabcebf4993e63e5a02696c [0,2,0,0,0,0|2,0,0]=4 11028 B11R0.109 CO[C@@H](C)CNC[C@@H](O)C(=O)O 39456a59dfcaa144a7fdbf302a818d37 [0,2,0,0,0,0|2,0,0]=4 11029 B11R0.109 CO[C@@H](C)CNC[C@H](C)C(=O)O 6a296190ee6b526d915a3c0f46548e6e [0,2,0,0,0,0|2,0,0]=4 11030 B11R0.109 CO[C@@H](C)CNC[C@H](O)C(=O)O 8da3bc5c3fdf25f554f5d5fb76db3b11 [0,2,0,0,0,0|2,0,0]=4 11031 B11R0.109 CO[C@@H](C)COCC(C)C(=O)O f1f6e8275b9fbf86d558b9c8a978a401 [0,2,0,0,0,0|2,0,0]=4 11032 B11R0.109 CO[C@@H](C)COC[C@@H](C)C(=O)O e24b7f1a3a9730d95221eb3fb81d4693 [0,2,0,0,0,0|2,0,0]=4 11033 B11R0.109 CO[C@@H](C)COC[C@H](C)C(=O)O 7d036e6237e562aca316161567186205 [0,2,0,0,0,0|2,0,0]=4 11034 B11R0.109 CO[C@H](C)CNCC(C)C(=O)O 985c948912e53f1e7521335a8cc50fa6 [0,2,0,0,0,0|2,0,0]=4 11035 B11R0.109 CO[C@H](C)CNCC(F)C(=O)O ae2ee48f4a3315c7fd02c28c49384f90 [0,2,0,0,0,0|2,0,0]=4 11036 B11R0.109 CO[C@H](C)CNCC(O)C(=O)O 68c18433f19611488951464577465c80 [0,2,0,0,0,0|2,0,0]=4 11037 B11R0.109 CO[C@H](C)CNC[C@@H](C)C(=O)O c02bb250b198a261e393d9129521a930 [0,2,0,0,0,0|2,0,0]=4 11038 B11R0.109 CO[C@H](C)CNC[C@@H](O)C(=O)O 05c65b3bc22da433812f8560421d6172 [0,2,0,0,0,0|2,0,0]=4 11039 B11R0.109 CO[C@H](C)CNC[C@H](C)C(=O)O f2d3d49b71db091ac44464d3058d9d26 [0,2,0,0,0,0|2,0,0]=4 11040 B11R0.109 CO[C@H](C)CNC[C@H](O)C(=O)O 3ab589c390b53fe8255dafd6e6cbbc0c [0,2,0,0,0,0|2,0,0]=4 11041 B11R0.109 CO[C@H](C)COCC(C)C(=O)O 654990ecc1574cf1a5fa175d318a338a [0,2,0,0,0,0|2,0,0]=4 11042 B11R0.109 CO[C@H](C)COC[C@@H](C)C(=O)O 75b2151e1a14ecc26b16791dab870dc6 [0,2,0,0,0,0|2,0,0]=4 11043 B11R0.109 CO[C@H](C)COC[C@H](C)C(=O)O dc5a860036ae4baac6762b97e7200a1a [0,2,0,0,0,0|2,0,0]=4 11044 B11R0.109 C[C@@H](CNCC(O)CF)C(=O)O fab39b0661e5539ab270167ab6276a0b [0,2,0,0,0,0|2,0,0]=4 11045 B11R0.109 C[C@@H](CNCC(O)CO)C(=O)O 5fdff20f2ecaa5092875a1bc912aa7c9 [0,2,0,0,0,0|2,0,0]=4 11046 B11R0.109 C[C@@H](CNC[C@@H](O)CO)C(=O)O 790439e22549f6b5cf1531684b8a1e6a [0,2,0,0,0,0|2,0,0]=4 11047 B11R0.109 C[C@@H](CNC[C@H](O)CO)C(=O)O f6033a31bffc67abd8a342728ffe58c2 [0,2,0,0,0,0|2,0,0]=4 11048 B11R0.109 C[C@@H](CO)CCN[C@@H](C)C(=O)O ff59426de85e5cd1cb5c6df1e72a9ce2 [0,2,0,0,0,0|2,0,0]=4 11049 B11R0.109 C[C@@H](CO)CCN[C@H](C)C(=O)O c485acbef4bd2c71c54ca06807b106f4 [0,2,0,0,0,0|2,0,0]=4 11050 B11R0.109 C[C@@H](CO)CNCC(F)C(=O)O 632e67eba3db400769b05fca05d6d628 [0,2,0,0,0,0|2,0,0]=4 11051 B11R0.109 C[C@@H](CO)CNCC(O)C(=O)O 8ba87a812fb751d40756cffa3f46ba09 [0,2,0,0,0,0|2,0,0]=4 11052 B11R0.109 C[C@@H](CO)CNC[C@@H](C)C(=O)O 38885abd56591a1f465f28503a8a8e09 [0,2,0,0,0,0|2,0,0]=4 11053 B11R0.109 C[C@@H](CO)CNC[C@@H](O)C(=O)O 7ea77c2fdbb37c92f0d448444f28af24 [0,2,0,0,0,0|2,0,0]=4 11054 B11R0.109 C[C@@H](CO)CNC[C@H](C)C(=O)O a6ace3f33efc733a43bea5f6f121428b [0,2,0,0,0,0|2,0,0]=4 11055 B11R0.109 C[C@@H](CO)CNC[C@H](O)C(=O)O e81e583cfe13b9f50723563c5d39a996 [0,2,0,0,0,0|2,0,0]=4 11056 B11R0.109 C[C@@H](CO)NCCC(F)C(=O)O 4e8793b0596c2141f335941fd90bc8a7 [0,2,0,0,0,0|2,0,0]=4 11057 B11R0.109 C[C@@H](CO)NCCC(O)C(=O)O 4c52dee66896c05594d3d8d204d4bef5 [0,2,0,0,0,0|2,0,0]=4 11058 B11R0.109 C[C@@H](CO)NCC[C@H](O)C(=O)O 3323cd9841514c322cae1346b493c56e [0,2,0,0,0,0|2,0,0]=4 11059 B11R0.109 C[C@@H](COCC(O)CO)C(=O)O 6edc779cc35af44a76d642db0b85f65f [0,2,0,0,0,0|2,0,0]=4 11060 B11R0.109 C[C@@H](COC[C@@H](O)CO)C(=O)O 14d0d2bfde85c8a871e4caae0727c938 [0,2,0,0,0,0|2,0,0]=4 11061 B11R0.109 C[C@@H](COC[C@H](O)CO)C(=O)O 939c8ea5c4d0b6fe5171aa5a786610cc [0,2,0,0,0,0|2,0,0]=4 11062 B11R0.109 C[C@@H](NCCC(O)CO)C(=O)O 806e9098ffb2836484483ab81b2b0920 [0,2,0,0,0,0|2,0,0]=4 11063 B11R0.109 C[C@H](CNCC(O)CF)C(=O)O 744fa93a40562a214011b1d13f76c5f0 [0,2,0,0,0,0|2,0,0]=4 11064 B11R0.109 C[C@H](CNCC(O)CO)C(=O)O 23dd12504b025c333c76683557df628a [0,2,0,0,0,0|2,0,0]=4 11065 B11R0.109 C[C@H](CNC[C@@H](O)CO)C(=O)O 7453aff1c034b354d3d29b6dc786faa8 [0,2,0,0,0,0|2,0,0]=4 11066 B11R0.109 C[C@H](CNC[C@H](O)CO)C(=O)O 5ed94b38556f5c46e00d0e9375306985 [0,2,0,0,0,0|2,0,0]=4 11067 B11R0.109 C[C@H](CO)CNCC(F)C(=O)O 912e1f5de4b7d51fa00bc8208462f7e4 [0,2,0,0,0,0|2,0,0]=4 11068 B11R0.109 C[C@H](CO)CNCC(O)C(=O)O 29ee19eaf2794344f2d9d0f25594d97d [0,2,0,0,0,0|2,0,0]=4 11069 B11R0.109 C[C@H](CO)CNC[C@@H](C)C(=O)O 78258a3ccf60d1c9f348dea457e2c106 [0,2,0,0,0,0|2,0,0]=4 11070 B11R0.109 C[C@H](CO)CNC[C@@H](O)C(=O)O 966261db5ad0ae19c135e544328b8ce3 [0,2,0,0,0,0|2,0,0]=4 11071 B11R0.109 C[C@H](CO)CNC[C@H](C)C(=O)O 1565ca008c2beb90f17afbd1b47e30de [0,2,0,0,0,0|2,0,0]=4 11072 B11R0.109 C[C@H](CO)CNC[C@H](O)C(=O)O 86444d7f39f80cb43bbcce979f73c769 [0,2,0,0,0,0|2,0,0]=4 11073 B11R0.109 C[C@H](CO)NCCC(F)C(=O)O ac8872ea1308f2fe99f927c12deb3e52 [0,2,0,0,0,0|2,0,0]=4 11074 B11R0.109 C[C@H](CO)NCCC(O)C(=O)O 85ba82b8af62cdb1a99a9cafe74fad96 [0,2,0,0,0,0|2,0,0]=4 11075 B11R0.109 C[C@H](CO)NCC[C@H](O)C(=O)O 43b1da80c1ef5dc9070e3716f5f703c1 [0,2,0,0,0,0|2,0,0]=4 11076 B11R0.109 C[C@H](COCC(O)CO)C(=O)O c9555cd918b1d71b73296d51389ccd11 [0,2,0,0,0,0|2,0,0]=4 11077 B11R0.109 C[C@H](COC[C@@H](O)CO)C(=O)O b76957535ac16dc5e86fe83e70a311f0 [0,2,0,0,0,0|2,0,0]=4 11078 B11R0.109 C[C@H](COC[C@H](O)CO)C(=O)O d5bd89d97a94cdfdaef121a0d8b26639 [0,2,0,0,0,0|2,0,0]=4 11079 B11R0.109 C[C@H](NCCC(O)CO)C(=O)O 23e8c7cd752d836bf8427c34da528927 [0,2,0,0,0,0|2,0,0]=4 11080 B11R0.109 O=C(O)C(F)CNCC(O)CF 15cc517fbdd63ad7d6ce0858231cebc7 [0,2,0,0,0,0|2,0,0]=4 11081 B11R0.109 O=C(O)C(F)CNCC(O)CO 047424101db770813c42ea66c7e07de2 [0,2,0,0,0,0|2,0,0]=4 11082 B11R0.109 O=C(O)C(F)CNC[C@@H](O)CO 4edec9dc5fd54db0253261266770a5a5 [0,2,0,0,0,0|2,0,0]=4 11083 B11R0.109 O=C(O)C(F)CNC[C@H](O)CO bc4a2bb9a3a320975c48812016b63d02 [0,2,0,0,0,0|2,0,0]=4 11084 B11R0.109 O=C(O)C(O)CNCC(Br)CBr d69602eaabbe4e77822897348a737f2e [0,2,0,0,0,0|2,0,0]=4 11085 B11R0.109 O=C(O)C(O)CNCC(F)CO 5c8f558251f404f22750f4d3fd8fa5db [0,2,0,0,0,0|2,0,0]=4 11086 B11R0.109 O=C(O)C(O)CNCC(O)CF 5526d89a523cbbb2de98639070d12edf [0,2,0,0,0,0|2,0,0]=4 11087 B11R0.109 O=C(O)C(O)CNCC(O)CO d6260d40d7679d3a18e7bafc8301b2f1 [0,2,0,0,0,0|2,0,0]=4 11088 B11R0.109 O=C(O)C(O)CNC[C@@H](F)CO f16e40407c8a8d747a2603f8c40ed88d [0,2,0,0,0,0|2,0,0]=4 11089 B11R0.109 O=C(O)C(O)CNC[C@@H](O)CO 514116af33664f134d2998bd89fc9839 [0,2,0,0,0,0|2,0,0]=4 11090 B11R0.109 O=C(O)C(O)CNC[C@H](F)CO 0669e09b389a705004d5744eebc53f10 [0,2,0,0,0,0|2,0,0]=4 11091 B11R0.109 O=C(O)C(O)CNC[C@H](O)CO aae5e7ec81144a303f4858cf4da038ad [0,2,0,0,0,0|2,0,0]=4 11092 B11R0.109 O=C(O)[C@@H](O)CNCC(Br)CBr 85e8559ac912354ad5b088d50560d392 [0,2,0,0,0,0|2,0,0]=4 11093 B11R0.109 O=C(O)[C@@H](O)CNCC(F)CO 602aeb40de261174919836c5dfdbbfd1 [0,2,0,0,0,0|2,0,0]=4 11094 B11R0.109 O=C(O)[C@@H](O)CNCC(O)CF 9b874195728eebdbb0806f37ca9d1773 [0,2,0,0,0,0|2,0,0]=4 11095 B11R0.109 O=C(O)[C@@H](O)CNCC(O)CO f1f5ef599e2034483b4bdbf6e0cbc83f [0,2,0,0,0,0|2,0,0]=4 11096 B11R0.109 O=C(O)[C@@H](O)CNC[C@@H](F)CO bbb8fcd1b88e20ce26b339ce0240dbbe [0,2,0,0,0,0|2,0,0]=4 11097 B11R0.109 O=C(O)[C@@H](O)CNC[C@@H](O)CO c94c6ef988bd8088466c0dd3d787e39f [0,2,0,0,0,0|2,0,0]=4 11098 B11R0.109 O=C(O)[C@@H](O)CNC[C@H](F)CO 6a9b56e5facb27c7fb2f17ee0107ff99 [0,2,0,0,0,0|2,0,0]=4 11099 B11R0.109 O=C(O)[C@@H](O)CNC[C@H](O)CO 22f50ac7587c7a94c6405254c794b952 [0,2,0,0,0,0|2,0,0]=4 11100 B11R0.109 O=C(O)[C@H](O)CNCC(O)CF c9cb48b4a0c3797cd4598b562f84ccc2 [0,2,0,0,0,0|2,0,0]=4 11101 B11R0.109 O=C(O)[C@H](O)CNCC(O)CO 572199ae0db04050c120c99d2f6708d0 [0,2,0,0,0,0|2,0,0]=4 11102 B11R0.109 O=C(O)[C@H](O)CNC[C@@H](O)CO 3ac2f78853e65498ec9e643f2b5af0e6 [0,2,0,0,0,0|2,0,0]=4 11103 B11R0.109 O=C(O)[C@H](O)CNC[C@H](O)CO e7dce7e40342724cb5f172216aefa73f [0,2,0,0,0,0|2,0,0]=4 11104 B11R0.127 CC(C)(CF)CNCCC(=O)O 4f548228e950c36d8eaa9b2dcde58048 [0,2,0,0,0,0|2,0,0]=4 11105 B11R0.127 CC(C)(CF)COCCC(=O)O 458869b9e3d71ef35cd66205c1044cd1 [0,2,0,0,0,0|2,0,0]=4 11106 B11R0.127 CC(C)(CO)CNCCC(=O)O 4a2116607b804daeb589aa4bd9b3a7d0 [0,2,0,0,0,0|2,0,0]=4 11107 B11R0.127 CC(C)(CO)NCCCC(=O)O 7a2fb89c6b9acbe89b26bccb21bc37cd [0,2,0,0,0,0|2,0,0]=4 11108 B11R0.127 CCC(C)(C)CCNCC(=O)C e513a62402cc3c15ad49e99485e92913 [0,2,0,0,0,0|2,0,0]=4 11109 B11R0.127 CCC(C)(C)CCNCC(=O)N 77f36aefbc0616024f33114eb242de87 [0,2,0,0,0,0|2,0,0]=4 11110 B11R0.127 CCC(C)(C)CCNCC(=O)O 4a548ae0e1a1deeb28b3f18755296df2 [0,2,0,0,0,0|1,0,0]=3 11111 B11R0.127 CCC(C)(C)CCOCC(=O)C 5e42d49136a64f8f67e374dc1d038b3a [0,2,0,0,0,0|2,0,0]=4 11112 B11R0.127 CCC(C)(C)CCOCC(=O)N c967b5332a5da7863d7a95228d357641 [0,2,0,0,0,0|2,0,0]=4 11113 B11R0.127 CCC(C)(C)CCOCC(=O)O 1f116ec9dd3e500114b9de1a9098f5fa [0,2,0,0,0,0|1,0,0]=3 11114 B11R0.127 CCC(C)(C)CCOCS(=O)O 2c88d0dee621daf6376e7b75e7dcbaa0 [0,2,0,0,0,0|2,0,0]=4 11115 B11R0.127 CCC(C)(C)CNCCC(=O)C 15b60926bcabc2cb29d40703356b4512 [0,2,0,0,0,0|2,0,0]=4 11116 B11R0.127 CCC(C)(C)CNCCC(=O)N 3a5d4422f9ac8883f250cf5ef7c39c77 [0,2,0,0,0,0|2,0,0]=4 11117 B11R0.127 CCC(C)(C)CNCCC(=O)O da6cc53ad28d7981754058e533d0be27 [0,2,0,0,0,0|1,0,0]=3 11118 B11R0.127 CCC(C)(C)NCCCC(=O)C a139768b10b0d43d06f29321950b4416 [0,2,0,0,0,0|2,0,0]=4 11119 B11R0.127 CCC(C)(C)NCCCC(=O)N 1737b968c428683e1cbe66d236a16523 [0,2,0,0,0,0|2,0,0]=4 11120 B11R0.127 CCC(C)(O)CNCCC(=O)C 839e577a0188c555650aebe51d2e662d [0,2,0,0,0,0|2,0,0]=4 11121 B11R0.127 CCC(C)(O)CNCCC(=O)N 06247758263fe69bd5e10cddc49ddbf6 [0,2,0,0,0,0|2,0,0]=4 11122 B11R0.127 CCC(C)(O)CNCCC(=O)O a9bcac6e4a6d40d4ee5849a1bf5b7bb8 [0,2,0,0,0,0|1,0,0]=3 11123 B11R0.127 CCC(F)(F)COCCC(=O)C 374d427acab5d0976de57bd09d2bd079 [0,2,0,0,0,0|2,0,0]=4 11124 B11R0.127 CCC(F)(F)COCCC(=O)N 55995c4a7b764a22679dcc8243cdfde0 [0,2,0,0,0,0|2,0,0]=4 11125 B11R0.127 CCC(F)(F)COCCC(=O)O 0efc97fa93e30dccaced617f55c249d4 [0,2,0,0,0,0|1,0,0]=3 11126 B11R0.127 CCS(=O)(=O)CCNCC(=O)O f950df842b6a433579e9efe3433e9f5b [0,2,0,0,0,0|2,0,0]=4 11127 B11R0.127 COC(C)(C)CCNCC(=O)O 61e49e26e2dfb1f50c2449c1d941ccf0 [0,2,0,0,0,0|2,0,0]=4 11128 B11R0.127 COC(C)(C)CCOCC(=O)O c22a0d4601e81c4d03beb02f06bfacf7 [0,2,0,0,0,0|2,0,0]=4 11129 B11R0.127 COC(C)(C)CNCCC(=O)O c73a5666f5afaa70d84ea126d5e2b5cd [0,2,0,0,0,0|2,0,0]=4 11130 B11R0.127 COC(C)(C)COCCC(=O)O 35ec855d2b3e67bae37e294063ba0b2e [0,2,0,0,0,0|2,0,0]=4 11131 B11R0.127 O=C(O)CNCCC(F)(F)CO 6148fb01a7a2b351b25a95245ac49b8d [0,2,0,0,0,0|2,0,0]=4 11132 B11R0.4 C#CCC(=O)NCCCCCC 78d69b0891860d5affdc4888b8ef7d70 [0,2,0,0,0,0|2,0,0]=4 11133 B11R0.4 C/C=C/C(=O)NCCCCCC 377f28d02111af193298308d162007ca [0,2,0,0,0,0|2,0,0]=4 11134 B11R0.4 C=CCC(=O)NCCCCCC d46661bf423214425230279ca4e72208 [0,2,0,0,0,0|2,0,0]=4 11135 B11R0.4 C=COC(=O)CNCCCCC e6c41c963035bf66eddcbe37fd9bae11 [0,2,0,0,0,0|1,0,0]=3 11136 B11R0.4 C=COC(=O)CNCCCCCl 0ff31f1e48c7991e055c9a8d3d54fd9d [0,2,0,0,0,0|2,0,0]=4 11137 B11R0.4 C=COC(=O)CNCCCCO 9f0f5ef49aa53f5c4ddd14431f706631 [0,2,0,0,0,0|2,0,0]=4 11138 B11R0.4 C=COC(=O)CNCCCCS d8dd379b9a0020703e3ef609cffb6446 [0,2,0,0,0,0|2,0,0]=4 11139 B11R0.4 C=COC(=O)CNCCCOC 2c3a5189f1039eb0d03a45832fa53ad3 [0,2,0,0,0,0|2,0,0]=4 11140 B11R0.4 C=COC(=O)CNCCCSC 12b94d810764f379ab548944bcd40375 [0,2,0,0,0,0|2,0,0]=4 11141 B11R0.4 C=COC(=O)CNCCOCC 6a6f59f06e19816424f1c1e9dc374b82 [0,2,0,0,0,0|2,0,0]=4 11142 B11R0.4 C=COC(=O)CNCCSCC d1306ecac350ff8958bec696ac819bdc [0,2,0,0,0,0|2,0,0]=4 11143 B11R0.4 C=COC(=O)COCCCCC 70588743801f5a1d2b1ef51b7eaba200 [0,2,0,0,0,0|1,0,0]=3 11144 B11R0.4 C=COC(=O)COCCCCF 8d4fc8d68e0ff80991dce3a548274292 [0,2,0,0,0,0|2,0,0]=4 11145 B11R0.4 C=COC(=O)COCCCCS 68b1af5c49c206ccc51b47671520446d [0,2,0,0,0,0|2,0,0]=4 11146 B11R0.4 C=COC(=O)COCCCOC 330fc361f5a558c4fa93e3167f886824 [0,2,0,0,0,0|2,0,0]=4 11147 B11R0.4 C=COC(=O)COCCCSC 6650fd235270d2e359b33bbbd5d03a47 [0,2,0,0,0,0|2,0,0]=4 11148 B11R0.4 C=COC(=O)COCCOCC 53b564d36d2efeae2b73365a22bf8591 [0,2,0,0,0,0|2,0,0]=4 11149 B11R0.4 C=COC(=O)COCCSCC 3f56691a43c2cd3f1d9d92c65a3e5be2 [0,2,0,0,0,0|2,0,0]=4 11150 B11R0.4 CC#CC(=O)NCCCCCC ee8dd4151d0a744df992b430667c9ab8 [0,2,0,0,0,0|2,0,0]=4 11151 B11R0.4 CCCCCCCC(=O)NC#N df7abb6ddc6eb1895b480e1234379408 [0,2,0,0,0,0|1,0,0]=3 11152 B11R0.4 CCCCCCCC(C)OCC 55dc2743b0b446cf9a6056de2b74c617 [0,2,0,0,0,0|1,0,1]=4 11153 B11R0.4 CCCCCCCC(C)OCF 3fba61538d49d98b37b9f07a88c7f983 [0,2,0,0,0,0|1,0,1]=4 11154 B11R0.4 CCCCCCCN(C)CC=O 2ce968d3977ae174a926bfa45881d258 [0,2,0,0,0,0|2,0,0]=4 11155 B11R0.4 CCCCCCCN(C)CCO 4b82b57c2e27ee478b4db099376fba2f [0,2,0,0,0,0|2,0,0]=4 11156 B11R0.4 CCCCCCCN(C)COC 6b1c941d11ed516810c29fb4806a97a3 [0,2,0,0,0,0|2,0,0]=4 11157 B11R0.4 CCCCCCC[C@H](C)NC=O c442fbbe6ed7aa25c681c876729d7560 [0,2,0,0,0,0|1,0,1]=4 11158 B11R0.4 CCCCCCC[C@H](C)NCO b897aee6051defb04f5f6cf3c8a31ab5 [0,2,0,0,0,0|1,0,1]=4 11159 B11R0.4 CCCCCCNC(=O)/C=C/Br b3a483ec9e07d392a823769ab58a8a3f [0,2,0,0,0,0|2,0,0]=4 11160 B11R0.4 CCCCCCNC(=O)/C=C/Cl 0edfcd4abbed3c279b5a5db1db683b0f [0,2,0,0,0,0|2,0,0]=4 11161 B11R0.4 CCCCCCNC(=O)/C=C/I edd8beb2074c6ebaf2691867fa1dead1 [0,2,0,0,0,0|2,0,0]=4 11162 B11R0.4 CCCCCCNC(=O)/C=C\Br d4f5f0432c5532a5be846dba2748e2db [0,2,0,0,0,0|2,0,0]=4 11163 B11R0.4 CCCCCCNC(=O)/C=C\Cl 131b728cc8ab5e32a238bba599ec081f [0,2,0,0,0,0|2,0,0]=4 11164 B11R0.4 CCCCCCNC(=O)/C=C\I 24147ed224973445dd6e9b3cbfacdebc [0,2,0,0,0,0|2,0,0]=4 11165 B11R0.4 CCCCCCNC(=O)C#CBr e18cc468271d784ec3ca516fc13f33c3 [0,2,0,0,0,0|2,0,0]=4 11166 B11R0.4 CCCCCCNC(=O)C=CBr b76c2faa6995ab790eec9636b8e3d045 [0,2,0,0,0,0|2,0,0]=4 11167 B11R0.4 CCCCCCNC(=O)C=CI 8b16a6f00c2b238f2a28d3ec870e0485 [0,2,0,0,0,0|2,0,0]=4 11168 B11R0.4 CCCCCCNC(=O)CC#N 3a118a916d898cecbd36d1f2947583f3 [0,2,0,0,0,0|2,0,0]=4 11169 B11R0.4 CCCCCCNC(=O)CC=O a7f1da0dd2cd94dffb8186943176c7dc [0,2,0,0,0,0|1,0,1]=4 11170 B11R0.4 CCCCCCNC(=O)CCC 86ff0f5e9c808359785c4d555716a0c6 [0,2,0,0,0,0|2,0,0]=4 11171 B11R0.4 CCCCCCNC(=O)CCF 0e16ccb662e7e0ac93051a877f48470e [0,2,0,0,0,0|2,0,0]=4 11172 B11R0.4 CCCCCCNC(=O)CCO c087b3675c7cb5dcfde9fa6dcbdb3e38 [0,2,0,0,0,0|1,0,0]=3 11173 B11R0.4 CCCCCCNC(=O)CCS e76f3d6d22ed4cd16bf2a3f98e737a89 [0,2,0,0,0,0|1,1,0]=4 11174 B11R0.4 CCCCCCNC(=O)COC 714e5a0281995088b6f3f1f962d227b2 [0,2,0,0,0,0|1,0,0]=3 11175 B11R0.4 CCCCCCNC(=O)CON 66d10e7cd363894c05bf81dbb602d532 [0,2,0,0,0,0|1,0,0]=3 11176 B11R0.4 CCCCCCNC(=O)CSC c9cc6aa932351aac48e1944e9ae4f49e [0,2,0,0,0,0|1,1,0]=4 11177 B11R0.4 CCCCCCNC(=O)NC#N 452fa640e93ed079413d89508f83cb27 [0,2,0,0,0,0|2,0,0]=4 11178 B11R0.4 CCCCCNCC(=O)CCC 5c0a36c9da6990262983584768700e06 [0,2,0,0,0,0|2,0,0]=4 11179 B11R0.4 CCCCCNCC(=O)COC 502d17c7ceaf127c86a16e7809b966c6 [0,2,0,0,0,0|1,0,0]=3 11180 B11R0.4 CCCCCNCC(=O)NCC 8d174055167832aa82e7a62942ebadb3 [0,2,0,0,0,0|2,0,0]=4 11181 B11R0.4 CCCCCNCC(=O)NCO aaf498b21bb4f2353489f1e4167ee52e [0,2,0,0,0,0|1,0,0]=3 11182 B11R0.4 CCCCCNCC(=O)OCC 4304655bf379f4366dd088701cf7e21c [0,2,0,0,0,0|1,0,0]=3 11183 B11R0.4 CCCCCOCC(=O)CCC 8262177c32a9450a29113f02c3e40c8e [0,2,0,0,0,0|2,0,0]=4 11184 B11R0.4 CCCCCOCC(=O)NCC 7e231127cc82282dbbf3308dc7e1564c [0,2,0,0,0,0|2,0,0]=4 11185 B11R0.4 CCCCCOCC(=O)OCC f64a848703599a93df3dbf25be548f27 [0,2,0,0,0,0|1,0,0]=3 11186 B11R0.4 CCCCNCCC(=O)NCC 7c1ce674cd02b76f256893a6da664746 [0,2,0,0,0,0|2,0,0]=4 11187 B11R0.4 CCCCNCCC(=O)OCC dc7dea90b346ecbda1f0d157b0c94f32 [0,2,0,0,0,0|1,0,0]=3 11188 B11R0.4 CCCCNCOC(=O)OCC ca409d7539df0c74dbd07384dd478520 [0,2,0,0,0,0|2,0,0]=4 11189 B11R0.4 CCCCOCCC(=O)NC#N d51a2df9b224068b0f05dc192a8cac34 [0,2,0,0,0,0|2,0,0]=4 11190 B11R0.4 CCCCOCCC(=O)NCC 2cf33a536e71aa672563b2e6c9b353ba [0,2,0,0,0,0|2,0,0]=4 11191 B11R0.4 CCCCOCCC(=O)OCC 95ad894d01602c07de1d2b4aae4a0e6e [0,2,0,0,0,0|1,0,0]=3 11192 B11R0.4 CCCCOCOC(=O)OCC f9445a123e97e58df2bd304b13c696ca [0,2,0,0,0,0|2,0,0]=4 11193 B11R0.4 CCCNCCCC(=O)OCC f6461f8e22f3d933186943d4b183108e [0,2,0,0,0,0|1,0,0]=3 11194 B11R0.4 CCCOCCCC(=O)OCC 44f3c08715c24b28a3685ca7f9c36e30 [0,2,0,0,0,0|1,0,0]=3 11195 B11R0.4 CCCOCCNC(=O)CCO 6d308239c94ac8e860e2d79889c8facb [0,2,0,0,0,0|2,0,0]=4 11196 B11R0.4 CCCOCCNC(=O)COC 6067c71ef34c0399492ad8122c06202c [0,2,0,0,0,0|2,0,0]=4 11197 B11R0.4 CCCOCCNC(=O)CON a7918d286952c9dd1f121c3571c9c3dc [0,2,0,0,0,0|2,0,0]=4 11198 B11R0.4 CCNCCCCS(=O)CCO 76bcafe4a552308121ef9178c2962f25 [0,2,0,0,0,0|2,0,0]=4 11199 B11R0.4 CCOC(=O)CCCCOCF 1e1261add10b19284371a248568d711b [0,2,0,0,0,0|2,0,0]=4 11200 B11R0.4 CCOC(=O)CCCNCCBr 60bcbe922041739189bc281fb6a2bb23 [0,2,0,0,0,0|2,0,0]=4 11201 B11R0.4 CCOC(=O)CCCNCCF a8ca23c887e3f27d9ce4ce70ce8ce85c [0,2,0,0,0,0|2,0,0]=4 11202 B11R0.4 CCOC(=O)CCCNCCI 4edd1ec513d467813532911b2cbedef7 [0,2,0,0,0,0|2,0,0]=4 11203 B11R0.4 CCOC(=O)CCCNCCO 6cab9fdd8c1a3159e64bec0608483f43 [0,2,0,0,0,0|2,0,0]=4 11204 B11R0.4 CCOC(=O)CCCNCCS bf3d906c2feaf34f02a7b4012db66253 [0,2,0,0,0,0|2,0,0]=4 11205 B11R0.4 CCOC(=O)CCCNCOC 09a4cb9ed4f5f8b605e172f8b0db0671 [0,2,0,0,0,0|2,0,0]=4 11206 B11R0.4 CCOC(=O)CCCNCSC d614302bf0ca880f0177d2ffc0476d8a [0,2,0,0,0,0|2,0,0]=4 11207 B11R0.4 CCOC(=O)CCCOCCF 909acc390bbb1ceea04a19919f52152b [0,2,0,0,0,0|2,0,0]=4 11208 B11R0.4 CCOC(=O)CCCOCCS 78b20295e211bf8850dff862a4729f37 [0,2,0,0,0,0|2,0,0]=4 11209 B11R0.4 CCOC(=O)CCCOCOC 5bf104d8710e6b32f35db6c9e133e980 [0,2,0,0,0,0|2,0,0]=4 11210 B11R0.4 CCOC(=O)CCCOCSC a236b3de67b8591907dc1349d6aacabc [0,2,0,0,0,0|2,0,0]=4 11211 B11R0.4 CCOC(=O)CCNCCCCl a89c084bdffb1d422d065823b9073077 [0,2,0,0,0,0|2,0,0]=4 11212 B11R0.4 CCOC(=O)CCNCCCF 70a1dc79e0e4bc47520362815d5c0544 [0,2,0,0,0,0|2,0,0]=4 11213 B11R0.4 CCOC(=O)CCNCCCO 51aaffebe3df7434f9d32c43a0c6dace [0,2,0,0,0,0|2,0,0]=4 11214 B11R0.4 CCOC(=O)CCNCCCS 5bcc16b3c3f0425f0080dc188f736d03 [0,2,0,0,0,0|2,0,0]=4 11215 B11R0.4 CCOC(=O)CCNCCOC 1c46d7d7fb66a967176c3228bbbad3fb [0,2,0,0,0,0|2,0,0]=4 11216 B11R0.4 CCOC(=O)CCNCCSC aa9be64800f205656b7a4f74e69a29d3 [0,2,0,0,0,0|2,0,0]=4 11217 B11R0.4 CCOC(=O)CCOCCCF a7be7eb6d4bf413eef8e017143e3f700 [0,2,0,0,0,0|2,0,0]=4 11218 B11R0.4 CCOC(=O)CCOCCCS f6284e96b38ea040626353532b55676c [0,2,0,0,0,0|2,0,0]=4 11219 B11R0.4 CCOC(=O)CCOCCOC 5eab465898645a5ae67f5c769be3f00c [0,2,0,0,0,0|2,0,0]=4 11220 B11R0.4 CCOC(=O)CCOCCSC cba55ac5252fa9caa5a0ba30c08c4f44 [0,2,0,0,0,0|2,0,0]=4 11221 B11R0.4 CCOC(=O)CNCCCCCl 296a499f8be352bf681ae9c7effc53de [0,2,0,0,0,0|2,0,0]=4 11222 B11R0.4 CCOC(=O)CNCCCCF f53911aa8d81b2451a539d276eea2100 [0,2,0,0,0,0|2,0,0]=4 11223 B11R0.4 CCOC(=O)CNCCCCO 5567fb2e0fc75fd72e36e84016c9b7ee [0,2,0,0,0,0|2,0,0]=4 11224 B11R0.4 CCOC(=O)CNCCCCS 04305ddf2d4b9a89f1f8710f12ab691d [0,2,0,0,0,0|2,0,0]=4 11225 B11R0.4 CCOC(=O)CNCCCOC 24714c2c7807ed3ce35740638d7e471f [0,2,0,0,0,0|2,0,0]=4 11226 B11R0.4 CCOC(=O)CNCCCSC b297861fcb32dc5e0d19d3c9a20bab5c [0,2,0,0,0,0|2,0,0]=4 11227 B11R0.4 CCOC(=O)CNCCSCC ab73db73736783d81dfec5042e756f02 [0,2,0,0,0,0|2,0,0]=4 11228 B11R0.4 CCOC(=O)COCCCCF bdd3130414d7bb52901d2af99d6baad4 [0,2,0,0,0,0|2,0,0]=4 11229 B11R0.4 CCOC(=O)COCCCCS d9f6c265a2fd8cb1d0d139c1fd8ea40e [0,2,0,0,0,0|2,0,0]=4 11230 B11R0.4 CCOC(=O)COCCCOC eb98c0daf8901cd4eec41b84833eccbf [0,2,0,0,0,0|2,0,0]=4 11231 B11R0.4 CCOC(=O)COCCCSC 00a233a412e6525cdc70bdadeb0a8d89 [0,2,0,0,0,0|2,0,0]=4 11232 B11R0.4 CCOC(=O)COCCSCC 0d930b0adeba2e697fe84aabdd6723e8 [0,2,0,0,0,0|2,0,0]=4 11233 B11R0.4 CCOCCCCC(=O)NC#N 04f5c8fbeccb206bbe80b131d96f3f15 [0,2,0,0,0,0|2,0,0]=4 11234 B11R0.4 CCOCCCCC(=O)OCC dff7da0a71f6e7070ea70a6d5afe214a [0,2,0,0,0,0|1,0,0]=3 11235 B11R0.4 CCOCCCNC(=O)CCO 8acfd0c25451d107aefdb0a60f29f631 [0,2,0,0,0,0|2,0,0]=4 11236 B11R0.4 CCOCCCNC(=O)COC 70a73149310d8c3f110d5cb9b03dbd40 [0,2,0,0,0,0|2,0,0]=4 11237 B11R0.4 CCOCCCNC(=O)CON 622a429aad3eb288333e392a8a196e9b [0,2,0,0,0,0|2,0,0]=4 11238 B11R0.4 CCOCCNCC(=O)COC fdb8505df54fbba3c2adf0cfb62df184 [0,2,0,0,0,0|2,0,0]=4 11239 B11R0.4 CCOCCNCC(=O)NCO 730498886a0a6d5f202e71217a4546d0 [0,2,0,0,0,0|2,0,0]=4 11240 B11R0.4 CCOCCNCC(=O)OCC 3eef08623d91f6c723acaf832f2ae8de [0,2,0,0,0,0|2,0,0]=4 11241 B11R0.4 CCOCCOCC(=O)COC dbb7b3dd5ddf63d54f30b38b4ecaf7c8 [0,2,0,0,0,0|2,0,0]=4 11242 B11R0.4 CCOCCOCC(=O)OCC 1e47a791ce24a3105a78deacbb6e4ae7 [0,2,0,0,0,0|2,0,0]=4 11243 B11R0.4 CCOCNCCC(=O)OCC e0a0602d211c58d51b802fc20f7123fa [0,2,0,0,0,0|2,0,0]=4 11244 B11R0.4 CCOCOCCC(=O)OCC adf258b99474a5da1b50ec3aeed30c5b [0,2,0,0,0,0|2,0,0]=4 11245 B11R0.4 CCSCCNCC(=O)COC 6e155effc108796e28a3252eae7ac084 [0,2,0,0,0,0|2,0,0]=4 11246 B11R0.4 CCSCCNCC(=O)NCO a39447c9d4a5e89c573fbf072b6699ae [0,2,0,0,0,0|2,0,0]=4 11247 B11R0.4 CCSCCOCC(=O)COC 6b7424a0912b8c7461eacd3ba1762ba5 [0,2,0,0,0,0|2,0,0]=4 11248 B11R0.4 COCC(=O)CNCCCCCl 94890e0df7382ac64c28586919cd3948 [0,2,0,0,0,0|2,0,0]=4 11249 B11R0.4 COCC(=O)CNCCCCS 519234dc4566e81da37f72e235238ff5 [0,2,0,0,0,0|2,0,0]=4 11250 B11R0.4 COCC(=O)CNCCCSC aaa4a34c6a0fc86eef3dabc0a7439a41 [0,2,0,0,0,0|2,0,0]=4 11251 B11R0.4 COCC(=O)COCCCCF 64f1546e16c70ee2e4e07aced5677625 [0,2,0,0,0,0|2,0,0]=4 11252 B11R0.4 COCC(=O)COCCCCS 1c69a5e1cf0dd2d22b4517ff2bf45ec5 [0,2,0,0,0,0|2,0,0]=4 11253 B11R0.4 COCC(=O)COCCCSC b7514f231ed5bceecb60df57c287f67a [0,2,0,0,0,0|2,0,0]=4 11254 B11R0.4 COCC(=O)NCCCCCCl aa42ab5e3ec51e9d22abf292fda9d7f1 [0,2,0,0,0,0|2,0,0]=4 11255 B11R0.4 COCC(=O)NCCCCCO 1fa76c874db0b7688d7ddf0c18481da7 [0,2,0,0,0,0|2,0,0]=4 11256 B11R0.4 COCC(=O)NCCCCSC 0ce1c58b53ffdb53ba5746947397b799 [0,2,0,0,0,0|2,0,0]=4 11257 B11R0.4 COCCCCCC(=O)NC#N 873a2d07127ca7afc3afcc40a82182a8 [0,2,0,0,0,0|2,0,0]=4 11258 B11R0.4 COCCCCNC(=O)CCO e37a21d48ecc449870eea705bdcc361f [0,2,0,0,0,0|2,0,0]=4 11259 B11R0.4 COCCCCNC(=O)COC 745cdb59c6b7ff7633b3b16ac9c6ee7c [0,2,0,0,0,0|2,0,0]=4 11260 B11R0.4 COCCCCNC(=O)CON 8df6fb5cffb6bf20ea1b47ce8f4fcc8d [0,2,0,0,0,0|2,0,0]=4 11261 B11R0.4 COCCCNCC(=O)COC 4e228feef20a32b9641ba3447dec0698 [0,2,0,0,0,0|2,0,0]=4 11262 B11R0.4 COCCCNCC(=O)NCO 0c9857729fe991d69ee83297f6b13e59 [0,2,0,0,0,0|2,0,0]=4 11263 B11R0.4 COCCCOCC(=O)COC f65d05f3157a1048b7ede41de889fd20 [0,2,0,0,0,0|2,0,0]=4 11264 B11R0.4 CSCCCCNC(=O)CCO 0def3c0e3424429db8620419b88082cd [0,2,0,0,0,0|2,0,0]=4 11265 B11R0.4 CSCCCCNC(=O)CON e61f0f6b4f698b06bc1bdf0cad390579 [0,2,0,0,0,0|2,0,0]=4 11266 B11R0.4 CSCCCNCC(=O)NCO f570e368191aba90098de1da6fb52329 [0,2,0,0,0,0|2,0,0]=4 11267 B11R0.4 N#CNC(=O)CCCCCCF 8f226001c5d9975f19d678c53c001dd0 [0,2,0,0,0,0|2,0,0]=4 11268 B11R0.4 N#CNC(=O)CCCCCCO 48cbbafd38fc883351efa1bcd34d8f6a [0,2,0,0,0,0|2,0,0]=4 11269 B11R0.4 N#CNC(=O)CCCCCCS 673b17c86a1464e64686d5937e31a40f [0,2,0,0,0,0|2,0,0]=4 11270 B11R0.4 NOCC(=O)NCCCCCCl 925f5308a049c417008d9bba6cac7c88 [0,2,0,0,0,0|2,0,0]=4 11271 B11R0.4 NOCC(=O)NCCCCCO 9a2ec76919528a1ba5eade29d6db9ef1 [0,2,0,0,0,0|2,0,0]=4 11272 B11R0.4 O=C(CCO)NCCCCCCl 5cefc3da5dae80b8a6093512df3bf750 [0,2,0,0,0,0|2,0,0]=4 11273 B11R0.4 O=C(CCO)NCCCCCO 32b75911b963a5b740609c2714e64ebe [0,2,0,0,0,0|2,0,0]=4 11274 B11R0.4 O=C(CNCCCCCl)NCO f72e1caea1ccec4e529e6281c186c6ae [0,2,0,0,0,0|2,0,0]=4 11275 B11R0.4 O=C(CNCCCCO)NCO 3b2e6d9bec87c799cb0207e9127f7b3a [0,2,0,0,0,0|2,0,0]=4 11276 B11R0.4 O=C(CNCCCCS)NCO b4442cc0a628a9a39a782d7f85204d7f [0,2,0,0,0,0|2,0,0]=4 11277 B11R0.70 C#CC(=O)NCC(O)CCCC 95cc913eec20d12c91b63b5606e1d4f5 [0,2,0,0,0,0|2,0,0]=4 11278 B11R0.70 C=C(CNC(C)CCCC)OC f1ef0693ccc2378f0569ea7ee0444cfe [0,2,0,0,0,0|2,0,0]=4 11279 B11R0.70 C=C(CN[C@H](C)CCCC)OC d4c520c1418ffb437f64030a39970e39 [0,2,0,0,0,0|2,0,0]=4 11280 B11R0.70 C=C(CO)CNC(C)CCCC e29ddeff862e40bae87891eb266658c1 [0,2,0,0,0,0|2,0,0]=4 11281 B11R0.70 C=C(CO)CN[C@H](C)CCCC db195244cf2cc9fa510956c1e992a34a [0,2,0,0,0,0|2,0,0]=4 11282 B11R0.70 C=C(COC(C)CCCC)OC 6b8a5e04da3dad7390ecf5e81096b57f [0,2,0,0,0,0|2,0,0]=4 11283 B11R0.70 C=C(CO[C@@H](C)CCCC)OC dc8a161de269123262deb4337a57bc2c [0,2,0,0,0,0|2,0,0]=4 11284 B11R0.70 C=C(CO[C@H](C)CCCC)OC 2ed107aae7a44e9f29385be286037f39 [0,2,0,0,0,0|2,0,0]=4 11285 B11R0.70 C=CC(=O)NCC(O)CCCC 798ababdc1e848127441b37bde8f846e [0,2,0,0,0,0|2,0,0]=4 11286 B11R0.70 CC(CCCO)NCC(=O)CO 5cfbe7895f48d6795493bda78a176658 [0,2,0,0,0,0|2,0,0]=4 11287 B11R0.70 CC(CCCO)NCC(=O)NO 9a4363cef4173abcab931951cb52898d [0,2,0,0,0,0|2,0,0]=4 11288 B11R0.70 CCCCC(=O)NCC(=O)NO b6a814cb8f461ece1f612e77778ba2d8 [0,2,0,0,0,0|1,0,1]=4 11289 B11R0.70 CCCCC(=O)NCC(=O)OC 3fd39277b6f20b9624c81cfaab7d64bb [0,2,0,0,0,0|1,0,1]=4 11290 B11R0.70 CCCCC(C)NCC(=O)CC c561f2171e24ea12ec567fc4f74e5f3c [0,2,0,0,0,0|2,0,0]=4 11291 B11R0.70 CCCCC(C)NCC(=O)CO 790473564bf1b3df6bb69086835cbd10 [0,2,0,0,0,0|1,0,0]=3 11292 B11R0.70 CCCCC(C)NCC(=O)NC 3844b5be7d553f9d3854ed30711a08a6 [0,2,0,0,0,0|2,0,0]=4 11293 B11R0.70 CCCCC(C)NCC(=O)NO e269c1513df1016deb0211389104bc26 [0,2,0,0,0,0|1,0,0]=3 11294 B11R0.70 CCCCC(C)NCC(=O)OC dea370713a261b9db8561fcfadd7d635 [0,2,0,0,0,0|1,0,0]=3 11295 B11R0.70 CCCCC(C)OCC(=O)CC 91d666f1796a689af64430251353285c [0,2,0,0,0,0|2,0,0]=4 11296 B11R0.70 CCCCC(C)OCC(=O)NC ba0fbb8b6b7dadd5d08145641a30fec5 [0,2,0,0,0,0|2,0,0]=4 11297 B11R0.70 CCCCC(C)OCC(=O)OC df4e5fb162716db8a526500670efe27c [0,2,0,0,0,0|1,0,0]=3 11298 B11R0.70 CCCCC(O)CNC(=O)C=O 131323dac83ef580d7d1d2f1ea3f9d05 [0,2,0,0,0,0|1,0,1]=4 11299 B11R0.70 CCCCC(O)CNC(=O)CC a18614707b31b705fea3a9214509c6d7 [0,2,0,0,0,0|2,0,0]=4 11300 B11R0.70 CCCCC(O)CNC(=O)CF ce8ca8ca5f0e28cabd232514364fbc83 [0,2,0,0,0,0|2,0,0]=4 11301 B11R0.70 CCCCC(O)CNC(=O)CO 23ce94bd5798ad1c8f3ff6df534c98ad [0,2,0,0,0,0|1,0,0]=3 11302 B11R0.70 CCCCC(O)CNC(=O)CS 749c4e231ee415305ca2874da9b6e609 [0,2,0,0,0,0|1,1,0]=4 11303 B11R0.70 CCCCN(C)CCC(=O)NC 510a752b34327429c5250d8a984761de [0,2,0,0,0,0|2,0,0]=4 11304 B11R0.70 CCCCN(C)CCC(=O)OC 1ad22cd2e476c7ec72932a232e75b1de [0,2,0,0,0,0|1,0,0]=3 11305 B11R0.70 CCCCN(C)COC(=O)OC cd7d2c3f82adbaf2330dfb58647703c3 [0,2,0,0,0,0|2,0,0]=4 11306 B11R0.70 CCCC[C@@H](C)NCC(=O)CC 35325ab00544718ec7f8e316798f7adc [0,2,0,0,0,0|2,0,0]=4 11307 B11R0.70 CCCC[C@@H](C)NCC(=O)CO ab411550a427fd791d80ad8677da67b5 [0,2,0,0,0,0|1,0,0]=3 11308 B11R0.70 CCCC[C@@H](C)NCC(=O)NC 39328bc9ebcf5a9dbc5340052385ad19 [0,2,0,0,0,0|2,0,0]=4 11309 B11R0.70 CCCC[C@@H](C)NCC(=O)OC f9c205165d4d34d6b16662bb8057658f [0,2,0,0,0,0|1,0,0]=3 11310 B11R0.70 CCCC[C@@H](C)OCC(=O)CC cb52e73602982a5316a49d74e42880c1 [0,2,0,0,0,0|2,0,0]=4 11311 B11R0.70 CCCC[C@@H](C)OCC(=O)NC bbf0e2fb27d2fa12374f3696d66c9f5b [0,2,0,0,0,0|2,0,0]=4 11312 B11R0.70 CCCC[C@@H](C)OCC(=O)OC d46ed4e6b264e4da227d681e0b482c0f [0,2,0,0,0,0|1,0,0]=3 11313 B11R0.70 CCCC[C@H](C)OCC(=O)CC 3a021690484f71f44ba979115207b6b2 [0,2,0,0,0,0|2,0,0]=4 11314 B11R0.70 CCCC[C@H](C)OCC(=O)NC 624cfe9e9a16d9f6eca0a31b44929426 [0,2,0,0,0,0|2,0,0]=4 11315 B11R0.70 CCCC[C@H](C)OCC(=O)OC 005217b48658963e7d8277039bb97993 [0,2,0,0,0,0|1,0,0]=3 11316 B11R0.70 CCCNC(=O)CCC(=O)NO a0f109fdaa10befb61da2856eb26f91e [0,2,0,0,0,0|1,0,1]=4 11317 B11R0.70 CCCNC(=O)CCC(=O)OC 0f91cc319eb7044065dbfb4b9ca7a263 [0,2,0,0,0,0|1,0,1]=4 11318 B11R0.70 CCCNC(C)CCC(=O)OC 9f30ac298e6a52d4146f18e020d85cfd [0,2,0,0,0,0|1,0,0]=3 11319 B11R0.70 CCCOC(C)CCC(=O)OC fb37d2dab98ad3681fa9792c014dd77f [0,2,0,0,0,0|1,0,0]=3 11320 B11R0.70 CCOCC(C)OCC(=O)OC f9aa85ce6178e8e399c3fe38107a59a6 [0,2,0,0,0,0|2,0,0]=4 11321 B11R0.70 CCOCC(O)CNC(=O)CO 777ad5df988397dde618342f1929a398 [0,2,0,0,0,0|2,0,0]=4 11322 B11R0.70 CCOCN(C)CCC(=O)OC 449f9d7482299bbb13676cc5821a0270 [0,2,0,0,0,0|2,0,0]=4 11323 B11R0.70 COC(=O)CCC(C)NCCBr 31c40bacf3b0e053881f843b8283ebf5 [0,2,0,0,0,0|2,0,0]=4 11324 B11R0.70 COC(=O)CCC(C)NCCF 3ceb606cf8829eea38c7afd061d2d143 [0,2,0,0,0,0|2,0,0]=4 11325 B11R0.70 COC(=O)CCC(C)NCCI 2e0f874037d04e6bda7716415a58e33d [0,2,0,0,0,0|2,0,0]=4 11326 B11R0.70 COC(=O)CCC(C)NCCO 061b64678cf984758823fc2903e74956 [0,2,0,0,0,0|2,0,0]=4 11327 B11R0.70 COC(=O)CCC(C)NCCS 053cb72bf5405346a63aba681c356089 [0,2,0,0,0,0|2,0,0]=4 11328 B11R0.70 COC(=O)CCC(C)OCCS 69a864be4a63ee6543597d0a4ca720b2 [0,2,0,0,0,0|2,0,0]=4 11329 B11R0.70 COC(=O)CCN(C)CCCF 97b27122c51fc28cbcfd72435740f7d3 [0,2,0,0,0,0|2,0,0]=4 11330 B11R0.70 COC(=O)CCN(C)CCCO 8a99c6040150fd047ba0dc717e7f7841 [0,2,0,0,0,0|2,0,0]=4 11331 B11R0.70 COC(=O)CCN(C)CCCS f7c63d5fe91aef3e4d99c8b33ec5231b [0,2,0,0,0,0|2,0,0]=4 11332 B11R0.70 COC(=O)CCN(C)CCSC df171317d3dc635ee34c31e275e869c6 [0,2,0,0,0,0|2,0,0]=4 11333 B11R0.70 COC(=O)CNC(C)CCCO 8ad227221676f08712df2b598c9a8466 [0,2,0,0,0,0|2,0,0]=4 11334 B11R0.70 COC(=O)CN[C@H](C)CCCO 10e667bf331193bd26e93982e0301837 [0,2,0,0,0,0|2,0,0]=4 11335 B11R0.70 COC(=O)COC(C)CCSC dda468550cfdbb3cbffb0335fe9fe317 [0,2,0,0,0,0|2,0,0]=4 11336 B11R0.70 COCCC(C)OCC(=O)OC 7fc894ff441bfae9f24ee7d5c8639cc0 [0,2,0,0,0,0|2,0,0]=4 11337 B11R0.70 COCCN(C)CCC(=O)OC 59d43145d73ad52cb671ff0346091397 [0,2,0,0,0,0|2,0,0]=4 11338 B11R0.70 COCOC(C)CCC(=O)OC 702482fadd0d4cf74a2696be73ac52d0 [0,2,0,0,0,0|2,0,0]=4 11339 B11R0.70 C[C@H](CCCO)CNC(=O)CO 5bae356ab1dc33c30828a685e21e46ff [0,2,0,0,0,0|2,0,0]=4 11340 B11R0.70 C[C@H](CCCO)NCC(=O)CO 695e7858e6535550b601fc14776390d6 [0,2,0,0,0,0|2,0,0]=4 11341 B11R0.124 CCCCCCCN(C=O)CC 80dacb67574c723024dc07e5a2de7374 [0,2,0,0,0,0|2,0,0]=4 11342 B11R0.124 CCCCCCCN(CC)CO 17ab000f929823190cb5a48d0f1468e4 [0,2,0,0,0,0|2,0,0]=4 11343 B11R0.142 C#CC(=O)N(C)CCCCCC 0173f29db1853c5fa79292ed89e4a836 [0,2,0,0,0,0|2,0,0]=4 11344 B11R0.142 C=C(CNCCCC)C(=O)OC 53c2de65fec0755bbe5ffc40b13b3a84 [0,2,0,0,0,0|1,0,1]=4 11345 B11R0.142 C=C(COCCCC)C(=O)OC 2670a0bb6e62b0bce720cea99a8bf9ce [0,2,0,0,0,0|1,0,1]=4 11346 B11R0.142 C=CC(=O)N(C)CCCCCC 93b6d7a05f5c33882e284a31f50eac14 [0,2,0,0,0,0|2,0,0]=4 11347 B11R0.142 CCCCCCN(C)C(=O)C=O 7d7387771db3d689acb9cf7d82c61676 [0,2,0,0,0,0|1,0,1]=4 11348 B11R0.142 CCCCCCN(C)C(=O)CC c25fee109e3505330a0f823c56988e5a [0,2,0,0,0,0|2,0,0]=4 11349 B11R0.142 CCCCCCN(C)C(=O)CF 8f2802cd4105d321091afa6c867f9d8a [0,2,0,0,0,0|2,0,0]=4 11350 B11R0.142 CCCCCCN(C)C(=O)CO ff6df48d23a3987ff88fad6f68fd8d1c [0,2,0,0,0,0|1,0,0]=3 11351 B11R0.142 CCCCCCN(C)C(=O)CS 53378136722e7688576c49f2efe4b1f1 [0,2,0,0,0,0|1,1,0]=4 11352 B11R0.142 CCCCCNC(=O)C(=O)OC 8111b1e6fb8bd2a57b809499c8b8e317 [0,2,0,0,0,0|1,0,1]=4 11353 B11R0.142 CCCCCNC(C)C(=O)CC f08ad8041b9881421294dcf33e95a044 [0,2,0,0,0,0|2,0,0]=4 11354 B11R0.142 CCCCCNC(C)C(=O)NC ab1dcde0036a77d5dca2cf4cec82a484 [0,2,0,0,0,0|2,0,0]=4 11355 B11R0.142 CCCCCNC(C)C(=O)OC ceda658c32f2717705b5753d95254732 [0,2,0,0,0,0|1,0,0]=3 11356 B11R0.142 CCCCCN[C@@H](C)C(=O)OC a70c734a04042f9e2c29976744ca1db7 [0,2,0,0,0,0|1,0,0]=3 11357 B11R0.142 CCCCCN[C@H](C)C(=O)OC f83769fcf8a52442a99a180792631049 [0,2,0,0,0,0|1,0,0]=3 11358 B11R0.142 CCCCCOC(C)C(=O)CC e1ca68c4c69b484481885dc7e641f465 [0,2,0,0,0,0|2,0,0]=4 11359 B11R0.142 CCCCCOC(C)C(=O)NC 4e04b55b7a01d68352559baee71eb68a [0,2,0,0,0,0|2,0,0]=4 11360 B11R0.142 CCCCCOC(C)C(=O)OC c98b88bf4ee6dc23e9db5b7a644cb7b3 [0,2,0,0,0,0|1,0,0]=3 11361 B11R0.142 CCCCCO[C@@H](C)C(=O)OC afd8f96c1d28270745640effa22059a9 [0,2,0,0,0,0|1,0,0]=3 11362 B11R0.142 CCCCCO[C@H](C)C(=O)OC ed1b03b86456edaec6348184ff47bcfd [0,2,0,0,0,0|1,0,0]=3 11363 B11R0.142 CCCCNCC(=O)C(=O)OC d0af9a9a17c911307996c52c1b603cc9 [0,2,0,0,0,0|1,0,1]=4 11364 B11R0.142 CCCCNCC(C)C(=O)OC b484220b46772cd5124cefc21e4c9a4c [0,2,0,0,0,0|1,0,0]=3 11365 B11R0.142 CCCCNCC(O)C(=O)OC de1110f46b4655a9b052a8c63538b994 [0,2,0,0,0,0|1,0,0]=3 11366 B11R0.142 CCCCNC[C@@H](C)C(=O)OC 243d0086fa7de32e5aa01dd763cc94fa [0,2,0,0,0,0|1,0,0]=3 11367 B11R0.142 CCCCNC[C@H](C)C(=O)OC d5fd048b54b76c390e88c9c8f93fa500 [0,2,0,0,0,0|1,0,0]=3 11368 B11R0.142 CCCCOCC(=O)C(=O)OC a3b07f302c91d3009f4c5596fb58b4c0 [0,2,0,0,0,0|1,0,1]=4 11369 B11R0.142 CCCCOCC(C)C(=O)OC 2a428f13a16476db3c3646a1056d2697 [0,2,0,0,0,0|1,0,0]=3 11370 B11R0.142 CCCCOCC(F)C(=O)OC dcce8be3eb0b5248eab081b1171db910 [0,2,0,0,0,0|1,0,0]=3 11371 B11R0.142 CCCCOC[C@@H](C)C(=O)OC b94e575e56b960aca51d1d5ccfdeebf4 [0,2,0,0,0,0|1,0,0]=3 11372 B11R0.142 CCCCOC[C@H](C)C(=O)OC b41ada1bd4c1876a7499387b56903098 [0,2,0,0,0,0|1,0,0]=3 11373 B11R0.142 CCCNCCC(C)C(=O)OC 1c2ea45b264e72292927d13f97c0a2c0 [0,2,0,0,0,0|1,0,0]=3 11374 B11R0.142 CCCOCCC(C)C(=O)OC 16254c5922c3369c7e34436020a43f8f [0,2,0,0,0,0|1,0,0]=3 11375 B11R0.142 CCOCCNC(C)C(=O)OC b5d459efe6748b9999ae2dee7af13406 [0,2,0,0,0,0|2,0,0]=4 11376 B11R0.142 CCOCCN[C@@H](C)C(=O)OC 846e0abb37134aa9e882fa8a4e600639 [0,2,0,0,0,0|2,0,0]=4 11377 B11R0.142 CCOCCN[C@H](C)C(=O)OC ba1d21e991cc9a73796fd99b94ada4a4 [0,2,0,0,0,0|2,0,0]=4 11378 B11R0.142 CCOCCOC(C)C(=O)OC 32035046005e8b95892cedecbf1f193e [0,2,0,0,0,0|2,0,0]=4 11379 B11R0.142 CCOCCO[C@@H](C)C(=O)OC b830a5f7ab806c3939b45e2bd5e1e354 [0,2,0,0,0,0|2,0,0]=4 11380 B11R0.142 CCOCCO[C@H](C)C(=O)OC 9006d91d670ad3dffd664db727be9d5b [0,2,0,0,0,0|2,0,0]=4 11381 B11R0.142 CCOCNCC(C)C(=O)OC 1893b7e1d51927ab9ba4fb6a5aeee707 [0,2,0,0,0,0|2,0,0]=4 11382 B11R0.142 CCOCOCC(F)C(=O)OC 42c7cc0695025f40b2ab11787d26831c [0,2,0,0,0,0|2,0,0]=4 11383 B11R0.142 CCSCCNC(C)C(=O)OC fbe5b47ce3b342b91d8830869a04359c [0,2,0,0,0,0|2,0,0]=4 11384 B11R0.142 CCSCCN[C@@H](C)C(=O)OC 106fa963f628ccdc87113b96f3f963d2 [0,2,0,0,0,0|2,0,0]=4 11385 B11R0.142 CCSCCN[C@H](C)C(=O)OC fa7bd2988921e36fea9aee5949ec838b [0,2,0,0,0,0|2,0,0]=4 11386 B11R0.142 CCSCCOC(C)C(=O)OC 219ef7c74a036f21283e9da6860d2a4a [0,2,0,0,0,0|2,0,0]=4 11387 B11R0.142 CCSCCO[C@@H](C)C(=O)OC e274d964f6a7ce63dfc7999bd210f107 [0,2,0,0,0,0|2,0,0]=4 11388 B11R0.142 CCSCCO[C@H](C)C(=O)OC e1b280ab310b082e7627bc77c2e2118e [0,2,0,0,0,0|2,0,0]=4 11389 B11R0.142 CN(CCCCCO)C(=O)CO 11fb01b4f7ac820aa1f1aa39e8a46285 [0,2,0,0,0,0|2,0,0]=4 11390 B11R0.142 COC(=O)C(C)CCNCCBr 2fd34c3217ce76317dd514d4c11ed895 [0,2,0,0,0,0|2,0,0]=4 11391 B11R0.142 COC(=O)C(C)CCNCCF d3dcda1f3cad353ca06c93a8c1c4e3a0 [0,2,0,0,0,0|2,0,0]=4 11392 B11R0.142 COC(=O)C(C)CCNCCI d2e025466ca0279e1a5f773d6df2fc67 [0,2,0,0,0,0|2,0,0]=4 11393 B11R0.142 COC(=O)C(C)CCNCCO 5c8058985472bc69b9b2b77f5d40f3c6 [0,2,0,0,0,0|2,0,0]=4 11394 B11R0.142 COC(=O)C(C)CCNCCS afa62ea129176c0c968e66b03ac111f5 [0,2,0,0,0,0|2,0,0]=4 11395 B11R0.142 COC(=O)C(C)CCOCCF 481ead0c49b9f77fc0d672a8683210ff [0,2,0,0,0,0|2,0,0]=4 11396 B11R0.142 COC(=O)C(C)CCOCCS a7b5a6c869d314113ee3845b721794ea [0,2,0,0,0,0|2,0,0]=4 11397 B11R0.142 COC(=O)C(C)CNCCCCl ca760c25d653fac901f91970c2bc47f0 [0,2,0,0,0,0|2,0,0]=4 11398 B11R0.142 COC(=O)C(C)CNCCCF b17afe90be4b33a4ab21adfa2b2368a5 [0,2,0,0,0,0|2,0,0]=4 11399 B11R0.142 COC(=O)C(C)CNCCCO 0247b22355b8a369eb2e469ca0c47018 [0,2,0,0,0,0|2,0,0]=4 11400 B11R0.142 COC(=O)C(C)CNCCCS 25c4e1e56ab74c6b26ffe36bcd1e3fd4 [0,2,0,0,0,0|2,0,0]=4 11401 B11R0.142 COC(=O)C(C)CNCCSC b7ee09d7246fc2e225eac4d370a4ed35 [0,2,0,0,0,0|2,0,0]=4 11402 B11R0.142 COC(=O)C(C)COCCCF e61e00ecc31298fd583180178911a3ae [0,2,0,0,0,0|2,0,0]=4 11403 B11R0.142 COC(=O)C(C)COCCCS 1f8ee234f9c27d02f3d99afbc2ce402b [0,2,0,0,0,0|2,0,0]=4 11404 B11R0.142 COC(=O)C(C)COCCSC 06ee4b017ab3a03fc311500246fb2e89 [0,2,0,0,0,0|2,0,0]=4 11405 B11R0.142 COC(=O)C(C)NCCCCCl ee71ab87d90d9043c241e822fa3a3c5f [0,2,0,0,0,0|2,0,0]=4 11406 B11R0.142 COC(=O)C(C)NCCCCO fcaf180f356e99a134389a2d4cde3d27 [0,2,0,0,0,0|2,0,0]=4 11407 B11R0.142 COC(=O)C(C)NCCCCS 450b88f3cd93e22e414f7759829ff111 [0,2,0,0,0,0|2,0,0]=4 11408 B11R0.142 COC(=O)C(C)NCCCSC 5fb9cdc0c38354aef821b11f49303bad [0,2,0,0,0,0|2,0,0]=4 11409 B11R0.142 COC(=O)C(C)OCCCCF 1c73fdbcf7acd624e9dbfce72c753945 [0,2,0,0,0,0|2,0,0]=4 11410 B11R0.142 COC(=O)C(C)OCCCSC 4e47319cc96facf7350259b4c9269848 [0,2,0,0,0,0|2,0,0]=4 11411 B11R0.142 COC(=O)C(F)COCCCF d86d64836126cce73d05131d8dee80cc [0,2,0,0,0,0|2,0,0]=4 11412 B11R0.142 COC(=O)C(F)COCCCS 16a174b91d7030e553c75ddde6e21034 [0,2,0,0,0,0|2,0,0]=4 11413 B11R0.142 COC(=O)C(F)COCCSC 4c822b30d0e54c97f2607bb5e3bcbfd3 [0,2,0,0,0,0|2,0,0]=4 11414 B11R0.142 COC(=O)C(O)CNCCCCl 892e8ed48adbef8b93a92822e4a0f31f [0,2,0,0,0,0|2,0,0]=4 11415 B11R0.142 COC(=O)C(O)CNCCCO 1008ce82f33b2677f64b581e643acb37 [0,2,0,0,0,0|2,0,0]=4 11416 B11R0.142 COC(=O)C(O)CNCCSC e1b4e07e0443227f268de744bfb6c4bc [0,2,0,0,0,0|2,0,0]=4 11417 B11R0.142 COC(=O)[C@@H](C)CNCCCCl 0aa6b65af5f54afa7351f3782c387daf [0,2,0,0,0,0|2,0,0]=4 11418 B11R0.142 COC(=O)[C@@H](C)CNCCCO d42f2e49cef8f6c71ca35d74bdd3e61e [0,2,0,0,0,0|2,0,0]=4 11419 B11R0.142 COC(=O)[C@@H](C)CNCCSC afd8dba6b6aade9ca106e391bf4601ca [0,2,0,0,0,0|2,0,0]=4 11420 B11R0.142 COC(=O)[C@@H](C)COCCCF 4e77309f93631e03c98a9cc09797eaec [0,2,0,0,0,0|2,0,0]=4 11421 B11R0.142 COC(=O)[C@@H](C)COCCCS 72b8d59e989776203d1ee14bc8b34cdd [0,2,0,0,0,0|2,0,0]=4 11422 B11R0.142 COC(=O)[C@@H](C)COCCSC 20770ccf42b664787fd1f208976aae70 [0,2,0,0,0,0|2,0,0]=4 11423 B11R0.142 COC(=O)[C@@H](C)NCCCCCl 29636ef48e15aba93c077192ff04fb41 [0,2,0,0,0,0|2,0,0]=4 11424 B11R0.142 COC(=O)[C@@H](C)NCCCCO 605ae9fe724da1f5b3dc82528315ef48 [0,2,0,0,0,0|2,0,0]=4 11425 B11R0.142 COC(=O)[C@@H](C)NCCCCS cab8156917d4974738d2f850f9ae4c02 [0,2,0,0,0,0|2,0,0]=4 11426 B11R0.142 COC(=O)[C@@H](C)NCCCSC 6be08ebb6bfde8a3ebf3ea3a3583bf88 [0,2,0,0,0,0|2,0,0]=4 11427 B11R0.142 COC(=O)[C@@H](C)OCCCCF 8e80d31737a8675f2814c1c48d436e58 [0,2,0,0,0,0|2,0,0]=4 11428 B11R0.142 COC(=O)[C@@H](C)OCCCSC bbe035b579031e04e2af4b91e015c406 [0,2,0,0,0,0|2,0,0]=4 11429 B11R0.142 COC(=O)[C@H](C)CNCCCCl 7a165d8812f06d74936607466548eb36 [0,2,0,0,0,0|2,0,0]=4 11430 B11R0.142 COC(=O)[C@H](C)CNCCCO ee596a9ee8390da426f406fe4be68b76 [0,2,0,0,0,0|2,0,0]=4 11431 B11R0.142 COC(=O)[C@H](C)CNCCSC 67903417917972a9b751da8f9fadf89b [0,2,0,0,0,0|2,0,0]=4 11432 B11R0.142 COC(=O)[C@H](C)COCCCF 64436f94c66f19b1dce14e496ec6cbba [0,2,0,0,0,0|2,0,0]=4 11433 B11R0.142 COC(=O)[C@H](C)COCCCS 5f01416b362edb7bab5ab55916fd6a61 [0,2,0,0,0,0|2,0,0]=4 11434 B11R0.142 COC(=O)[C@H](C)COCCSC d4bfd8edbdbc87d3a56b49324d761d42 [0,2,0,0,0,0|2,0,0]=4 11435 B11R0.142 COC(=O)[C@H](C)NCCCCCl 57a491ea5cd1fd317b1e2398bc1abdc0 [0,2,0,0,0,0|2,0,0]=4 11436 B11R0.142 COC(=O)[C@H](C)NCCCCO c3737c5b051295f908ea8eea119ff029 [0,2,0,0,0,0|2,0,0]=4 11437 B11R0.142 COC(=O)[C@H](C)NCCCCS aab632ba4d6ba5891c01621674ff7cd6 [0,2,0,0,0,0|2,0,0]=4 11438 B11R0.142 COC(=O)[C@H](C)NCCCSC 8c21fd7af132f74a954dc4324336db80 [0,2,0,0,0,0|2,0,0]=4 11439 B11R0.142 COC(=O)[C@H](C)OCCCCF e64df85d4a8779cbeb9e3ee07e4b7198 [0,2,0,0,0,0|2,0,0]=4 11440 B11R0.142 COC(=O)[C@H](C)OCCCSC 3ff640e216874c93354547525d5d20d4 [0,2,0,0,0,0|2,0,0]=4 11441 B11R0.142 COCCCCN(C)C(=O)CO 0ca26cd4c5feb75f31cdd8bfa0cf1155 [0,2,0,0,0,0|2,0,0]=4 11442 B11R0.142 COCCCNC(C)C(=O)OC 194ccf474da7f987e6faea6f0887caf2 [0,2,0,0,0,0|2,0,0]=4 11443 B11R0.142 COCCCN[C@@H](C)C(=O)OC 16a28ac04e8569babf470f0f07df73db [0,2,0,0,0,0|2,0,0]=4 11444 B11R0.142 COCCCN[C@H](C)C(=O)OC e3943a1642245c3fb2c90e94a94bdea1 [0,2,0,0,0,0|2,0,0]=4 11445 B11R0.142 COCCCOC(C)C(=O)OC e24e04b414eee78fd97a76b7cb97a112 [0,2,0,0,0,0|2,0,0]=4 11446 B11R0.142 COCCCO[C@@H](C)C(=O)OC ab86f828926ab1f6ed992bbcd3d2f075 [0,2,0,0,0,0|2,0,0]=4 11447 B11R0.142 COCCCO[C@H](C)C(=O)OC c59377635a656e4656656f606ef95ecf [0,2,0,0,0,0|2,0,0]=4 11448 B11R0.142 COCCNCC(C)C(=O)OC 2bb25a35513d120e927aa1a258a951e3 [0,2,0,0,0,0|2,0,0]=4 11449 B11R0.142 COCCNCC(O)C(=O)OC dff349353e5ed85b357c3d3003df271a [0,2,0,0,0,0|2,0,0]=4 11450 B11R0.142 COCCNC[C@@H](C)C(=O)OC b667e1e5ad14af14daa198cd10af9216 [0,2,0,0,0,0|2,0,0]=4 11451 B11R0.142 COCCNC[C@H](C)C(=O)OC 9c4e2e3427040a92cc8a5287e8923979 [0,2,0,0,0,0|2,0,0]=4 11452 B11R0.142 COCCOCC(C)C(=O)OC 82eb396044a3f392eb96981e7aa7ae21 [0,2,0,0,0,0|2,0,0]=4 11453 B11R0.142 COCCOCC(F)C(=O)OC 45f18ad75ad52372018aca8f37d25335 [0,2,0,0,0,0|2,0,0]=4 11454 B11R0.142 COCCOC[C@@H](C)C(=O)OC 1cf5fe7f4e41d3f7e583fb76de355163 [0,2,0,0,0,0|2,0,0]=4 11455 B11R0.142 COCCOC[C@H](C)C(=O)OC 5a9906f66e258fb72c843329ef65b5b0 [0,2,0,0,0,0|2,0,0]=4 11456 B11R0.142 COCOCCC(C)C(=O)OC 23b649250e14ccdf3473914f2893be02 [0,2,0,0,0,0|2,0,0]=4 11457 B11R0.76 C#CC(OCCCCC)C(=O)O 9ca6f34ca95e09307742c9e45a31d52b [0,2,0,0,0,0|1,0,0]=3 11458 B11R0.76 C#CC(OCCCCF)C(=O)O 2a5aa8f7eeb132ba086a00a4d6514dbb [0,2,0,0,0,0|2,0,0]=4 11459 B11R0.76 C#CC(OCCCOC)C(=O)O 623878fb93b0ddad9da8ebc4a68959f7 [0,2,0,0,0,0|2,0,0]=4 11460 B11R0.76 C#CC(OCCCSC)C(=O)O 31e7899eac207b2f3733ff283f68af76 [0,2,0,0,0,0|2,0,0]=4 11461 B11R0.76 C#CC(OCCOCC)C(=O)O b8479781ebe1229d124f43fe525a84cd [0,2,0,0,0,0|2,0,0]=4 11462 B11R0.76 C#CC(OCCSCC)C(=O)O 79532ec97c7dba280b6acbd27190bb5b [0,2,0,0,0,0|2,0,0]=4 11463 B11R0.76 C/C=C(\OCCCCC)/C(=O)O 28c8941b059a041d723117ef4463f7af [0,2,0,0,0,0|1,0,1]=4 11464 B11R0.76 C=CC(NCCCCC)C(=O)O 9889e6be0c3ea70d81a80a056b6e0b05 [0,2,0,0,0,0|1,0,0]=3 11465 B11R0.76 C=CC(NCCCCF)C(=O)O 55c6c181cea757a51500fd42570684f7 [0,2,0,0,0,0|2,0,0]=4 11466 B11R0.76 C=CC(NCCCCO)C(=O)O 798a00210fb476c79948971e88d30bc7 [0,2,0,0,0,0|2,0,0]=4 11467 B11R0.76 C=CC(NCCCOC)C(=O)O 4d168bde3eebba8aa91beca7dde98418 [0,2,0,0,0,0|2,0,0]=4 11468 B11R0.76 C=CC(NCCCSC)C(=O)O ce391bece11a6dff0e794c738c597182 [0,2,0,0,0,0|2,0,0]=4 11469 B11R0.76 C=CC(NCCOCC)C(=O)O 266e2ba9f3915a0998bf50546831f70b [0,2,0,0,0,0|2,0,0]=4 11470 B11R0.76 C=CC(NCCSCC)C(=O)O 554e4317f638bccc7e59782f12b09d85 [0,2,0,0,0,0|2,0,0]=4 11471 B11R0.76 C=C[C@H](NCCCCC)C(=O)O 618c7100ba2b9bcbd7ae3feed50c417a [0,2,0,0,0,0|1,0,0]=3 11472 B11R0.76 C=C[C@H](NCCCCF)C(=O)O eb154b6509acc853ffaa302df9ed9479 [0,2,0,0,0,0|2,0,0]=4 11473 B11R0.76 C=C[C@H](NCCCCO)C(=O)O 08e9a41a46a27a7a5d2e112907f5dc57 [0,2,0,0,0,0|2,0,0]=4 11474 B11R0.76 C=C[C@H](NCCCOC)C(=O)O f375f4c212d50cb385c73336b8da32c8 [0,2,0,0,0,0|2,0,0]=4 11475 B11R0.76 C=C[C@H](NCCCSC)C(=O)O 6ff9b204a8fada7ad1682bfec3c7b6b3 [0,2,0,0,0,0|2,0,0]=4 11476 B11R0.76 C=C[C@H](NCCOCC)C(=O)O eaf217a37c74a6c0e16e3c9fe51a1ff6 [0,2,0,0,0,0|2,0,0]=4 11477 B11R0.76 C=C[C@H](NCCSCC)C(=O)O 2a8b17f29d251268cd35a01827f8c4cb [0,2,0,0,0,0|2,0,0]=4 11478 B11R0.76 CCC(NCCCCCl)C(=O)O b9f029cbfdce3361d90a567293fdad33 [0,2,0,0,0,0|2,0,0]=4 11479 B11R0.76 CCC(NCCCCF)C(=O)O 1f3f1526a3d642b27ff82002c873cbd6 [0,2,0,0,0,0|2,0,0]=4 11480 B11R0.76 CCC(NCCCCO)C(=O)O bee50b26f9652d263597921388ce9988 [0,2,0,0,0,0|2,0,0]=4 11481 B11R0.76 CCC(NCCCCS)C(=O)O f80c3902993b4fb1fe314b0248de0f9b [0,2,0,0,0,0|2,0,0]=4 11482 B11R0.76 CCC(NCCCOC)C(=O)O 7de5a872c2bff6c54b50aa9d812b3490 [0,2,0,0,0,0|2,0,0]=4 11483 B11R0.76 CCC(NCCCSC)C(=O)O cfa382ba707def5cb3eb050d4973b477 [0,2,0,0,0,0|2,0,0]=4 11484 B11R0.76 CCC(OCCCCF)C(=O)O 639faad3a00c321088de9dee12b9772f [0,2,0,0,0,0|2,0,0]=4 11485 B11R0.76 CCC(OCCCCS)C(=O)O b9e6a78d324cb4499f8b0819ace7ba72 [0,2,0,0,0,0|2,0,0]=4 11486 B11R0.76 CCC(OCCCOC)C(=O)O 970f2ac1116867c3b66eedff2a8f1225 [0,2,0,0,0,0|2,0,0]=4 11487 B11R0.76 CCC(OCCCSC)C(=O)O f6f0876b2fdfff770adc1a08a4ece7e9 [0,2,0,0,0,0|2,0,0]=4 11488 B11R0.76 CCCCCNC(C#N)C(=O)N 655138d2652f56c671d19c9a4cf68795 [0,2,0,0,0,0|2,0,0]=4 11489 B11R0.76 CCCCCNC(CC)C(=O)N 0a5114e1d2fb532950d086c3f2bead63 [0,2,0,0,0,0|2,0,0]=4 11490 B11R0.76 CCCCCNC(CC)C(=O)O ee35fb5ade654703c1bfadb1dc6af952 [0,2,0,0,0,0|1,0,0]=3 11491 B11R0.76 CCCCCNC(CCl)C(=O)O 68d0236193583c64a9422ce170e54f5f [0,2,0,0,0,0|1,0,0]=3 11492 B11R0.76 CCCCCNC(CF)C(=O)O 0d34e1255a6d4fdc61d8e01fcbde6b3e [0,2,0,0,0,0|1,0,0]=3 11493 B11R0.76 CCCCCNC(CO)C(=O)N 4ee6ebc23f265d312d17fa032414b219 [0,2,0,0,0,0|2,0,0]=4 11494 B11R0.76 CCCCCNC(CO)C(=O)O bd269efe5ba2e4c76085b05bc866b460 [0,2,0,0,0,0|1,0,0]=3 11495 B11R0.76 CCCCCNC(CS)C(=O)O 0006af5ad0312370d8160ec2688a6a3e [0,2,0,0,0,0|1,0,0]=3 11496 B11R0.76 CCCCCN[C@@H](CC)C(=O)N f532bc824cc0fdd71aedd866197a0ce8 [0,2,0,0,0,0|2,0,0]=4 11497 B11R0.76 CCCCCN[C@@H](CC)C(=O)O 4f93ee7ecbf66e1ad95ad56c9805283f [0,2,0,0,0,0|1,0,0]=3 11498 B11R0.76 CCCCCN[C@@H](CCl)C(=O)O b7dd59b6009200ec5781136bdd726727 [0,2,0,0,0,0|1,0,0]=3 11499 B11R0.76 CCCCCN[C@@H](CO)C(=O)N 66be632ea25e524d7186808bbbdd23c4 [0,2,0,0,0,0|2,0,0]=4 11500 B11R0.76 CCCCCN[C@@H](CO)C(=O)O eb5da792b6c53deb3635aa01d8d9922c [0,2,0,0,0,0|1,0,0]=3 11501 B11R0.76 CCCCCN[C@@H](CS)C(=O)O 7b4efa6c6a5884b87d09811af45c9d22 [0,2,0,0,0,0|1,0,0]=3 11502 B11R0.76 CCCCCN[C@H](CC)C(=O)O 9831815d87e6650dbc79d44712a20603 [0,2,0,0,0,0|1,0,0]=3 11503 B11R0.76 CCCCCN[C@H](CCl)C(=O)O 2915dfa1103b32ef2a043842f1ed2212 [0,2,0,0,0,0|1,0,0]=3 11504 B11R0.76 CCCCCN[C@H](CO)C(=O)O f854d361d8101fb50b52f966c0aa4099 [0,2,0,0,0,0|1,0,0]=3 11505 B11R0.76 CCCCCN[C@H](CS)C(=O)O 910fe54d2e1ae477b00d3a8807d9a465 [0,2,0,0,0,0|1,0,0]=3 11506 B11R0.76 CCCCCOC(CC)C(=O)N f08b86b16bcddce25fea4f9fd5eb665e [0,2,0,0,0,0|2,0,0]=4 11507 B11R0.76 CCCCCOC(CC)C(=O)O f6277b2fcdd6221a3700cb86b4a6e5a7 [0,2,0,0,0,0|1,0,0]=3 11508 B11R0.76 CCCCCO[C@@H](CC)C(=O)O 5429cc3a413ddac2c6e48187393149fb [0,2,0,0,0,0|1,0,0]=3 11509 B11R0.76 CCCCCO[C@H](CC)C(=O)O 9da6f96959940297813614910c6206da [0,2,0,0,0,0|1,0,0]=3 11510 B11R0.76 CCCCCO[C@H](CF)C(=O)O b4d7775d104ec88011b45fec5d6cb046 [0,2,0,0,0,0|1,0,0]=3 11511 B11R0.76 CCCCNCC(C#N)C(=O)O 9bce2ba791a6379585bdb3d7df58b3d7 [0,2,0,0,0,0|1,0,0]=3 11512 B11R0.76 CCCCNC[C@H](CC)C(=O)O fee4ca36f440ff93126b12a69b65b784 [0,2,0,0,0,0|1,0,0]=3 11513 B11R0.76 CCCCNC[C@H](CO)C(=O)O 8c7e0b728930291222e75419bc3f68fa [0,2,0,0,0,0|1,0,0]=3 11514 B11R0.76 CCCNCCC(OC)C(=O)O a8024159c230cb1f76fe446956b0a5cd [0,2,0,0,0,0|1,0,0]=3 11515 B11R0.76 CCOCCNC(CC)C(=O)O 25548982996c1571f55eef1ba80c1306 [0,2,0,0,0,0|2,0,0]=4 11516 B11R0.76 CCOCCNC(CCl)C(=O)O beb39a1ac91cd5568b5b5afa36cf0ce4 [0,2,0,0,0,0|2,0,0]=4 11517 B11R0.76 CCOCCNC(CF)C(=O)O 5572daf1b643fe04412808c2d1d9998a [0,2,0,0,0,0|2,0,0]=4 11518 B11R0.76 CCOCCNC(CO)C(=O)O fb58f2502cc7aa4a421780985838214c [0,2,0,0,0,0|2,0,0]=4 11519 B11R0.76 CCOCCNC(CS)C(=O)O 600967acb4f8a7ae3cab03db683a677e [0,2,0,0,0,0|2,0,0]=4 11520 B11R0.76 CCOCCN[C@@H](CC)C(=O)O dbc3279cd54ee79fb4249eb29befa73c [0,2,0,0,0,0|2,0,0]=4 11521 B11R0.76 CCOCCN[C@@H](CCl)C(=O)O b36cfc19b83a059e3fec042e6b82757d [0,2,0,0,0,0|2,0,0]=4 11522 B11R0.76 CCOCCN[C@@H](CO)C(=O)O 380f21974fb83c097de37f083d986656 [0,2,0,0,0,0|2,0,0]=4 11523 B11R0.76 CCOCCN[C@@H](CS)C(=O)O 74d76923da7f31bd52104932a960fce8 [0,2,0,0,0,0|2,0,0]=4 11524 B11R0.76 CCOCCN[C@H](CC)C(=O)O 96b3c17a0ad3c81a764238891e807cf8 [0,2,0,0,0,0|2,0,0]=4 11525 B11R0.76 CCOCCN[C@H](CCl)C(=O)O e62ea97ead71c3d56622c9780c6cb6cf [0,2,0,0,0,0|2,0,0]=4 11526 B11R0.76 CCOCCN[C@H](CO)C(=O)O 978d069baac64b916537212b2e1a80be [0,2,0,0,0,0|2,0,0]=4 11527 B11R0.76 CCOCCN[C@H](CS)C(=O)O 048423b1e560412d94cb13515bd38558 [0,2,0,0,0,0|2,0,0]=4 11528 B11R0.76 CCOCCOC(CC)C(=O)O d902ca9a0112c78c670ad84c10630f6e [0,2,0,0,0,0|2,0,0]=4 11529 B11R0.76 CCOCCOC(CF)C(=O)O e0a80253265f93289ccd2762c2ea8d20 [0,2,0,0,0,0|2,0,0]=4 11530 B11R0.76 CCOCCO[C@@H](CC)C(=O)O 440abaf5acaa37f7a793ed869cef5fbc [0,2,0,0,0,0|2,0,0]=4 11531 B11R0.76 CCOCCO[C@H](CC)C(=O)O 29d495b49d338c98aaf462a75d28fd05 [0,2,0,0,0,0|2,0,0]=4 11532 B11R0.76 CCOCCO[C@H](CF)C(=O)O 4dbbc33a93a07ca05dd9d2fbc67ca38d [0,2,0,0,0,0|2,0,0]=4 11533 B11R0.76 CCOCNCC(C#N)C(=O)O f649b880ae9500ea9259a0746475b8f9 [0,2,0,0,0,0|2,0,0]=4 11534 B11R0.76 CCOCNC[C@H](CC)C(=O)O fe1b7bc51673002d51282c552eeebf0f [0,2,0,0,0,0|2,0,0]=4 11535 B11R0.76 CCOCNC[C@H](CO)C(=O)O 4ddde15f8f38e45005f785632ca8278c [0,2,0,0,0,0|2,0,0]=4 11536 B11R0.76 CCSCCNC(CC)C(=O)O de3dd3f3564180c075dffb119f0fa2f9 [0,2,0,0,0,0|2,0,0]=4 11537 B11R0.76 CCSCCNC(CCl)C(=O)O 78f1a3d77fbf200be0c0cbd55df74cbd [0,2,0,0,0,0|2,0,0]=4 11538 B11R0.76 CCSCCNC(CF)C(=O)O 1dcdd770dfc3a3223fe1e7309e0b2452 [0,2,0,0,0,0|2,0,0]=4 11539 B11R0.76 CCSCCNC(CO)C(=O)O 9568f7428f65dfda832bbd799bb373f7 [0,2,0,0,0,0|2,0,0]=4 11540 B11R0.76 CCSCCNC(CS)C(=O)O e348568cb479546d3ccf8923adc949d5 [0,2,0,0,0,0|2,0,0]=4 11541 B11R0.76 CCSCCN[C@@H](CC)C(=O)O d2fc4020e66ec20c4d7d8d5d9b630fac [0,2,0,0,0,0|2,0,0]=4 11542 B11R0.76 CCSCCN[C@@H](CCl)C(=O)O 295e53bccc380a08bd15cdd270d2d9d9 [0,2,0,0,0,0|2,0,0]=4 11543 B11R0.76 CCSCCN[C@@H](CO)C(=O)O 32319e3ecfedf6b604ce8ec22b4711ee [0,2,0,0,0,0|2,0,0]=4 11544 B11R0.76 CCSCCN[C@@H](CS)C(=O)O a222b0f9b5e60ee66ac8ec955a040f62 [0,2,0,0,0,0|2,0,0]=4 11545 B11R0.76 CCSCCN[C@H](CC)C(=O)O 680a470545bcfb29bacb734269216cee [0,2,0,0,0,0|2,0,0]=4 11546 B11R0.76 CCSCCN[C@H](CCl)C(=O)O 4d8f9acb2c319456cda84b446f6184e5 [0,2,0,0,0,0|2,0,0]=4 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[0,2,0,0,0,0|2,0,0]=4 11558 B11R0.76 CC[C@@H](NCCCCF)C(=O)O 09e7e9bfd6d4b24e14e4435b125cf415 [0,2,0,0,0,0|2,0,0]=4 11559 B11R0.76 CC[C@@H](NCCCCO)C(=O)O d32bd506fc33551128e926c68417e249 [0,2,0,0,0,0|2,0,0]=4 11560 B11R0.76 CC[C@@H](NCCCCS)C(=O)O b5c09f0b3e9d9ac726ac64afea0106a2 [0,2,0,0,0,0|2,0,0]=4 11561 B11R0.76 CC[C@@H](NCCCOC)C(=O)O 3a6bb9b4eed32e8b793f199adfdb0974 [0,2,0,0,0,0|2,0,0]=4 11562 B11R0.76 CC[C@@H](NCCCSC)C(=O)O d487d0f23297222621305874ba3b6fd9 [0,2,0,0,0,0|2,0,0]=4 11563 B11R0.76 CC[C@@H](OCCCCF)C(=O)O 19f5d90f506bebe62977e3b98bc79b21 [0,2,0,0,0,0|2,0,0]=4 11564 B11R0.76 CC[C@@H](OCCCCS)C(=O)O 51552f07efb4741d0d712e8e284b486f [0,2,0,0,0,0|2,0,0]=4 11565 B11R0.76 CC[C@@H](OCCCOC)C(=O)O 7ce422677b2e841fbdde9a991f1d8258 [0,2,0,0,0,0|2,0,0]=4 11566 B11R0.76 CC[C@@H](OCCCSC)C(=O)O 88a4ed0d60b4ebcb460f976b4f7ddc64 [0,2,0,0,0,0|2,0,0]=4 11567 B11R0.76 CC[C@H](NCCCCCl)C(=O)O 0fcf1457aeaa2d4d6756830424a55344 [0,2,0,0,0,0|2,0,0]=4 11568 B11R0.76 CC[C@H](NCCCCF)C(=O)O cd90b385b4da438bd55f22a2ca14443e [0,2,0,0,0,0|2,0,0]=4 11569 B11R0.76 CC[C@H](NCCCCO)C(=O)O 2928f2ba1946d60dcf1d1dcf46811d92 [0,2,0,0,0,0|2,0,0]=4 11570 B11R0.76 CC[C@H](NCCCCS)C(=O)O 58a293b5a21443eefc4a17b2fc2b8750 [0,2,0,0,0,0|2,0,0]=4 11571 B11R0.76 CC[C@H](NCCCOC)C(=O)O 8d12e464e7068bbdee44eb94173df2d0 [0,2,0,0,0,0|2,0,0]=4 11572 B11R0.76 CC[C@H](NCCCSC)C(=O)O 2bc411c13a04610ee3304d9d6f07872a [0,2,0,0,0,0|2,0,0]=4 11573 B11R0.76 CC[C@H](OCCCCF)C(=O)O f5cc95a12cb1f73972839c61c8772832 [0,2,0,0,0,0|2,0,0]=4 11574 B11R0.76 CC[C@H](OCCCCS)C(=O)O 14045259be03a43751edc3c54f67ec75 [0,2,0,0,0,0|2,0,0]=4 11575 B11R0.76 CC[C@H](OCCCOC)C(=O)O 673942fa9f9a6e021385ab35ad598b7a [0,2,0,0,0,0|2,0,0]=4 11576 B11R0.76 CC[C@H](OCCCSC)C(=O)O 8e125d58e2b9799437843d0099101bad [0,2,0,0,0,0|2,0,0]=4 11577 B11R0.76 COC(CCNCCF)C(=O)O 454ed5e268578ad938c14f006597edc4 [0,2,0,0,0,0|2,0,0]=4 11578 B11R0.76 COC(CCNCCO)C(=O)O 246ad118d472140101bff58c545e17b6 [0,2,0,0,0,0|2,0,0]=4 11579 B11R0.76 COC(CCNCCS)C(=O)O 676643bd993e363fa230643bad583a26 [0,2,0,0,0,0|2,0,0]=4 11580 B11R0.76 COC(CCNCSC)C(=O)O 60ed0f34c3de7ac3d2db4cda30c27183 [0,2,0,0,0,0|2,0,0]=4 11581 B11R0.76 COCCCNC(CCl)C(=O)O 79c694f98476e366c8cbc4275b95daad [0,2,0,0,0,0|2,0,0]=4 11582 B11R0.76 COCCCNC(CF)C(=O)O 82ec2486ef6f6342ebdcaf021862b428 [0,2,0,0,0,0|2,0,0]=4 11583 B11R0.76 COCCCNC(CO)C(=O)O e3bbb8802601eb67f180cf398069a769 [0,2,0,0,0,0|2,0,0]=4 11584 B11R0.76 COCCCNC(CS)C(=O)O 5a5f7265ed1861f13fffa350e13bd6be [0,2,0,0,0,0|2,0,0]=4 11585 B11R0.76 COCCCN[C@@H](CCl)C(=O)O 5beb04683c18a7d364d9100cb7fb292f [0,2,0,0,0,0|2,0,0]=4 11586 B11R0.76 COCCCN[C@@H](CO)C(=O)O 74e9a5b20a203ea6770b260cea50b070 [0,2,0,0,0,0|2,0,0]=4 11587 B11R0.76 COCCCN[C@@H](CS)C(=O)O abb990a9282d69f2ac34110b9ae92e36 [0,2,0,0,0,0|2,0,0]=4 11588 B11R0.76 COCCCN[C@H](CCl)C(=O)O 9a6525da7b5daf27ea5859d7c3f80b58 [0,2,0,0,0,0|2,0,0]=4 11589 B11R0.76 COCCCN[C@H](CO)C(=O)O 45bf3e7b417a6c287e9edbdf8664044b [0,2,0,0,0,0|2,0,0]=4 11590 B11R0.76 COCCCN[C@H](CS)C(=O)O 7b0f66645850552638b6fee5b096d7b8 [0,2,0,0,0,0|2,0,0]=4 11591 B11R0.76 COCCCO[C@H](CF)C(=O)O f243f07aaf2653f19a4cf232ff02ed24 [0,2,0,0,0,0|2,0,0]=4 11592 B11R0.76 COCCNCC(C#N)C(=O)O 751a7248bad3f73a1f3db88f95e8ee33 [0,2,0,0,0,0|2,0,0]=4 11593 B11R0.76 COCCNC[C@H](CO)C(=O)O fa91d671698b5a875e7f92e82457a031 [0,2,0,0,0,0|2,0,0]=4 11594 B11R0.76 COCNCCC(OC)C(=O)O 9ad6e7ca8962f2739f7f547a08612365 [0,2,0,0,0,0|2,0,0]=4 11595 B11R0.76 CSCCCNC(CCl)C(=O)O 0f6356b14724ec718c71fcfd28199743 [0,2,0,0,0,0|2,0,0]=4 11596 B11R0.76 CSCCCNC(CF)C(=O)O 05bff1488f97e29e744d219dfeabebf4 [0,2,0,0,0,0|2,0,0]=4 11597 B11R0.76 CSCCCNC(CO)C(=O)O 29f44db05627885d3cf1dd60b27f3d2a [0,2,0,0,0,0|2,0,0]=4 11598 B11R0.76 CSCCCNC(CS)C(=O)O e7d080653979c14c0120ee97f40dcbf8 [0,2,0,0,0,0|2,0,0]=4 11599 B11R0.76 CSCCCN[C@@H](CCl)C(=O)O 406a68c9d944e0b8e7f83de7ceeb2a51 [0,2,0,0,0,0|2,0,0]=4 11600 B11R0.76 CSCCCN[C@@H](CO)C(=O)O 69637f2a3e83bd73b1139cd962cb9302 [0,2,0,0,0,0|2,0,0]=4 11601 B11R0.76 CSCCCN[C@@H](CS)C(=O)O 2a597ad3180093239d9373a8d447fde5 [0,2,0,0,0,0|2,0,0]=4 11602 B11R0.76 CSCCCN[C@H](CCl)C(=O)O ab733bc8f3c15b85743932337061279a [0,2,0,0,0,0|2,0,0]=4 11603 B11R0.76 CSCCCN[C@H](CO)C(=O)O f8663281172e45df5531bb2909e88bcf [0,2,0,0,0,0|2,0,0]=4 11604 B11R0.76 CSCCCN[C@H](CS)C(=O)O 0cb42e0d12996c17c776ad515a3c8a02 [0,2,0,0,0,0|2,0,0]=4 11605 B11R0.76 CSCCCO[C@H](CF)C(=O)O 4af5d0cc0ab0b8c1bd32f6c7918ff0f4 [0,2,0,0,0,0|2,0,0]=4 11606 B11R0.76 CSCCNCC(C#N)C(=O)O 6dac585ce4266a670a04f5d216b1e2ee [0,2,0,0,0,0|2,0,0]=4 11607 B11R0.76 CSCCNC[C@H](CO)C(=O)O 05ec58689f77595f1ad4d04a1e52b990 [0,2,0,0,0,0|2,0,0]=4 11608 B11R0.76 N#CC(CNCCCF)C(=O)O 711736e5f92d2b84f72a59399c3e688a [0,2,0,0,0,0|2,0,0]=4 11609 B11R0.76 N#CC(CNCCCO)C(=O)O 62ebad7ed88f5ff641ac6519ecb147b1 [0,2,0,0,0,0|2,0,0]=4 11610 B11R0.76 O=C(O)C(CCl)NCCCCF 3a48d9f52537365d0ba9c0b72b2cccf4 [0,2,0,0,0,0|2,0,0]=4 11611 B11R0.76 O=C(O)C(CCl)NCCCCO bb40bc5541c37f3e2313bd492e95bda3 [0,2,0,0,0,0|2,0,0]=4 11612 B11R0.76 O=C(O)C(CF)NCCCCCl 9ce32673c360609d23cf648979546aea [0,2,0,0,0,0|2,0,0]=4 11613 B11R0.76 O=C(O)C(CF)NCCCCF 57c1ecb1acd133244eaf23259acbce8d [0,2,0,0,0,0|2,0,0]=4 11614 B11R0.76 O=C(O)C(CF)NCCCCO 15560b68a1056ea0013b55667c11e4cd [0,2,0,0,0,0|2,0,0]=4 11615 B11R0.76 O=C(O)C(CF)NCCCCS 6cbb8aae94eb3275f64bee90536d9057 [0,2,0,0,0,0|2,0,0]=4 11616 B11R0.76 O=C(O)C(CO)NCCCCCl c9498bca344e88136f11e5a950a76dae [0,2,0,0,0,0|2,0,0]=4 11617 B11R0.76 O=C(O)C(CO)NCCCCF 1eba39484a0330d6e7a1bc6b372bc74f [0,2,0,0,0,0|2,0,0]=4 11618 B11R0.76 O=C(O)C(CO)NCCCCO 105374b1f4cb8fbb734a4b47d70cbf7c [0,2,0,0,0,0|2,0,0]=4 11619 B11R0.76 O=C(O)C(CO)NCCCCS b51fe3b7561fcb9795f44b2be08d87da [0,2,0,0,0,0|2,0,0]=4 11620 B11R0.76 O=C(O)C(CS)NCCCCF 6d31649f60be6591140103984e45003a [0,2,0,0,0,0|2,0,0]=4 11621 B11R0.76 O=C(O)C(CS)NCCCCO 7500bde23e633b5127bc22598fdb6a77 [0,2,0,0,0,0|2,0,0]=4 11622 B11R0.76 O=C(O)[C@@H](CCl)NCCCCF 32b7075c42b1b2df6a6d1cc07f8fb9c8 [0,2,0,0,0,0|2,0,0]=4 11623 B11R0.76 O=C(O)[C@@H](CCl)NCCCCO 16b1b3de6bd45f41870ef697e093dd48 [0,2,0,0,0,0|2,0,0]=4 11624 B11R0.76 O=C(O)[C@@H](CF)OCCCCF 3a76bb6f7f132d1cd248f77959aa5698 [0,2,0,0,0,0|2,0,0]=4 11625 B11R0.76 O=C(O)[C@@H](CO)CNCCCF 9118b97092cc2f17386355d054e070f7 [0,2,0,0,0,0|2,0,0]=4 11626 B11R0.76 O=C(O)[C@@H](CO)CNCCCO bbf6abfd10dd977e70ffec70360d9446 [0,2,0,0,0,0|2,0,0]=4 11627 B11R0.76 O=C(O)[C@@H](CO)CNCCCS d12e4267365386531cfc508053c970d1 [0,2,0,0,0,0|2,0,0]=4 11628 B11R0.76 O=C(O)[C@@H](CO)NCCCCCl b08aeabd900287a98571b25f7719d3a2 [0,2,0,0,0,0|2,0,0]=4 11629 B11R0.76 O=C(O)[C@@H](CO)NCCCCF 72719700470a075ddeb00dd874fde6ad [0,2,0,0,0,0|2,0,0]=4 11630 B11R0.76 O=C(O)[C@@H](CO)NCCCCO 53952dc16eaa15d2d86804c433eedebe [0,2,0,0,0,0|2,0,0]=4 11631 B11R0.76 O=C(O)[C@@H](CO)NCCCCS 8d35a7447ad55c152e8fbb1519b70520 [0,2,0,0,0,0|2,0,0]=4 11632 B11R0.76 O=C(O)[C@@H](CS)NCCCCF 09940966286e85a5c0fea7d196024e4e [0,2,0,0,0,0|2,0,0]=4 11633 B11R0.76 O=C(O)[C@@H](CS)NCCCCO c695ed6a023c313cdafdcb2104b2a300 [0,2,0,0,0,0|2,0,0]=4 11634 B11R0.76 O=C(O)[C@H](CCl)NCCCCF fb0a61078205230cf368f9cf4ac7c614 [0,2,0,0,0,0|2,0,0]=4 11635 B11R0.76 O=C(O)[C@H](CCl)NCCCCO 5d942d225ad7bba6764de7ad740165a5 [0,2,0,0,0,0|2,0,0]=4 11636 B11R0.76 O=C(O)[C@H](CO)NCCCCCl d9c4184b1f2afc3987948e6a3a625374 [0,2,0,0,0,0|2,0,0]=4 11637 B11R0.76 O=C(O)[C@H](CO)NCCCCF 8fa64000fad2839290b9a934f12b0db9 [0,2,0,0,0,0|2,0,0]=4 11638 B11R0.76 O=C(O)[C@H](CO)NCCCCO 667385576a5e9745a2743ee354239377 [0,2,0,0,0,0|2,0,0]=4 11639 B11R0.76 O=C(O)[C@H](CO)NCCCCS da3dc9118c08314335008f7af90a4afc [0,2,0,0,0,0|2,0,0]=4 11640 B11R0.76 O=C(O)[C@H](CS)NCCCCF 413174273c9a74ccceab341976f1292d [0,2,0,0,0,0|2,0,0]=4 11641 B11R0.76 O=C(O)[C@H](CS)NCCCCO d08b4f69a0fd598eece5583c8f77d38b [0,2,0,0,0,0|2,0,0]=4 11642 B11R0.125 CC(C)(CCNCCF)C(=O)O 4c2bbb64fcc8465dea517809a12e650b [0,2,0,0,0,0|2,0,0]=4 11643 B11R0.125 CC(C)(CCNCCO)C(=O)O ae789116f4a1313cec62a5a4bf99f4e1 [0,2,0,0,0,0|2,0,0]=4 11644 B11R0.125 CC(C)(CCNCCS)C(=O)O 0e36bccca5fffd5d8aabb8914b9761bd [0,2,0,0,0,0|2,0,0]=4 11645 B11R0.125 CC(C)(CNCCCCl)C(=O)O 88699d23de239a643ad4bb5de4e5becb [0,2,0,0,0,0|2,0,0]=4 11646 B11R0.125 CC(C)(CNCCCF)C(=O)O 6843b145b97774b66abb654ad82dfb4a [0,2,0,0,0,0|2,0,0]=4 11647 B11R0.125 CC(C)(CNCCCO)C(=O)O 1def1a18ba92cf7364372121f9a4d50f [0,2,0,0,0,0|2,0,0]=4 11648 B11R0.125 CC(C)(CNCCCS)C(=O)O 84661fc60700de6ffdc2f2c74efb721c [0,2,0,0,0,0|2,0,0]=4 11649 B11R0.125 CC(C)(COCCCF)C(=O)O c93d5c05229a3c59ab2a1b190959a815 [0,2,0,0,0,0|2,0,0]=4 11650 B11R0.125 CC(C)(COCCCS)C(=O)O aaba8da5986f3ff7e9e4b7a34096f620 [0,2,0,0,0,0|2,0,0]=4 11651 B11R0.125 CC(C)(NCCCCF)C(=O)O 3f56d93b2d0e7908d957f0f3e271b486 [0,2,0,0,0,0|2,0,0]=4 11652 B11R0.125 CC(C)(NCCCCO)C(=O)O ea346df137576373f914a788ad880e0b [0,2,0,0,0,0|2,0,0]=4 11653 B11R0.125 CC(O)(CNCCCCl)C(=O)O 024eaa28e091e79f2f1798fd0294e4e8 [0,2,0,0,0,0|2,0,0]=4 11654 B11R0.125 CC(O)(CNCCCO)C(=O)O 26b229965c77e77d1c1d473d29a9e27f [0,2,0,0,0,0|2,0,0]=4 11655 B11R0.125 CC(O)(COCCCF)C(=O)O 11d310e6b85c3c6a2a34d75cbac62640 [0,2,0,0,0,0|2,0,0]=4 11656 B11R0.125 CC(O)(COCCCS)C(=O)O d7e6d9d33067c6804ecccd3f09ad47b2 [0,2,0,0,0,0|2,0,0]=4 11657 B11R0.125 CCCCCNC(C)(C)C(=O)C 2aa6b3da83a9a8571c4f550d53b26b4a [0,2,0,0,0,0|2,0,0]=4 11658 B11R0.125 CCCCCNC(C)(C)C(=O)N dea3764303f6ebb143fe3980b04eaab0 [0,2,0,0,0,0|2,0,0]=4 11659 B11R0.125 CCCCCNC(C)(C)C(=O)O 9aa1dbc4eb827782e24b494146fea67a [0,2,0,0,0,0|1,0,0]=3 11660 B11R0.125 CCCCNCC(C)(C)C(=O)F 6b422aaeae35bc3a9f8f9b1a59478a41 [0,2,0,0,0,0|2,0,0]=4 11661 B11R0.125 CCCCNCC(C)(C)C(=O)N 4c4e4bb3a5e3cdc4961a7881138724af [0,2,0,0,0,0|2,0,0]=4 11662 B11R0.125 CCCCNCC(C)(C)C(=O)O c07ebc3db051f573f963f4517da0fd45 [0,2,0,0,0,0|1,0,0]=3 11663 B11R0.125 CCCCNCC(C)(O)C(=O)O 630292fddf5efce96e67b40c4e3479c8 [0,2,0,0,0,0|1,0,0]=3 11664 B11R0.125 CCCCNCC(F)(F)C(=O)O 80a0ed168ebed4ffec092ff9f1d2e4fa [0,2,0,0,0,0|1,0,0]=3 11665 B11R0.125 CCCCNC[C@@](C)(O)C(=O)O 16be6e717bb4b05c3b6a71f47cf789a3 [0,2,0,0,0,0|1,0,0]=3 11666 B11R0.125 CCCCNC[C@](C)(O)C(=O)O 64e7089ec0bdd3a910505a3cfc9d9bcf [0,2,0,0,0,0|1,0,0]=3 11667 B11R0.125 CCCCOCC(C)(C)C(=O)C 060f34bcfb63195ba069019ddf3ba615 [0,2,0,0,0,0|2,0,0]=4 11668 B11R0.125 CCCCOCC(C)(C)C(=O)F 17cf5cbb091aaa5d239e661ce04e73c4 [0,2,0,0,0,0|2,0,0]=4 11669 B11R0.125 CCCCOCC(C)(C)C(=O)N 07f0e0821c8caf906328bc75b3ebaf33 [0,2,0,0,0,0|2,0,0]=4 11670 B11R0.125 CCCCOCC(C)(C)C(=O)O d60239bbf74f783a51423d4b661cf875 [0,2,0,0,0,0|1,0,0]=3 11671 B11R0.125 CCCCOCC(C)(O)C(=O)O 7952eca172280a5f9fac9858ec7a46b9 [0,2,0,0,0,0|1,0,0]=3 11672 B11R0.125 CCCCOC[C@@](C)(O)C(=O)O 077d3bd149cd0a29daa5114cb89a2461 [0,2,0,0,0,0|1,0,0]=3 11673 B11R0.125 CCCCOC[C@](C)(O)C(=O)O 94f0904d356f694be8d7a90111ee19e4 [0,2,0,0,0,0|1,0,0]=3 11674 B11R0.125 CCCNCCC(C)(C)C(=O)O 4954d29b31cd7e771c9950c0465d7590 [0,2,0,0,0,0|1,0,0]=3 11675 B11R0.125 CCCOCCC(C)(C)C(=O)N 9eb1e6436b9fc0e89b2ba36f3176249e [0,2,0,0,0,0|2,0,0]=4 11676 B11R0.125 CCOCCNC(C)(C)C(=O)O ec7c232fdd63ab8474a2d8f4e5da4198 [0,2,0,0,0,0|2,0,0]=4 11677 B11R0.125 CCOCNCC(C)(C)C(=O)O 08a880b14e1106079b960f779f95c91d [0,2,0,0,0,0|2,0,0]=4 11678 B11R0.125 CCOCNCC(F)(F)C(=O)O 510824c2b487719432565aa277ee582e [0,2,0,0,0,0|2,0,0]=4 11679 B11R0.125 CCSCCNC(C)(C)C(=O)O e18509229a2ec0b9b9d58ac97b4de651 [0,2,0,0,0,0|2,0,0]=4 11680 B11R0.125 COCCCNC(C)(C)C(=O)O f7fca69d94f2355fcbaa662bdfffeaae [0,2,0,0,0,0|2,0,0]=4 11681 B11R0.125 COCCNCC(C)(C)C(=O)O b3077d92163c095ca8af28c7068e91de [0,2,0,0,0,0|2,0,0]=4 11682 B11R0.125 COCCNCC(C)(O)C(=O)O 91059fab318e3aa10221b9b326509159 [0,2,0,0,0,0|2,0,0]=4 11683 B11R0.125 COCCNCC(F)(F)C(=O)O 2ae564af68229845d0264cf942d8f9a0 [0,2,0,0,0,0|2,0,0]=4 11684 B11R0.125 COCCNC[C@@](C)(O)C(=O)O 0c7d2009ef31b78a03db452eea4f4625 [0,2,0,0,0,0|2,0,0]=4 11685 B11R0.125 COCCNC[C@](C)(O)C(=O)O 25067e8edd1cdf05d5862017f8e889f8 [0,2,0,0,0,0|2,0,0]=4 11686 B11R0.125 COCCOCC(C)(C)C(=O)O 81214fb0f7998f015e6271cc3f87ee14 [0,2,0,0,0,0|2,0,0]=4 11687 B11R0.125 COCCOCC(C)(O)C(=O)O 1c72441d1566a782b53b5b3c9efac141 [0,2,0,0,0,0|2,0,0]=4 11688 B11R0.125 COCCOC[C@@](C)(O)C(=O)O 51e0b79f5d14e92a9ec9342506441e14 [0,2,0,0,0,0|2,0,0]=4 11689 B11R0.125 COCCOC[C@](C)(O)C(=O)O 27f2161713872bcce9df1a724d51d7c9 [0,2,0,0,0,0|2,0,0]=4 11690 B11R0.125 COCNCCC(C)(C)C(=O)O 39adcced14e22460ca5846985fcd0ed7 [0,2,0,0,0,0|2,0,0]=4 11691 B11R0.125 CSCCCNC(C)(C)C(=O)O 394d5eefdc47a8483e387f8c84a32646 [0,2,0,0,0,0|2,0,0]=4 11692 B11R0.125 CSCCNCC(C)(C)C(=O)O bc9cd9cab1003dc0519ddbd498c10286 [0,2,0,0,0,0|2,0,0]=4 11693 B11R0.125 CSCCNCC(C)(O)C(=O)O 389a6041161583c132101725b4487543 [0,2,0,0,0,0|2,0,0]=4 11694 B11R0.125 CSCCNCC(F)(F)C(=O)O 0f4f89842a5414dba6fb55ac55c49fde [0,2,0,0,0,0|2,0,0]=4 11695 B11R0.125 CSCCNC[C@@](C)(O)C(=O)O f306ce35146e0e894d5a8db6d9d3228b [0,2,0,0,0,0|2,0,0]=4 11696 B11R0.125 CSCCNC[C@](C)(O)C(=O)O 9c408039cc9d0376e5140eab42fd6ca7 [0,2,0,0,0,0|2,0,0]=4 11697 B11R0.125 CSCCOCC(C)(C)C(=O)O 662f3d27b880fd2c067e25b1cca2979f [0,2,0,0,0,0|2,0,0]=4 11698 B11R0.125 CSCCOCC(C)(O)C(=O)O 2f491c4a5d295c0c709781f3c308e24c [0,2,0,0,0,0|2,0,0]=4 11699 B11R0.125 CSCCOC[C@@](C)(O)C(=O)O b26c2588eae91ef709b9a334c2e1be5e [0,2,0,0,0,0|2,0,0]=4 11700 B11R0.125 CSCCOC[C@](C)(O)C(=O)O 8cbbc0a8fd61b85368fd0136094cf744 [0,2,0,0,0,0|2,0,0]=4 11701 B11R0.125 CSCNCCC(C)(C)C(=O)O 5ab99d8fec9e835210bc6a7ff86a93f3 [0,2,0,0,0,0|2,0,0]=4 11702 B11R0.125 C[C@@](O)(CNCCCCl)C(=O)O e0b2d50426d18d4c840f6340911166ed [0,2,0,0,0,0|2,0,0]=4 11703 B11R0.125 C[C@@](O)(CNCCCO)C(=O)O 1e3dbf75e542319c823123dd1e8e1f44 [0,2,0,0,0,0|2,0,0]=4 11704 B11R0.125 C[C@@](O)(COCCCF)C(=O)O 1649752345ffead0d7e4d0195c639e4f [0,2,0,0,0,0|2,0,0]=4 11705 B11R0.125 C[C@@](O)(COCCCS)C(=O)O 81e3755acd4158cdfbd0fa413dca4c28 [0,2,0,0,0,0|2,0,0]=4 11706 B11R0.125 C[C@](O)(CNCCCCl)C(=O)O c8b995e73cdf40735528579479c4f02d [0,2,0,0,0,0|2,0,0]=4 11707 B11R0.125 C[C@](O)(CNCCCO)C(=O)O b0a8b5e8d37fcf8cdcb9a296f0993983 [0,2,0,0,0,0|2,0,0]=4 11708 B11R0.125 C[C@](O)(COCCCF)C(=O)O 16b4e815627e0f2c401d47e74df882a0 [0,2,0,0,0,0|2,0,0]=4 11709 B11R0.125 C[C@](O)(COCCCS)C(=O)O c16a4f21b611a5d4adc05c6d27334965 [0,2,0,0,0,0|2,0,0]=4 11710 B11R0.125 O=C(O)C(F)(F)CNCCCF 40ecc1149ea515e9e26c757ab7554bdf [0,2,0,0,0,0|2,0,0]=4 11711 B11R0.125 O=C(O)C(F)(F)CNCCCO 7b5cf5d8db55a7ecbadc1d5327da6178 [0,2,0,0,0,0|2,0,0]=4 11712 B11R0.125 O=C(O)C(F)(F)CNCCCS d8b3bacaa2f5a75cd3395a91accd76f4 [0,2,0,0,0,0|2,0,0]=4 11713 B11R0.163 C=C(CN(C)CCCC)C(=O)O 26e85ab7a9083ec4b4370596f77535bd [0,2,0,0,0,0|1,0,1]=4 11714 B11R0.163 CC(CCCO)NC(C)C(=O)O b71db67084b308674e5ece444ab5348b [0,2,0,0,0,0|2,0,0]=4 11715 B11R0.163 CC(CCCO)NC(O)C(=O)O 4607cb8afdaedfa031aa220161af1862 [0,2,0,0,0,0|2,0,0]=4 11716 B11R0.163 CC(CCCO)N[C@@H](C)C(=O)O b47e06954a69afb65e2d9d2ced9865cd [0,2,0,0,0,0|2,0,0]=4 11717 B11R0.163 CC(CCCO)N[C@H](C)C(=O)O 6e756070e1eab71921bc55709b3280f3 [0,2,0,0,0,0|2,0,0]=4 11718 B11R0.163 CC(CN(C)CCCO)C(=O)O 1aab16f0ac5ffc06d7d8be43d6d7abf5 [0,2,0,0,0,0|2,0,0]=4 11719 B11R0.163 CCCCC(C)NC(C)C(=O)C fa81c2073b456f190a71a92b8c67d9d0 [0,2,0,0,0,0|2,0,0]=4 11720 B11R0.163 CCCCC(C)NC(C)C(=O)N ab792b628489c1e96b63af4def8ee9a2 [0,2,0,0,0,0|2,0,0]=4 11721 B11R0.163 CCCCC(C)NC(C)C(=O)O 7ab30410cae7b55db37b9f951e3a275a [0,2,0,0,0,0|1,0,0]=3 11722 B11R0.163 CCCCC(C)NC(F)C(=O)N 97386fea910e36262e88091ff16a45c8 [0,2,0,0,0,0|2,0,0]=4 11723 B11R0.163 CCCCC(C)NC(O)C(=O)O e9c7e5720c804ec4f8b82c73ae27526c [0,2,0,0,0,0|1,0,0]=3 11724 B11R0.163 CCCCC(C)N[C@@H](C)C(=O)N cc32affaf368b737f9e8392e0de35ab0 [0,2,0,0,0,0|2,0,0]=4 11725 B11R0.163 CCCCC(C)N[C@@H](C)C(=O)O 443166eb17a429278ee7aa872ae18b9a [0,2,0,0,0,0|1,0,0]=3 11726 B11R0.163 CCCCC(C)N[C@H](C)C(=O)N 0c55bb008da7a05e6d4b9c8d92a3c534 [0,2,0,0,0,0|2,0,0]=4 11727 B11R0.163 CCCCC(C)N[C@H](C)C(=O)O ff8c336f577b29aadb47a936c6a57f9a [0,2,0,0,0,0|1,0,0]=3 11728 B11R0.163 CCCCC(C)OC(C)C(=O)C 3e20f4fc3ab682640005f421c9bad07d [0,2,0,0,0,0|2,0,0]=4 11729 B11R0.163 CCCCC(C)OC(C)C(=O)N cd7dc9d53403b7368fa66ad932893310 [0,2,0,0,0,0|2,0,0]=4 11730 B11R0.163 CCCCC(C)OC(F)C(=O)N 3b8fb98cea7f7893e0b3297fd17dff81 [0,2,0,0,0,0|2,0,0]=4 11731 B11R0.163 CCCCC(C)O[C@@H](C)C(=O)N c50e7fedb2d6b29e8af0e39f7b5d2da1 [0,2,0,0,0,0|2,0,0]=4 11732 B11R0.163 CCCCC(C)O[C@H](C)C(=O)N f658110f3b7d565bf51a0fd6b56825fc [0,2,0,0,0,0|2,0,0]=4 11733 B11R0.163 CCCCN(C)CC(=O)C(=O)O b1c24cf4d4d71682bb41599c7986d63f [0,2,0,0,0,0|1,0,1]=4 11734 B11R0.163 CCCCN(C)CC(C)C(=O)O 63f1baec53b4fe345bbe12e7eda7ef85 [0,2,0,0,0,0|1,0,0]=3 11735 B11R0.163 CCCCN(C)CC(O)C(=O)O 0e54810fac86f0f0bb0e5047571ff391 [0,2,0,0,0,0|1,0,0]=3 11736 B11R0.163 CCCCN(C)C[C@H](O)C(=O)O fd5eac6ed056427e9ac86703e2db7b28 [0,2,0,0,0,0|1,0,0]=3 11737 B11R0.163 CCCC[C@@H](C)NC(C)C(=O)C 508096b0f847bfc5a1386656289d8591 [0,2,0,0,0,0|2,0,0]=4 11738 B11R0.163 CCCC[C@@H](C)NC(C)C(=O)N fdb90397ce78b83ad6843da69cfb3f85 [0,2,0,0,0,0|2,0,0]=4 11739 B11R0.163 CCCC[C@@H](C)NC(C)C(=O)O 5ddc4611fb5ea16d204fd099e89a5629 [0,2,0,0,0,0|1,0,0]=3 11740 B11R0.163 CCCC[C@@H](C)NC(F)C(=O)N c60912388939ba039a5fc71866500e22 [0,2,0,0,0,0|2,0,0]=4 11741 B11R0.163 CCCC[C@@H](C)N[C@@H](C)C(=O)N 9297c07994c24a3886a72512c777c2a7 [0,2,0,0,0,0|2,0,0]=4 11742 B11R0.163 CCCC[C@@H](C)N[C@@H](C)C(=O)O 4344ee6914c0b51b37a7b57371781b62 [0,2,0,0,0,0|1,0,0]=3 11743 B11R0.163 CCCC[C@@H](C)N[C@H](C)C(=O)N 2715dbd159c0c4f9bcde591f9761d2df [0,2,0,0,0,0|2,0,0]=4 11744 B11R0.163 CCCC[C@@H](C)N[C@H](C)C(=O)O 4b29f0f4dbe8bf6c2ae1fbf3e9014f6b [0,2,0,0,0,0|1,0,0]=3 11745 B11R0.163 CCCC[C@@H](C)OC(C)C(=O)C 32aa7c49bc1e2faa901595e7d979fad1 [0,2,0,0,0,0|2,0,0]=4 11746 B11R0.163 CCCC[C@@H](C)OC(C)C(=O)N 5ae714f8920bd760fabecad670ab5ce0 [0,2,0,0,0,0|2,0,0]=4 11747 B11R0.163 CCCC[C@@H](C)OC(F)C(=O)N 8a0306cb9df19799445800854a34dea6 [0,2,0,0,0,0|2,0,0]=4 11748 B11R0.163 CCCC[C@@H](C)O[C@@H](C)C(=O)N a8b7502270f843da670f2f81edfabbe9 [0,2,0,0,0,0|2,0,0]=4 11749 B11R0.163 CCCC[C@@H](C)O[C@H](C)C(=O)N 45af82817b9dc196de61e40f83a7aa22 [0,2,0,0,0,0|2,0,0]=4 11750 B11R0.163 CCCC[C@H](C)OC(C)C(=O)C 4dd7572b8c4abd8660280c6ec20486e0 [0,2,0,0,0,0|2,0,0]=4 11751 B11R0.163 CCCC[C@H](C)OC(C)C(=O)N 0bf86bbf0bfc5655e8879f23a7ce4794 [0,2,0,0,0,0|2,0,0]=4 11752 B11R0.163 CCCC[C@H](C)OC(F)C(=O)N 72534eb88108b6f942959ab59a8ba541 [0,2,0,0,0,0|2,0,0]=4 11753 B11R0.163 CCCC[C@H](C)O[C@@H](C)C(=O)N 0b34fecb28da9696ccade4b192f1b8a1 [0,2,0,0,0,0|2,0,0]=4 11754 B11R0.163 CCCC[C@H](C)O[C@H](C)C(=O)N e19e43127c267944e96a22b541cc8cee [0,2,0,0,0,0|2,0,0]=4 11755 B11R0.163 CCOCN(C)C[C@H](O)C(=O)O 11f33ce2607d460b5ec59ffdf7fcf97e [0,2,0,0,0,0|2,0,0]=4 11756 B11R0.163 CN(CCCF)C[C@H](O)C(=O)O 2f3fb6a8aa2c987020c14dc10be4cef8 [0,2,0,0,0,0|2,0,0]=4 11757 B11R0.163 CN(CCCO)CC(O)C(=O)O 547000449cd1f4d189e6c6fa99f59c23 [0,2,0,0,0,0|2,0,0]=4 11758 B11R0.163 CN(CCCO)C[C@H](O)C(=O)O 6538de8e8fccae7d846b57cce2b823fd [0,2,0,0,0,0|2,0,0]=4 11759 B11R0.163 CN(CCCS)C[C@H](O)C(=O)O bc1e440a5e33db316d80b7758594f35d [0,2,0,0,0,0|2,0,0]=4 11760 B11R0.163 COCCN(C)CC(C)C(=O)O 973af07ae77eecf5a397c34fd24b1ff8 [0,2,0,0,0,0|2,0,0]=4 11761 B11R0.163 COCCN(C)C[C@H](O)C(=O)O b7da099e7820ea6de764eec44573dc74 [0,2,0,0,0,0|2,0,0]=4 11762 B11R0.163 CSCCN(C)CC(C)C(=O)O 0b1d040e9c0690e46d4c210ba86f83c2 [0,2,0,0,0,0|2,0,0]=4 11763 B11R0.163 CSCCN(C)C[C@H](O)C(=O)O d7adc71ff96f32aa6c2622ddadc9a66a [0,2,0,0,0,0|2,0,0]=4 11764 B11R0.85 C=C(C)CCN(C)CCC(=O)O bad8a956dd9ab66fedc704936af520eb [0,2,0,0,0,0|1,0,1]=4 11765 B11R0.85 C=C(C)CNC(C)CCC(=O)O d770c48b35a6944e288910fe1e1adb50 [0,2,0,0,0,0|1,0,1]=4 11766 B11R0.85 C=C(C)CN[C@@H](C)CCC(=O)O aa37a278472f58a14aee1f475c04e15f [0,2,0,0,0,0|1,0,1]=4 11767 B11R0.85 C=C(C)COC(C)CCC(=O)O e788c4197d350de80315bc5820d22273 [0,2,0,0,0,0|1,0,1]=4 11768 B11R0.85 CC(=O)CCN(C)CCC(=O)O ccf0604ee547df957c2a5ecf84828722 [0,2,0,0,0,0|1,0,1]=4 11769 B11R0.85 CC(=O)CCN(C)CCC(C)C 248265a69dc8291432fd58ebb87dee07 [0,2,0,0,0,0|2,0,0]=4 11770 B11R0.85 CC(=O)CCN(C)CCC(C)O 2402dbf6ff4fda4b331afef2f789e44d [0,2,0,0,0,0|2,0,0]=4 11771 B11R0.85 CC(=O)CNC(C)CCC(C)C 3df8973a97db7e328873b27cec91bea0 [0,2,0,0,0,0|2,0,0]=4 11772 B11R0.85 CC(=O)COC(C)CCC(=O)O a7359b8d983481d3e4127c046af752ba [0,2,0,0,0,0|1,0,1]=4 11773 B11R0.85 CC(=O)COC(C)CCC(C)C 30ed8bf13536fc1ba09950c04b4633a7 [0,2,0,0,0,0|2,0,0]=4 11774 B11R0.85 CC(C)CCC(C)NCC(=O)N 9ab22ac5ec8922ce452bbea0f38a546d [0,2,0,0,0,0|2,0,0]=4 11775 B11R0.85 CC(C)CCC(C)NCC(=O)O f55a261811fdde29b8d6fb25b74888e7 [0,2,0,0,0,0|1,0,0]=3 11776 B11R0.85 CC(C)CCC(C)OCC(=O)N de728c1f01eb1ce5276a7c9681e6732d [0,2,0,0,0,0|2,0,0]=4 11777 B11R0.85 CC(C)CCC(C)OCC(=O)O b636f97caf878514ec37901c2ee96154 [0,2,0,0,0,0|1,0,0]=3 11778 B11R0.85 CC(C)CCC(C)OCS(=O)O a1f264ac2e40f5c09e73828e4485c363 [0,2,0,0,0,0|2,0,0]=4 11779 B11R0.85 CC(C)CCN(C)CCC(=O)N 4603e675051fd03bea1dba3a23850696 [0,2,0,0,0,0|2,0,0]=4 11780 B11R0.85 CC(C)CCN(C)CCC(=O)O 91becdb51f7ea3710cf9d0e4e820a44f [0,2,0,0,0,0|1,0,0]=3 11781 B11R0.85 CC(C)CNC(C)CCC(=O)O eb0e3364b2327656e587f6f6200174f7 [0,2,0,0,0,0|1,0,0]=3 11782 B11R0.85 CC(C)CN[C@@H](C)CCC(=O)O d130be53e5e0660221edbaebca35f6d0 [0,2,0,0,0,0|1,0,0]=3 11783 B11R0.85 CC(C)COC(C)CCC(=O)O c71efad6b0ee53531cee1651fc8384d8 [0,2,0,0,0,0|1,0,0]=3 11784 B11R0.85 CC(C)NCC(=O)CCC(=O)O 0bb82d745fd894038c0a3783262a7bff [0,2,0,0,0,0|1,0,1]=4 11785 B11R0.85 CC(C)OCC(=O)CCC(=O)O 0261cf551b04c65a65b35e16ac5380df [0,2,0,0,0,0|1,0,1]=4 11786 B11R0.85 CC(C)OCC(C)OCC(=O)O c01babcdd56cf2c2d856620f3116abb0 [0,2,0,0,0,0|2,0,0]=4 11787 B11R0.85 CC(C)OCN(C)CCC(=O)O df9730706f811e349cb24b5004ecf8b8 [0,2,0,0,0,0|2,0,0]=4 11788 B11R0.85 CC(C)OC[C@H](C)OCC(=O)O cbd66b397eafa12f4695d79db5b9c265 [0,2,0,0,0,0|2,0,0]=4 11789 B11R0.85 CC(CCC(=O)O)NCC(F)F 8359de3d58856c18b8df3faa824e588f [0,2,0,0,0,0|2,0,0]=4 11790 B11R0.85 CC(CCC(=O)O)NCN(C)C ca12ebae2515985e769d6eef6bace660 [0,2,0,0,0,0|2,0,0]=4 11791 B11R0.85 CC(CCC(=O)O)NC[C@H](C)O 27fb0e0c59d4a9a04123a682358c5111 [0,2,0,0,0,0|1,0,0]=3 11792 B11R0.85 CC(CCC(=O)O)OCC(F)F cbd24aa18ebc889408fe3ab670d2e38f [0,2,0,0,0,0|2,0,0]=4 11793 B11R0.85 CC(CCC(=O)O)OCN(C)C c0cc4ff1c42a3520c71ff3038961ba8e [0,2,0,0,0,0|2,0,0]=4 11794 B11R0.85 CC(CCC(=O)O)OC[C@@H](C)F 4bf008dc01341f3072aeed0e127859a0 [0,2,0,0,0,0|1,0,0]=3 11795 B11R0.85 CC(CCC(=O)O)OC[C@H](C)F 7bb83ec86664f8925c0aa9360b6d9719 [0,2,0,0,0,0|1,0,0]=3 11796 B11R0.85 CC(CCN(C)C)NCC(=O)O 2b7825e4e8951f1e659ecb89551437da [0,2,0,0,0,0|2,0,0]=4 11797 B11R0.85 CC(CCN(C)C)OCC(=O)O 60f31961c8d3f01a83acdd254de75e37 [0,2,0,0,0,0|2,0,0]=4 11798 B11R0.85 CC(F)COC(C)CCC(=O)O 112fcbb2b164a91a0309b27d36c8490b [0,2,0,0,0,0|1,0,0]=3 11799 B11R0.85 CC(O)CCN(C)CCC(=O)N 83ba469be530f5a9d8f9a4b21bccf905 [0,2,0,0,0,0|2,0,0]=4 11800 B11R0.85 CC(O)CCN(C)CCC(=O)O 50cca8d4d40e6d85d9afb673a2ec50f3 [0,2,0,0,0,0|1,0,0]=3 11801 B11R0.85 CC(O)CNC(C)CCC(=O)O aae524f7b99a6d44eeeb0ee87d1d21a3 [0,2,0,0,0,0|1,0,0]=3 11802 B11R0.85 CC(O)CN[C@@H](C)CCC(=O)O 87eb3f3bc66c7e6a1019fb6313488cc8 [0,2,0,0,0,0|1,0,0]=3 11803 B11R0.85 CN(C)CCN(C)CCC(=O)O 029126ba804c5d916b856aecdd4ead4c [0,2,0,0,0,0|2,0,0]=4 11804 B11R0.85 CN(CCC(=O)O)CCC(F)F c3711cc0c930e6a6509e9a57287af19e [0,2,0,0,0,0|2,0,0]=4 11805 B11R0.85 CN(CCC(=O)O)CCS(=O)C 45d1dfa9deb92858f383359428d113a7 [0,2,0,0,0,0|2,0,0]=4 11806 B11R0.85 C[C@@H](CCC(=O)O)NCC(F)F ba6a59a450d6b099e10cf509067fa33f [0,2,0,0,0,0|2,0,0]=4 11807 B11R0.85 C[C@@H](CCC(=O)O)NCN(C)C 6e37cd9125512dedc566971db3bc3ba1 [0,2,0,0,0,0|2,0,0]=4 11808 B11R0.85 C[C@@H](CCN(C)C)NCC(=O)O b49c61cf9c7d359bc800a9f43dd69d7c [0,2,0,0,0,0|2,0,0]=4 11809 B11R0.85 C[C@H](CCN(C)C)NCC(=O)O 8707f8d50c0e887230d0dd351b5b6511 [0,2,0,0,0,0|2,0,0]=4 11810 B11R0.85 C[C@H](O)CN[C@@H](C)CCC(=O)O 56e413831dbbdcd2f73fc55782855d2e [0,2,0,0,0,0|1,0,0]=3 11811 B11R0.164 C#CC(CCCC)OCC(=O)N 1d207966f5da13936d9f6bf30301046b [0,2,0,0,0,0|2,0,0]=4 11812 B11R0.164 C#CC(CCCC)OCC(=O)O 7e7da104e7c635ef6b462bb68a7a863d [0,2,0,0,0,0|1,0,0]=3 11813 B11R0.164 C=CC(CCC(=O)O)NCCC d38c2c10f601664647ed98f5fe3e7ea5 [0,2,0,0,0,0|1,0,0]=3 11814 B11R0.164 C=CC(CCC(=O)O)NCCF 8a33644e7dbb1e48ea0365a03d240f73 [0,2,0,0,0,0|2,0,0]=4 11815 B11R0.164 C=CC(CCC(=O)O)NCCO 2297f83a8f84ed2c9bdd61911823451e [0,2,0,0,0,0|2,0,0]=4 11816 B11R0.164 C=CC(CCC(=O)O)NCCS 790297a78295524bd4e68c3d1a2d641b [0,2,0,0,0,0|2,0,0]=4 11817 B11R0.164 C=CC(CCC(=O)O)NCOC 407b3dcf7c40bbc1319982907c9e18ca [0,2,0,0,0,0|2,0,0]=4 11818 B11R0.164 C=CC(CCC(=O)O)NCSC 30bb8f1876ebf51ac13444b67acd5b02 [0,2,0,0,0,0|2,0,0]=4 11819 B11R0.164 C=CC(CCCC)OCC(=O)N 25c15bcd631f1442a9c2fc0a873303dc [0,2,0,0,0,0|2,0,0]=4 11820 B11R0.164 C=CC(CCCC)OCC(=O)O 21b499b5330ca5eea066443100897b22 [0,2,0,0,0,0|1,0,0]=3 11821 B11R0.164 C=C[C@H](CCC(=O)O)NCCC a2e96507267914a500f2da58d28cfea1 [0,2,0,0,0,0|1,0,0]=3 11822 B11R0.164 C=C[C@H](CCC(=O)O)NCCF 017309e6a94e18594829b63280ff1c75 [0,2,0,0,0,0|2,0,0]=4 11823 B11R0.164 C=C[C@H](CCC(=O)O)NCCO 67ad4643a06cf066f9f52a2197c7cb79 [0,2,0,0,0,0|2,0,0]=4 11824 B11R0.164 C=C[C@H](CCC(=O)O)NCCS 1045624fe18af4ccae6322b9e0a9ca8c [0,2,0,0,0,0|2,0,0]=4 11825 B11R0.164 C=C[C@H](CCC(=O)O)NCOC 7f0160c83fffaa20eb2e77fde7fb8dea [0,2,0,0,0,0|2,0,0]=4 11826 B11R0.164 C=C[C@H](CCC(=O)O)NCSC bf67ed8044c9227829fbaabe714bb53d [0,2,0,0,0,0|2,0,0]=4 11827 B11R0.164 CCCCC(CC)CNC(=O)C 092cbec5d95206f3dd73d43c1499e0ae [0,2,0,0,0,0|2,0,0]=4 11828 B11R0.164 CCCCC(CC)NCC(=O)C 278a6255d6ad25ef9d825e434160bc89 [0,2,0,0,0,0|2,0,0]=4 11829 B11R0.164 CCCCC(CC)NCC(=O)N 886fca8e4b701dacef52ac985f749d33 [0,2,0,0,0,0|2,0,0]=4 11830 B11R0.164 CCCCC(CC)NCC(=O)O 0a9ba9468e01bc05f3df3c050759f056 [0,2,0,0,0,0|1,0,0]=3 11831 B11R0.164 CCCCC(CC)OCC(=O)C 8f292c4a5463fb2df01179e4439b4051 [0,2,0,0,0,0|2,0,0]=4 11832 B11R0.164 CCCCC(CC)OCC(=O)N de5351257d4503db8137ecc3bada6e4f [0,2,0,0,0,0|2,0,0]=4 11833 B11R0.164 CCCCC(CC)OCC(=O)O 81545feb4b6c0500506b0979d2ee1ac0 [0,2,0,0,0,0|1,0,0]=3 11834 B11R0.164 CCCCC(CC)OCS(=O)O 7795250698c2ce03fb4e1b72bc8910de [0,2,0,0,0,0|2,0,0]=4 11835 B11R0.164 CCCCC(CO)NCC(=O)C 0b4e7802926c365d99ede1a7159bdb18 [0,2,0,0,0,0|2,0,0]=4 11836 B11R0.164 CCCCC(CO)NCC(=O)N 68151550470bbaab349e96458c4bf537 [0,2,0,0,0,0|2,0,0]=4 11837 B11R0.164 CCCCC(CO)NCC(=O)O 0ac86f318b4ada3badd347348f4357d6 [0,2,0,0,0,0|1,0,0]=3 11838 B11R0.164 CCCCN(CC)CCC(=O)C 2dfe68c567e1eebe418adaef85530776 [0,2,0,0,0,0|2,0,0]=4 11839 B11R0.164 CCCCN(CC)CCC(=O)N 45f2506a31ed20fe9c5a8ccab248e57b [0,2,0,0,0,0|2,0,0]=4 11840 B11R0.164 CCCC[C@@H](CO)NCC(=O)N 63a3ed2c7cdb5fddeb5e48f6b26dc13e [0,2,0,0,0,0|2,0,0]=4 11841 B11R0.164 CCCC[C@@H](CO)NCC(=O)O a2799527c20df37f76895d5212d240b3 [0,2,0,0,0,0|1,0,0]=3 11842 B11R0.164 CCCC[C@H](CO)NCC(=O)N 0cff149f0e2067d5cfca7d0317c5a5f3 [0,2,0,0,0,0|2,0,0]=4 11843 B11R0.164 CCCC[C@H](CO)NCC(=O)O 5410b6543adf46dbfb9e04d3e69919ba [0,2,0,0,0,0|1,0,0]=3 11844 B11R0.164 CCN(CCCO)CCC(=O)O e92d34009704adbcc92b7f581b542db9 [0,2,0,0,0,0|2,0,0]=4 11845 B11R0.164 CSCCC(CO)NCC(=O)O c23a18dffc25e03a7a3952f1b8557451 [0,2,0,0,0,0|2,0,0]=4 11846 B11R0.164 CSCC[C@@H](CO)NCC(=O)O 3bf8f6a4cfdb1aeb74aa5311b47e57ae [0,2,0,0,0,0|2,0,0]=4 11847 B11R0.164 CSCC[C@H](CO)NCC(=O)O 3445659cb7a507da33c5c9191fa38d84 [0,2,0,0,0,0|2,0,0]=4 11848 B11R0.164 O=C(O)CNC(CO)CCCO 8a9d86e8755dc91f890f820286957315 [0,2,0,0,0,0|2,0,0]=4 11849 B11R0.219 CC(C)(CCC(=O)O)NCCF 4e908c7f45479c54758def4fdeb5f121 [0,2,0,0,0,0|2,0,0]=4 11850 B11R0.219 CC(C)(CCC(=O)O)NCCO 2855612c6a9dd9521b25168e9896712e [0,2,0,0,0,0|2,0,0]=4 11851 B11R0.219 CC(C)(CCC(=O)O)NCCS 9bec273aeca96b7cbc7e75f825353fb3 [0,2,0,0,0,0|2,0,0]=4 11852 B11R0.219 CC(C)(CCCO)NCC(=O)O 50ba8d91d338b89a478c49a824bf50d9 [0,2,0,0,0,0|2,0,0]=4 11853 B11R0.219 CCCNC(C)(C)CCC(=O)O 47e80a81adbd480af1488dc9781a4cb1 [0,2,0,0,0,0|1,0,0]=3 11854 B11R0.219 CCOCC(C)(C)NCC(=O)O 8ed94bd3e4e6ec008334119072fcc3fb [0,2,0,0,0,0|2,0,0]=4 11855 B11R0.219 CCSCC(C)(C)NCC(=O)O cc39fd990b5458ad1f3d6d33c49c0ec3 [0,2,0,0,0,0|2,0,0]=4 11856 B11R0.219 COCNC(C)(C)CCC(=O)O 278623b148c4ea1508ccf36fac728025 [0,2,0,0,0,0|2,0,0]=4 11857 B11R0.219 CSCCC(C)(C)NCC(=O)O 8642f509fa7afb4cd611880f8f2e493c [0,2,0,0,0,0|2,0,0]=4 11858 B11R0.219 CSCNC(C)(C)CCC(=O)O 645cffe5f646ecb2572b4db56ae57ec9 [0,2,0,0,0,0|2,0,0]=4 11859 B9R1.4 C=CCN1CCC1CC 80dfc38a710a73642943fc9e6dca1e58 [1,0,0,1,0,0|2,0,0]=4 11860 B9R1.4 CCC1CCN1CC=O aee48a138645dd7a756ef2b78311f413 [1,0,0,1,0,0|1,0,0]=3 11861 B9R1.4 CCC1CCN1CCO 42e0c0d6b21111978f6a52e5b99908e1 [1,0,0,1,0,0|1,0,1]=4 11862 B9R1.4 CCCN1CCC1CO 33129f2326759bd9720a53e2ca2c6bf6 [1,0,0,1,0,0|1,0,1]=4 11863 B9R1.4 CCCN1CC[C@@H]1CO e1b1e89d7dc4e0489358392e42c76f69 [1,0,0,1,0,0|1,0,1]=4 11864 B9R1.4 CCCN1CC[C@H]1CO d7949bf66e85eea0dd23f24feebae878 [1,0,0,1,0,0|1,0,1]=4 11865 B9R1.4 CCN1CCC1CCO 8ae3244fa8f43e0a305689cf5a724afa [1,0,0,1,0,0|1,0,1]=4 11866 B9R1.4 COC1CCC1NC=O 0516ce26a02ed622900cc504f80eba14 [1,0,0,1,0,0|2,0,0]=4 11867 B9R1.4 COCC1CCN1C=O c8b8b5b0fdbcc9317c0fd4bfbe42e156 [1,0,0,1,0,0|2,0,0]=4 11868 B9R1.4 COC[C@@H]1CCN1C=O 4300e27a8cfd5eda3ca1f78e5c5877b6 [1,0,0,1,0,0|2,0,0]=4 11869 B9R1.4 COC[C@H]1CCN1C=O dc6d58be0dbd75769c416bde7f6785a9 [1,0,0,1,0,0|2,0,0]=4 11870 B9R1.4 CO[C@@H]1CC[C@@H]1NC=O 13b3ff47b5c1143e5efc5fc4a12ae663 [1,0,0,1,0,0|2,0,0]=4 11871 B9R1.4 CO[C@@H]1CC[C@H]1NC=O 5ace3a07ef2f61f85978acb689b55bb8 [1,0,0,1,0,0|2,0,0]=4 11872 B9R1.4 CO[C@H]1CC[C@@H]1NC=O 55fdc1b99ccc1745203679378dc7e779 [1,0,0,1,0,0|2,0,0]=4 11873 B9R1.4 CO[C@H]1CC[C@H]1NC=O 529d28774ce1207e0706afe7464d213a [1,0,0,1,0,0|2,0,0]=4 11874 B9R1.4 O=CCN1CCC1CO 95a9c6cf997b1ee1bea439b0af827cb9 [1,0,0,1,0,0|2,0,0]=4 11875 B9R1.4 O=CCN1CC[C@@H]1CO d986023f80a4fb46daf987d35489bd1d [1,0,0,1,0,0|2,0,0]=4 11876 B9R1.4 O=CCN1CC[C@H]1CO f110fa973937fd6be620801acb63a0fb [1,0,0,1,0,0|2,0,0]=4 11877 B9R1.4 O=CN1CCC1CCO c85a94914843f4f69a819dff95e34c1e [1,0,0,1,0,0|2,0,0]=4 11878 B9R1.8 CCNC1C=CCCC1 381b66b498fdea5c28ca09d8304c5d3a [1,0,0,1,0,0|2,0,0]=4 11879 B9R1.8 CCOC1C=CCCC1 7b09c8f3de0d6e6b8ab9978bfcb2c07e [1,0,0,1,0,0|2,0,0]=4 11880 B9R1.8 CCOC1CCCCO1 c72d85277d313af8f6a59b457effacb6 [1,0,0,1,0,0|1,0,1]=4 11881 B9R1.8 O=CCN1CCCOC1 709ce0dcd7369ac00ecc2d178dc45731 [1,0,0,1,0,0|2,0,0]=4 11882 B9R1.8 O=CCN1CCCSC1 c444ef249aa1c28412dad52581423289 [1,0,0,1,0,0|2,0,0]=4 11883 B9R1.8 O=CCN1CCOCC1 778eddfbfb27d7c608e1655d14d4d3d5 [1,0,0,1,0,0|2,0,0]=4 11884 B9R1.8 O=CCN1CCSCC1 9430518bfe46cf3dbda46338d6c1da9e [1,0,0,1,0,0|2,0,0]=4 11885 B9R1.8 O=CNC1CCCOC1 230b24f50ce1e8c0a34eb41e94513599 [1,0,0,1,0,0|2,0,0]=4 11886 B9R1.8 O=CNC1CCOCC1 e1b43468903b1fa23f622360e9159712 [1,0,0,1,0,0|2,0,0]=4 11887 B9R1.8 O=CN[C@@H]1CCCOC1 83c33e90ba16c0a9e9741e4f12c1fbfc [1,0,0,1,0,0|2,0,0]=4 11888 B9R1.8 O=CN[C@H]1CCCOC1 37e29b35f2ab9b94e3109d2bf0c29f79 [1,0,0,1,0,0|2,0,0]=4 11889 B9R1.12 C=CCNC1CCCC1 a44dfccd7811107fa017bf97428af755 [1,0,0,1,0,0|2,0,0]=4 11890 B9R1.12 C=CCOC1CCCC1 22f7677a5a2db535f14966e96785d78f [1,0,0,1,0,0|2,0,0]=4 11891 B9R1.12 CCCOC1C=CCC1 c828ce14c6c0406fcb0a810d3d8e329e [1,0,0,1,0,0|2,0,0]=4 11892 B9R1.12 CCCOC1CCCO1 4e4ce5597ea66ad501ec25fa53d020dd [1,0,0,1,0,0|1,0,1]=4 11893 B9R1.12 CCNCC1CCCO1 0d10918d6022ab0ba029f9bc507ef0d5 [1,0,0,1,0,0|1,0,1]=4 11894 B9R1.12 CCNC[C@@H]1CCCO1 b1829889cbf982f3fcb1bb0335d251c8 [1,0,0,1,0,0|1,0,1]=4 11895 B9R1.12 CCNC[C@H]1CCCO1 5696667f73ca7c93f1dd7a4fdf14dc92 [1,0,0,1,0,0|1,0,1]=4 11896 B9R1.12 CCOCC1C=CCC1 608a599d2ce1d9806fd4dc0424859b06 [1,0,0,1,0,0|2,0,0]=4 11897 B9R1.12 CCOCC1CCCO1 2054eb6e81b646f33dc6d98216be64f2 [1,0,0,1,0,0|1,0,1]=4 11898 B9R1.12 CCOC[C@@H]1CCCO1 a2ec9082c3cefa87960b2eb598c83c97 [1,0,0,1,0,0|1,0,1]=4 11899 B9R1.12 CCOC[C@H]1CCCO1 2cdc5ffd4542ac26ce370875427cfda2 [1,0,0,1,0,0|1,0,1]=4 11900 B9R1.12 O=CCCN1CCSC1 819953bd2902a335952003d0e2062a4c [1,0,0,1,0,0|2,0,0]=4 11901 B9R1.12 O=CCNC1CCCC1 5c29f4b53ebb87f60f2e590cae79d70e [1,0,0,1,0,0|1,0,0]=3 11902 B9R1.12 O=CCNC1CCOC1 5ebd18c32723aecf0a10ba0b1026f623 [1,0,0,1,0,0|2,0,0]=4 11903 B9R1.12 O=CCNC1CCSC1 94dd37d0be671d43fdf2361d32027eb7 [1,0,0,1,0,0|2,0,0]=4 11904 B9R1.12 O=CCN[C@@H]1CCOC1 c004fef25816fba950d6dc5d24530df6 [1,0,0,1,0,0|2,0,0]=4 11905 B9R1.12 O=CCN[C@H]1CCOC1 9ca8efb181f33f329c38592f6f8b2f1d [1,0,0,1,0,0|2,0,0]=4 11906 B9R1.12 O=CCOC1CCCC1 a6adf3d3a9898d822d20d244584a5d22 [1,0,0,1,0,0|1,0,0]=3 11907 B9R1.12 O=CCOC1CCCO1 b12387ccaf578e9136cfdda5442c6ed5 [1,0,0,1,0,0|2,0,0]=4 11908 B9R1.12 O=CCOC1CCOC1 dc39bcd71af6fa4a51e765dc1c7cc22b [1,0,0,1,0,0|2,0,0]=4 11909 B9R1.12 O=CCOC1CCSC1 d2117f08ca242a7df7aed3c889c7183d [1,0,0,1,0,0|2,0,0]=4 11910 B9R1.12 O=CCO[C@@H]1CCOC1 ba6a023905b97fe4c3886891f0169109 [1,0,0,1,0,0|2,0,0]=4 11911 B9R1.12 O=CCO[C@@H]1CCSC1 c32996f1fdfc0ecf3541c8ebef4f1bfc [1,0,0,1,0,0|2,0,0]=4 11912 B9R1.12 O=CCO[C@H]1CCOC1 ba4a88d81a344c083f0092fd5cbc39ac [1,0,0,1,0,0|2,0,0]=4 11913 B9R1.12 O=CCO[C@H]1CCSC1 1a840422c6e1aec7b7491b309995c9af [1,0,0,1,0,0|2,0,0]=4 11914 B9R1.12 O=CNCC1CCCC1 07bc0016cbba20adfd4b5def8fc2be28 [1,0,0,1,0,0|1,0,0]=3 11915 B9R1.12 O=CNCC1CCCO1 119dc507c9398e42b1f4ed984596ee10 [1,0,0,1,0,0|2,0,0]=4 11916 B9R1.12 O=CNCC1CCOC1 d0a8b11bfe41f1a2881d21d4b8d8fda7 [1,0,0,1,0,0|2,0,0]=4 11917 B9R1.12 O=CNC[C@@H]1CCCO1 1db6e6cf4b42f513cad73704b19cd2ea [1,0,0,1,0,0|2,0,0]=4 11918 B9R1.12 O=CNC[C@@H]1CCOC1 0cdeaf208e802b3ac6af755e7b6ce1c7 [1,0,0,1,0,0|2,0,0]=4 11919 B9R1.12 O=CNC[C@H]1CCCO1 d67473c99765cbcf463c4cc54c44cf84 [1,0,0,1,0,0|2,0,0]=4 11920 B9R1.12 O=CNC[C@H]1CCOC1 3972f408d9cc05ccac06471e1022cfb3 [1,0,0,1,0,0|2,0,0]=4 11921 B9R1.12 OCCNC1CCCC1 9d5f875d5eb73651d88d7104c6380a67 [1,0,0,1,0,0|1,0,1]=4 11922 B9R1.12 OCNCC1CCCC1 63e67e159d02f35a31c5acd4ee272edf [1,0,0,1,0,0|1,0,1]=4 11923 B9R1.14 CCC1CCCN1C=O 9bfd3104fb9bd3ec80e56f7f40a87d09 [1,0,0,1,0,0|1,0,0]=3 11924 B9R1.14 CCC1CCCN1CO c6b0552297ecd81b340673988242e49e [1,0,0,1,0,0|1,0,1]=4 11925 B9R1.14 CCN1CCCC1CO 4cc70a524b6a49ae6ff776db26f663d6 [1,0,0,1,0,0|1,0,1]=4 11926 B9R1.14 CCN1CCC[C@@H]1CO 06f5f2fca38eb9626faec3727a8f59e6 [1,0,0,1,0,0|1,0,1]=4 11927 B9R1.14 CCN1CCC[C@H]1CO e5330ba4d388a8e39b15a149c876b607 [1,0,0,1,0,0|1,0,1]=4 11928 B9R1.14 CC[C@@H]1CCCN1C=O da9d0e05329f820d63cc29621bd7430d [1,0,0,1,0,0|1,0,0]=3 11929 B9R1.14 CC[C@@H]1CCCN1CO 79102ed9add4e6c642219a59503e87a6 [1,0,0,1,0,0|1,0,1]=4 11930 B9R1.14 COC1CCCN1C=O 8aa7b22777bc471212d982f27b92f5fd [1,0,0,1,0,0|2,0,0]=4 11931 B9R1.14 O=CN1CCCC1CO 75b12ffa9bd2f35acc3b984d4ad2e6f7 [1,0,0,1,0,0|2,0,0]=4 11932 B9R1.14 O=CN1CCC[C@@H]1CF 45884ece6cccc8922acf889d282db837 [1,0,0,1,0,0|2,0,0]=4 11933 B9R1.14 O=CN1CCC[C@@H]1CO b2e4d0ee0a911eac6a5bfd92181e1f8a [1,0,0,1,0,0|2,0,0]=4 11934 B9R1.14 O=CN1CCC[C@H]1CF efa94b1e9832aaf370863a6f8233628a [1,0,0,1,0,0|2,0,0]=4 11935 B9R1.14 O=CN1CCC[C@H]1CO 6edb00daf504246f581ca4815eae2e10 [1,0,0,1,0,0|2,0,0]=4 11936 B9R1.15 CC1CCCCN1C=O 5edffbe7b981e62d376cf463cc81b5a0 [1,0,0,1,0,0|1,0,0]=3 11937 B9R1.15 CC1CCCCN1CO 51fa6066fe243cadf796064968abed1d [1,0,0,1,0,0|1,0,1]=4 11938 B9R1.15 CC1COCCN1C=O 04bb76f81435fa2bb54099b84251b430 [1,0,0,1,0,0|2,0,0]=4 11939 B9R1.15 C[C@@H]1CCCCN1C=O a3eec1c9235da9d654fdc4f1cd619716 [1,0,0,1,0,0|1,0,0]=3 11940 B9R1.15 C[C@@H]1CCCCN1CO 48a916b223b43cd97604cd793c27c7ee [1,0,0,1,0,0|1,0,1]=4 11941 B9R1.15 C[C@@H]1COCCN1C=O 0c7d5e9730004733a4641e1221ef05f8 [1,0,0,1,0,0|2,0,0]=4 11942 B9R1.15 C[C@H]1CCCCN1C=O ca092eb4253ff1332fa8641d72ce7d5e [1,0,0,1,0,0|1,0,0]=3 11943 B9R1.15 C[C@H]1CCCCN1CO c9f51543a38eb85e2bdab1d085a77a87 [1,0,0,1,0,0|1,0,1]=4 11944 B9R1.15 C[C@H]1COCCN1C=O 768699be3648dab4c6a8b1f24cf31cd1 [1,0,0,1,0,0|2,0,0]=4 11945 B9R1.16 C=C1CC1COCCC dbf7f65a57254b2e5c70dceecfec1a08 [1,0,0,1,0,0|2,0,0]=4 11946 B9R1.16 C=CCCNC1CC1C 747a4f501e0865aab3cf0c231ab14d8f [1,0,0,1,0,0|2,0,0]=4 11947 B9R1.16 C=CCOCC1CC1C 647676f58a9166a3b1d49e87f83fd548 [1,0,0,1,0,0|2,0,0]=4 11948 B9R1.16 C=CCOC[C@@H]1C[C@@H]1C f69e8d4df7003fd1349e7e58d7969c45 [1,0,0,1,0,0|2,0,0]=4 11949 B9R1.16 C=CCOC[C@@H]1C[C@H]1C abf188b83ca4f21c698711925d337650 [1,0,0,1,0,0|2,0,0]=4 11950 B9R1.16 C=CCOC[C@H]1C[C@@H]1C eea92b22b51f725ae81f9a25c2a44125 [1,0,0,1,0,0|2,0,0]=4 11951 B9R1.16 CC1CC1COCC=O e38c4912a5bd244cfef6cdfcd630eadf [1,0,0,1,0,0|1,0,0]=3 11952 B9R1.16 CC1CC1NC/C=C\O 9a9e5e2582457eba9ff0336079c77c3b [1,0,0,1,0,0|1,0,1]=4 11953 B9R1.16 CC1CC1NCCC=O 41a62504559929453219af6a8e069423 [1,0,0,1,0,0|1,0,0]=3 11954 B9R1.16 CC1CC1NCCCO d8cc7bd276ec3b4c8d2a48d69b32c773 [1,0,0,1,0,0|1,0,1]=4 11955 B9R1.16 C[C@@H]1C[C@H]1COCC=O 7ae74dfc03906b5b41f7f9d5bbdb763b [1,0,0,1,0,0|1,0,0]=3 11956 B9R1.16 C[C@H]1C[C@@H]1COCC=O b02f0ce03a967d9b5a7484bce5693d9b [1,0,0,1,0,0|1,0,0]=3 11957 B9R1.16 C[C@H]1C[C@H]1COCC=O c17ac892c3cf503bcc9858e0bcb45921 [1,0,0,1,0,0|1,0,0]=3 11958 B9R1.16 O=CCCN[C@@H]1C[C@H]1F 1f01b5d02c2fbd7145130960e1468714 [1,0,0,1,0,0|2,0,0]=4 11959 B9R1.16 O=CCCN[C@H]1C[C@@H]1F 843863b95aca607e9f10934bbf968501 [1,0,0,1,0,0|2,0,0]=4 11960 B9R1.16 O=CCCN[C@H]1C[C@H]1F 468fea7d20ce2cc141785093b5471b2d [1,0,0,1,0,0|2,0,0]=4 11961 B9R1.16 O=CCOC[C@@H]1C[C@@H]1F 2599da318090007136ea8223a4e64677 [1,0,0,1,0,0|2,0,0]=4 11962 B9R1.16 O=CCOC[C@@H]1C[C@H]1F b0dec97c30095db53fb117109e8dcb49 [1,0,0,1,0,0|2,0,0]=4 11963 B9R1.16 O=CCOC[C@H]1C[C@@H]1F e66145835b4bc6e6d4f422015aeb3dd4 [1,0,0,1,0,0|2,0,0]=4 11964 B9R1.16 O=CCOC[C@H]1C[C@H]1F 9ebf315b16b29ab352ce1122a8ed679d [1,0,0,1,0,0|2,0,0]=4 11965 B9R1.17 C=CCCCN1CCC1 79fbb3a2d17451a36b670f0f8ba89738 [1,0,0,1,0,0|2,0,0]=4 11966 B9R1.17 C=CCCNC1CCC1 b2ca0b88deeb83a7c2d61204f59e8ff3 [1,0,0,1,0,0|2,0,0]=4 11967 B9R1.17 C=CCCOC1CCC1 c328b7599efb51dd1bfb7291c6261276 [1,0,0,1,0,0|2,0,0]=4 11968 B9R1.17 C=CCNCC1CCC1 5da1fe94035d41e639fcc0fbbfde87b2 [1,0,0,1,0,0|2,0,0]=4 11969 B9R1.17 C=CCOCC1CCC1 5c7cdd4f65c4652a52a56bde68d5c494 [1,0,0,1,0,0|2,0,0]=4 11970 B9R1.17 CCCNCC1CCO1 787b259f563a64412a05f6375c510307 [1,0,0,1,0,0|1,0,1]=4 11971 B9R1.17 CCCNC[C@@H]1CCO1 09e702ada7d1001485e8ef84f376d413 [1,0,0,1,0,0|1,0,1]=4 11972 B9R1.17 CCCNC[C@H]1CCO1 cff33eb3b6a9e99c0c6a161e680951b7 [1,0,0,1,0,0|1,0,1]=4 11973 B9R1.17 CCCOCC1CCO1 dce9304902398e33f033a8ebfca20c53 [1,0,0,1,0,0|1,0,1]=4 11974 B9R1.17 CCCOC[C@@H]1CCO1 c245ae24508202032a63f9f16acb84cf [1,0,0,1,0,0|1,0,1]=4 11975 B9R1.17 CCCOC[C@H]1CCO1 41d8fefb0693f7efdbac57d0fec29667 [1,0,0,1,0,0|1,0,1]=4 11976 B9R1.17 CCNCCC1CCO1 4ae5fe85c000a9c5bb25d4ff5bb61f46 [1,0,0,1,0,0|1,0,1]=4 11977 B9R1.17 CCNCC[C@@H]1CCO1 87fce7fd72273e8060816918b85a2637 [1,0,0,1,0,0|1,0,1]=4 11978 B9R1.17 CCOCCC1CCO1 cd6091d78b963fcc0d69fc11334e4cc1 [1,0,0,1,0,0|1,0,1]=4 11979 B9R1.17 CCOCC[C@@H]1CCO1 5a8cf1d590ea701c17ab71cbcce8b435 [1,0,0,1,0,0|1,0,1]=4 11980 B9R1.17 CCOCC[C@H]1CCO1 585e9080fae90924dbee753be634e6b9 [1,0,0,1,0,0|1,0,1]=4 11981 B9R1.17 O/C=C\CNC1CCC1 f40d8cab44d9002b94a78cf51c0df6fd [1,0,0,1,0,0|1,0,1]=4 11982 B9R1.17 O=CCCCN1CCC1 c9421be176719d154eb5accc0053f780 [1,0,0,1,0,0|1,0,0]=3 11983 B9R1.17 O=CCCNC1CCC1 1b528abcf9d669c9f08c41d2e17cde6d [1,0,0,1,0,0|1,0,0]=3 11984 B9R1.17 O=CCCNC1COC1 00cc925a959752d614e674854d9483d1 [1,0,0,1,0,0|2,0,0]=4 11985 B9R1.17 O=CCCOC1CCC1 ca0325a8327dd5387ba03d5c4c035d7d [1,0,0,1,0,0|1,0,0]=3 11986 B9R1.17 O=CCCOC1COC1 d07b3b02d2724e6681cc4efe799ddcb6 [1,0,0,1,0,0|2,0,0]=4 11987 B9R1.17 O=CCCOC1CSC1 a9563b190c6825eaeb6555de6452e9bc [1,0,0,1,0,0|2,0,0]=4 11988 B9R1.17 O=CCNCC1CCC1 d9fc727438c262514562cfe2c9442588 [1,0,0,1,0,0|1,0,0]=3 11989 B9R1.17 O=CCNCC1CCO1 53951d28b9df08002a19d39ca06b7918 [1,0,0,1,0,0|2,0,0]=4 11990 B9R1.17 O=CCNCC1COC1 48b53a77c4dde2cc348a871e1accbed5 [1,0,0,1,0,0|2,0,0]=4 11991 B9R1.17 O=CCNC[C@@H]1CCO1 c7e724e65ea113db3b8415392e768b54 [1,0,0,1,0,0|2,0,0]=4 11992 B9R1.17 O=CCNC[C@H]1CCO1 4aed42d70e6d66954b2efd5890ed1d45 [1,0,0,1,0,0|2,0,0]=4 11993 B9R1.17 O=CCOCC1CCC1 df39e2693a3babd07be9a7e868d03e5c [1,0,0,1,0,0|1,0,0]=3 11994 B9R1.17 O=CCOCC1CCO1 ad64a9ccf1d143930aaf0f51c2aa134c [1,0,0,1,0,0|2,0,0]=4 11995 B9R1.17 O=CCOCC1COC1 7bc35b7dc9db121591ff34bd5659dce1 [1,0,0,1,0,0|2,0,0]=4 11996 B9R1.17 O=CCOCC1CSC1 0bfd3fdfe369cf64805dbdc14ec6ac93 [1,0,0,1,0,0|2,0,0]=4 11997 B9R1.17 O=CCOC[C@@H]1CCO1 4207442a892712e2538b05a4cbb7aad8 [1,0,0,1,0,0|2,0,0]=4 11998 B9R1.17 O=CCOC[C@H]1CCO1 833770d149e7932d30d50a5f6aa07c80 [1,0,0,1,0,0|2,0,0]=4 11999 B9R1.17 O=CNCCC1CCC1 e202ec16281bf0e218ffc459925c1fd6 [1,0,0,1,0,0|1,0,0]=3 12000 B9R1.17 O=CNCCC1CCO1 cdf38e52e7d02ed5e20cbef43a20f6b9 [1,0,0,1,0,0|2,0,0]=4 12001 B9R1.17 O=CNCCC1COC1 b9ec2701a554368fc6ec06579c4cd9f5 [1,0,0,1,0,0|2,0,0]=4 12002 B9R1.17 O=CNCCN1CCC1 6730ab1f9f0bf6f2fcaf5bbea4cd4d18 [1,0,0,1,0,0|2,0,0]=4 12003 B9R1.17 O=CNCC[C@@H]1CCO1 7931fbc71d7a018e517df0f2d3977f68 [1,0,0,1,0,0|2,0,0]=4 12004 B9R1.17 OCCCCN1CCC1 ad673b251846124d682e68d41bd69794 [1,0,0,1,0,0|1,0,1]=4 12005 B9R1.17 OCCCNC1CCC1 2d0a61911a932f7b3f70f4abdaf93c51 [1,0,0,1,0,0|1,0,1]=4 12006 B9R1.17 OCCNCC1CCC1 0db2b43d5f2b6e2bb72f605ddaa5a4a3 [1,0,0,1,0,0|1,0,1]=4 12007 B9R1.17 OCNCCC1CCC1 6cb48fdafa62be8921fec5036f8c18bd [1,0,0,1,0,0|1,0,1]=4 12008 B9R1.18 COC[C@@H]1C[C@@H]1NC=O e8a9d54923fee9355d76b1ab2fc703fa [1,0,0,1,0,0|2,0,0]=4 12009 B9R1.18 COC[C@H]1C[C@@H]1NC=O 51a259aae5519abbdb003acfe8bc77a1 [1,0,0,1,0,0|2,0,0]=4 12010 B9R1.20 CCCNC1CC1C=O 5a1255ba47b3f9b77a8f94f9f9e96699 [1,0,0,1,0,0|1,0,0]=3 12011 B9R1.20 CCCN[C@@H]1C[C@H]1CO 01648121b5a98061b42153e4ab393cb1 [1,0,0,1,0,0|1,0,1]=4 12012 B9R1.20 CCCN[C@H]1C[C@@H]1CO a1b2b11710ee676daec5dfb5dac0dd9a [1,0,0,1,0,0|1,0,1]=4 12013 B9R1.20 CCCN[C@H]1C[C@H]1CO 4d8b1610d3004ae2b8fad1ac32f50857 [1,0,0,1,0,0|1,0,1]=4 12014 B9R1.20 CCCOC1CC1C=O 31262bf4a61a94a8c2a2cb7b4ef3e962 [1,0,0,1,0,0|1,0,0]=3 12015 B9R1.20 CCNCC1CC1CO cbd7260b3c76e2ddd15b4e5660cc138c [1,0,0,1,0,0|1,0,1]=4 12016 B9R1.20 COCOC1CC1C=O c319311ff32df99d9df72e297622b91b [1,0,0,1,0,0|2,0,0]=4 12017 B9R1.20 CO[C@H]1C[C@H]1NCC=O a5564d0e9296ad2a5285dd25438bff78 [1,0,0,1,0,0|2,0,0]=4 12018 B9R1.20 O=CC1CC1NCCBr 388e7e5bf8f46219c6c674717a0bcca9 [1,0,0,1,0,0|2,0,0]=4 12019 B9R1.20 O=CC1CC1NCCF bdcd63c436f1c6e429d04b5125869608 [1,0,0,1,0,0|2,0,0]=4 12020 B9R1.20 O=CC1CC1NCCI 3f251dd0770ad449efaf191f3450d62d [1,0,0,1,0,0|2,0,0]=4 12021 B9R1.20 O=CC1CC1NCCO d5edf66784041201e0b25f9c09b6d2e2 [1,0,0,1,0,0|2,0,0]=4 12022 B9R1.20 O=CC1CC1NCCS 69c43f278bf510cdb9286fa30b4e6b0d [1,0,0,1,0,0|2,0,0]=4 12023 B9R1.20 O=CC1CC1OCCF d7daf990654b2937f44bf00a5852616c [1,0,0,1,0,0|2,0,0]=4 12024 B9R1.20 O=CC1CC1OCCS 33ec9ebf7ade6482ca866b2176954a1d [1,0,0,1,0,0|2,0,0]=4 12025 B9R1.20 O=CCN[C@@H]1C[C@H]1CO a4e1554de94d067c3fbd12eb0ed1b3f1 [1,0,0,1,0,0|2,0,0]=4 12026 B9R1.20 O=CCN[C@H]1C[C@@H]1CO a3f19837da9d9b9253d8cd3345c66dca [1,0,0,1,0,0|2,0,0]=4 12027 B9R1.20 O=CCN[C@H]1C[C@H]1CO f97d674d9d53873e0127292fa661202b [1,0,0,1,0,0|2,0,0]=4 12028 B9R1.20 O=CNCC1CC1CO a4206d433de73e574d80fb3fe1eae53b [1,0,0,1,0,0|2,0,0]=4 12029 B9R1.33 C=CCN1CCCC1C 23b9d7c6e1c51172c4b7f3c143a21823 [1,0,0,1,0,0|2,0,0]=4 12030 B9R1.33 C=CCN1CCC[C@@H]1C 4e286cb09daddaed56ef6d50629bb6c7 [1,0,0,1,0,0|2,0,0]=4 12031 B9R1.33 C=CCN1CCC[C@H]1C d7485f6c33d5bda25c408090ba454490 [1,0,0,1,0,0|2,0,0]=4 12032 B9R1.33 CC1CCCN1CC=O 27928a5411863f8bf406ba8c60b72aa7 [1,0,0,1,0,0|1,0,0]=3 12033 B9R1.33 CC1CCCN1CCO 281a8d841757602b2230f2ac436bc7ad [1,0,0,1,0,0|1,0,1]=4 12034 B9R1.33 CC1SCCN1CC=O e074df1e5165ebc9fde046428f7d1e09 [1,0,0,1,0,0|2,0,0]=4 12035 B9R1.33 CCCN1CCCC1O 896bbb6e21363ca7dd9cc7555c30bb4b [1,0,0,1,0,0|1,0,1]=4 12036 B9R1.33 CCNC1CCCC1O 4082360f4f038038f347b5d184fd111c [1,0,0,1,0,0|1,0,1]=4 12037 B9R1.33 CCNC1CCNC1=O 7ca8029da61d3d4038e53b166243ebeb [1,0,0,1,0,0|2,0,0]=4 12038 B9R1.33 CCNC1CCSC1=O b170125bf493751e42532dd86c219256 [1,0,0,1,0,0|2,0,0]=4 12039 B9R1.33 CCN[C@@H]1CCC[C@@H]1O 7fc0c82c19f54fdb7ff37f6b41c3ad62 [1,0,0,1,0,0|1,0,1]=4 12040 B9R1.33 CCN[C@@H]1CCC[C@H]1O 7200f16a31f279f976985efc0dd1963a [1,0,0,1,0,0|1,0,1]=4 12041 B9R1.33 CCN[C@@H]1CCNC1=O b778b480924bfa692e02248b56fb56cd [1,0,0,1,0,0|2,0,0]=4 12042 B9R1.33 CCN[C@@H]1CCOC1=O 74b3897799f45738d0bb44924384c10e [1,0,0,1,0,0|2,0,0]=4 12043 B9R1.33 CCN[C@H]1CCC[C@@H]1O 7e9e41c880fd9b1705872b4570e9e9a4 [1,0,0,1,0,0|1,0,1]=4 12044 B9R1.33 CCN[C@H]1CCC[C@H]1O b25a1a46741ef202e0fa8a6fbd0108ff [1,0,0,1,0,0|1,0,1]=4 12045 B9R1.33 CCN[C@H]1CCNC1=O 659170641ab39dc9cbd8871033438dcc [1,0,0,1,0,0|2,0,0]=4 12046 B9R1.33 CCN[C@H]1CCOC1=O 5ec21f69d9ce47df74aa6d4e2b7c83d0 [1,0,0,1,0,0|2,0,0]=4 12047 B9R1.33 CCOC1CCCC1=O 19fd59f8b378305519536cfc5c950157 [1,0,0,1,0,0|1,0,0]=3 12048 B9R1.33 CCOC1CCNC1=O 8fdacff95d4ce2d1c3d495fa66f75dd5 [1,0,0,1,0,0|2,0,0]=4 12049 B9R1.33 CCO[C@@H]1CCNC1=O d615de1523fb9db14752de0db1c501b4 [1,0,0,1,0,0|2,0,0]=4 12050 B9R1.33 CCO[C@H]1CCNC1=O 5eaae9c583183b85f65e479b22e5ff87 [1,0,0,1,0,0|2,0,0]=4 12051 B9R1.33 C[C@@H]1CCCN1CC=O 628393964742a01eee790b1703c7f48c [1,0,0,1,0,0|1,0,0]=3 12052 B9R1.33 C[C@@H]1CCCN1CCO 09597fc03649e0133d260389224063ff [1,0,0,1,0,0|1,0,1]=4 12053 B9R1.33 C[C@H]1CCCN1CC=O 7489760bd07ab3dac73fc24ef598634e [1,0,0,1,0,0|1,0,0]=3 12054 B9R1.33 C[C@H]1CCCN1CCO d9a463a7c3fe8fd3082bc4ccbe366d3c [1,0,0,1,0,0|1,0,1]=4 12055 B9R1.33 O=C1CCCC1OCF b783fc93d29df7b700fa1dae2c7b2018 [1,0,0,1,0,0|2,0,0]=4 12056 B9R1.33 O=CCN1CCCC1O 01cd7a46a4aeeeea309967ac9e52751a [1,0,0,1,0,0|2,0,0]=4 12057 B9R1.39 C=CCN[C@@H]1CC[C@H]1C 797a6c1bec8774f1131e38d629ebf289 [1,0,0,1,0,0|2,0,0]=4 12058 B9R1.39 C=CCN[C@H]1CC[C@H]1C a2113edba5b85ccfd3c7ed37a186f8af [1,0,0,1,0,0|2,0,0]=4 12059 B9R1.39 CC1OCC1NCC=O 8d47a35fcaf3d0abffe6f38155949c87 [1,0,0,1,0,0|2,0,0]=4 12060 B9R1.39 CC1OCC1OCC=O ea69815746541ac6f999bf555977edb0 [1,0,0,1,0,0|2,0,0]=4 12061 B9R1.39 CCCNC1CCC1O d155a733c41c62abda7d08da95cfc65c [1,0,0,1,0,0|1,0,1]=4 12062 B9R1.39 CCCN[C@@H]1CC[C@@H]1O 26f710b672dad38acbb559b9bae73466 [1,0,0,1,0,0|1,0,1]=4 12063 B9R1.39 CCCN[C@@H]1CC[C@H]1O 1240837254956ece18ef0c124fef8aba [1,0,0,1,0,0|1,0,1]=4 12064 B9R1.39 CCCN[C@H]1CC[C@@H]1O 393ffdf10510a7842b6493a44dc8cabe [1,0,0,1,0,0|1,0,1]=4 12065 B9R1.39 CCCN[C@H]1CC[C@H]1O 05a01537d0a8846f5484509481105bbc [1,0,0,1,0,0|1,0,1]=4 12066 B9R1.39 CCCN[C@H]1CNC1=O d54fb2abe7455950df3e037f3ce21945 [1,0,0,1,0,0|2,0,0]=4 12067 B9R1.39 CCCOC1CCC1=O 6747d0d4bf3ca4d2474fd2057207f365 [1,0,0,1,0,0|1,0,0]=3 12068 B9R1.39 CCOCC1CCC1=O a06c32f97be82794ffc1ab53b750de7f [1,0,0,1,0,0|1,0,0]=3 12069 B9R1.39 CN1CCC1CNC=O 4ed43e8d18b2935d99bd7891c23f5d60 [1,0,0,1,0,0|2,0,0]=4 12070 B9R1.39 COCOC1CCC1=O cb47f60d015388daefcfa2b6dd0ad8dd [1,0,0,1,0,0|2,0,0]=4 12071 B9R1.39 CSCOC1CCC1=O 7048061bc11cd0d22a524721b970ff41 [1,0,0,1,0,0|2,0,0]=4 12072 B9R1.39 C[C@@H]1CC[C@@H]1NCC=O 010d1f07421a6ab7666be29e45bdb933 [1,0,0,1,0,0|1,0,0]=3 12073 B9R1.39 C[C@@H]1CC[C@@H]1NCCO 06a8fabda842982d62baff95336c3842 [1,0,0,1,0,0|1,0,1]=4 12074 B9R1.39 C[C@@H]1CC[C@H]1NCC=O 5bdea5e6a123d69d5ec9a77ce96f151b [1,0,0,1,0,0|1,0,0]=3 12075 B9R1.39 C[C@@H]1CC[C@H]1NCCO 20e40c68c6c9e73ece74b6b077aa5521 [1,0,0,1,0,0|1,0,1]=4 12076 B9R1.39 O=C1CCC1COCF 1634c48acd08b0642ca0e9a669398342 [1,0,0,1,0,0|2,0,0]=4 12077 B9R1.39 O=C1CCC1NCCI bbc9d8cfca0a3c47d4f408026b04c9ca [1,0,0,1,0,0|2,0,0]=4 12078 B9R1.39 O=C1CCC1NCCO 6ba8bc28b11ed8fcaf6b4ee2f92451e5 [1,0,0,1,0,0|2,0,0]=4 12079 B9R1.39 O=C1CCC1OCCF dd8162d9e9efdcef395b302d66117a1f [1,0,0,1,0,0|2,0,0]=4 12080 B9R1.39 O=C1CCC1OCCS 623af281b20256d582f920eb3b4a5f07 [1,0,0,1,0,0|2,0,0]=4 12081 B9R1.39 O=CCNC1CCC1F f082f85f56586cb398eb1b149b790013 [1,0,0,1,0,0|2,0,0]=4 12082 B9R1.39 O=CCNC1CCC1O 123dc0b3c91dd7ff182bb805a40ce98b [1,0,0,1,0,0|2,0,0]=4 12083 B9R1.39 O=CCN[C@@H]1CC[C@@H]1O d7612e1757c0ece081dd528b83fe282b [1,0,0,1,0,0|2,0,0]=4 12084 B9R1.39 O=CCN[C@@H]1CC[C@H]1O 182b220c474d40b4e6c0526ba10de229 [1,0,0,1,0,0|2,0,0]=4 12085 B9R1.39 O=CCN[C@H]1CC[C@@H]1O 3e58017061e613410fad4778411deeb5 [1,0,0,1,0,0|2,0,0]=4 12086 B9R1.39 O=CCN[C@H]1CC[C@H]1O 0acbbb0584ec3f9cea59d2dad2c7a1b9 [1,0,0,1,0,0|2,0,0]=4 12087 B9R1.83 C=CCCCNC1CC1 fd03e8d96a892feb80bd9124662e54eb [1,0,0,1,0,0|2,0,0]=4 12088 B9R1.83 C=CCCCOC1CC1 f50c46c5e6361c6f38ecbc945267201f [1,0,0,1,0,0|2,0,0]=4 12089 B9R1.83 C=CCCNCC1CC1 99f83c26da404011e22f37cdeeaa0989 [1,0,0,1,0,0|2,0,0]=4 12090 B9R1.83 C=CCCOCC1CC1 3c9b915cf00d6498b589d15c57a937be [1,0,0,1,0,0|2,0,0]=4 12091 B9R1.83 C=CCNCCC1CC1 0cc2360cdbffe20d82b5ece4cbb3be17 [1,0,0,1,0,0|2,0,0]=4 12092 B9R1.83 C=CCOCCC1CC1 6c68105a3b7e7c21024b8d52b38c3fcc [1,0,0,1,0,0|2,0,0]=4 12093 B9R1.83 O/C=C\CNCC1CC1 d334ec2882453580e7bf1aa7c14449be [1,0,0,1,0,0|1,0,1]=4 12094 B9R1.83 O=CCCCNC1CC1 90250eaeb8b0faae4f92ea1a0d59bfaf [1,0,0,1,0,0|1,0,0]=3 12095 B9R1.83 O=CCCCOC1CC1 8c56cd950e39548ad0d9b9606b829577 [1,0,0,1,0,0|1,0,0]=3 12096 B9R1.83 O=CCCNCC1CC1 7c4d27f4b68b41c8eddb041c82ef0a24 [1,0,0,1,0,0|1,0,0]=3 12097 B9R1.83 O=CCCOCC1CC1 daa9b247c38693dadc6d33a20c9e023c [1,0,0,1,0,0|1,0,0]=3 12098 B9R1.83 O=CCNCCC1CC1 c081918168c1dc9e5f44e991519eecf1 [1,0,0,1,0,0|1,0,0]=3 12099 B9R1.83 O=CCNCCN1CC1 e8ab8bc5eec11a4416c54797f171c427 [1,0,0,1,0,0|2,0,0]=4 12100 B9R1.83 O=CCOCCC1CC1 e95c5fc4c9f9574f689822c866eeb674 [1,0,0,1,0,0|1,0,0]=3 12101 B9R1.83 O=CCOCCN1CC1 e180a4a310ef673098f7407d6614588a [1,0,0,1,0,0|2,0,0]=4 12102 B9R1.83 O=CNCCOC1CC1 44267b449bf44e7f8fd59e98843644fe [1,0,0,1,0,0|2,0,0]=4 12103 B9R1.83 O=COCCOC1CC1 827a5d8c0ec3a0e23501930474206359 [1,0,0,1,0,0|2,0,0]=4 12104 B9R1.83 OCCCCNC1CC1 c4f4967ad469c6a279d6aa96bd53fadd [1,0,0,1,0,0|1,0,1]=4 12105 B9R1.83 OCCCNCC1CC1 40d7db90d231f4b1706e12f0cfad86e0 [1,0,0,1,0,0|1,0,1]=4 12106 B9R1.83 OCCNCCC1CC1 21febed634739e021e8829c4a7554e2e [1,0,0,1,0,0|1,0,1]=4 12107 B9R1.89 O=CN1CCCCCC1 4a543573026aecbb7f088b43cea970d5 [1,0,0,1,0,0|1,0,0]=3 12108 B9R1.89 O=CN1CCCOCC1 ac69421f50e86b391ee77e2bd7abf564 [1,0,0,1,0,0|2,0,0]=4 12109 B9R1.89 OCN1CCCCCC1 62c49bb1745f5c0f3dee14a3d4e5f5d5 [1,0,0,1,0,0|1,0,1]=4 12110 B9R1.2 CCN1CCCC(=O)C1 b0afeee675d5ec52ec51d9d2cdcf36a5 [1,0,0,1,0,0|2,0,0]=4 12111 B9R1.7 CCOC1CCC(=O)C1 20f868b46959ea3477a4c5711e7faca7 [1,0,0,1,0,0|2,0,0]=4 12112 B9R1.9 CCCNC1CC(=O)C1 367843f6c154ea9b1b2ab5b6982e35c8 [1,0,0,1,0,0|2,0,0]=4 12113 B9R1.9 CCCOC1CC(=O)C1 cb8b05388c0c6b6c847ea07bd6f740db [1,0,0,1,0,0|2,0,0]=4 12114 B9R1.9 CCOCC1CC(=O)C1 314fc2b69b99eb56a50a5b1c782af7e0 [1,0,0,1,0,0|2,0,0]=4 12115 B9R1.9 CCOCC1CC(=O)N1 4d4a394646263ac2a76d63e6bf0523d3 [1,0,0,1,0,0|2,0,0]=4 12116 B9R1.9 CCOC[C@@H]1CC(=O)N1 0014850b07eba2466726f06d24d9917a [1,0,0,1,0,0|2,0,0]=4 12117 B9R1.9 CCOC[C@H]1CC(=O)N1 7563fb6dd848526ece65c4c755fed6d6 [1,0,0,1,0,0|2,0,0]=4 12118 B9R1.13 CC(=O)NC1CCCC1 a2d6bc9cfdeb39e26a278a42ee1d6324 [1,0,0,1,0,0|2,0,0]=4 12119 B9R1.13 O=C(O)CN1CCSC1 3cee187b91b84407a74d8a64ddd2529a [1,0,0,1,0,0|2,0,0]=4 12120 B9R1.41 CC(=O)N1CCCC1C f3ed72e102a18b3ca7365fff10aeb6f8 [1,0,0,1,0,0|2,0,0]=4 12121 B9R1.41 CC(=O)N1CCC[C@@H]1C 45c9778b44581f9933633398df3c02d2 [1,0,0,1,0,0|2,0,0]=4 12122 B9R1.41 CC(=O)N1CCC[C@H]1C 77e41bde24aa3c51a340cfebe6f455b1 [1,0,0,1,0,0|2,0,0]=4 12123 B9R1.46 CC1CC1NCC(=O)N 0f761d58efdd237db8c0f17aea937594 [1,0,0,1,0,0|2,0,0]=4 12124 B9R1.46 CC1CC1NCC(=O)O 3bfaf8234ce2a2ce9175fc2c1a135a09 [1,0,0,1,0,0|1,0,0]=3 12125 B9R1.46 O=C(O)CN[C@@H]1C[C@H]1F a6c43cdb6b93e8ffb5565a60fb69e134 [1,0,0,1,0,0|2,0,0]=4 12126 B9R1.46 O=C(O)CN[C@H]1C[C@@H]1F 69d5a409f8843b0b8e9804d9f047552d [1,0,0,1,0,0|2,0,0]=4 12127 B9R1.46 O=C(O)CN[C@H]1C[C@H]1F cedd2a80fac675c783fcb497e5c8c7a7 [1,0,0,1,0,0|2,0,0]=4 12128 B9R1.67 CC(=O)N[C@@H]1CC[C@H]1C 5c49b9b8f08f59f55b778fc02f7c64d4 [1,0,0,1,0,0|2,0,0]=4 12129 B9R1.67 CC(=O)N[C@H]1CC[C@H]1C c339870f892b73bf50fa9d649fc76de5 [1,0,0,1,0,0|2,0,0]=4 12130 B9R1.84 CC(=O)CCN1CCC1 c956718020bd2b18bed19cbea6541b6f [1,0,0,1,0,0|2,0,0]=4 12131 B9R1.84 CC(=O)CNC1CCC1 bd7acdba40fc474c96d220c49c50bbfc [1,0,0,1,0,0|2,0,0]=4 12132 B9R1.84 CC(=O)COC1CCC1 d88d952edae987109b22eaffa67aceef [1,0,0,1,0,0|2,0,0]=4 12133 B9R1.84 CC(=O)NCC1CCC1 49ba76efa54494cc240e1d7dd1323f42 [1,0,0,1,0,0|2,0,0]=4 12134 B9R1.84 NC(=O)CCN1CCC1 7c7dcf2beb6babc71bb570ae0577e033 [1,0,0,1,0,0|2,0,0]=4 12135 B9R1.84 NC(=O)CNC1CCC1 22d17700eecb0c06f3b842c18a223914 [1,0,0,1,0,0|2,0,0]=4 12136 B9R1.84 NC(=O)COC1CCC1 2e70bd2c52f1b1ce8734b1f0deba9c6c [1,0,0,1,0,0|2,0,0]=4 12137 B9R1.84 O=C(O)CCN1CCC1 c7456b9216b4090bb9138555bed1407a [1,0,0,1,0,0|1,0,0]=3 12138 B9R1.84 O=C(O)CNC1CCC1 cd102a6a388082590edc8eed5830f2b0 [1,0,0,1,0,0|1,0,0]=3 12139 B9R1.84 O=C(O)CNC1COC1 6bb06b4c2db0ff27bdfc2db31b9d0a43 [1,0,0,1,0,0|2,0,0]=4 12140 B9R1.84 O=C(O)COC1CCC1 6ea2b5eaf8c15cb47b19add287442093 [1,0,0,1,0,0|1,0,0]=3 12141 B9R1.84 O=C(O)COC1COC1 018c9639a2203f1b493d64da9ef6e678 [1,0,0,1,0,0|2,0,0]=4 12142 B9R1.84 O=C(O)COC1CSC1 386bd6c5f64faff25702916ce2fff970 [1,0,0,1,0,0|2,0,0]=4 12143 B9R1.84 O=S(O)COC1CCC1 41f090ccc207301c7067fca8add75b7b [1,0,0,1,0,0|2,0,0]=4 12144 B9R1.85 CC(=O)CCNC1CC1 47abd95c844e9d1957c333790f465980 [1,0,0,1,0,0|2,0,0]=4 12145 B9R1.85 CC(=O)CCOC1CC1 71bcc53c6961c217f2fe0eeac463e457 [1,0,0,1,0,0|2,0,0]=4 12146 B9R1.85 CC(=O)CNCC1CC1 0e70ea741601e77cf733a6778389766b [1,0,0,1,0,0|2,0,0]=4 12147 B9R1.85 CC(=O)COCC1CC1 e2c3813cb7e7a8aa347ec5eecae51c32 [1,0,0,1,0,0|2,0,0]=4 12148 B9R1.85 CC(=O)NCCC1CC1 e17912b5d20abd22f2eb1736360bbd32 [1,0,0,1,0,0|2,0,0]=4 12149 B9R1.85 NC(=O)CCNC1CC1 483a1398436bb03ac3b47583a045e7fa [1,0,0,1,0,0|2,0,0]=4 12150 B9R1.85 NC(=O)CCOC1CC1 e606ed505d7697d9f714c4395a14fa31 [1,0,0,1,0,0|2,0,0]=4 12151 B9R1.85 NC(=O)CNCC1CC1 20ebedd011b375c931ef532bff65156e [1,0,0,1,0,0|2,0,0]=4 12152 B9R1.85 NC(=O)COCC1CC1 96a956ffbb3f4717e41e4ec22d046bcb [1,0,0,1,0,0|2,0,0]=4 12153 B9R1.85 O=C(O)CCNC1CC1 d7e51b454c1ee077c45877f37cbd9dbc [1,0,0,1,0,0|1,0,0]=3 12154 B9R1.85 O=C(O)CCOC1CC1 920ebb5ee7c45a619a1db975c9276d90 [1,0,0,1,0,0|1,0,0]=3 12155 B9R1.85 O=C(O)CNCC1CC1 8970904c8ad5ee5911fea5cdeb7d255c [1,0,0,1,0,0|1,0,0]=3 12156 B9R1.85 O=C(O)COCC1CC1 bc7f43afa7576a49960c4f48c84cf235 [1,0,0,1,0,0|1,0,0]=3 12157 B9R1.85 O=S(O)CCNC1CC1 94430ad6d7db95012341d5c559357b1e [1,0,0,1,0,0|2,0,0]=4 12158 B9R1.85 O=S(O)COCC1CC1 0d96823bb52c88fc09e1ef8215fd789f [1,0,0,1,0,0|2,0,0]=4 12159 B9R1.96 CCC1CCN1C(=O)C f8a8c2660e185a53a38bd009b5fd9a1e [1,0,0,1,0,0|2,0,0]=4 12160 B9R1.96 CCN1CCC1C(=O)N 1cfe5ebf987ecebafa868cbdeb4b7422 [1,0,0,1,0,0|2,0,0]=4 12161 B9R1.96 CCN1CCC1C(=O)O ca0bbfd670281167636f7e4dd4cc56bf [1,0,0,1,0,0|1,0,0]=3 12162 B9R1.96 CCN1CC[C@@H]1C(=O)N d26915c9d0e6ed65803bfdf786a1b1ce [1,0,0,1,0,0|2,0,0]=4 12163 B9R1.96 CCN1CC[C@@H]1C(=O)O e809f9b39a76e5f73ee720d520f2d8da [1,0,0,1,0,0|1,0,0]=3 12164 B9R1.96 CCN1CC[C@H]1C(=O)N 32f8eb51fb894d3b554c30dd0433e814 [1,0,0,1,0,0|2,0,0]=4 12165 B9R1.96 CCN1CC[C@H]1C(=O)O 90d4ef3b77b2d2edfd444739e71a1146 [1,0,0,1,0,0|1,0,0]=3 12166 B9R1.96 O=C(O)C1CCN1CF a73c50a5747fbf1c9dcb89ff140eef56 [1,0,0,1,0,0|2,0,0]=4 12167 B9R1.96 O=C(O)C1CCN1CO dcd47fec92d7cd22c146c2f982367c0e [1,0,0,1,0,0|2,0,0]=4 12168 B9R1.96 O=C(O)[C@@H]1CCN1CF 33bf6032edb12ba6e0c6af4b3ab637c5 [1,0,0,1,0,0|2,0,0]=4 12169 B9R1.96 O=C(O)[C@@H]1CCN1CO 2d3df4b77e74f2ed1add2f1fa0f35f44 [1,0,0,1,0,0|2,0,0]=4 12170 B9R1.96 O=C(O)[C@H]1CCN1CF 732a43f42ed58b977b82331718d13123 [1,0,0,1,0,0|2,0,0]=4 12171 B9R1.96 O=C(O)[C@H]1CCN1CO 49245c491708831bcf451e59d5634aff [1,0,0,1,0,0|2,0,0]=4 12172 B11R1.64 CCN1C(SCC1C(=O)O)C 2ddfad5f683ddfdf94df0eb1af18a76d [0,1,0,1,0,0|2,0,0]=4 12173 B11R1.90 C=C(Br)COC1CCCC1C fd5478e68dc515e62062b94cd037d995 [0,1,0,1,0,0|2,0,0]=4 12174 B11R1.90 C=C(Br)CO[C@@H]1CCC[C@@H]1C ae92a4c0056fab562e1b7964d3c1b183 [0,1,0,1,0,0|2,0,0]=4 12175 B11R1.90 C=C(Br)CO[C@@H]1CCC[C@H]1C 13bcbfd245c65c10e8fd848f9ce66abc [0,1,0,1,0,0|2,0,0]=4 12176 B11R1.90 C=C(Br)CO[C@H]1CCC[C@@H]1C 5d8129ffb6b401c39d3da5309f1ae554 [0,1,0,1,0,0|2,0,0]=4 12177 B11R1.90 C=C(Br)CO[C@H]1CCC[C@H]1C 06c7a71e308759f1c66a9ffe7ca5bf88 [0,1,0,1,0,0|2,0,0]=4 12178 B11R1.90 C=C(C)CCN1CCCC1C 87a1a81c80f3154aa2c2456c289e7364 [0,1,0,1,0,0|2,0,0]=4 12179 B11R1.90 C=C(C)CCN1CCC[C@@H]1C 788d855812be09f408be47bc85589895 [0,1,0,1,0,0|2,0,0]=4 12180 B11R1.90 C=C(C)CCN1CCC[C@H]1C 9a74a6f80472fad0eb29fb68d2942eb9 [0,1,0,1,0,0|2,0,0]=4 12181 B11R1.90 C=C(C)COC1CCCC1C a7f9a25e16e8b047312c73bcb82cca03 [0,1,0,1,0,0|2,0,0]=4 12182 B11R1.90 C=C(C)CO[C@@H]1CCC[C@@H]1C 4d6a7adcc1b1dc7097dc2aadc2e94d4d [0,1,0,1,0,0|2,0,0]=4 12183 B11R1.90 C=C(C)CO[C@@H]1CCC[C@H]1C 3df7be631dca05a649b34fed28185645 [0,1,0,1,0,0|2,0,0]=4 12184 B11R1.90 C=C(C)CO[C@H]1CCC[C@@H]1C b1dad4a92eab8c680a06e745f132a2b4 [0,1,0,1,0,0|2,0,0]=4 12185 B11R1.90 C=C(C)CO[C@H]1CCC[C@H]1C 35825b3f3bfc5ad835e3fe05bb62e5d5 [0,1,0,1,0,0|2,0,0]=4 12186 B11R1.90 C=C(Cl)COC1CCCC1C 947c39d06441fb9f678c838fa3d21455 [0,1,0,1,0,0|2,0,0]=4 12187 B11R1.90 C=C(Cl)CO[C@@H]1CCC[C@@H]1C 2b95e2fe9786efaabdbe3f5ee351436c [0,1,0,1,0,0|2,0,0]=4 12188 B11R1.90 C=C(Cl)CO[C@@H]1CCC[C@H]1C 6a21d4dcf4ba7d247830fce267110a2f [0,1,0,1,0,0|2,0,0]=4 12189 B11R1.90 C=C(Cl)CO[C@H]1CCC[C@@H]1C 901d86f41d7ef80ef6ef40f40b2e93c2 [0,1,0,1,0,0|2,0,0]=4 12190 B11R1.90 C=C(Cl)CO[C@H]1CCC[C@H]1C 7593a71db5b9333e9046795edbfb0f09 [0,1,0,1,0,0|2,0,0]=4 12191 B11R1.90 C=C(F)COC1CCCC1C a779447891c08f0ae00b5f605feaa383 [0,1,0,1,0,0|2,0,0]=4 12192 B11R1.90 C=C(F)CO[C@@H]1CCC[C@@H]1C be20db8d34cd6f7ca4eac5cd3ab9dc80 [0,1,0,1,0,0|2,0,0]=4 12193 B11R1.90 C=C(F)CO[C@@H]1CCC[C@H]1C 5553a326511ba3fce51159d6b3533dff [0,1,0,1,0,0|2,0,0]=4 12194 B11R1.90 C=C(F)CO[C@H]1CCC[C@@H]1C 6bc400b08f93ad9360f0aaf9f79d073d [0,1,0,1,0,0|2,0,0]=4 12195 B11R1.90 C=C(F)CO[C@H]1CCC[C@H]1C aa4ef0ef8297e3f072c6dc5286b2fdd5 [0,1,0,1,0,0|2,0,0]=4 12196 B11R1.90 CC(=O)CCN1CCCC1C ab55e2f108912d002326fbc457da1c44 [0,1,0,1,0,0|1,0,0]=3 12197 B11R1.90 CC(=O)CCN1CCCC1O 632736a29579ebb1a1eb82c2792d86f3 [0,1,0,1,0,0|2,0,0]=4 12198 B11R1.90 CC(=O)CCN1CCC[C@@H]1C dc6ff659b42cbdb6029974e19a8a3368 [0,1,0,1,0,0|1,0,0]=3 12199 B11R1.90 CC(=O)CCN1CCC[C@H]1C 7d2b7f9be62fb5dde93f0a91e0251b7e [0,1,0,1,0,0|1,0,0]=3 12200 B11R1.90 CC(=O)CCN1CCSC1C 568a773e04fda3a251a793ab2c82343c [0,1,0,1,0,0|2,0,0]=4 12201 B11R1.90 CC(=O)CNC1CCCC1O 472f7783b80e9cd08b560ca9f08febae [0,1,0,1,0,0|2,0,0]=4 12202 B11R1.90 CC(=O)NCC1CCCC1O c742412c82108bc2a7c8d8d13a8e3bff [0,1,0,1,0,0|2,0,0]=4 12203 B11R1.90 CC(=O)NCC1CCCN1C 0b1bca6c0f46f7cbd974bfca60d60e98 [0,1,0,1,0,0|2,0,0]=4 12204 B11R1.90 CC(=O)NC[C@@H]1CCCN1C 44117fe2bcc8ddb8bd974df5072f799d [0,1,0,1,0,0|2,0,0]=4 12205 B11R1.90 CC(=O)NC[C@H]1CCCN1C 5974ed54a84d47be6f8cdd58624f19b0 [0,1,0,1,0,0|2,0,0]=4 12206 B11R1.90 CC(=O)OCN1CCCC1C e1206aa7bf532f6eda3cb28910b45932 [0,1,0,1,0,0|2,0,0]=4 12207 B11R1.90 CC(=O)OCN1CCC[C@@H]1C 4345c5e09fb225bd93485b0af7507a8f [0,1,0,1,0,0|2,0,0]=4 12208 B11R1.90 CC(=O)OCN1CCC[C@H]1C 3a5542a1ee98723342b848946d8d6382 [0,1,0,1,0,0|2,0,0]=4 12209 B11R1.90 CC(O)CCN1CCCC1C 0534d9fafec12288d1bffcc4dbcba705 [0,1,0,1,0,0|1,0,1]=4 12210 B11R1.90 CC(O)CCN1CCC[C@@H]1C 9971487b5c3d4c90ac0c7790a8fbf742 [0,1,0,1,0,0|1,0,1]=4 12211 B11R1.90 CC(O)CCN1CCC[C@H]1C d3da0fc2f580ed5f28623b0b34f807f5 [0,1,0,1,0,0|1,0,1]=4 12212 B11R1.90 CC1CCCC1OCC(=O)N 4fee3f88e46733ad34c4c115601bb5c5 [0,1,0,1,0,0|1,0,0]=3 12213 B11R1.90 CC1CCCC1OCC(=O)O 8b302fdcccb2e5b0cbc05eb78f61b043 [0,1,0,1,0,0|0,0,0]=2 12214 B11R1.90 CC1CCCC1OC[N+](=O)[O-] 02516cb505d365adaf1550a56b74744e [0,1,0,1,0,0|1,0,1]=4 12215 B11R1.90 CC1CCCN1CCC(=O)N f9f01f0c93049664c15074828dda8b03 [0,1,0,1,0,0|1,0,0]=3 12216 B11R1.90 CC1CCCN1CCC(=O)O 5dcf506a51a046fb0501db2e405b0462 [0,1,0,1,0,0|0,0,0]=2 12217 B11R1.90 CC1CCCN1CCS(=O)C 7079475bea2b015bff24900a5455a28b [0,1,0,1,0,0|2,0,0]=4 12218 B11R1.90 CC1CCCN1CSC(=O)N c25304707530576b2be8331c7d034388 [0,1,0,1,0,0|2,0,0]=4 12219 B11R1.90 CC1COCC1OCC(=O)N de9266ade73b80e1945cda1801792dc9 [0,1,0,1,0,0|2,0,0]=4 12220 B11R1.90 CC1COCC1OCC(=O)O df066681c986e1d0ed881ddaea060f92 [0,1,0,1,0,0|1,0,0]=3 12221 B11R1.90 CC1SCCN1CCC(=O)N 455d60a8f252297975eb9d64210c2d2c [0,1,0,1,0,0|2,0,0]=4 12222 B11R1.90 C[C@@H]1CCCN1CCC(=O)N ee174c696ba6e526988c2f02cc2c0c2a [0,1,0,1,0,0|1,0,0]=3 12223 B11R1.90 C[C@@H]1CCCN1CCC(=O)O 96dc0a47aa28ac6e47d8d4bf1e71e990 [0,1,0,1,0,0|0,0,0]=2 12224 B11R1.90 C[C@@H]1CCCN1CCS(=O)C 5b6eaa3e4207586fd3eec5c45a70e741 [0,1,0,1,0,0|2,0,0]=4 12225 B11R1.90 C[C@@H]1CCCN1CSC(=O)N 8a84fffd576464d5698a2a5f6d66c3e7 [0,1,0,1,0,0|2,0,0]=4 12226 B11R1.90 C[C@@H]1CCC[C@@H]1OCC(=O)N 1184acc8b4aad430dc992135fd786da5 [0,1,0,1,0,0|1,0,0]=3 12227 B11R1.90 C[C@@H]1CCC[C@@H]1OCC(=O)O 735a45401cd3b3bbab8ed3fa02f5be83 [0,1,0,1,0,0|0,0,0]=2 12228 B11R1.90 C[C@@H]1CCC[C@@H]1OC[N+](=O)[O-] d9a7d2945724c9908e27b5fd5eab0e4d [0,1,0,1,0,0|1,0,1]=4 12229 B11R1.90 C[C@@H]1CCC[C@H]1OCC(=O)N ca726fed3322bb1ce526546ad44049f4 [0,1,0,1,0,0|1,0,0]=3 12230 B11R1.90 C[C@@H]1CCC[C@H]1OCC(=O)O 1c7967d6457face00634b93870635bd7 [0,1,0,1,0,0|0,0,0]=2 12231 B11R1.90 C[C@@H]1CCC[C@H]1OC[N+](=O)[O-] d1cdc2488cc97fc3a621d9a7120f5e83 [0,1,0,1,0,0|1,0,1]=4 12232 B11R1.90 C[C@@H]1COC[C@@H]1OCC(=O)N ff23cae2947930b0fe48c1385d2c859c [0,1,0,1,0,0|2,0,0]=4 12233 B11R1.90 C[C@@H]1COC[C@@H]1OCC(=O)O aaaaed8b059f1ced6e228d2f6e718e67 [0,1,0,1,0,0|1,0,0]=3 12234 B11R1.90 C[C@H]1CCCN1CCC(=O)N 282778205b3870c26b4527f56d58959f [0,1,0,1,0,0|1,0,0]=3 12235 B11R1.90 C[C@H]1CCCN1CCC(=O)O 15177369ccddfffa267e0f1ea23ee8e6 [0,1,0,1,0,0|0,0,0]=2 12236 B11R1.90 C[C@H]1CCCN1CCS(=O)C ec499272fd606ee0bbecc6da119d1e5b [0,1,0,1,0,0|2,0,0]=4 12237 B11R1.90 C[C@H]1CCCN1CSC(=O)N 89c174d4ceb24c69d016a44d20bfef4f [0,1,0,1,0,0|2,0,0]=4 12238 B11R1.90 C[C@H]1CCC[C@@H]1OCC(=O)N acb029276a46ec825cfebe05c4167b98 [0,1,0,1,0,0|1,0,0]=3 12239 B11R1.90 C[C@H]1CCC[C@@H]1OCC(=O)O 1011d83d813a08e7d91c46348c016f66 [0,1,0,1,0,0|0,0,0]=2 12240 B11R1.90 C[C@H]1CCC[C@@H]1OC[N+](=O)[O-] a3d0cda7022c2b26a94309afd3309401 [0,1,0,1,0,0|1,0,1]=4 12241 B11R1.90 C[C@H]1CCC[C@H]1OCC(=O)N bd5b8c042241bb80179df5c047c5960c [0,1,0,1,0,0|1,0,0]=3 12242 B11R1.90 C[C@H]1CCC[C@H]1OCC(=O)O 41f392f14989d15a78b37a9a4a93f045 [0,1,0,1,0,0|0,0,0]=2 12243 B11R1.90 C[C@H]1CCC[C@H]1OC[N+](=O)[O-] 569063c3d8717157b42d04e037e754ec [0,1,0,1,0,0|1,0,1]=4 12244 B11R1.90 C[C@H]1COC[C@@H]1OCC(=O)N dc4524fe685b246085f20aea2b811118 [0,1,0,1,0,0|2,0,0]=4 12245 B11R1.90 C[C@H]1COC[C@@H]1OCC(=O)O 3c1c50f9789739472bd1035efc9db00e [0,1,0,1,0,0|1,0,0]=3 12246 B11R1.90 C[C@H]1COC[C@H]1OCC(=O)N 88333b4e878f07ebbe30b530fb8981f5 [0,1,0,1,0,0|2,0,0]=4 12247 B11R1.90 C[C@H]1COC[C@H]1OCC(=O)O fd7d1abc48621d493bf9bddf84293b38 [0,1,0,1,0,0|1,0,0]=3 12248 B11R1.90 NC(=O)CCN1CCCC1O 22c09dba00a50c376ccdf934896cd6cb [0,1,0,1,0,0|2,0,0]=4 12249 B11R1.90 NC(=O)CNC1CCCC1O 32e8d19023bf98727e7c7079abc61f38 [0,1,0,1,0,0|2,0,0]=4 12250 B11R1.90 NC(=O)CN[C@@H]1CCC[C@@H]1O 16f2ad0ec0208d9e6749943cd76bc7e0 [0,1,0,1,0,0|2,0,0]=4 12251 B11R1.90 NC(=O)CN[C@@H]1CCC[C@H]1O 5f951f69de3259ceb2e37f39ac476af6 [0,1,0,1,0,0|2,0,0]=4 12252 B11R1.90 NC(=O)CN[C@H]1CCC[C@@H]1O 689100c3f11a8eba47910c8cb6c7a62f [0,1,0,1,0,0|2,0,0]=4 12253 B11R1.90 NC(=O)CN[C@H]1CCC[C@H]1O b242531adccd052135e876b0d7a2684d [0,1,0,1,0,0|2,0,0]=4 12254 B11R1.90 NC(=O)CO[C@@H]1CCC[C@H]1F be90274dd068092449e5ac28e96d9ee4 [0,1,0,1,0,0|2,0,0]=4 12255 B11R1.90 O=C(O)CCN1CCCC1O 3c721be2a5f13d4f83ec3fdb254a149f [0,1,0,1,0,0|1,0,0]=3 12256 B11R1.90 O=C(O)CNC1CCCC1O 4ebe649c114bd55216e6381c318bf421 [0,1,0,1,0,0|1,0,0]=3 12257 B11R1.90 O=C(O)CNC1COCC1O a7ce619aef5b10a70515f7aaa8043dd1 [0,1,0,1,0,0|2,0,0]=4 12258 B11R1.90 O=C(O)CN[C@@H]1CCC[C@@H]1O 4e3c6cfcceaae1d8e09f0b43011ac18b [0,1,0,1,0,0|1,0,0]=3 12259 B11R1.90 O=C(O)CN[C@@H]1CCC[C@H]1O 0004ed21fdc2e98760db8a34ad8da636 [0,1,0,1,0,0|1,0,0]=3 12260 B11R1.90 O=C(O)CN[C@@H]1COC[C@@H]1O 649271099b5d6c9a251d94ba34c44d63 [0,1,0,1,0,0|2,0,0]=4 12261 B11R1.90 O=C(O)CN[C@@H]1COC[C@H]1O 943f0069ef9605f2d66b20fff91dad16 [0,1,0,1,0,0|2,0,0]=4 12262 B11R1.90 O=C(O)CN[C@H]1CCC[C@@H]1O 83d9e7b37b03d01fa38520665b96bcfa [0,1,0,1,0,0|1,0,0]=3 12263 B11R1.90 O=C(O)CN[C@H]1CCC[C@H]1O 489d3fcb2f42477c58cba9671541d376 [0,1,0,1,0,0|1,0,0]=3 12264 B11R1.90 O=C(O)CN[C@H]1COC[C@@H]1O 256d179e71f38721a37bfd43360f87b8 [0,1,0,1,0,0|2,0,0]=4 12265 B11R1.90 O=C(O)CN[C@H]1COC[C@H]1F 467164739ab2bd96d8ec55739156ce18 [0,1,0,1,0,0|2,0,0]=4 12266 B11R1.90 O=C(O)CN[C@H]1COC[C@H]1O a95a3797132df7154819fd017e74c39e [0,1,0,1,0,0|2,0,0]=4 12267 B11R1.90 O=C(O)COC1CCCC1=O de7a2320c8b4a9fc7111197b63c3342f [0,1,0,1,0,0|1,0,1]=4 12268 B11R1.90 O=C(O)COC1COCC1F cafaf634c7ad3f1c4f90a1a9a68b87f7 [0,1,0,1,0,0|2,0,0]=4 12269 B11R1.90 O=C(O)CO[C@@H]1CCC[C@H]1F b444918d808f918451551dfb25df770b [0,1,0,1,0,0|1,0,0]=3 12270 B11R1.90 O=C(O)CO[C@@H]1COC[C@H]1F 06e869009c2658cfadfded6eb7c14f30 [0,1,0,1,0,0|2,0,0]=4 12271 B11R1.90 O=C(O)CO[C@H]1COC[C@H]1F d03da2928bae04d8838f2f514518d904 [0,1,0,1,0,0|2,0,0]=4 12272 B11R1.120 CCCC1CN(C1)CC(=O)N 4d1f786764f6eb733fe8c64d45d60153 [0,1,0,1,0,0|2,0,0]=4 12273 B11R1.120 CCCC1CN(C1)CC(=O)O fba412a0f82a1ee01a04aa56e0be3704 [0,1,0,1,0,0|1,0,0]=3 12274 B11R1.120 CCCN1CC(C1)CC(=O)O a74e28eea77eddbeba86cd4e29d4aa9b [0,1,0,1,0,0|1,0,0]=3 12275 B11R1.120 CCNC1CC(C1)CC(=O)O c932d50daca709bf607994bb55329947 [0,1,0,1,0,0|1,0,0]=3 12276 B11R1.120 CCOC1CN(C1)CC(=O)O 637b792170cf8bcab7a459a6ee960ecd [0,1,0,1,0,0|2,0,0]=4 12277 B11R1.120 CCO[C@H]1C[C@@H](C1)CC(=O)O 7213447776fdd469a90351d8026dd1cf [0,1,0,1,0,0|1,0,0]=3 12278 B11R1.120 CCO[C@H]1C[C@H](C1)CC(=O)O 706ccad5650b5b666cd4735ffcf461be [0,1,0,1,0,0|1,0,0]=3 12279 B11R1.120 COCC1CN(C1)CC(=O)O 587774d78c0341511052cb1b626bd6ed [0,1,0,1,0,0|2,0,0]=4 12280 B11R1.120 COCN1CC(C1)CC(=O)O d3cfefa24cebb718a9f560308fcce556 [0,1,0,1,0,0|2,0,0]=4 12281 B11R1.120 CSCN1CC(C1)CC(=O)O 93f3f5721f9cfd7683d2363aee1621bf [0,1,0,1,0,0|2,0,0]=4 12282 B11R1.120 O=C(O)CC1CC(C1)NCF ee7e70a317c7bdd83c741c774ac01150 [0,1,0,1,0,0|2,0,0]=4 12283 B11R1.120 O=C(O)CC1CC(C1)NCO a5b2000ea6cf7e9fbb56a030f6ffcffa [0,1,0,1,0,0|2,0,0]=4 12284 B11R1.120 O=C(O)CC1CN(C1)CCF 756e1fc581014784574d4b2469244b18 [0,1,0,1,0,0|2,0,0]=4 12285 B11R1.120 O=C(O)CC1CN(C1)CCO b7a4d528304329cb0fda9a1e0e32e135 [0,1,0,1,0,0|2,0,0]=4 12286 B11R1.120 O=C(O)CC1CN(C1)CCS 9e3f90880ea5cc8c448c94a70f0ae50f [0,1,0,1,0,0|2,0,0]=4 12287 B11R1.120 O=C(O)C[C@H]1C[C@@H](C1)OCF a452630265608e1da249b59fc2be4263 [0,1,0,1,0,0|2,0,0]=4 12288 B11R1.120 O=C(O)C[C@H]1C[C@H](C1)OCF 5d09c7c69eac2abeefd4df3b6983ff44 [0,1,0,1,0,0|2,0,0]=4 12289 B11R1.124 CCCC1CCN(C1)C(=O)C cf653038333ed4fdc6e97034154be45f [0,1,0,1,0,0|2,0,0]=4 12290 B11R1.124 CCCN1CCC(C1)C(=O)C 68b9d9e425da70cd916c3aad788516b4 [0,1,0,1,0,0|2,0,0]=4 12291 B11R1.124 CCCN1CCC(C1)C(=O)N 7cd2d813f0b7507a3c74c2bf90a9fed4 [0,1,0,1,0,0|2,0,0]=4 12292 B11R1.124 CCCN1CCC(C1)C(=O)O 87e4e74ec5a2a9417c4168cd294b1c79 [0,1,0,1,0,0|1,0,0]=3 12293 B11R1.124 CCCN1CC[C@@H](C1)C(=O)N b6b263aad262f62bd56a2ad52c2e9884 [0,1,0,1,0,0|2,0,0]=4 12294 B11R1.124 CCCN1CC[C@@H](C1)C(=O)O f0e8b057ca9fdfbb4fe5cb890d06cef6 [0,1,0,1,0,0|1,0,0]=3 12295 B11R1.124 CCCN1CC[C@H](C1)C(=O)N 77bfbc14e23184f046d519235cd3dbc6 [0,1,0,1,0,0|2,0,0]=4 12296 B11R1.124 CCCN1CC[C@H](C1)C(=O)O 095997d10c82d1b711b0c726dec4d13b [0,1,0,1,0,0|1,0,0]=3 12297 B11R1.124 CCNC1CCC(C1)C(=O)N 04a3d61423b766205458bacba408aeac [0,1,0,1,0,0|2,0,0]=4 12298 B11R1.124 CCNC1CCC(C1)C(=O)O 8a32177e05f38c3811851d2f49ef5522 [0,1,0,1,0,0|1,0,0]=3 12299 B11R1.124 CCN[C@@H]1CC[C@@H](C1)C(=O)N 150a20774f705c74e63b48cb9f264db1 [0,1,0,1,0,0|2,0,0]=4 12300 B11R1.124 CCN[C@@H]1CC[C@@H](C1)C(=O)O e7e3b1762a14d8784b53e835bcc25e83 [0,1,0,1,0,0|1,0,0]=3 12301 B11R1.124 CCN[C@@H]1CC[C@H](C1)C(=O)N 1428a286538cce2ffbe60100599f4246 [0,1,0,1,0,0|2,0,0]=4 12302 B11R1.124 CCN[C@@H]1CC[C@H](C1)C(=O)O 9f7dcb7e6933010f42d1a423e4ec32d6 [0,1,0,1,0,0|1,0,0]=3 12303 B11R1.124 CCN[C@H]1CC[C@@H](C1)C(=O)N f46adc1b72ada2ef491662a6c78d18f8 [0,1,0,1,0,0|2,0,0]=4 12304 B11R1.124 CCN[C@H]1CC[C@@H](C1)C(=O)O f1d4a8fc9dcb3ed49175ba69ea4366f3 [0,1,0,1,0,0|1,0,0]=3 12305 B11R1.124 CCN[C@H]1CC[C@H](C1)C(=O)N 615de7ef05d17820c52cb92c76c3becc [0,1,0,1,0,0|2,0,0]=4 12306 B11R1.124 CCN[C@H]1CC[C@H](C1)C(=O)O 3e2cefc860eaf3d2a67e665161acd3fa [0,1,0,1,0,0|1,0,0]=3 12307 B11R1.124 CCOC1CCC(C1)C(=O)O 86af6eb36c87a7444d960bd2c4c650d0 [0,1,0,1,0,0|1,0,0]=3 12308 B11R1.124 CCOC1CSC(O1)C(=O)O c65d607c84ba6caad4edcd2cb66e94ef [0,1,0,1,0,0|2,0,0]=4 12309 B11R1.124 CCO[C@@H]1CC[C@@H](C1)C(=O)O 54f622e4e633f49f0d461b8256af8593 [0,1,0,1,0,0|1,0,0]=3 12310 B11R1.124 CCO[C@@H]1CC[C@H](C1)C(=O)O 42ca338ff930d0894841ecff9ee89c70 [0,1,0,1,0,0|1,0,0]=3 12311 B11R1.124 CCO[C@H]1CC[C@@H](C1)C(=O)O 41c318617516a60d965d51435ee5c3de [0,1,0,1,0,0|1,0,0]=3 12312 B11R1.124 CCO[C@H]1CC[C@H](C1)C(=O)O c106c74419daa459f04264af8c285c7a [0,1,0,1,0,0|1,0,0]=3 12313 B11R1.124 COCN1CCC(C1)C(=O)O 0f848fb20f596af9f29e75b05c585e17 [0,1,0,1,0,0|2,0,0]=4 12314 B11R1.124 COCN1CC[C@@H](C1)C(=O)O a7b8cd2961f98448e733dfa697671537 [0,1,0,1,0,0|2,0,0]=4 12315 B11R1.124 COCN1CC[C@H](C1)C(=O)O 1173552c3a6a7886ab37dcbbacaac032 [0,1,0,1,0,0|2,0,0]=4 12316 B11R1.124 CSCN1CCC(C1)C(=O)O 3d5c042c339e4f3e07c4f45c260bd8ac [0,1,0,1,0,0|2,0,0]=4 12317 B11R1.124 CSCN1CC[C@@H](C1)C(=O)O 003dfd2012f78ff84a0d14b61c062183 [0,1,0,1,0,0|2,0,0]=4 12318 B11R1.124 CSCN1CC[C@H](C1)C(=O)O 2715e92b5b63e635e71f44d4716028f8 [0,1,0,1,0,0|2,0,0]=4 12319 B11R1.124 O=C(O)C1CCC(C1)NCF f70bd6be0a811088038783384e2678fe [0,1,0,1,0,0|2,0,0]=4 12320 B11R1.124 O=C(O)C1CCC(C1)NCO b62cc43cd18f972aad5899d0ce7ffaf7 [0,1,0,1,0,0|2,0,0]=4 12321 B11R1.124 O=C(O)C1CCC(C1)OCF b42fac8cdd540aaec6224c034d644860 [0,1,0,1,0,0|2,0,0]=4 12322 B11R1.124 O=C(O)C1CCN(C1)CCF 665242f64b2fb6751157e097834de387 [0,1,0,1,0,0|2,0,0]=4 12323 B11R1.124 O=C(O)C1CCN(C1)CCO 7fdb450b440bb8b33fafa5b534302657 [0,1,0,1,0,0|2,0,0]=4 12324 B11R1.124 O=C(O)C1CCN(C1)CCS 684369a156fc4b73696447dee7f31631 [0,1,0,1,0,0|2,0,0]=4 12325 B11R1.124 O=C(O)[C@@H]1CCN(C1)CCF 0f4ef53e14dcc90f56ff9a22d9c31e9e [0,1,0,1,0,0|2,0,0]=4 12326 B11R1.124 O=C(O)[C@@H]1CCN(C1)CCO 0e55f3e145890c2603667c5c8cb20d88 [0,1,0,1,0,0|2,0,0]=4 12327 B11R1.124 O=C(O)[C@@H]1CCN(C1)CCS 3b10c34d7e41daadf26a445d195d1ae0 [0,1,0,1,0,0|2,0,0]=4 12328 B11R1.124 O=C(O)[C@@H]1CC[C@@H](C1)NCF 5ee6404c3a05b1240103486e8cdf10a5 [0,1,0,1,0,0|2,0,0]=4 12329 B11R1.124 O=C(O)[C@@H]1CC[C@@H](C1)NCO 82a686ca772b5684edb3185fd2a0d8a4 [0,1,0,1,0,0|2,0,0]=4 12330 B11R1.124 O=C(O)[C@@H]1CC[C@@H](C1)OCF dd7a5586532f60bd8d0ac3ada6365f78 [0,1,0,1,0,0|2,0,0]=4 12331 B11R1.124 O=C(O)[C@@H]1CC[C@H](C1)NCF a2132214728792ab59f5c899c7eb5cb1 [0,1,0,1,0,0|2,0,0]=4 12332 B11R1.124 O=C(O)[C@@H]1CC[C@H](C1)NCO d8064306f12d5b451e799446c0b34e2c [0,1,0,1,0,0|2,0,0]=4 12333 B11R1.124 O=C(O)[C@@H]1CC[C@H](C1)OCF f60469806def02edb245481d43cfb5f3 [0,1,0,1,0,0|2,0,0]=4 12334 B11R1.124 O=C(O)[C@H]1CCN(C1)CCF af94c42b7a0180866aaf15493eaacda9 [0,1,0,1,0,0|2,0,0]=4 12335 B11R1.124 O=C(O)[C@H]1CCN(C1)CCO 62510ec389da0c8195aa16a13a341f1c [0,1,0,1,0,0|2,0,0]=4 12336 B11R1.124 O=C(O)[C@H]1CCN(C1)CCS e880f0d4ab950ede4b3ea118dc3a5ce5 [0,1,0,1,0,0|2,0,0]=4 12337 B11R1.124 O=C(O)[C@H]1CC[C@@H](C1)NCF 324581668bd1252f9d499fa9f1bc5fda [0,1,0,1,0,0|2,0,0]=4 12338 B11R1.124 O=C(O)[C@H]1CC[C@@H](C1)NCO 68924ecd7c6f43a3048d6b0091f65911 [0,1,0,1,0,0|2,0,0]=4 12339 B11R1.124 O=C(O)[C@H]1CC[C@@H](C1)OCF 0b99a6bed2cddfa2b5d66c7507850aa7 [0,1,0,1,0,0|2,0,0]=4 12340 B11R1.124 O=C(O)[C@H]1CC[C@H](C1)NCF 48d09c22177d0fe1fd197444e9522591 [0,1,0,1,0,0|2,0,0]=4 12341 B11R1.124 O=C(O)[C@H]1CC[C@H](C1)NCO 0b80b9625817ecf095056dd4f3c6ad92 [0,1,0,1,0,0|2,0,0]=4 12342 B11R1.124 O=C(O)[C@H]1CC[C@H](C1)OCF 0e591c7872c528a75d39be4e398a34cb [0,1,0,1,0,0|2,0,0]=4 12343 B11R1.130 COC[C@@H]1C[C@@H]1NCC(=O)N 027feec904a663694cc41fda8eaff355 [0,1,0,1,0,0|2,0,0]=4 12344 B11R1.130 COC[C@@H]1C[C@@H]1NCC(=O)O 8a855f44292adb9bb1627cd62faafe14 [0,1,0,1,0,0|1,0,0]=3 12345 B11R1.130 COC[C@H]1C[C@@H]1NCC(=O)N 6e3985383e32ab2aee33adf8885617b0 [0,1,0,1,0,0|2,0,0]=4 12346 B11R1.130 COC[C@H]1C[C@@H]1NCC(=O)O 464c962d51a08e4a2bd3e6501c20c7ad [0,1,0,1,0,0|1,0,0]=3 12347 B11R1.135 CCCN1CCCC(=O)CC1 5d78a27b1115d294c02accd204f79118 [0,1,0,1,0,0|2,0,0]=4 12348 B11R1.135 CCOC1CCCC(=O)NC1 4189d64438fb7860c330be2892be390d [0,1,0,1,0,0|2,0,0]=4 12349 B11R1.154 C=C(C)CNCC1CC(=O)O1 8f6d8234a6f4195178be112470db4e28 [0,1,0,1,0,0|1,0,1]=4 12350 B11R1.154 C=C(C)COCC1CC(=O)O1 01137665347b646440a3d4837e202d3c [0,1,0,1,0,0|1,0,1]=4 12351 B11R1.154 C=C1CC(C1)CNCC(=O)O bbff987138c159a703a438e4c587e65d [0,1,0,1,0,0|1,0,1]=4 12352 B11R1.154 C=C1CC(C1)COCC(=O)O f2e83198481c136d338ec24c9d51db1e [0,1,0,1,0,0|1,0,1]=4 12353 B11R1.154 CC(=O)CCCN1CC(C1)F 99288959a5e01260dbebf6b890e13dfd [0,1,0,1,0,0|2,0,0]=4 12354 B11R1.154 CC(=O)CCCN1CC(C1)O 1fd6fdf9700c130b8f37ed12b555b691 [0,1,0,1,0,0|2,0,0]=4 12355 B11R1.154 CC(=O)CCNC1CC(C1)F cfab63a63e72f75a2695e06ebf6b0394 [0,1,0,1,0,0|2,0,0]=4 12356 B11R1.154 CC(=O)CCNC1CC(C1)O e70d8a6e9d7aa1b4dd5487e2be206b84 [0,1,0,1,0,0|2,0,0]=4 12357 B11R1.154 CC(=O)CCN[C@H]1C[C@@H](C1)F f0e30409501b207f078769c948a1226d [0,1,0,1,0,0|2,0,0]=4 12358 B11R1.154 CC(=O)CCN[C@H]1C[C@@H](C1)O 0b056a52ef2f2abb79fe3688468860e8 [0,1,0,1,0,0|2,0,0]=4 12359 B11R1.154 CC(=O)CCN[C@H]1C[C@H](C1)F 177f195c0250f7c339c0d429bb4402ae [0,1,0,1,0,0|2,0,0]=4 12360 B11R1.154 CC(=O)CCN[C@H]1C[C@H](C1)O dacc40c9881c1fac529fb5d361e5cfeb [0,1,0,1,0,0|2,0,0]=4 12361 B11R1.154 CC(=O)CCOC1CC(C1)C f638250c9ef8f9729ae005a6840e9d7d [0,1,0,1,0,0|2,0,0]=4 12362 B11R1.154 CC(=O)CCOC1CC(C1)F af94e322a73cdd046d5155a5d4ecff5d [0,1,0,1,0,0|2,0,0]=4 12363 B11R1.154 CC(=O)CCO[C@H]1C[C@@H](C1)F 4f8861e026549e714c009151661dbdd8 [0,1,0,1,0,0|2,0,0]=4 12364 B11R1.154 CC(=O)CCO[C@H]1C[C@H](C1)F 9d3dcc8af21603dcb5b13e4b7021c50f [0,1,0,1,0,0|2,0,0]=4 12365 B11R1.154 CC(=O)CNCC1CC(=O)O1 867995c99a11b9597b38f195de9c77ae [0,1,0,1,0,0|1,0,1]=4 12366 B11R1.154 CC(=O)CNCC1CC(C1)C cdd9f4a8b035d361bc34df517c6268e6 [0,1,0,1,0,0|2,0,0]=4 12367 B11R1.154 CC(=O)CNCC1CC(C1)O 8ad83069a282d10963ac3fb8adc75f39 [0,1,0,1,0,0|2,0,0]=4 12368 B11R1.154 CC(=O)CNC[C@H]1C[C@H](C1)F 77a4bbdfc78557930f64e09490ad6c77 [0,1,0,1,0,0|2,0,0]=4 12369 B11R1.154 CC(=O)COCC1CC(=O)O1 2aaff0bef80e05b186f6c55f610c8d2c [0,1,0,1,0,0|1,0,1]=4 12370 B11R1.154 CC(=O)COCC1CC(C1)C 790ed7d519fbc8d9a26e93e22dfeeb80 [0,1,0,1,0,0|2,0,0]=4 12371 B11R1.154 CC(=O)COC[C@H]1C[C@H](C1)F 6a7270bc3f915714a3682c3605bc02c5 [0,1,0,1,0,0|2,0,0]=4 12372 B11R1.154 CC(C)CCOC1CC(=O)C1 77ceedcc27815a0602269a8265836b4f [0,1,0,1,0,0|2,0,0]=4 12373 B11R1.154 CC(C)CNCC1CC(=O)C1 71747bea3db2b03b6b0dc24f1389b1f1 [0,1,0,1,0,0|2,0,0]=4 12374 B11R1.154 CC(C)CNCC1CC(=O)N1 048d5b278cb33be321fb230898d1d86d [0,1,0,1,0,0|2,0,0]=4 12375 B11R1.154 CC(C)CNCC1CC(=O)O1 b327f4806ae10e8cb0c7c2f3307e3dc5 [0,1,0,1,0,0|1,0,0]=3 12376 B11R1.154 CC(C)COCC1CC(=O)C1 1f0ca36373015fd7624852104d85cb8d [0,1,0,1,0,0|2,0,0]=4 12377 B11R1.154 CC(C)COCC1CC(=O)N1 5d9850f7d948fa1d9ffc6a9995591800 [0,1,0,1,0,0|2,0,0]=4 12378 B11R1.154 CC(C)COCC1CC(=O)O1 250e0380d5d13c59313f7c64efcd83d2 [0,1,0,1,0,0|1,0,0]=3 12379 B11R1.154 CC(C)COC[C@@H]1CC(=O)N1 7e24991365c427de676a688669e1fcd5 [0,1,0,1,0,0|2,0,0]=4 12380 B11R1.154 CC(C)COC[C@H]1CC(=O)N1 252237eceb232909106e2c019d1f51af [0,1,0,1,0,0|2,0,0]=4 12381 B11R1.154 CC(F)COCC1CC(=O)C1 8a862b5e635536c2be1ae6ea9e78597c [0,1,0,1,0,0|2,0,0]=4 12382 B11R1.154 CC(F)COCC1CC(=O)N1 5a125e31d5d4ff5a9d2a5f40c43235c9 [0,1,0,1,0,0|2,0,0]=4 12383 B11R1.154 CC(F)COCC1CC(=O)O1 4477de8e9b29a8b1ed156b31fba799c0 [0,1,0,1,0,0|1,0,0]=3 12384 B11R1.154 CC(O)CNCC1CC(=O)C1 9bc588e792014938e6dd2ed3b4025f02 [0,1,0,1,0,0|2,0,0]=4 12385 B11R1.154 CC(O)CNCC1CC(=O)N1 d018a46e0631033b116c8e83a2fb0f01 [0,1,0,1,0,0|2,0,0]=4 12386 B11R1.154 CC(O)CNCC1CC(=O)O1 6c2cdcf91fb4b4a5dc2799ca738a0706 [0,1,0,1,0,0|1,0,0]=3 12387 B11R1.154 CC(S)COCC1CC(=O)C1 1dacaed992232d983ebb907649148bab [0,1,0,1,0,0|2,0,0]=4 12388 B11R1.154 CC(S)COCC1CC(=O)N1 df1d87ea95493bd3ff509f70bad70e1f [0,1,0,1,0,0|2,0,0]=4 12389 B11R1.154 CC(S)COCC1CC(=O)O1 94536510d4f8b16c3829ab8d6d64eb83 [0,1,0,1,0,0|1,0,0]=3 12390 B11R1.154 CC1CC(C1)CNCC(=O)N 151f13d7f9274463c9cb32b56b7e1707 [0,1,0,1,0,0|2,0,0]=4 12391 B11R1.154 CC1CC(C1)CNCC(=O)O d3139215aa66f818e5323ca9ce866f0e [0,1,0,1,0,0|1,0,0]=3 12392 B11R1.154 CC1CC(C1)COCC(=O)N e49a930ae6769f6434670c7af1094d9c [0,1,0,1,0,0|2,0,0]=4 12393 B11R1.154 CC1CC(C1)COCC(=O)O 9ce845a05b390ab993e463fcdaf015e8 [0,1,0,1,0,0|1,0,0]=3 12394 B11R1.154 CC1CC(C1)COCS(=O)O 53962b92255e3a833df0ff0369e6890b [0,1,0,1,0,0|2,0,0]=4 12395 B11R1.154 CC1CC(C1)OCCC(=O)N c218764a290ea1a668ae4646299ab8d4 [0,1,0,1,0,0|2,0,0]=4 12396 B11R1.154 CC1CC(C1)OCCC(=O)O 7882b013c44ba84815b84cca3b07e2f4 [0,1,0,1,0,0|1,0,0]=3 12397 B11R1.154 CN1CC(C1)CNCC(=O)O a57156e6b58268e5ed744c48415cc368 [0,1,0,1,0,0|2,0,0]=4 12398 B11R1.154 CN1CC(C1)COCC(=O)O 2670c1c8620b3cb4d6fcf087423e5fe1 [0,1,0,1,0,0|2,0,0]=4 12399 B11R1.154 CN1CC(C1)NCCC(=O)O 73f69c73b4bf5979df81792375238345 [0,1,0,1,0,0|2,0,0]=4 12400 B11R1.154 CN1CC(C1)OCCC(=O)O d4db551a50d56422d32925964584556e [0,1,0,1,0,0|2,0,0]=4 12401 B11R1.154 C[C@@H](F)COCC1CC(=O)C1 aa7911b83f8006bc385c8f8c58645ba2 [0,1,0,1,0,0|2,0,0]=4 12402 B11R1.154 C[C@@H](F)COCC1CC(=O)N1 b01839ce090c23ea99110b62896eb53d [0,1,0,1,0,0|2,0,0]=4 12403 B11R1.154 C[C@@H](F)COCC1CC(=O)O1 ae28893162a88fc56b43119e5fb78924 [0,1,0,1,0,0|1,0,0]=3 12404 B11R1.154 C[C@@H](O)CNCC1CC(=O)C1 6368a4a03665e410968d03d18c06941d [0,1,0,1,0,0|2,0,0]=4 12405 B11R1.154 C[C@@H](O)CNCC1CC(=O)N1 2ef022bb6f09bec6765c3f2d5f537d11 [0,1,0,1,0,0|2,0,0]=4 12406 B11R1.154 C[C@@H](O)CNCC1CC(=O)O1 c9306922d7db23f2e112a939ca683ab6 [0,1,0,1,0,0|1,0,0]=3 12407 B11R1.154 C[C@H](F)COCC1CC(=O)C1 4304df66146e5fc29943bd6d01352ec2 [0,1,0,1,0,0|2,0,0]=4 12408 B11R1.154 C[C@H](F)COCC1CC(=O)N1 136fe8d0bdc2617a2acc8ba303327718 [0,1,0,1,0,0|2,0,0]=4 12409 B11R1.154 C[C@H](F)COCC1CC(=O)O1 b190504787a58263036cac0bcd9257af [0,1,0,1,0,0|1,0,0]=3 12410 B11R1.154 C[C@H](O)CNCC1CC(=O)C1 7a0db6ba2510c51bdca748ab2e8135fd [0,1,0,1,0,0|2,0,0]=4 12411 B11R1.154 C[C@H](O)CNCC1CC(=O)N1 d4167c77040f6d20c627fad6ea6f714c [0,1,0,1,0,0|2,0,0]=4 12412 B11R1.154 C[C@H](O)CNCC1CC(=O)O1 cc082ad0f24c98e62c93448d6f80b256 [0,1,0,1,0,0|1,0,0]=3 12413 B11R1.154 C[C@H]1C[C@@H](C1)COCC(=O)N bba0e81c5a2a942f6f4a05e77306204e [0,1,0,1,0,0|2,0,0]=4 12414 B11R1.154 C[C@H]1C[C@@H](C1)COCC(=O)O db532a939327caf51a3e4e2529d3301d [0,1,0,1,0,0|1,0,0]=3 12415 B11R1.154 NC(=O)CCCN1CC(C1)F 951e2a0199e70d996e6938d9fc154715 [0,1,0,1,0,0|2,0,0]=4 12416 B11R1.154 NC(=O)CCCN1CC(C1)O 873dcdd04554847214e4195633bab6ba [0,1,0,1,0,0|2,0,0]=4 12417 B11R1.154 NC(=O)CCNC1CC(C1)F c2d4dd38736235d46ccccd2be89f5672 [0,1,0,1,0,0|2,0,0]=4 12418 B11R1.154 NC(=O)CCNC1CC(C1)O 6b2439af52a947b8e9e17329892d5903 [0,1,0,1,0,0|2,0,0]=4 12419 B11R1.154 NC(=O)CCN[C@H]1C[C@@H](C1)F d9d212b5ae52ee21cc5cf37f48436664 [0,1,0,1,0,0|2,0,0]=4 12420 B11R1.154 NC(=O)CCN[C@H]1C[C@@H](C1)O 8f80327c87d42d349878cc6d0f33a566 [0,1,0,1,0,0|2,0,0]=4 12421 B11R1.154 NC(=O)CCN[C@H]1C[C@H](C1)F d5ea2d05770eb85483423dca4185b18a [0,1,0,1,0,0|2,0,0]=4 12422 B11R1.154 NC(=O)CCN[C@H]1C[C@H](C1)O 89bae8fd0b6dc245ee7ea6e51642bc3e [0,1,0,1,0,0|2,0,0]=4 12423 B11R1.154 NC(=O)CCOC1CC(C1)F 4863df63c79dcc58b1ee1601378d5440 [0,1,0,1,0,0|2,0,0]=4 12424 B11R1.154 NC(=O)CCO[C@H]1C[C@@H](C1)F c3ad28db20f7eda6f243e986fea56d00 [0,1,0,1,0,0|2,0,0]=4 12425 B11R1.154 NC(=O)CCO[C@H]1C[C@H](C1)F 6b15c959a0f2e60a189450aad2d28095 [0,1,0,1,0,0|2,0,0]=4 12426 B11R1.154 NC(=O)CNCC1CC(C1)O 89c5a6318e51cfce9f16d1f101e80463 [0,1,0,1,0,0|2,0,0]=4 12427 B11R1.154 NC(=O)CNC[C@H]1C[C@@H](C1)O 04d7fb8199f209ebaa0c6f8cfa331113 [0,1,0,1,0,0|2,0,0]=4 12428 B11R1.154 NC(=O)CNC[C@H]1C[C@H](C1)F 27b667bcdd8b12282609b0283ef145e1 [0,1,0,1,0,0|2,0,0]=4 12429 B11R1.154 NC(=O)CNC[C@H]1C[C@H](C1)O 942a89087868506f56437f27dc22bcc4 [0,1,0,1,0,0|2,0,0]=4 12430 B11R1.154 NC(=O)COCC1CC(C1)F 174226300c013a5da166ccbc14769723 [0,1,0,1,0,0|2,0,0]=4 12431 B11R1.154 NC(=O)COC[C@H]1C[C@H](C1)F dfd4956664e179638acca56759128dda [0,1,0,1,0,0|2,0,0]=4 12432 B11R1.154 O=C(O)CCCN1CC(C1)O 7a1e345834398b26c8a08e1dbfb8e9c4 [0,1,0,1,0,0|1,0,0]=3 12433 B11R1.154 O=C(O)CCNC1CC(C1)F db919788765ddee70934b8c10005f2c6 [0,1,0,1,0,0|1,0,0]=3 12434 B11R1.154 O=C(O)CCNC1CC(C1)O 9038a4370a6640d6f5c91d317639f4c6 [0,1,0,1,0,0|1,0,0]=3 12435 B11R1.154 O=C(O)CCN[C@H]1C[C@@H](C1)F 2208ac8ee9a6415dd0fd46a19c2fcb8f [0,1,0,1,0,0|1,0,0]=3 12436 B11R1.154 O=C(O)CCN[C@H]1C[C@@H](C1)O 67279b2feccaa4c8f3d51cafebe2ea8d [0,1,0,1,0,0|1,0,0]=3 12437 B11R1.154 O=C(O)CCN[C@H]1C[C@H](C1)F 7515130818cf85d0d885520f01c0efaf [0,1,0,1,0,0|1,0,0]=3 12438 B11R1.154 O=C(O)CCN[C@H]1C[C@H](C1)O 62ba698db6462c6bd55e603a67d249a2 [0,1,0,1,0,0|1,0,0]=3 12439 B11R1.154 O=C(O)CNCC1CC(=O)C1 bf52cce24aa2ef84a147e56f820d3a3a [0,1,0,1,0,0|1,0,1]=4 12440 B11R1.154 O=C(O)CNCC1CC(C1)O a4219adf67f65d471d004e2ce7e43b6f [0,1,0,1,0,0|1,0,0]=3 12441 B11R1.154 O=C(O)CNC[C@H]1C[C@@H](C1)O bcaf666f5b2e481fae22c3cee4cf9618 [0,1,0,1,0,0|1,0,0]=3 12442 B11R1.154 O=C(O)CNC[C@H]1C[C@H](C1)F 985d7f6b3d0bf71fdb30f42ee51b1692 [0,1,0,1,0,0|1,0,0]=3 12443 B11R1.154 O=C(O)CNC[C@H]1C[C@H](C1)O af99f916a1c8d73b02cc19a650972d1c [0,1,0,1,0,0|1,0,0]=3 12444 B11R1.154 O=C(O)COCC1CC(=O)C1 a3ccc269af51aee3770f34cae63ddd6f [0,1,0,1,0,0|1,0,1]=4 12445 B11R1.154 O=C(O)COCC1CC(C1)F 1b95253775b0b5446d67e19d9066eac7 [0,1,0,1,0,0|1,0,0]=3 12446 B11R1.154 O=C(O)COC[C@H]1C[C@H](C1)F 6cda81c33e9ac5cbca18a6e46b757fec [0,1,0,1,0,0|1,0,0]=3 12447 B11R1.154 O=C1CC(O1)CNCC(F)F 851e76b32090e0fb858689040df576f5 [0,1,0,1,0,0|2,0,0]=4 12448 B11R1.154 O=C1CC(O1)COCC(F)F 6fa9db854d37660c732f769161e4f93f [0,1,0,1,0,0|2,0,0]=4 12449 B11R1.154 O=S(O)COC[C@H]1C[C@H](C1)F e8d25515c8751c8f4bf3d230e15d21a9 [0,1,0,1,0,0|2,0,0]=4 12450 B11R1.157 CC(=O)NC1CCCC(C1)C 2210d24c85aacb9ca5ad7d0be5468509 [0,1,0,1,0,0|2,0,0]=4 12451 B11R1.157 CC(=O)NC1CCCC(C1)O 967c8e42f6277b130f66885e6b186eb9 [0,1,0,1,0,0|2,0,0]=4 12452 B11R1.157 CC(=O)N[C@@H]1CCC[C@@H](C1)O 036cedc2973fe4851309407026c34750 [0,1,0,1,0,0|2,0,0]=4 12453 B11R1.157 CC(=O)N[C@@H]1CCC[C@H](C1)C 71f4655f46cf4d4862a6cce1470e6ac9 [0,1,0,1,0,0|2,0,0]=4 12454 B11R1.157 CC(=O)N[C@@H]1CCC[C@H](C1)O 133d6afedfa5f62b0664ee93a2cd1962 [0,1,0,1,0,0|2,0,0]=4 12455 B11R1.157 CC(=O)N[C@H]1CCC[C@@H](C1)O 292207cd518c12ebcc52dfe886a419f2 [0,1,0,1,0,0|2,0,0]=4 12456 B11R1.157 CC(=O)N[C@H]1CCC[C@H](C1)O 39171aab208d3c96c4e74e0e531fdbfd [0,1,0,1,0,0|2,0,0]=4 12457 B11R1.157 CC(C)CN1CCCC(=O)C1 01feab4c741a21af025610bc47778f29 [0,1,0,1,0,0|2,0,0]=4 12458 B11R1.157 CC(C)OC1CCCC(=O)C1 3e286e7df846184fe088cd1d6507ef33 [0,1,0,1,0,0|2,0,0]=4 12459 B11R1.157 CC(O)CN1CCCC(=O)C1 917247992a9e78f9855dc807edfc4687 [0,1,0,1,0,0|2,0,0]=4 12460 B11R1.157 CC1CCCN(C1)CC(=O)N e447a44f6aaeb356f7e500f1b96df590 [0,1,0,1,0,0|2,0,0]=4 12461 B11R1.157 CC1CCCN(C1)CC(=O)O d4ebd15284a303f50f85ba6b4d90a793 [0,1,0,1,0,0|1,0,0]=3 12462 B11R1.157 CC1CN(CCO1)CC(=O)O 65a4eae5f096b9d591902c15eb7b227f [0,1,0,1,0,0|2,0,0]=4 12463 B11R1.157 C[C@@H]1CCCN(C1)CC(=O)N 4a45d3fffe869f1cabc2186339f1e6d2 [0,1,0,1,0,0|2,0,0]=4 12464 B11R1.157 C[C@@H]1CCCN(C1)CC(=O)O 870d6379068dbf78f34bb30d36be26d2 [0,1,0,1,0,0|1,0,0]=3 12465 B11R1.157 C[C@@H]1CN(CCO1)CC(=O)O 5173402d4fdebf8295e061525cc11bc6 [0,1,0,1,0,0|2,0,0]=4 12466 B11R1.157 C[C@H](O)CN1CCCC(=O)C1 58da09957614f4f4beda4c0c527016c6 [0,1,0,1,0,0|2,0,0]=4 12467 B11R1.157 C[C@H]1CCCN(C1)CC(=O)N de0fec5a29957430feafb98f70a91f3e [0,1,0,1,0,0|2,0,0]=4 12468 B11R1.157 C[C@H]1CCCN(C1)CC(=O)O 4c02b5b686cf18ffb51df551db136b7c [0,1,0,1,0,0|1,0,0]=3 12469 B11R1.157 C[C@H]1CN(CCO1)CC(=O)O 8cc45e12876a56b76924cb11e6d57c90 [0,1,0,1,0,0|2,0,0]=4 12470 B11R1.157 NC(=O)CN1CCCC(C1)F a64e2093ad33b20ea743ef75c6268a3d [0,1,0,1,0,0|2,0,0]=4 12471 B11R1.157 NC(=O)CN1CCCC(C1)O acc855203aefeda057ab4a47394a6bf3 [0,1,0,1,0,0|2,0,0]=4 12472 B11R1.157 NC(=O)CN1CCC[C@@H](C1)F 2fe487edf025d77170015478a1a75de6 [0,1,0,1,0,0|2,0,0]=4 12473 B11R1.157 NC(=O)CN1CCC[C@@H](C1)O 513ee4c8af75b8631e89a459ac0a3825 [0,1,0,1,0,0|2,0,0]=4 12474 B11R1.157 NC(=O)CN1CCC[C@H](C1)F e80930800a50f0c397adab879df68a21 [0,1,0,1,0,0|2,0,0]=4 12475 B11R1.157 NC(=O)CN1CCC[C@H](C1)O b36c5a0be2a8d61533a7487e4ecd806c [0,1,0,1,0,0|2,0,0]=4 12476 B11R1.157 O=C(O)CN1CCCC(=O)C1 8045d226811d2aa76499a0cc0d16ccf5 [0,1,0,1,0,0|1,0,1]=4 12477 B11R1.157 O=C(O)CN1CCCC(C1)F df26d481d723ae859133b1dd45263f8b [0,1,0,1,0,0|1,0,0]=3 12478 B11R1.157 O=C(O)CN1CCCC(C1)O 8a9081ae81f569ea0a4f01bce3eedfa1 [0,1,0,1,0,0|1,0,0]=3 12479 B11R1.157 O=C(O)CN1CCC[C@@H](C1)F 3877c0bc29adfde3b5f9efc3b6d550a4 [0,1,0,1,0,0|1,0,0]=3 12480 B11R1.157 O=C(O)CN1CCC[C@@H](C1)O ff18856f3d9fccfbb76f3f7e4a4cf5e0 [0,1,0,1,0,0|1,0,0]=3 12481 B11R1.157 O=C(O)CN1CCC[C@H](C1)F af0bc4e19c0db595d39589bdbc4a3cc0 [0,1,0,1,0,0|1,0,0]=3 12482 B11R1.157 O=C(O)CN1CCC[C@H](C1)O 50428b9f90feb50aec1d3ab69a75f460 [0,1,0,1,0,0|1,0,0]=3 12483 B11R1.166 CC(=O)N1CCC(CC1C)C 79debca874e1e801e879bc99cc737d94 [0,1,0,1,0,0|2,0,0]=4 12484 B11R1.166 CC(=O)N1CCC(CC1C)O b12b84598e97a50b70e202ec89adfdf2 [0,1,0,1,0,0|2,0,0]=4 12485 B11R1.166 CC(=O)N1CC[C@@H](C[C@@H]1C)C 8763d2b8efe12ec8def77bdfda5941f6 [0,1,0,1,0,0|2,0,0]=4 12486 B11R1.166 CC(=O)N1CC[C@@H](C[C@H]1C)O bce48f067c233c8f54e7cc25436c93ee [0,1,0,1,0,0|2,0,0]=4 12487 B11R1.166 CC(=O)N1CC[C@H](C[C@H]1C)C 7908b2802189f2c391c91d6175e5da8a [0,1,0,1,0,0|2,0,0]=4 12488 B11R1.166 CC(=O)N1CC[C@H](C[C@H]1C)O d7f019d93eee0e10ba2760040546b77d [0,1,0,1,0,0|2,0,0]=4 12489 B11R1.172 C=C(Br)CCOC1CCCC1 4504f6831c323e3f90f6f930cb3ca9bd [0,1,0,1,0,0|2,0,0]=4 12490 B11R1.172 C=C(Br)CNCC1CCCC1 2ab8f9e9c0e83956aa027f6aba5bab4e [0,1,0,1,0,0|2,0,0]=4 12491 B11R1.172 C=C(Br)COCC1CCCC1 18f45b6a8d1625178f034af9543f7798 [0,1,0,1,0,0|2,0,0]=4 12492 B11R1.172 C=C(C)CCNC1CCCC1 76d89e29037dec98642f691a42b5ce19 [0,1,0,1,0,0|2,0,0]=4 12493 B11R1.172 C=C(C)CCOC1CCCC1 08b2fb4a07a2e567832257c49a85359f [0,1,0,1,0,0|2,0,0]=4 12494 B11R1.172 C=C(C)CNCC1CCCC1 19a36c16de5ab2653d09cfe069095932 [0,1,0,1,0,0|2,0,0]=4 12495 B11R1.172 C=C(C)COCC1CCCC1 a1a4ad5ab87552f1db1a32684218f98d [0,1,0,1,0,0|2,0,0]=4 12496 B11R1.172 C=C(Cl)CNCC1CCCC1 3c385feebf26204876a4a47716d9ea45 [0,1,0,1,0,0|2,0,0]=4 12497 B11R1.172 C=C(Cl)COCC1CCCC1 1976feccd6c9f1c965b335d97d6dd3d4 [0,1,0,1,0,0|2,0,0]=4 12498 B11R1.172 C=C(F)CNCC1CCCC1 1d264732498d5bfeca8a2bcd5373a3c5 [0,1,0,1,0,0|2,0,0]=4 12499 B11R1.172 C=C(F)COCC1CCCC1 8c93392d0d0fffba0eb6847567aab7a0 [0,1,0,1,0,0|2,0,0]=4 12500 B11R1.172 C=C(I)COCC1CCCC1 51e737d700f2876f7bc8ae2cab86adf3 [0,1,0,1,0,0|2,0,0]=4 12501 B11R1.172 CC(=O)CCCN1CCSC1 cbb8e62f91a767a0025a9c9b111e9cf6 [0,1,0,1,0,0|2,0,0]=4 12502 B11R1.172 CC(=O)CCNC1CCCC1 12a1fa790ce310ff827d382b823d687e [0,1,0,1,0,0|1,0,0]=3 12503 B11R1.172 CC(=O)CCNC1CCOC1 20e301f3ef9115a65aa87392bd173b53 [0,1,0,1,0,0|2,0,0]=4 12504 B11R1.172 CC(=O)CCNC1CCSC1 4e10f30cd33751f17161d77f5785df33 [0,1,0,1,0,0|2,0,0]=4 12505 B11R1.172 CC(=O)CCN[C@@H]1CCOC1 73375355738037911147f1dbf6db2cb5 [0,1,0,1,0,0|2,0,0]=4 12506 B11R1.172 CC(=O)CCN[C@H]1CCOC1 0b9fc6338715b5627d04b9e36fa704ae [0,1,0,1,0,0|2,0,0]=4 12507 B11R1.172 CC(=O)CCOC1CCCC1 b85de27e387a2e6432a9ebd23d0fde69 [0,1,0,1,0,0|1,0,0]=3 12508 B11R1.172 CC(=O)CCOC1CCCO1 cd1aa6056a70ffdcc35e76acd50f5796 [0,1,0,1,0,0|2,0,0]=4 12509 B11R1.172 CC(=O)CCOC1CCOC1 d367a62e5f2c4007a241d1c02e67187f [0,1,0,1,0,0|2,0,0]=4 12510 B11R1.172 CC(=O)CCOC1CCSC1 014bec54ab0017ca92385c60a6018b02 [0,1,0,1,0,0|2,0,0]=4 12511 B11R1.172 CC(=O)CCO[C@@H]1CCOC1 05c33e4b022ac87a125adb4058d5e74d [0,1,0,1,0,0|2,0,0]=4 12512 B11R1.172 CC(=O)CCO[C@@H]1CCSC1 aeccf17dd7dfc18affc8001e0c27bcde [0,1,0,1,0,0|2,0,0]=4 12513 B11R1.172 CC(=O)CCO[C@H]1CCOC1 64144058609623a3d552e78e3e1fd099 [0,1,0,1,0,0|2,0,0]=4 12514 B11R1.172 CC(=O)CCO[C@H]1CCSC1 913c9295da5d67af79a61f8c3820a935 [0,1,0,1,0,0|2,0,0]=4 12515 B11R1.172 CC(=O)CNCC1CCCC1 800b82f192e6095478611556b2672a2c [0,1,0,1,0,0|1,0,0]=3 12516 B11R1.172 CC(=O)CNCC1CCCO1 b38c1e9c023562860b0e57ac1b5c1659 [0,1,0,1,0,0|2,0,0]=4 12517 B11R1.172 CC(=O)CNCC1CCOC1 53e3cdefdaed51bc77c2a79036adb05e [0,1,0,1,0,0|2,0,0]=4 12518 B11R1.172 CC(=O)COCC1CCCC1 87780bcc9709eef0316afed28b298097 [0,1,0,1,0,0|1,0,0]=3 12519 B11R1.172 CC(=O)COCC1CCCO1 2c3e1702a47218da12df3ef7a9f9a5a2 [0,1,0,1,0,0|2,0,0]=4 12520 B11R1.172 CC(=O)COCC1CCOC1 78354962b989b514ef46ea40b3d95968 [0,1,0,1,0,0|2,0,0]=4 12521 B11R1.172 CC(=O)NCCC1CCCC1 fbc141d594a57736dbd8cf80bf081fad [0,1,0,1,0,0|1,0,0]=3 12522 B11R1.172 CC(=O)NCCC1CCCO1 86a90be8616d1e4c92dbcc9c97059001 [0,1,0,1,0,0|2,0,0]=4 12523 B11R1.172 CC(=O)NCCC1CCOC1 0090133e721b5d0e9491fcfa3d78e722 [0,1,0,1,0,0|2,0,0]=4 12524 B11R1.172 CC(=O)NCCN1CCCC1 ef2ffba59421ca14e24dca8dced309b3 [0,1,0,1,0,0|2,0,0]=4 12525 B11R1.172 CC(=O)NCOC1CCCC1 1360806bf33057533614617026ee6e20 [0,1,0,1,0,0|2,0,0]=4 12526 B11R1.172 CC(=O)OCNC1CCCC1 6c08fa4a82ce35c9e2b7f7378f82b430 [0,1,0,1,0,0|2,0,0]=4 12527 B11R1.172 CC(=O)OCOC1CCCC1 c9c3352279f6268f1e73b5549a8db426 [0,1,0,1,0,0|2,0,0]=4 12528 B11R1.172 CC(O)CCNC1CCCC1 afc76907d0b9e80cce600d96be08fffb [0,1,0,1,0,0|1,0,1]=4 12529 B11R1.172 CC(O)CNCC1CCCC1 93c08beebf5ce5a94ae43f93dd99f843 [0,1,0,1,0,0|1,0,1]=4 12530 B11R1.172 CS(=O)CCNC1CCCC1 a271bb58bda18bfed77d757eb7683077 [0,1,0,1,0,0|2,0,0]=4 12531 B11R1.172 CS(=O)CCOC1CCCC1 53d3cc504b1e4fefc9dd8fe83d165984 [0,1,0,1,0,0|2,0,0]=4 12532 B11R1.172 C[C@@H](O)CCNC1CCCC1 01a08df4278ae56f9ce81ecb085cb36a [0,1,0,1,0,0|1,0,1]=4 12533 B11R1.172 C[C@@H](O)CNCC1CCCC1 18cba5e5fea8d69e88ae9cd345456750 [0,1,0,1,0,0|1,0,1]=4 12534 B11R1.172 C[C@H](O)CCNC1CCCC1 244055ba93d79d95c03bceadcf5d0c05 [0,1,0,1,0,0|1,0,1]=4 12535 B11R1.172 C[C@H](O)CNCC1CCCC1 09cf9ef0b76988786cefde99b3fcb501 [0,1,0,1,0,0|1,0,1]=4 12536 B11R1.172 NC(=O)CCCN1CCSC1 d8a080736c5388dbd298b2dc69709e61 [0,1,0,1,0,0|2,0,0]=4 12537 B11R1.172 NC(=O)CCNC1CCCC1 6ad1f6f23cc54a1f62805f0fd965e181 [0,1,0,1,0,0|1,0,0]=3 12538 B11R1.172 NC(=O)CCNC1CCOC1 edb0dde8049f5db9fe662632ac6806cc [0,1,0,1,0,0|2,0,0]=4 12539 B11R1.172 NC(=O)CCNC1CCSC1 5f83e0ba759e79b5ec2332b1e9e606b8 [0,1,0,1,0,0|2,0,0]=4 12540 B11R1.172 NC(=O)CCN[C@@H]1CCOC1 0fbfb634870e6a38dae4718f8e1c3dcf [0,1,0,1,0,0|2,0,0]=4 12541 B11R1.172 NC(=O)CCN[C@H]1CCOC1 90914558470db938b9352779eaf72daf [0,1,0,1,0,0|2,0,0]=4 12542 B11R1.172 NC(=O)CCOC1CCCC1 ebf5328f3f8c43524eb5068855193bd6 [0,1,0,1,0,0|1,0,0]=3 12543 B11R1.172 NC(=O)CCOC1CCCO1 225d9ce38074c1fb4100b39613a28685 [0,1,0,1,0,0|2,0,0]=4 12544 B11R1.172 NC(=O)CCOC1CCOC1 527644a7610289f19e3e665aa3e825a5 [0,1,0,1,0,0|2,0,0]=4 12545 B11R1.172 NC(=O)CCOC1CCSC1 b37f8966b70a0b8f71d0deb3ce1bee8a [0,1,0,1,0,0|2,0,0]=4 12546 B11R1.172 NC(=O)CCO[C@@H]1CCOC1 a85dd63ab5d8fe3b735b55e83aeccab4 [0,1,0,1,0,0|2,0,0]=4 12547 B11R1.172 NC(=O)CCO[C@@H]1CCSC1 0dd8c9ac23f9602906a14b42b37e3601 [0,1,0,1,0,0|2,0,0]=4 12548 B11R1.172 NC(=O)CCO[C@H]1CCOC1 efaafc68f5b0e0801d515b09ba0cd53d [0,1,0,1,0,0|2,0,0]=4 12549 B11R1.172 NC(=O)CCO[C@H]1CCSC1 b22e4df971efe95942c0f87dfd991e19 [0,1,0,1,0,0|2,0,0]=4 12550 B11R1.172 NC(=O)CNCC1CCCC1 2074c28fa9e1109e2b8e4500c19104b9 [0,1,0,1,0,0|1,0,0]=3 12551 B11R1.172 NC(=O)CNCC1CCCO1 e681c444ac2c6d865cac75ebf3701fc4 [0,1,0,1,0,0|2,0,0]=4 12552 B11R1.172 NC(=O)CNCC1CCOC1 e80e7e8d51f72d0bdd41c483f1c9bd51 [0,1,0,1,0,0|2,0,0]=4 12553 B11R1.172 NC(=O)CNC[C@@H]1CCCO1 139dc4d274593d268845dd1fdbd79bbb [0,1,0,1,0,0|2,0,0]=4 12554 B11R1.172 NC(=O)CNC[C@@H]1CCOC1 783e7d4268f58d5009fa956b7c9c7384 [0,1,0,1,0,0|2,0,0]=4 12555 B11R1.172 NC(=O)CNC[C@H]1CCCO1 dc3c1f855a8ec6457167b63b223e7f03 [0,1,0,1,0,0|2,0,0]=4 12556 B11R1.172 NC(=O)CNC[C@H]1CCOC1 64647a5a4400604cae1d1c2240e948db [0,1,0,1,0,0|2,0,0]=4 12557 B11R1.172 NC(=O)COCC1CCCC1 7d8953e71217a6dc6fb5bd1cc2df7a1c [0,1,0,1,0,0|1,0,0]=3 12558 B11R1.172 NC(=O)COCC1CCCO1 f5aa667548744c127b26079a2f550cf5 [0,1,0,1,0,0|2,0,0]=4 12559 B11R1.172 NC(=O)COCC1CCCS1 b5a93dd8efe1c7227efc851c376af0df [0,1,0,1,0,0|2,0,0]=4 12560 B11R1.172 NC(=O)COCC1CCOC1 865961f46f35f0dd773acb0b84f387c9 [0,1,0,1,0,0|2,0,0]=4 12561 B11R1.172 NC(=O)COCN1CCCC1 9154ac042c427e04b60907b5814a0c94 [0,1,0,1,0,0|2,0,0]=4 12562 B11R1.172 NC(=O)COC[C@@H]1CCCO1 c747cf09398c37f38dc79c60207a39c5 [0,1,0,1,0,0|2,0,0]=4 12563 B11R1.172 NC(=O)COC[C@@H]1CCOC1 78c6509eb2222cde0bb5cb2231eb384a [0,1,0,1,0,0|2,0,0]=4 12564 B11R1.172 NC(=O)COC[C@H]1CCCO1 dadbc8fcfd161a579c45d8bf522f91df [0,1,0,1,0,0|2,0,0]=4 12565 B11R1.172 NC(=O)COC[C@H]1CCOC1 88db29ff4eb8a748e3c526279936b8d4 [0,1,0,1,0,0|2,0,0]=4 12566 B11R1.172 NC(=O)NCOC1CCCC1 3a4571b0bfb5d80787f0d3cda167655b [0,1,0,1,0,0|2,0,0]=4 12567 B11R1.172 NC(=O)SCNC1CCCC1 0ef363ee5a3ddb4fa730d757c927c72b [0,1,0,1,0,0|2,0,0]=4 12568 B11R1.172 NC(=O)SCOC1CCCC1 7ae8ce59c1f86b7bbc3c61021529088e [0,1,0,1,0,0|2,0,0]=4 12569 B11R1.172 NC(=S)CCNC1CCCC1 0de2d4d435db50ce2a475028bbf9280e [0,1,0,1,0,0|1,1,0]=4 12570 B11R1.172 NC(=S)COCC1CCCC1 68b8bc5213ca0e878297bb2c81978a85 [0,1,0,1,0,0|1,1,0]=4 12571 B11R1.172 O=C(O)CCCN1CC=CC1 4030f0d969c0fbef108084693eb67236 [0,1,0,1,0,0|0,0,2]=4 12572 B11R1.172 O=C(O)CCCN1CCSC1 6e6fe64de3c37ef4f49fbe65b0f984b5 [0,1,0,1,0,0|1,0,0]=3 12573 B11R1.172 O=C(O)CCNC1CC=CC1 bda6bffa25b387684b089807b2e58e9b [0,1,0,1,0,0|0,0,2]=4 12574 B11R1.172 O=C(O)CCNC1CCCC1 cc87dbfa2423c2d2dc1bbd7e31f32e66 [0,1,0,1,0,0|0,0,0]=2 12575 B11R1.172 O=C(O)CCNC1CCOC1 ebd7df469b3e79070c5e37eba7a6740d [0,1,0,1,0,0|1,0,0]=3 12576 B11R1.172 O=C(O)CCNC1CCSC1 8719865c4bb5b71cede070a9ab2210d4 [0,1,0,1,0,0|1,0,0]=3 12577 B11R1.172 O=C(O)CCN[C@@H]1CCOC1 c7dbfb514fd7d8fbc4bd757f1b9f4456 [0,1,0,1,0,0|1,0,0]=3 12578 B11R1.172 O=C(O)CCN[C@H]1CCOC1 6350aa5fa158a3cb3c5ff02bc92ea171 [0,1,0,1,0,0|1,0,0]=3 12579 B11R1.172 O=C(O)CCOC1C=CCC1 49a2f0a9e0560317646d0143572c5fb4 [0,1,0,1,0,0|0,0,2]=4 12580 B11R1.172 O=C(O)CCOC1CC=CC1 7f7b7ac255e4ac0b86d19779c5544aca [0,1,0,1,0,0|0,0,2]=4 12581 B11R1.172 O=C(O)CCOC1CCCC1 a78608f01bf2d90213806fa026bc85f0 [0,1,0,1,0,0|0,0,0]=2 12582 B11R1.172 O=C(O)CCOC1CCCO1 313411f21e8befe79033da76bc3cd22e [0,1,0,1,0,0|1,0,0]=3 12583 B11R1.172 O=C(O)CCOC1CCOC1 94c1ae57cf50d0e89517e22dfa2fe759 [0,1,0,1,0,0|1,0,0]=3 12584 B11R1.172 O=C(O)CCOC1CCSC1 4793719aa7c0e2632093ccae1a2bfd4d [0,1,0,1,0,0|1,0,0]=3 12585 B11R1.172 O=C(O)CCO[C@@H]1CCOC1 536186413b306eb237efd28709042492 [0,1,0,1,0,0|1,0,0]=3 12586 B11R1.172 O=C(O)CCO[C@@H]1CCSC1 ded85805f28723f178a06d46105ee3a1 [0,1,0,1,0,0|1,0,0]=3 12587 B11R1.172 O=C(O)CCO[C@H]1CCOC1 eb27a1ae5e7a4edf25a9dbffb74b8d45 [0,1,0,1,0,0|1,0,0]=3 12588 B11R1.172 O=C(O)CCO[C@H]1CCSC1 e539cc5fbcdba5826ecaea7d3f6af92a [0,1,0,1,0,0|1,0,0]=3 12589 B11R1.172 O=C(O)CNCC1CC=CC1 233aa3054c04f73883b99c7f5ae557b7 [0,1,0,1,0,0|0,0,2]=4 12590 B11R1.172 O=C(O)CNCC1CCCC1 a418b6153ed46a2a6f91546a4f64b56b [0,1,0,1,0,0|0,0,0]=2 12591 B11R1.172 O=C(O)CNCC1CCCO1 ed95df039766cd0b443288b0d49fcc55 [0,1,0,1,0,0|1,0,0]=3 12592 B11R1.172 O=C(O)CNCC1CCOC1 6cbd8805e5855fd0869b3b133fb694f8 [0,1,0,1,0,0|1,0,0]=3 12593 B11R1.172 O=C(O)CNC[C@@H]1CCCO1 ac3327b32b8483564ff7dcddc1162c1c [0,1,0,1,0,0|1,0,0]=3 12594 B11R1.172 O=C(O)CNC[C@@H]1CCOC1 1730730e90fb2d8921db1dbbde54faff [0,1,0,1,0,0|1,0,0]=3 12595 B11R1.172 O=C(O)CNC[C@H]1CCCO1 83b5533196926e02a8eabf9074faf9bb [0,1,0,1,0,0|1,0,0]=3 12596 B11R1.172 O=C(O)CNC[C@H]1CCOC1 0518b052e52f0cb8f88bd0ff6a770c30 [0,1,0,1,0,0|1,0,0]=3 12597 B11R1.172 O=C(O)COCC1C=CCC1 d563048ad0dbafa94d14d1868c6a31fe [0,1,0,1,0,0|0,0,2]=4 12598 B11R1.172 O=C(O)COCC1CC=CC1 1217c86a6caeaa9231322652c2f5ddba [0,1,0,1,0,0|0,0,2]=4 12599 B11R1.172 O=C(O)COCC1CCCC1 1a12f19c6aab26de4be4dc52bf7172ec [0,1,0,1,0,0|0,0,0]=2 12600 B11R1.172 O=C(O)COCC1CCCO1 60f7f5fc7516ca8e919f9c571b279434 [0,1,0,1,0,0|1,0,0]=3 12601 B11R1.172 O=C(O)COCC1CCCS1 d30770f71ca4fd8ba75025e47026df5a [0,1,0,1,0,0|1,0,0]=3 12602 B11R1.172 O=C(O)COCC1CCOC1 f9f502ad07b4fe7318099b02c84b0b1f [0,1,0,1,0,0|1,0,0]=3 12603 B11R1.172 O=C(O)COCN1CCCC1 56f37ea3411363410de6cf53e5955d8f [0,1,0,1,0,0|1,0,0]=3 12604 B11R1.172 O=C(O)COC[C@@H]1CCCO1 363d7d055425870722a7d41976be2cde [0,1,0,1,0,0|1,0,0]=3 12605 B11R1.172 O=C(O)COC[C@@H]1CCOC1 ea64f07338e6ca2e8ab70dbe92e4d30f [0,1,0,1,0,0|1,0,0]=3 12606 B11R1.172 O=C(O)COC[C@H]1CCCO1 c883797efa974dbe4ef25cc3eb893b66 [0,1,0,1,0,0|1,0,0]=3 12607 B11R1.172 O=C(O)COC[C@H]1CCOC1 1b9f5a67b774f6171a273a0ccb0abfcb [0,1,0,1,0,0|1,0,0]=3 12608 B11R1.172 O=S(O)CCNC1CCCC1 c699dddebd45bb788f6fac3354ae374e [0,1,0,1,0,0|1,0,0]=3 12609 B11R1.172 O=S(O)CCNC1CCOC1 47a78080c3c245c8b58bcd5845088236 [0,1,0,1,0,0|2,0,0]=4 12610 B11R1.172 O=S(O)CCN[C@@H]1CCOC1 ffdda72259bcd46222af018a0ad9b79c [0,1,0,1,0,0|2,0,0]=4 12611 B11R1.172 O=S(O)CCN[C@H]1CCOC1 10aa6c70c3b792dcea7b178a2c24e3b1 [0,1,0,1,0,0|2,0,0]=4 12612 B11R1.172 O=S(O)COCC1CCCC1 7b082bfe3f2b00ba56c3e400dbe82d68 [0,1,0,1,0,0|1,0,0]=3 12613 B11R1.172 O=S(O)COCC1CCCO1 731a2804df4cc4da599f9d41bd2d531f [0,1,0,1,0,0|2,0,0]=4 12614 B11R1.172 O=S(O)COCC1CCOC1 d13291c78115eadcee48a8265d54951f [0,1,0,1,0,0|2,0,0]=4 12615 B11R1.172 O=[N+]([O-])CCOC1CCCC1 fb8e126d2e2aa46ba204c9e62e77469c [0,1,0,1,0,0|1,0,1]=4 12616 B11R1.172 O=[N+]([O-])CNCC1CCCC1 9b0f0f3dc338f42b3b98a57405188822 [0,1,0,1,0,0|1,0,1]=4 12617 B11R1.172 O=[N+]([O-])COCC1CCCC1 1afd796d723f539990cc00478dcf8083 [0,1,0,1,0,0|1,0,1]=4 12618 B11R1.201 CCCN(C)CC1CC(=O)C1 cd37998699135c4e3228cf129e545c8a [0,1,0,1,0,0|2,0,0]=4 12619 B11R1.201 CCCN(C)CC1CC(=O)N1 883ccdc027fa03b073e0fb5ae569788c [0,1,0,1,0,0|2,0,0]=4 12620 B11R1.201 CCCN(C)CC1CC(=O)O1 8f89f6e9ab78d435c5a0908a418b3fc6 [0,1,0,1,0,0|1,0,0]=3 12621 B11R1.201 CN(CCF)CC1CC(=O)O1 45c5ddcebf32a0749dcddf92cc6c6914 [0,1,0,1,0,0|2,0,0]=4 12622 B11R1.201 CN(CCO)CC1CC(=O)O1 6e1591e303cb6ad28a8ad8abbe1d6307 [0,1,0,1,0,0|2,0,0]=4 12623 B11R1.241 C#C[C@H]1C[C@H]1COCC(=O)O 8d0137214f5d2290bcbfddecbf6446d4 [0,1,0,1,0,0|0,0,2]=4 12624 B11R1.241 CC(=O)CCN[C@@H]1C[C@H]1CO 8a2fac4d42a8e0deff34bf2e5b4e7d87 [0,1,0,1,0,0|2,0,0]=4 12625 B11R1.241 CC(=O)CCN[C@H]1C[C@@H]1CO d08f4b94c270682cfe6e0b82f3dfbb52 [0,1,0,1,0,0|2,0,0]=4 12626 B11R1.241 CC(=O)CCN[C@H]1C[C@H]1CO 1f2b1877cb06675f6d70a97ded4a4f2f [0,1,0,1,0,0|2,0,0]=4 12627 B11R1.241 CO[C@H]1C[C@H]1NCCC(=O)C 507fecaa0e0e52a216f91afb606e86cf [0,1,0,1,0,0|2,0,0]=4 12628 B11R1.241 CO[C@H]1C[C@H]1NCCC(=O)N 8b9963f1fb89c274536f80bc13cc2d81 [0,1,0,1,0,0|2,0,0]=4 12629 B11R1.241 CO[C@H]1C[C@H]1NCCC(=O)O 1bd95028f9ff006047b18066205f146a [0,1,0,1,0,0|1,0,0]=3 12630 B11R1.241 N#CC1CC1COCC(=O)O e805a489feecf91405210bd0b227f5d3 [0,1,0,1,0,0|1,0,1]=4 12631 B11R1.241 NC(=O)CCN[C@@H]1C[C@H]1CO e55dcd8fdff30e3d66c58437dab2362a [0,1,0,1,0,0|2,0,0]=4 12632 B11R1.241 NC(=O)CCN[C@H]1C[C@@H]1CO c1eb274f52e81d8e383e4ce05c322caa [0,1,0,1,0,0|2,0,0]=4 12633 B11R1.241 NC(=O)CCN[C@H]1C[C@H]1CO 63d0f2bc34b62f1d97defbb3ba00ced4 [0,1,0,1,0,0|2,0,0]=4 12634 B11R1.241 NC(=O)CNCC1CC1CO 9ab583668634c2bf2571b40929c19e0d [0,1,0,1,0,0|2,0,0]=4 12635 B11R1.241 O=C(O)CCN[C@@H]1C[C@H]1CO c4bd441ad5886f1eead964298715ce2f [0,1,0,1,0,0|1,0,0]=3 12636 B11R1.241 O=C(O)CCN[C@H]1C[C@@H]1CO 79879e320f2d02f0806900351dcfd263 [0,1,0,1,0,0|1,0,0]=3 12637 B11R1.241 O=C(O)CCN[C@H]1C[C@H]1CO 67d45ee9d748aa746a9e9b3a919f0177 [0,1,0,1,0,0|1,0,0]=3 12638 B11R1.241 O=C(O)CNCC1CC1CO 0294a75cdacc51bee28786e480a57820 [0,1,0,1,0,0|1,0,0]=3 12639 B11R1.241 O=CC1CC1NCCC(=O)O 64f87ed0e276ce7aeab7762351ba9d71 [0,1,0,1,0,0|1,0,1]=4 12640 B11R1.241 O=CC1CC1OCCC(=O)O 2b6cea90580134500f9740968f2be79b [0,1,0,1,0,0|1,0,1]=4 12641 B11R1.565 CC(=O)N1CCCC(CC1)C 0c9587fec1108a5850215ac415a6d746 [0,1,0,1,0,0|2,0,0]=4 12642 B11R1.565 CC(=O)N1CCCC(CC1)F 915e30e048d9a491acf41fe1321e215c [0,1,0,1,0,0|2,0,0]=4 12643 B11R1.565 CC(=O)N1CCCC(CC1)O a5a31536ab5c5569640f751e53c17fc8 [0,1,0,1,0,0|2,0,0]=4 12644 B11R1.565 CC(=O)N1CCC[C@@H](CC1)O 486148636055b72d2ceae9c7fe667aef [0,1,0,1,0,0|2,0,0]=4 12645 B11R1.565 CC(=O)N1CCC[C@H](CC1)O fb7a7287697369fbda7ffe704edcb7c7 [0,1,0,1,0,0|2,0,0]=4 12646 B11R1.645 C[C@@H]1C[C@@H](CN1CC(=O)N)F 14ae95f89c2bec8b4673573fcf95c45e [0,1,0,1,0,0|2,0,0]=4 12647 B11R1.645 C[C@@H]1C[C@@H](CN1CC(=O)N)O 7547e17097c86258832b88f4bbae1af0 [0,1,0,1,0,0|2,0,0]=4 12648 B11R1.645 C[C@@H]1C[C@@H](CN1CC(=O)O)F ebbd0d1de71861dad3967fd9a3a5d96a [0,1,0,1,0,0|1,0,0]=3 12649 B11R1.645 C[C@@H]1C[C@@H](CN1CC(=O)O)O 3fe4b39a5fca8a98740f08829eab5e27 [0,1,0,1,0,0|1,0,0]=3 12650 B11R1.645 C[C@@H]1C[C@H](CN1CC(=O)N)F abeba68606d07209f87150e55d1c6dc9 [0,1,0,1,0,0|2,0,0]=4 12651 B11R1.645 C[C@@H]1C[C@H](CN1CC(=O)N)O 398b4899e03dd6c26e47dad97e3dffed [0,1,0,1,0,0|2,0,0]=4 12652 B11R1.645 C[C@@H]1C[C@H](CN1CC(=O)O)F 3ff03b1e21d5753e82033b5998f0721f [0,1,0,1,0,0|1,0,0]=3 12653 B11R1.645 C[C@@H]1C[C@H](CN1CC(=O)O)O 9a0384689eb4114a280e838d1b6c063d [0,1,0,1,0,0|1,0,0]=3 12654 B11R1.645 C[C@H]1C[C@@H](CN1CC(=O)N)F c4d6b16ce2059d19f2eda82dd8872159 [0,1,0,1,0,0|2,0,0]=4 12655 B11R1.645 C[C@H]1C[C@@H](CN1CC(=O)N)O cc8a1c9da6152f34b20a52edb492d6df [0,1,0,1,0,0|2,0,0]=4 12656 B11R1.645 C[C@H]1C[C@@H](CN1CC(=O)O)F 6f6d8a99b15989539726576089efb8fd [0,1,0,1,0,0|1,0,0]=3 12657 B11R1.645 C[C@H]1C[C@@H](CN1CC(=O)O)O cfe427217c99af61255cba0dbb6110c9 [0,1,0,1,0,0|1,0,0]=3 12658 B11R1.645 C[C@H]1C[C@H](CN1CC(=O)N)F 2600ab487a1f107d998f91ce0e64d3b2 [0,1,0,1,0,0|2,0,0]=4 12659 B11R1.645 C[C@H]1C[C@H](CN1CC(=O)N)O 03f3c8b7e2237b108e7370a0b8ff2a89 [0,1,0,1,0,0|2,0,0]=4 12660 B11R1.645 C[C@H]1C[C@H](CN1CC(=O)O)F 2e149e53b9d51510f8b46e666f489f9a [0,1,0,1,0,0|1,0,0]=3 12661 B11R1.645 C[C@H]1C[C@H](CN1CC(=O)O)O ae29a23d23808038cb09266e20912ef7 [0,1,0,1,0,0|1,0,0]=3 12662 B11R1.659 CC1(CC1F)COCC(=O)O 3ce592b97e9f0f5256967814618d44d5 [0,1,0,1,0,0|2,0,0]=4 12663 B11R1.674 CC(=O)CCN1C(CC1C)C b055fe1d0d9e9ee2fa899b8f015071d2 [0,1,0,1,0,0|2,0,0]=4 12664 B11R1.674 CC(=O)CCN1[C@@H](C[C@@H]1C)C 1d449ece7d58fcd8d4f7fa7ca4777b97 [0,1,0,1,0,0|2,0,0]=4 12665 B11R1.674 CC(=O)CCN1[C@@H](C[C@H]1C)C 00fb003a134fa3fc311a971229cc5785 [0,1,0,1,0,0|2,0,0]=4 12666 B11R1.674 CC(=O)CCN1[C@H](C[C@@H]1C)C 894521c84950eef5da7546a031824786 [0,1,0,1,0,0|2,0,0]=4 12667 B11R1.674 CC1CC(N1CCC(=O)N)C 848fa11407153e68e0dae1a9b6051156 [0,1,0,1,0,0|2,0,0]=4 12668 B11R1.674 CC1CC(N1CCC(=O)O)C 31e818f90f08709d1cc7e722f8b7422f [0,1,0,1,0,0|1,0,0]=3 12669 B11R1.674 C[C@@H]1C[C@@H](N1CCC(=O)N)C 715ba12aa1026f843eb0b4c1e1824419 [0,1,0,1,0,0|2,0,0]=4 12670 B11R1.674 C[C@@H]1C[C@@H](N1CCC(=O)O)C 3371b6239e30850aac02963beccde582 [0,1,0,1,0,0|1,0,0]=3 12671 B11R1.674 C[C@@H]1C[C@H](N1CCC(=O)N)C f0f4c5a5ffa1dd81fd725eb851e8301a [0,1,0,1,0,0|2,0,0]=4 12672 B11R1.674 C[C@@H]1C[C@H](N1CCC(=O)O)C 51bc46924c83c8b936cce095af59d385 [0,1,0,1,0,0|1,0,0]=3 12673 B11R1.674 C[C@H]1C[C@@H](N1CCC(=O)N)C 1a8223551003ba2771ddd2d7c02a7b1b [0,1,0,1,0,0|2,0,0]=4 12674 B11R1.674 C[C@H]1C[C@@H](N1CCC(=O)O)C ab2362f5964fa7df05063c9a38c1368a [0,1,0,1,0,0|1,0,0]=3 12675 B11R1.720 CC(=O)CCCN(C)C1CC1 65b8255d0435ac586f31b7bb30cc685e [0,1,0,1,0,0|2,0,0]=4 12676 B11R1.720 CC(=O)CCN[C@@H](C)C1CC1 2e8149a1eb6d84245df3e3c7c03e76c9 [0,1,0,1,0,0|2,0,0]=4 12677 B11R1.720 CC(=O)CCN[C@H](C)C1CC1 95d0a34b961e2bbbb747d0ef588fa70d [0,1,0,1,0,0|2,0,0]=4 12678 B11R1.720 CC(=O)CCOC(C)C1CC1 2e12185b7598e89de3a04aa51cf88871 [0,1,0,1,0,0|2,0,0]=4 12679 B11R1.720 CC(=O)CCO[C@@H](C)C1CC1 60abbf2770660f64881fb7e4451c884c [0,1,0,1,0,0|2,0,0]=4 12680 B11R1.720 CC(=O)CCO[C@H](C)C1CC1 c7fedd447ced35fef1c56d73a4507436 [0,1,0,1,0,0|2,0,0]=4 12681 B11R1.720 CC(=O)CNCC(O)C1CC1 874b85f1999d6b2236a3dc0268f8733b [0,1,0,1,0,0|2,0,0]=4 12682 B11R1.720 CC(COCC(=O)N)C1CC1 fb1bbeece96fca1b27700f0925d549c7 [0,1,0,1,0,0|2,0,0]=4 12683 B11R1.720 CC(NCCC(=O)N)C1CC1 461ef4a6bde4899a64ed0175a050d68f [0,1,0,1,0,0|2,0,0]=4 12684 B11R1.720 CC(NCCS(=O)O)C1CC1 c2c7ed0ffa835d6f22426efb62399a3a [0,1,0,1,0,0|2,0,0]=4 12685 B11R1.720 CC(OCCC(=O)N)C1CC1 01b072056bbbd1fa699de7637ec341c2 [0,1,0,1,0,0|2,0,0]=4 12686 B11R1.720 CC(OCCC(=O)O)C1CC1 33505e83478f5e348bf7129f02655238 [0,1,0,1,0,0|1,0,0]=3 12687 B11R1.720 CN(CCCC(=O)N)C1CC1 41c8f99d36d2d8180758ea453088c0b2 [0,1,0,1,0,0|2,0,0]=4 12688 B11R1.720 C[C@@H](NCCC(=O)N)C1CC1 ec4412ea14a4befe40dc915ff2f5c1c3 [0,1,0,1,0,0|2,0,0]=4 12689 B11R1.720 C[C@@H](NCCC(=O)O)C1CC1 c5d3c1b19ef81fc64ab197827b964024 [0,1,0,1,0,0|1,0,0]=3 12690 B11R1.720 C[C@@H](OCCC(=O)N)C1CC1 4f6ea16f76aa1d1414206170c439082b [0,1,0,1,0,0|2,0,0]=4 12691 B11R1.720 C[C@@H](OCCC(=O)O)C1CC1 676e1027aa60186be8dd88c48a76d29f [0,1,0,1,0,0|1,0,0]=3 12692 B11R1.720 C[C@H](NCCC(=O)N)C1CC1 faf552e9fcd800a6b62a550dfe87c65f [0,1,0,1,0,0|2,0,0]=4 12693 B11R1.720 C[C@H](NCCC(=O)O)C1CC1 195e69acb537cb8f7c8ffafff5763cd5 [0,1,0,1,0,0|1,0,0]=3 12694 B11R1.720 C[C@H](OCCC(=O)N)C1CC1 c78feff784575c704fe64ebe8115dc67 [0,1,0,1,0,0|2,0,0]=4 12695 B11R1.720 C[C@H](OCCC(=O)O)C1CC1 92750c09faaab1a73fb2bf0235a09328 [0,1,0,1,0,0|1,0,0]=3 12696 B11R1.720 NC(=O)CNCC(O)C1CC1 5a3e69ba40360919d87d9addb0c1d067 [0,1,0,1,0,0|2,0,0]=4 12697 B11R1.720 O=C(O)CNCC(=O)C1CC1 e75f66afd8f978ea08de20d84059d7a8 [0,1,0,1,0,0|1,0,1]=4 12698 B11R1.720 O=C(O)CNCC(O)C1CC1 c93323595de77df788589946c3295483 [0,1,0,1,0,0|1,0,0]=3 12699 B11R1.720 O=C(O)COCC(=O)C1CC1 fcf97fb12631c600e2cf456934606fdd [0,1,0,1,0,0|1,0,1]=4 12700 B11R1.816 CCCN(C)[C@@H]1C[C@@H]1C(=O)O 16e896b205fc27d28538743a13935c00 [0,1,0,1,0,0|1,0,0]=3 12701 B11R1.816 CCCN(C)[C@H]1C[C@@H]1C(=O)O 0abcd08ef6da21c364f7b485af160b2b [0,1,0,1,0,0|1,0,0]=3 12702 B11R1.816 CCCN(C)[C@H]1C[C@H]1C(=O)O f42a3fe1cdbbbe8cd3d3012dc6a19457 [0,1,0,1,0,0|1,0,0]=3 12703 B11R1.816 CN(CCF)[C@@H]1C[C@@H]1C(=O)O 6da76725b4ffbc260ed5f2de8215932e [0,1,0,1,0,0|2,0,0]=4 12704 B11R1.816 CN(CCF)[C@H]1C[C@@H]1C(=O)O 0261d8ac73143564f592544d1b9ead9f [0,1,0,1,0,0|2,0,0]=4 12705 B11R1.816 CN(CCF)[C@H]1C[C@H]1C(=O)O f46d9f39f7d9aca0d083275e7f13af38 [0,1,0,1,0,0|2,0,0]=4 12706 B11R1.816 CN(CCO)[C@@H]1C[C@@H]1C(=O)O e67304f3c886d915e2e2319e731c2813 [0,1,0,1,0,0|2,0,0]=4 12707 B11R1.816 CN(CCO)[C@H]1C[C@@H]1C(=O)O 6099383670ff1a07276b45ffe0d58b8e [0,1,0,1,0,0|2,0,0]=4 12708 B11R1.816 CN(CCO)[C@H]1C[C@H]1C(=O)O 9596a354d0f3489e7fee2f83b842c6e9 [0,1,0,1,0,0|2,0,0]=4 12709 B11R1.924 CC(=O)CCNC1(CCC1)C 4708806fd34a7cb7cd5522aa1b77f3a6 [0,1,0,1,0,0|2,0,0]=4 12710 B11R1.924 CC(=O)CNCC1(CCC1)C 62ad0b76bca459db2fcb17b91fc12987 [0,1,0,1,0,0|2,0,0]=4 12711 B11R1.924 CC(=O)COCC1(CCC1)C c9711ac964a3a546043f9e2019d3e8ef [0,1,0,1,0,0|2,0,0]=4 12712 B11R1.924 CC(=O)NCCC1(CCC1)O c32b8247c0d8fa1329df36091ac0409c [0,1,0,1,0,0|2,0,0]=4 12713 B11R1.924 CC1(CCC1)CNCC(=O)N e21db55b55bb6ab3deb5b278e56b0d32 [0,1,0,1,0,0|2,0,0]=4 12714 B11R1.924 CC1(CCC1)CNCC(=O)O e44c0e0815156ad54f43f1d2c8779904 [0,1,0,1,0,0|1,0,0]=3 12715 B11R1.924 CC1(CCC1)COCC(=O)N 2387d46c76c0c98c542bbbad48d58a74 [0,1,0,1,0,0|2,0,0]=4 12716 B11R1.924 CC1(CCC1)COCC(=O)O d8ccff4908cf2c1192bc97ce562b7ff1 [0,1,0,1,0,0|1,0,0]=3 12717 B11R1.924 CC1(CCC1)COCS(=O)O 0afe0e1d3285e68822545d5c1514fd2a [0,1,0,1,0,0|2,0,0]=4 12718 B11R1.924 CC1(CCC1)NCCC(=O)N 3a79284c47653554db1c99b12156a218 [0,1,0,1,0,0|2,0,0]=4 12719 B11R1.924 CC1(CCC1)NCCC(=O)O 905894510b7311ff9aaa85e812c06a64 [0,1,0,1,0,0|1,0,0]=3 12720 B11R1.924 CC1(CCO1)CNCC(=O)O 2f12779859df7dc6b646b4179eab6c20 [0,1,0,1,0,0|2,0,0]=4 12721 B11R1.924 CC1(CCO1)COCC(=O)O db7cad25f6bc4e705fe45018a57d482b [0,1,0,1,0,0|2,0,0]=4 12722 B11R1.924 CC1(COC1)CNCC(=O)O 5acb65e3bca0cd143b057a5339e8b607 [0,1,0,1,0,0|2,0,0]=4 12723 B11R1.924 CC1(COC1)COCC(=O)O 0ed26ad2ab00e0084e3e517d85f509a4 [0,1,0,1,0,0|2,0,0]=4 12724 B11R1.924 CC1(COC1)NCCC(=O)O 1e397b4870d37dfb0cd7dd41b30e7ff9 [0,1,0,1,0,0|2,0,0]=4 12725 B11R1.924 CC1(CSC1)COCC(=O)O daab4908d9b46a3d1445b4ebe28a77e6 [0,1,0,1,0,0|2,0,0]=4 12726 B11R1.924 CC1(CSC1)NCCC(=O)O 3627e3362e5eb65136489997df018ac4 [0,1,0,1,0,0|2,0,0]=4 12727 B11R1.924 C[C@@]1(CCO1)COCC(=O)O 4277c8a7830e0224ebd39840bac723ed [0,1,0,1,0,0|2,0,0]=4 12728 B11R1.924 C[C@]1(CCO1)CNCC(=O)O 8765c83e89100477fbd8b5c57946cdb2 [0,1,0,1,0,0|2,0,0]=4 12729 B11R1.924 C[C@]1(CCO1)COCC(=O)O dbf2e1fd28b7c5a0465cc12b871c5c90 [0,1,0,1,0,0|2,0,0]=4 12730 B11R1.924 NC(=O)CNCC1(CCC1)O afbbdd0327da6f4c265ec12f4471da12 [0,1,0,1,0,0|2,0,0]=4 12731 B11R1.924 NC(=O)COCC1(CCC1)F a2f8c11cd4f2bf66bc42f1c9461ace9d [0,1,0,1,0,0|2,0,0]=4 12732 B11R1.924 O=C(O)CNCC1(CCC1)O ff89372bcab915261826ba15aad63472 [0,1,0,1,0,0|1,0,0]=3 12733 B11R1.924 O=C(O)CNCC1(COC1)F 26423561af49b29647caea18d16d13af [0,1,0,1,0,0|2,0,0]=4 12734 B11R1.924 O=C(O)CNCC1(COC1)O 228dbc440dcd04579bc1278061f7016e [0,1,0,1,0,0|2,0,0]=4 12735 B11R1.924 O=C(O)COCC1(CCC1)F 0358235fd0e452fdb2364dbae5ca7303 [0,1,0,1,0,0|1,0,0]=3 12736 B11R1.924 O=C(O)COCC1(COC1)F f21793ee3eae146723aafebb606550ca [0,1,0,1,0,0|2,0,0]=4 12737 B11R1.24 CCCCN1CCCC(=O)C1 ab5d5aa4c692d5c921210400e463a35c [0,1,0,1,0,0|1,0,0]=3 12738 B11R1.24 CCCCN1CCCC(C1)O a13a79b54351a761d8066e1aee09f97c [0,1,0,1,0,0|1,0,1]=4 12739 B11R1.24 CCCCN1CCC[C@@H](C1)O fbdac0af8fd499acec50df56a7ba829e [0,1,0,1,0,0|1,0,1]=4 12740 B11R1.24 CCCCN1CCC[C@H](C1)O e7e4354e46b2995126b20895f9fc7e1d [0,1,0,1,0,0|1,0,1]=4 12741 B11R1.24 CCCCN1CCNC(=O)C1 c67c01d1a07bdda5d18b7096d1b290cd [0,1,0,1,0,0|2,0,0]=4 12742 B11R1.24 CCCCN1CCOC(=O)C1 3f4af70ed351ba7dae5c4daa38dbbec5 [0,1,0,1,0,0|2,0,0]=4 12743 B11R1.24 CCCNC1CCCC(=O)C1 f78a901451b50e451bf018305d12a0cc [0,1,0,1,0,0|1,0,0]=3 12744 B11R1.24 CCCNC1CCCC(C1)O 811c3009a0c66f0fe81892da0c1a38ef [0,1,0,1,0,0|1,0,1]=4 12745 B11R1.24 CCCNC1CCNC(=O)C1 ff447769b3400ca9cfacfb0d558a8376 [0,1,0,1,0,0|2,0,0]=4 12746 B11R1.24 CCCN[C@@H]1CCC[C@@H](C1)O 543b4bbf09e0778921287662b7e5eb66 [0,1,0,1,0,0|1,0,1]=4 12747 B11R1.24 CCCN[C@@H]1CCC[C@H](C1)O 45e532c5c8d8a723f96a2dffa9b74026 [0,1,0,1,0,0|1,0,1]=4 12748 B11R1.24 CCCN[C@@H]1CCNC(=O)C1 aa286dce50ef181bcbf1d9471bf48bde [0,1,0,1,0,0|2,0,0]=4 12749 B11R1.24 CCCN[C@H]1CCC[C@@H](C1)O 6f989413e30ada5271f6a296ee5ea92e [0,1,0,1,0,0|1,0,1]=4 12750 B11R1.24 CCCN[C@H]1CCC[C@H](C1)O a49bc53f294c95a93797df2c4ac2155c [0,1,0,1,0,0|1,0,1]=4 12751 B11R1.24 CCCN[C@H]1CCNC(=O)C1 5f93ac4d81551bd3f26157e304a8d35a [0,1,0,1,0,0|2,0,0]=4 12752 B11R1.24 CCCOC1C=C(CCC1)C 6dce11d0f49296f7fa9063d6a455adc2 [0,1,0,1,0,0|2,0,0]=4 12753 B11R1.24 CCCOC1CCCC(=O)C1 3a62b9596446c853f594c7714567c6fa [0,1,0,1,0,0|1,0,0]=3 12754 B11R1.24 CCCOC1CCNC(=O)C1 65105623f5191c21e4a7be8acdaca72e [0,1,0,1,0,0|2,0,0]=4 12755 B11R1.24 CCCO[C@@H]1CCNC(=O)C1 5bf264179db23a8df067b0bd13e7f763 [0,1,0,1,0,0|2,0,0]=4 12756 B11R1.24 CCCO[C@H]1CCNC(=O)C1 60cfa443462ad68a1346c33be32ed63f [0,1,0,1,0,0|2,0,0]=4 12757 B11R1.24 CCNCC1CCCC(=O)N1 245951673b534df0bf27d890092fcdeb [0,1,0,1,0,0|1,0,0]=3 12758 B11R1.24 CCNCC1CCCC(C1)O 59552859fe32530554ff42fbfb5e3e94 [0,1,0,1,0,0|1,0,1]=4 12759 B11R1.24 CCNCC1CCNC(=O)C1 c3ba1d2c37b362a2a269506588505c2c [0,1,0,1,0,0|2,0,0]=4 12760 B11R1.24 CCNC[C@H]1CCC[C@H](C1)O 86c891488cc5d20468f47dee60e90605 [0,1,0,1,0,0|1,0,1]=4 12761 B11R1.24 CCOCC1CCCC(=O)C1 59f3485ad485a6e1d97c966f04f592f9 [0,1,0,1,0,0|1,0,0]=3 12762 B11R1.24 CCOCC1CCCC(=O)N1 ae7b22866fb52b162e0bd2153c57f3fa [0,1,0,1,0,0|1,0,0]=3 12763 B11R1.24 CCOCC1CCNC(=O)C1 dfdbdc0d66883705877010ad07aa3ee3 [0,1,0,1,0,0|2,0,0]=4 12764 B11R1.24 CCOCC1COCC(=O)N1 36f45df23f7e834d02e2c23cc48318bd [0,1,0,1,0,0|2,0,0]=4 12765 B11R1.24 CCOCN1CCCC(=O)C1 67340f90abd6e7e3540fa8a66f5619c6 [0,1,0,1,0,0|2,0,0]=4 12766 B11R1.24 CCOC[C@@H]1CCCC(=O)N1 e702e00726367338ffd611c3a76033db [0,1,0,1,0,0|1,0,0]=3 12767 B11R1.24 CCOC[C@@H]1COCC(=O)N1 f46a3f179ac96b4a113c530e158c537e [0,1,0,1,0,0|2,0,0]=4 12768 B11R1.24 CCOC[C@H]1CCCC(=O)N1 aad994c462d12f350a0479fdd23025c1 [0,1,0,1,0,0|1,0,0]=3 12769 B11R1.24 CCOC[C@H]1COCC(=O)N1 ac8f292b8927597e85f58a6fbf709ea8 [0,1,0,1,0,0|2,0,0]=4 12770 B11R1.24 COCCN1CCCC(=O)C1 527a8c86725352137b2341559fe7f2dd [0,1,0,1,0,0|2,0,0]=4 12771 B11R1.24 COCOC1CCCC(=O)C1 f76735a0929d686795f1aa3f5f2f0167 [0,1,0,1,0,0|2,0,0]=4 12772 B11R1.24 CSCCN1CCCC(=O)C1 c4813bf7b71fb0a99baee0da0e4bc718 [0,1,0,1,0,0|2,0,0]=4 12773 B11R1.24 CSCOC1CCCC(=O)C1 4042f0cd5c9b2d5f415ee6628ac15295 [0,1,0,1,0,0|2,0,0]=4 12774 B11R1.24 O=C1CCCC(C1)COCF 11cafa08057b406bf6693799f7f4707d [0,1,0,1,0,0|2,0,0]=4 12775 B11R1.24 O=C1CCCC(C1)NCCBr f138dadc821c48e193c3577f29a08fe7 [0,1,0,1,0,0|2,0,0]=4 12776 B11R1.24 O=C1CCCC(C1)NCCF 5de2cc1db08490251cc8d4a2a5b6bd70 [0,1,0,1,0,0|2,0,0]=4 12777 B11R1.24 O=C1CCCC(C1)NCCI 63e170c3d3eb83f83e779f95ae1c7eee [0,1,0,1,0,0|2,0,0]=4 12778 B11R1.24 O=C1CCCC(C1)NCCO d99d47cab45c27d8095c6db03bb9e2ef [0,1,0,1,0,0|2,0,0]=4 12779 B11R1.24 O=C1CCCC(C1)NCCS 6a6636e940a94c28e7403354d5b17ebf [0,1,0,1,0,0|2,0,0]=4 12780 B11R1.24 O=C1CCCC(C1)OCCF 7d9b97cf25a585eeaeaeb9cf225eb6fe [0,1,0,1,0,0|2,0,0]=4 12781 B11R1.24 O=C1CCCC(C1)OCCS 24c64eb171cd6b0d2d85cd0c6615fda5 [0,1,0,1,0,0|2,0,0]=4 12782 B11R1.24 O=C1CCCC(N1)CNCF 36a243adba201cde5bf9ada0c28d7b92 [0,1,0,1,0,0|2,0,0]=4 12783 B11R1.24 O=C1CCCC(N1)CNCO 3feaf6e4e0063eec07929d85c7e21b51 [0,1,0,1,0,0|2,0,0]=4 12784 B11R1.24 O=C1CCCC(N1)COCF a68084eb1fecdb2991e94a617f5982f1 [0,1,0,1,0,0|2,0,0]=4 12785 B11R1.24 O=C1CCCN(C1)CCCF 3605742ddbee7daa92cb15a9b424be62 [0,1,0,1,0,0|2,0,0]=4 12786 B11R1.24 O=C1CCCN(C1)CCCO e7e21adb0f0315469f22431e1b72db87 [0,1,0,1,0,0|2,0,0]=4 12787 B11R1.24 O=C1CCCN(C1)CCCS f7933a56b28363f53c3289805c628664 [0,1,0,1,0,0|2,0,0]=4 12788 B11R1.24 O=C1CCC[C@@H](N1)COCF a15b232d0a26065ea3a1e9f205af1626 [0,1,0,1,0,0|2,0,0]=4 12789 B11R1.24 O=C1CCC[C@H](N1)COCF 7d27f75fa37870b29c495d34de259444 [0,1,0,1,0,0|2,0,0]=4 12790 B11R1.27 C#CCNCC1CCC(=O)O1 56920d32bc3d5ee15724ed229e708835 [0,1,0,1,0,0|0,0,2]=4 12791 B11R1.27 C#CCOCC1CCC(=O)O1 60a18823800d4d79832b073de1158fac [0,1,0,1,0,0|0,0,2]=4 12792 B11R1.27 C#CCOC[C@@H]1CCC(=O)O1 b5e32c0564e2749ee20766e1a5d5ffcb [0,1,0,1,0,0|0,0,2]=4 12793 B11R1.27 C#CCOC[C@H]1CCC(=O)O1 c81876c567dbdfea867b735c69026e5b [0,1,0,1,0,0|0,0,2]=4 12794 B11R1.27 C=CCOCC1CCC(=O)O1 e971373e4782bd5fc55423a18d2dcc75 [0,1,0,1,0,0|0,0,2]=4 12795 B11R1.27 C=CCOC[C@@H]1CCC(=O)O1 503d8391f69e2b2d3e357e787e103d33 [0,1,0,1,0,0|0,0,2]=4 12796 B11R1.27 C=CCOC[C@H]1CCC(=O)O1 f474b21f3a5384208a0bd917e9cf6369 [0,1,0,1,0,0|0,0,2]=4 12797 B11R1.27 CCCCCN1CCC(C1)O 660096ddac722e564b18325f84033519 [0,1,0,1,0,0|1,0,1]=4 12798 B11R1.27 CCCCCN1CC[C@@H](C1)O 3f857e5b4f1bf1f28ca72d51565fac9a [0,1,0,1,0,0|1,0,1]=4 12799 B11R1.27 CCCCCN1CC[C@H](C1)O c2d51d12d99d3cf79d5b992d16394bbb [0,1,0,1,0,0|1,0,1]=4 12800 B11R1.27 CCCCCN1CNC(=O)C1 49f47fdb41fa0be9bff09771193b259c [0,1,0,1,0,0|2,0,0]=4 12801 B11R1.27 CCCCNC1CCC(C1)O 9779be9d468f275a75a474b7205d6fec [0,1,0,1,0,0|1,0,1]=4 12802 B11R1.27 CCCCNC1CNC(=O)C1 f78ac4006091e9f06e57b27445536f46 [0,1,0,1,0,0|2,0,0]=4 12803 B11R1.27 CCCCN[C@@H]1CC[C@@H](C1)O 618052d677bb6e8e7b25993672363612 [0,1,0,1,0,0|1,0,1]=4 12804 B11R1.27 CCCCN[C@@H]1CC[C@H](C1)O 1603ca0ea566b98e9eb9775e24490ec8 [0,1,0,1,0,0|1,0,1]=4 12805 B11R1.27 CCCCN[C@@H]1CNC(=O)C1 e6e71c4450c7db55f5c2bad7078a11de [0,1,0,1,0,0|2,0,0]=4 12806 B11R1.27 CCCCN[C@H]1CC[C@@H](C1)O d58d5e17a6423379fd405f9d6cfdc172 [0,1,0,1,0,0|1,0,1]=4 12807 B11R1.27 CCCCN[C@H]1CC[C@H](C1)O 63d9dcebd98e728c12860738358fe144 [0,1,0,1,0,0|1,0,1]=4 12808 B11R1.27 CCCCN[C@H]1CNC(=O)C1 79517edc27cec99e1d66def4b205ea8b [0,1,0,1,0,0|2,0,0]=4 12809 B11R1.27 CCCCOC1=CC(=O)CC1 1d9caa8fcfe9112b183be080df047c84 [0,1,0,1,0,0|1,0,1]=4 12810 B11R1.27 CCCCOC1=COC(=O)C1 02660e1f2769e98a0d8f56d95e1b495b [0,1,0,1,0,0|1,0,1]=4 12811 B11R1.27 CCCCOC1C=CC(=O)C1 0d98e3380264e96c82b51496b84e5007 [0,1,0,1,0,0|2,0,0]=4 12812 B11R1.27 CCCCOC1C=CC(=O)O1 8de5a6aabb96fa2068f232a13afea463 [0,1,0,1,0,0|0,0,2]=4 12813 B11R1.27 CCCCOC1CCC(=O)C1 727929739aee4fa06897e895ceb533a0 [0,1,0,1,0,0|1,0,0]=3 12814 B11R1.27 CCCCOC1CNC(=O)C1 7f0b2d607a6fb4cfb285edbd6a01ecd2 [0,1,0,1,0,0|2,0,0]=4 12815 B11R1.27 CCCCOC1COC(=O)C1 8942dfa70be1c441ce518d6c18bc17ef [0,1,0,1,0,0|1,0,0]=3 12816 B11R1.27 CCCCO[C@@H]1CNC(=O)C1 1cb79a6d122f6612397547c0306298dd [0,1,0,1,0,0|2,0,0]=4 12817 B11R1.27 CCCCO[C@@H]1COC(=O)C1 18b802b82b8c088a6fdfd2d0aad01e77 [0,1,0,1,0,0|1,0,0]=3 12818 B11R1.27 CCCCO[C@H]1C=CC(=O)C1 207af7052b82c543be52becc1f233bfc [0,1,0,1,0,0|2,0,0]=4 12819 B11R1.27 CCCCO[C@H]1CNC(=O)C1 60e2710570a4df3b30f2d0357c7f1312 [0,1,0,1,0,0|2,0,0]=4 12820 B11R1.27 CCCCO[C@H]1COC(=O)C1 b8f4980b8ebe3abcee6815a8b1a7bed5 [0,1,0,1,0,0|1,0,0]=3 12821 B11R1.27 CCCNCC1CCC(=O)N1 30a24274dc2a4201a760959ff889a8ac [0,1,0,1,0,0|1,0,0]=3 12822 B11R1.27 CCCNCC1CCC(=O)O1 192e1b88d26e187571243f52c87c3f25 [0,1,0,1,0,0|0,0,0]=2 12823 B11R1.27 CCCNCC1CCC(C1)O 69767a48d5e511dcb48e6df252c878ee [0,1,0,1,0,0|1,0,1]=4 12824 B11R1.27 CCCNCC1CNC(=O)C1 b3cb147abaf182c94981946603432d59 [0,1,0,1,0,0|2,0,0]=4 12825 B11R1.27 CCCNC[C@@H]1CCC(=O)N1 f9262cdecc5e6e0e979d984d77f464f2 [0,1,0,1,0,0|1,0,0]=3 12826 B11R1.27 CCCNC[C@@H]1CNC(=O)C1 8f8cb49546f6c9b84965627f7c8eaadc [0,1,0,1,0,0|2,0,0]=4 12827 B11R1.27 CCCNC[C@H]1CCC(=O)N1 edad095491b7add8ca64d929567a3f7e [0,1,0,1,0,0|1,0,0]=3 12828 B11R1.27 CCCOCC1C=CC(=O)O1 9dadb827d673d8628bb482617f675d16 [0,1,0,1,0,0|0,0,2]=4 12829 B11R1.27 CCCOCC1CCC(=O)C1 e706b3e203ec0c6715752bcdbd3f5694 [0,1,0,1,0,0|1,0,0]=3 12830 B11R1.27 CCCOCC1CCC(=O)N1 69196ae092eace860730e3fef24858e6 [0,1,0,1,0,0|1,0,0]=3 12831 B11R1.27 CCCOCC1CCC(=O)O1 e9e82695e85d6e35f1d9b435b1472756 [0,1,0,1,0,0|0,0,0]=2 12832 B11R1.27 CCCOCC1CCC(O1)C 7245c0506fa318f9ec0ffb8bd206fb82 [0,1,0,1,0,0|1,0,1]=4 12833 B11R1.27 CCCOCC1CNC(=O)C1 df54d8d9385bcd6d947fec16b1748b29 [0,1,0,1,0,0|2,0,0]=4 12834 B11R1.27 CCCOCC1CNC(=O)N1 88642effb7c187a07c383c82c7c8e75d [0,1,0,1,0,0|2,0,0]=4 12835 B11R1.27 CCCOCC1COC(=O)C1 ad94d21cddc1444eebfe0f772bb0cd91 [0,1,0,1,0,0|1,0,0]=3 12836 B11R1.27 CCCOC[C@@H]1C=CC(=O)O1 7531c118a29ea18e38da49b72ee790bd [0,1,0,1,0,0|0,0,2]=4 12837 B11R1.27 CCCOC[C@@H]1CCC(=O)C1 f9bb9dadbddc29fa2aa419e4699cef28 [0,1,0,1,0,0|1,0,0]=3 12838 B11R1.27 CCCOC[C@@H]1CCC(=O)N1 06b21930b9e936208c8c09c97d53118a [0,1,0,1,0,0|1,0,0]=3 12839 B11R1.27 CCCOC[C@@H]1CCC(=O)O1 451cbd28723ca3d63ce2083daa5f1a8b [0,1,0,1,0,0|0,0,0]=2 12840 B11R1.27 CCCOC[C@@H]1CC[C@@H](O1)C dc1d7f544da463b9fa3fdd86a4095b16 [0,1,0,1,0,0|1,0,1]=4 12841 B11R1.27 CCCOC[C@@H]1CNC(=O)C1 a3d7c83895f82e57a6daa9f2c7daa28e [0,1,0,1,0,0|2,0,0]=4 12842 B11R1.27 CCCOC[C@H]1CCC(=O)N1 557bdab749391b52f868e5fd71e08cef [0,1,0,1,0,0|1,0,0]=3 12843 B11R1.27 CCCOC[C@H]1CCC(=O)O1 ba98c0589f5943fe8be2745df7bb5cb9 [0,1,0,1,0,0|0,0,0]=2 12844 B11R1.27 CCCOC[C@H]1CNC(=O)C1 63fb5f30519b260733541cd0d510f607 [0,1,0,1,0,0|2,0,0]=4 12845 B11R1.27 CCOCC[C@@H]1CCC(=O)N1 b50b945e43f449c2c8984f3d2635510d [0,1,0,1,0,0|1,0,0]=3 12846 B11R1.27 COCCOC1CCC(=O)C1 7203a7a5cf5b5f7b77457a53aecc4ed5 [0,1,0,1,0,0|2,0,0]=4 12847 B11R1.27 COCCOC1COC(=O)C1 b23c4add1ae8ecd8e30e8086d17dd856 [0,1,0,1,0,0|2,0,0]=4 12848 B11R1.27 COCCO[C@@H]1COC(=O)C1 0fd3e388c69500838df787d52da15f34 [0,1,0,1,0,0|2,0,0]=4 12849 B11R1.27 COCCO[C@H]1COC(=O)C1 a92fdc4775ae23e98291c3f75fb36b0c [0,1,0,1,0,0|2,0,0]=4 12850 B11R1.27 COCNCC1CCC(=O)N1 54e8481ba1a2ef42cf8a686c1366c305 [0,1,0,1,0,0|2,0,0]=4 12851 B11R1.27 COCNC[C@@H]1CCC(=O)N1 7dc54615ac4f2d625d14862a989c758b [0,1,0,1,0,0|2,0,0]=4 12852 B11R1.27 COCNC[C@H]1CCC(=O)N1 d9a601c9c9b89bb37841bdd6fe3313f4 [0,1,0,1,0,0|2,0,0]=4 12853 B11R1.27 COCOCC1CCC(=O)C1 1feeb093f9a5c73406b7ea5314841bd5 [0,1,0,1,0,0|2,0,0]=4 12854 B11R1.27 COCOCC1CCC(=O)N1 dc3143823753af7f58b517fa7ed7d344 [0,1,0,1,0,0|2,0,0]=4 12855 B11R1.27 COCOCC1CCC(=O)O1 0bc26c8413546f06f44394eb0d1b91f4 [0,1,0,1,0,0|1,0,0]=3 12856 B11R1.27 COCOCC1COC(=O)C1 a23407456a58c2320924671454ecf8d1 [0,1,0,1,0,0|2,0,0]=4 12857 B11R1.27 COCOC[C@@H]1CCC(=O)C1 c657d28a9b4656d9f918836950097cbe [0,1,0,1,0,0|2,0,0]=4 12858 B11R1.27 COCOC[C@@H]1CCC(=O)N1 ffd0c6c24b3248dfef60369265cf2315 [0,1,0,1,0,0|2,0,0]=4 12859 B11R1.27 COCOC[C@@H]1CCC(=O)O1 b66adb2b97b44d8d4f07a03cf38d6639 [0,1,0,1,0,0|1,0,0]=3 12860 B11R1.27 COCOC[C@H]1CCC(=O)N1 e9e4531b3f37b1a423390486ae6b8e1e [0,1,0,1,0,0|2,0,0]=4 12861 B11R1.27 COCOC[C@H]1CCC(=O)O1 7cde2a030b457b7cacd9be76c6fcab25 [0,1,0,1,0,0|1,0,0]=3 12862 B11R1.27 CSCCOC1CCC(=O)C1 a2bd150b2f0de81474ae1fbdf6f3bec7 [0,1,0,1,0,0|2,0,0]=4 12863 B11R1.27 CSCCOC1COC(=O)C1 6bd6b6d842aadc5bc93a67478922358f [0,1,0,1,0,0|2,0,0]=4 12864 B11R1.27 CSCCO[C@@H]1COC(=O)C1 ce9bdf028c4f58790dd2ac3dcb57ad5e [0,1,0,1,0,0|2,0,0]=4 12865 B11R1.27 CSCCO[C@H]1COC(=O)C1 85f6620ab798eedd94e7b5151fe7f723 [0,1,0,1,0,0|2,0,0]=4 12866 B11R1.27 CSCNCC1CCC(=O)N1 ff392bb66e4fff099bdde93553998b2b [0,1,0,1,0,0|2,0,0]=4 12867 B11R1.27 CSCNC[C@@H]1CCC(=O)N1 9758c41321124e1884b03b63240864ba [0,1,0,1,0,0|2,0,0]=4 12868 B11R1.27 CSCNC[C@H]1CCC(=O)N1 5b25ec6bfc97826f75b8a814bc79148e [0,1,0,1,0,0|2,0,0]=4 12869 B11R1.27 CSCOCC1CCC(=O)N1 824a93a6cdbe736f94c0fa8bfce30052 [0,1,0,1,0,0|2,0,0]=4 12870 B11R1.27 CSCOCC1COC(=O)C1 fb691dd3f9a76a93d3c3fae11553a458 [0,1,0,1,0,0|2,0,0]=4 12871 B11R1.27 CSCOC[C@@H]1CCC(=O)N1 43878a3006d1e7cb9bb03cd4ba59da1b [0,1,0,1,0,0|2,0,0]=4 12872 B11R1.27 CSCOC[C@H]1CCC(=O)N1 d8ae91a82b983649404079ff031624cf [0,1,0,1,0,0|2,0,0]=4 12873 B11R1.27 N#CCNCC1CCC(=O)O1 164cf1559abc4e89b8f2e9bdc61b99d2 [0,1,0,1,0,0|1,0,1]=4 12874 B11R1.27 N#CCOCC1CCC(=O)O1 731bc1b05fc8cae2199848a48dcf00db [0,1,0,1,0,0|1,0,1]=4 12875 B11R1.27 N#CCOC[C@@H]1CCC(=O)O1 16888b7b0ff96b167c6a944dbaa66ea5 [0,1,0,1,0,0|1,0,1]=4 12876 B11R1.27 N#CCOC[C@H]1CCC(=O)O1 52621217d6113d83540a66fed3e1a9c7 [0,1,0,1,0,0|1,0,1]=4 12877 B11R1.27 O=C1CC(CO1)COCCF d15f4031e7d7549838000fdec81097c9 [0,1,0,1,0,0|2,0,0]=4 12878 B11R1.27 O=C1CC(CO1)COCCS cf4b39aba974c4aab2272c7e481ab4c1 [0,1,0,1,0,0|2,0,0]=4 12879 B11R1.27 O=C1CC(CO1)OCCCF 272e1518c860999f7152279ff18359b6 [0,1,0,1,0,0|2,0,0]=4 12880 B11R1.27 O=C1CC(CO1)OCCCS 6bd180d5a60dfa931ce99c02225d8681 [0,1,0,1,0,0|2,0,0]=4 12881 B11R1.27 O=C1CCC(C1)COCCF e3666e81c34d7626565e84975f7a89b3 [0,1,0,1,0,0|2,0,0]=4 12882 B11R1.27 O=C1CCC(C1)COCCS d55395402014604211a9625b566fe52e [0,1,0,1,0,0|2,0,0]=4 12883 B11R1.27 O=C1CCC(C1)OCCCF 454cfbf794d41abb125e5b977d044bb2 [0,1,0,1,0,0|2,0,0]=4 12884 B11R1.27 O=C1CCC(C1)OCCCS c4f13eb1b084c5ee0d252c7e72ed2518 [0,1,0,1,0,0|2,0,0]=4 12885 B11R1.27 O=C1CCC(N1)CNCCBr 683d6e080f27839093e94f5bb35263ad [0,1,0,1,0,0|2,0,0]=4 12886 B11R1.27 O=C1CCC(N1)CNCCF d99638e7715bae55e5f3443727d4af05 [0,1,0,1,0,0|2,0,0]=4 12887 B11R1.27 O=C1CCC(N1)CNCCI 8a004819928dbb08d2f72525fb3039a0 [0,1,0,1,0,0|2,0,0]=4 12888 B11R1.27 O=C1CCC(N1)CNCCO de9fa4b5d210801f4d759b430ff1c736 [0,1,0,1,0,0|2,0,0]=4 12889 B11R1.27 O=C1CCC(N1)CNCCS 13e91731ead96ad98bffb0a6f4224f4b [0,1,0,1,0,0|2,0,0]=4 12890 B11R1.27 O=C1CCC(N1)COCCF 6b298085ff920bcdbca5541c4b0c476a [0,1,0,1,0,0|2,0,0]=4 12891 B11R1.27 O=C1CCC(N1)COCCS 340dca89008136e5ce801d56efe1c03b [0,1,0,1,0,0|2,0,0]=4 12892 B11R1.27 O=C1CCC(O1)CNCCBr 82ef3f4c05c4710243d0b911a82bb0c8 [0,1,0,1,0,0|1,0,0]=3 12893 B11R1.27 O=C1CCC(O1)CNCCF 8baa362bf9ce2cffff95686b955a48f5 [0,1,0,1,0,0|1,0,0]=3 12894 B11R1.27 O=C1CCC(O1)CNCCI 49baa9b0b225cbb33d16cffa4453cd53 [0,1,0,1,0,0|1,0,0]=3 12895 B11R1.27 O=C1CCC(O1)CNCCO 4ad376a826e33a8656380aea4cf82844 [0,1,0,1,0,0|1,0,0]=3 12896 B11R1.27 O=C1CCC(O1)CNCCS 3a200e3011103e4ea340eed1245f9bfa [0,1,0,1,0,0|1,0,0]=3 12897 B11R1.27 O=C1CCC(O1)COCCF 8b44256d489d669b66439448a3a08d3d [0,1,0,1,0,0|1,0,0]=3 12898 B11R1.27 O=C1CCC(O1)COCCS 9734e369e040cd029edb505263aadd13 [0,1,0,1,0,0|1,0,0]=3 12899 B11R1.27 O=C1CC[C@@H](N1)CNCCBr e8d4c7a4cff6bf50fb553050cd758c9b [0,1,0,1,0,0|2,0,0]=4 12900 B11R1.27 O=C1CC[C@@H](N1)CNCCF 0b7a8ad6e149679f30185ccc891aa6e9 [0,1,0,1,0,0|2,0,0]=4 12901 B11R1.27 O=C1CC[C@@H](N1)CNCCI 7e0ff95a77509646a626496b24f4d9f0 [0,1,0,1,0,0|2,0,0]=4 12902 B11R1.27 O=C1CC[C@@H](N1)CNCCO aa8ac892cfacfcc7d74cc9447574d9e9 [0,1,0,1,0,0|2,0,0]=4 12903 B11R1.27 O=C1CC[C@@H](N1)CNCCS 2d7453750f48d6c3af0e9bfa3427af15 [0,1,0,1,0,0|2,0,0]=4 12904 B11R1.27 O=C1CC[C@@H](N1)COCCF 3a50427d959dbd4d72e7d909669ba1a7 [0,1,0,1,0,0|2,0,0]=4 12905 B11R1.27 O=C1CC[C@@H](N1)COCCS aa0232c319dc46070b2df9210b8af8d4 [0,1,0,1,0,0|2,0,0]=4 12906 B11R1.27 O=C1CC[C@@H](O1)COCCF 5a8f953a3f7988df8b786a07995f5d8a [0,1,0,1,0,0|1,0,0]=3 12907 B11R1.27 O=C1CC[C@@H](O1)COCCS 4ce048852a979776f4ad91b5ae881e40 [0,1,0,1,0,0|1,0,0]=3 12908 B11R1.27 O=C1CC[C@H](C1)COCCF e4aba8eb162d9e8df0ed5147a5a5712b [0,1,0,1,0,0|2,0,0]=4 12909 B11R1.27 O=C1CC[C@H](C1)COCCS 07b93865903be5df0d6c4e91441830e4 [0,1,0,1,0,0|2,0,0]=4 12910 B11R1.27 O=C1CC[C@H](N1)CCOCF a4e2a4c25820a1890bb2c2326dfcb819 [0,1,0,1,0,0|2,0,0]=4 12911 B11R1.27 O=C1CC[C@H](N1)CNCCBr b524203718fa2d0a03e7267acd24dcf0 [0,1,0,1,0,0|2,0,0]=4 12912 B11R1.27 O=C1CC[C@H](N1)CNCCF a1e04ebc1fa3f0ff24c8d82405681d90 [0,1,0,1,0,0|2,0,0]=4 12913 B11R1.27 O=C1CC[C@H](N1)CNCCI 1585e4efb7db9c5c8f7bbc2bf54fbd50 [0,1,0,1,0,0|2,0,0]=4 12914 B11R1.27 O=C1CC[C@H](N1)CNCCO 674ec5dc3cd2e7a2cff2bf2e99dee410 [0,1,0,1,0,0|2,0,0]=4 12915 B11R1.27 O=C1CC[C@H](N1)CNCCS 0d3065ed08d91182002e91d6676457ad [0,1,0,1,0,0|2,0,0]=4 12916 B11R1.27 O=C1CC[C@H](N1)COCCF e988ec9d96c6ce0ff89255551dea01de [0,1,0,1,0,0|2,0,0]=4 12917 B11R1.27 O=C1CC[C@H](N1)COCCS 583c9f797af77e9862ee96c5806e4d85 [0,1,0,1,0,0|2,0,0]=4 12918 B11R1.27 O=C1CC[C@H](O1)COCCF a337c2cae5bb20c253e43c29c8e26538 [0,1,0,1,0,0|1,0,0]=3 12919 B11R1.27 O=C1CC[C@H](O1)COCCS 0b9030b2f233b188f2ccd225b3a07b89 [0,1,0,1,0,0|1,0,0]=3 12920 B11R1.27 O=C1C[C@@H](CO1)OCCCF 1e64ef1c75dc5fe4d2f06d850359615f [0,1,0,1,0,0|2,0,0]=4 12921 B11R1.27 O=C1C[C@@H](CO1)OCCCS 6cee4a0232f8c4fab79e866802561143 [0,1,0,1,0,0|2,0,0]=4 12922 B11R1.27 O=C1C[C@H](CO1)OCCCF 002bb5ecb1be310119c39f92064b4e6c [0,1,0,1,0,0|2,0,0]=4 12923 B11R1.27 O=C1C[C@H](CO1)OCCCS 6b263201d617535b2273b69f2456c49e [0,1,0,1,0,0|2,0,0]=4 12924 B11R1.27 O=CCOCC1CCC(=O)O1 5d1f7e7b7f2ff3d5be0237d3267d68ba [0,1,0,1,0,0|1,0,1]=4 12925 B11R1.27 O=CCOC[C@@H]1CCC(=O)O1 c3d96ecba9757c2e9d6e9da68d27266e [0,1,0,1,0,0|1,0,1]=4 12926 B11R1.27 O=CCOC[C@H]1CCC(=O)O1 82b3e829a4d4863e10d75e023549d527 [0,1,0,1,0,0|1,0,1]=4 12927 B11R1.46 C=C1CC1COCCCCC 7f45e40e79cf42ec7b7067b8eb37ec2a [0,1,0,1,0,0|2,0,0]=4 12928 B11R1.53 CC(=O)C1CCCCN1CF 2a8b7046d8ed49e3d7662c3080b1eea4 [0,1,0,1,0,0|2,0,0]=4 12929 B11R1.53 CC(=O)C1CCCCN1CO b6ced10c0baf6ac7d02a450feb076d72 [0,1,0,1,0,0|2,0,0]=4 12930 B11R1.53 CC(=O)N1CCCCC1CO 6e3fc41016db309df2c9bb6835832274 [0,1,0,1,0,0|2,0,0]=4 12931 B11R1.53 CC(=O)N1CCCC[C@@H]1CO 2d3b59cb82f776a44221fbfec3df07e6 [0,1,0,1,0,0|2,0,0]=4 12932 B11R1.53 CC(=O)N1CCCC[C@H]1CO 26d38e9d210a63947a2c7fdbfa974003 [0,1,0,1,0,0|2,0,0]=4 12933 B11R1.53 CCC1CCCCN1C(=O)C 8d91af042ec3ee454d245c12958ebfeb [0,1,0,1,0,0|1,0,0]=3 12934 B11R1.53 CCC1COCCN1C(=O)C 8dd2029cb4d1d2f81e06c54a1f5dbb35 [0,1,0,1,0,0|2,0,0]=4 12935 B11R1.53 CCN1CC=CC[C@H]1C(=O)O 31ffa7d9aa542b33e89e7c925519016f [0,1,0,1,0,0|0,0,2]=4 12936 B11R1.53 CCN1CCCCC1C(=O)C 66e745e3acee9cfa447bccc577764815 [0,1,0,1,0,0|1,0,0]=3 12937 B11R1.53 CCN1CCCCC1C(=O)N 00aa29d87fd7cc18aead98e4fddba9f3 [0,1,0,1,0,0|1,0,0]=3 12938 B11R1.53 CCN1CCCCC1C(=O)O 48e64a80b74ee0d57ef5f2c51793a0e0 [0,1,0,1,0,0|0,0,0]=2 12939 B11R1.53 CCN1CCCC[C@@H]1C(=O)N d88b4e4bdd088665793e230ad88658f8 [0,1,0,1,0,0|1,0,0]=3 12940 B11R1.53 CCN1CCCC[C@@H]1C(=O)O ffabe4d2c3400a07ec9d9a1b02445d18 [0,1,0,1,0,0|0,0,0]=2 12941 B11R1.53 CCN1CCCC[C@H]1C(=O)N 5ef3247fbd176524430d9698606233d1 [0,1,0,1,0,0|1,0,0]=3 12942 B11R1.53 CCN1CCCC[C@H]1C(=O)O bfa902a3d396d93371caf449fec9a938 [0,1,0,1,0,0|0,0,0]=2 12943 B11R1.53 CCN1CCCSC1C(=O)O 714ab7d5f47ac73dbab4bf4e7ca0563f [0,1,0,1,0,0|1,0,0]=3 12944 B11R1.53 CCN1CCOCC1C(=O)N 4597521994485702f168a2eb7373e877 [0,1,0,1,0,0|2,0,0]=4 12945 B11R1.53 CCN1CCOCC1C(=O)O 4e8e486d19bce548ce5dcd44da88bf93 [0,1,0,1,0,0|1,0,0]=3 12946 B11R1.53 CCN1CCOC[C@@H]1C(=O)N da28acb7b209a7aab0a297b67677ee3d [0,1,0,1,0,0|2,0,0]=4 12947 B11R1.53 CCN1CCOC[C@@H]1C(=O)O 29a626e348d78eb3932bfc1fc9125b04 [0,1,0,1,0,0|1,0,0]=3 12948 B11R1.53 CCN1CCOC[C@H]1C(=O)N ac29a60bce32229f4b74f5ee34b1d8cc [0,1,0,1,0,0|2,0,0]=4 12949 B11R1.53 CCN1CCOC[C@H]1C(=O)O fc40095b000bc9c3ac27524d64195911 [0,1,0,1,0,0|1,0,0]=3 12950 B11R1.53 CCN1CCSCC1C(=O)O d27fac1ccb72015ed59835c66ff0e5b1 [0,1,0,1,0,0|1,0,0]=3 12951 B11R1.53 CCN1CCSC[C@@H]1C(=O)O 98b6db6175552733deff2eab6f15041f [0,1,0,1,0,0|1,0,0]=3 12952 B11R1.53 CCN1CCSC[C@H]1C(=O)O 20d7734a9f8d49660c707d7b8bbe747d [0,1,0,1,0,0|1,0,0]=3 12953 B11R1.53 CC[C@@H]1CCCCN1C(=O)C 6739e20465d74f218273c8bb16bd22bb [0,1,0,1,0,0|1,0,0]=3 12954 B11R1.53 CC[C@@H]1COCCN1C(=O)C 7fdffc15c971fbe37aea280231e59131 [0,1,0,1,0,0|2,0,0]=4 12955 B11R1.53 CC[C@H]1CCCCN1C(=O)C 3f882d1db31c87fd415fbe582bfecb93 [0,1,0,1,0,0|1,0,0]=3 12956 B11R1.53 CC[C@H]1COCCN1C(=O)C 9048e0bf415d52b57570f4aa3fbdca7c [0,1,0,1,0,0|2,0,0]=4 12957 B11R1.53 NC(=O)C1CCCCN1CF 29d3eefb35a5712051336fd48f579ce6 [0,1,0,1,0,0|2,0,0]=4 12958 B11R1.53 NC(=O)C1CCCCN1CO d8589ebf19f20f009887ad1249e4fcc8 [0,1,0,1,0,0|2,0,0]=4 12959 B11R1.53 NC(=O)[C@@H]1CCCCN1CF 5fe164b47d9f7aa7b66e95dad5784cf6 [0,1,0,1,0,0|2,0,0]=4 12960 B11R1.53 NC(=O)[C@@H]1CCCCN1CO 3e21909c02010c55d36f2fea44137883 [0,1,0,1,0,0|2,0,0]=4 12961 B11R1.53 NC(=O)[C@H]1CCCCN1CF 834570d6b43a9f9c032693e934ba7746 [0,1,0,1,0,0|2,0,0]=4 12962 B11R1.53 NC(=O)[C@H]1CCCCN1CO f5e862e90c0b5a2f34ad1390f7d5e81d [0,1,0,1,0,0|2,0,0]=4 12963 B11R1.53 O=C(O)C1CCCCN1CF 34780400456104861d4e67d872dd68cc [0,1,0,1,0,0|1,0,0]=3 12964 B11R1.53 O=C(O)C1CCCCN1CO 830196dd603a43de36b162d205ac7bc0 [0,1,0,1,0,0|1,0,0]=3 12965 B11R1.53 O=C(O)C1COCCN1CF 950ffb9861cab7e58ca3ddf2be32e7ed [0,1,0,1,0,0|2,0,0]=4 12966 B11R1.53 O=C(O)C1COCCN1CO e8380119c9c4da5f35942b9bb9f2824e [0,1,0,1,0,0|2,0,0]=4 12967 B11R1.53 O=C(O)C1CSCCN1CF c371482562f36618f566cd1870efa133 [0,1,0,1,0,0|2,0,0]=4 12968 B11R1.53 O=C(O)C1CSCCN1CO b3fbc93091fd314451c40acda6a898f3 [0,1,0,1,0,0|2,0,0]=4 12969 B11R1.53 O=C(O)C1SCCCN1CF c414adcba490cfd86193afcb0ce6934b [0,1,0,1,0,0|2,0,0]=4 12970 B11R1.53 O=C(O)C1SCCCN1CO fc51dd5c7ae2d2029aaf4924dc653467 [0,1,0,1,0,0|2,0,0]=4 12971 B11R1.53 O=C(O)[C@@H]1CCCCN1CF b60cc8661b897ad6dadfa25aed592a67 [0,1,0,1,0,0|1,0,0]=3 12972 B11R1.53 O=C(O)[C@@H]1CCCCN1CO 1797d9998a13c93a688e0dced50d88f8 [0,1,0,1,0,0|1,0,0]=3 12973 B11R1.53 O=C(O)[C@@H]1COCCN1CF f6e7def076d244d589c7cfd941bed02e [0,1,0,1,0,0|2,0,0]=4 12974 B11R1.53 O=C(O)[C@@H]1COCCN1CO c3bf7c6a468e7d5a5453cb31a4bd69ce [0,1,0,1,0,0|2,0,0]=4 12975 B11R1.53 O=C(O)[C@@H]1CSCCN1CF 9f60c905731680dbf0d9257be26502d2 [0,1,0,1,0,0|2,0,0]=4 12976 B11R1.53 O=C(O)[C@@H]1CSCCN1CO 548129fa3818cc4b42c7e63972c15e9b [0,1,0,1,0,0|2,0,0]=4 12977 B11R1.53 O=C(O)[C@H]1CCCCN1CF ed9720e01c313c693f0b3f314ea15507 [0,1,0,1,0,0|1,0,0]=3 12978 B11R1.53 O=C(O)[C@H]1CCCCN1CO ae5de522198bb26e4b7ecb78dfb11746 [0,1,0,1,0,0|1,0,0]=3 12979 B11R1.53 O=C(O)[C@H]1COCCN1CF b0b0b703f831f9fb373123ac7806a148 [0,1,0,1,0,0|2,0,0]=4 12980 B11R1.53 O=C(O)[C@H]1COCCN1CO e198f883a27174862e88d2a495cb47fc [0,1,0,1,0,0|2,0,0]=4 12981 B11R1.53 O=C(O)[C@H]1CSCCN1CF 8c884b22a9c287cef6bc19f8233fae4b [0,1,0,1,0,0|2,0,0]=4 12982 B11R1.53 O=C(O)[C@H]1CSCCN1CO 9984b05b620cf2817a5b202bbefd1fe2 [0,1,0,1,0,0|2,0,0]=4 12983 B11R1.57 C#CC1CCCN1CC(=O)O 1eacfbbc38d8a3a72f121c9180621cee [0,1,0,1,0,0|0,0,2]=4 12984 B11R1.57 C=C(Br)CN1CCCC1CC d5cda209adeddcc3ded08a29fd0d2551 [0,1,0,1,0,0|2,0,0]=4 12985 B11R1.57 C=C(Br)CN1CCC[C@H]1CC 406f25eae1dd183de20d84325bdac17c [0,1,0,1,0,0|2,0,0]=4 12986 B11R1.57 C=C(C)CN1CCCC1CC 06a6655b8dad4b42d2850f31de35628a [0,1,0,1,0,0|2,0,0]=4 12987 B11R1.57 C=C(C)CN1CCC[C@H]1CC db9fbf903ca85b26740da9550eb18293 [0,1,0,1,0,0|2,0,0]=4 12988 B11R1.57 C=C(Cl)CN1CCCC1CC df05a0173d5c9489504de9dc9f5af22f [0,1,0,1,0,0|2,0,0]=4 12989 B11R1.57 C=C(Cl)CN1CCC[C@H]1CC a5ace9514421a6f1b04ffb666d01afde [0,1,0,1,0,0|2,0,0]=4 12990 B11R1.57 C=C(F)CN1CCCC1CC 0750480455720e0baf8a95bd5e067ef0 [0,1,0,1,0,0|2,0,0]=4 12991 B11R1.57 C=C(F)CN1CCC[C@H]1CC 9e007816e32c7e791f25728a58d2bb09 [0,1,0,1,0,0|2,0,0]=4 12992 B11R1.57 CC(=O)N[C@H]1CCC[C@H]1CO a01a5b4ecb6f8524b3e56b92ecdec507 [0,1,0,1,0,0|2,0,0]=4 12993 B11R1.57 CCC1CCCN1CC(=O)N c185fb22daa4500a714a8bda72f3f491 [0,1,0,1,0,0|1,0,0]=3 12994 B11R1.57 CCC1CCCN1CC(=O)O c31ac8bd4b3eeed7b5beb09db1545ade [0,1,0,1,0,0|0,0,0]=2 12995 B11R1.57 CCC1CCCN1CC(C)O b08912f4ae8ba9bd36687d6052586ea9 [0,1,0,1,0,0|1,0,1]=4 12996 B11R1.57 CCC1CCCN1C[C@@H](C)O 37a772954d12651c1774e8163cf8e38d [0,1,0,1,0,0|1,0,1]=4 12997 B11R1.57 CCC1CCCN1C[C@H](C)O bcb4994090664b7c43ab623961dcc860 [0,1,0,1,0,0|1,0,1]=4 12998 B11R1.57 CCC1CCCN1C[N+](=O)[O-] c872582c61e8172a1b2230624054c859 [0,1,0,1,0,0|1,0,1]=4 12999 B11R1.57 CCN1CCCC1CC(=O)O 8035896eb0b4ccf9532ccab0532ab2dc [0,1,0,1,0,0|0,0,0]=2 13000 B11R1.57 CCN1CCC[C@@H]1CC(=O)O 078da1d03ae15c1dbe297412c6b8c765 [0,1,0,1,0,0|0,0,0]=2 13001 B11R1.57 CCN1CCC[C@H]1CC(=O)O e31ed026b01212112bf4b9b75bdf0a78 [0,1,0,1,0,0|0,0,0]=2 13002 B11R1.57 CC[C@@H]1CCCN1CC(=O)N f3ff600658ba91efc1a54dbee891c810 [0,1,0,1,0,0|1,0,0]=3 13003 B11R1.57 CC[C@@H]1CCCN1CC(=O)O fcbfc0397f95ebb582b031ed6c75b8f9 [0,1,0,1,0,0|0,0,0]=2 13004 B11R1.57 CC[C@@H]1CCCN1CC(C)O a86924fcd76aac7c9da8412c26b51e4f [0,1,0,1,0,0|1,0,1]=4 13005 B11R1.57 CC[C@@H]1CCCN1C[C@@H](C)O bfbf5a29cf72a1035f339352ff190511 [0,1,0,1,0,0|1,0,1]=4 13006 B11R1.57 CC[C@@H]1CCCN1C[C@H](C)O f8bdccf003dab62d373d76976e65cece [0,1,0,1,0,0|1,0,1]=4 13007 B11R1.57 CC[C@@H]1CCCN1C[N+](=O)[O-] a7c91890412d487f436d948b560ea6bd [0,1,0,1,0,0|1,0,1]=4 13008 B11R1.57 CC[C@@H]1CCC[C@H]1NC(=O)C 3e0e1d15d776c3dcd038aea6de3e4dfb [0,1,0,1,0,0|1,0,0]=3 13009 B11R1.57 COC1CCCC1NC(=O)C 8da7fbc7ec54ef4f28a2ee6769a7a8cf [0,1,0,1,0,0|2,0,0]=4 13010 B11R1.57 COC1CCCN1CC(=O)N ec0f34113a645bb1d68e93c532637359 [0,1,0,1,0,0|2,0,0]=4 13011 B11R1.57 COC1CCCN1CC(=O)O b53221ba908aeb459ede6db241de034a [0,1,0,1,0,0|1,0,0]=3 13012 B11R1.57 CO[C@@H]1CCC[C@@H]1NC(=O)C 38043d3afc7f72488101da25572db660 [0,1,0,1,0,0|2,0,0]=4 13013 B11R1.57 CO[C@@H]1CCC[C@H]1NC(=O)C 4db371906024f4bac2c8b094a6772760 [0,1,0,1,0,0|2,0,0]=4 13014 B11R1.57 CO[C@H]1CCC[C@@H]1NC(=O)C 4d51e586caacf78fcf1ab76d6db4a3ed [0,1,0,1,0,0|2,0,0]=4 13015 B11R1.57 N#CC1CCCN1CC(=O)O 19371126b94f3ddddec76ff7880eb365 [0,1,0,1,0,0|1,0,1]=4 13016 B11R1.57 N#C[C@@H]1CCCN1CC(=O)O 5ec398051cef0d8a07748a40fa55cc57 [0,1,0,1,0,0|1,0,1]=4 13017 B11R1.57 NC(=O)CN1CCCC1CO 8bc400e4d2b8bec9c360e2be4f57d4f4 [0,1,0,1,0,0|2,0,0]=4 13018 B11R1.57 NC(=O)CN1CCC[C@@H]1CF 0e0a35fccc3ec9eb7e6c49bab904b518 [0,1,0,1,0,0|2,0,0]=4 13019 B11R1.57 NC(=O)CN1CCC[C@@H]1CO 081ff18163f72c60640dfa5ae51999c8 [0,1,0,1,0,0|2,0,0]=4 13020 B11R1.57 NC(=O)CN1CCC[C@H]1CF bc39c1e195de1c490fd22d82d36bb995 [0,1,0,1,0,0|2,0,0]=4 13021 B11R1.57 NC(=O)CN1CCC[C@H]1CO 87382528387b92cd1942995c2c6b42df [0,1,0,1,0,0|2,0,0]=4 13022 B11R1.57 O=C(O)CC1CCCN1CF 3a287768ef1b7da7171a674ab376bf68 [0,1,0,1,0,0|1,0,0]=3 13023 B11R1.57 O=C(O)CC1CCCN1CO 78657bf49c2c1b688e1cc7669dba9593 [0,1,0,1,0,0|1,0,0]=3 13024 B11R1.57 O=C(O)CN1CCCC1CO 18fd863028aad275999bc40f6d591e61 [0,1,0,1,0,0|1,0,0]=3 13025 B11R1.57 O=C(O)CN1CCC[C@@H]1CF 263fe6a95009679abd398b22b26de003 [0,1,0,1,0,0|1,0,0]=3 13026 B11R1.57 O=C(O)CN1CCC[C@@H]1CO c0e96541a04d6ea32d8c88e1d4d3476d [0,1,0,1,0,0|1,0,0]=3 13027 B11R1.57 O=C(O)CN1CCC[C@H]1CF b4a8362b840c2d285203cd7edfef101f [0,1,0,1,0,0|1,0,0]=3 13028 B11R1.57 O=C(O)CN1CCC[C@H]1CO 09199b79d3f006b679a7584910181061 [0,1,0,1,0,0|1,0,0]=3 13029 B11R1.57 O=C(O)C[C@@H]1CCCN1CF 328c792f31f63a96fa9363b323d175d3 [0,1,0,1,0,0|1,0,0]=3 13030 B11R1.57 O=C(O)C[C@@H]1CCCN1CO 0e5cbe2fc4622eadc3c287c533b5b280 [0,1,0,1,0,0|1,0,0]=3 13031 B11R1.57 O=C(O)C[C@H]1CCCN1CF 616b727bab28ac72371577c1d1597e86 [0,1,0,1,0,0|1,0,0]=3 13032 B11R1.57 O=C(O)C[C@H]1CCCN1CO 73db8aa3e045ecef15245ee6b0a1259b [0,1,0,1,0,0|1,0,0]=3 13033 B11R1.78 C#CCCNCC1CC(=O)O1 0e2b1a27ce2a57bf18d05bc5230040ec [0,1,0,1,0,0|0,0,2]=4 13034 B11R1.78 C#CCCOCC1CC(=O)O1 67ac3c125123f331476a0b4f603b6b59 [0,1,0,1,0,0|0,0,2]=4 13035 B11R1.78 C/C=C/COCC1CC(=O)O1 0599fb7d552161c3a78d29e4ddf258be [0,1,0,1,0,0|0,0,2]=4 13036 B11R1.78 C/C=C\COCC1CC(=O)O1 91a9b2b51893bc60ebb1890c428a1485 [0,1,0,1,0,0|0,0,2]=4 13037 B11R1.78 C=C1CC(C1)CNCCCC 95d3225660ded28baea1da3faf541fde [0,1,0,1,0,0|2,0,0]=4 13038 B11R1.78 C=C1CC(C1)COCCCC 57724be6548dd9aa718f4b379977e2cc [0,1,0,1,0,0|2,0,0]=4 13039 B11R1.78 C=CCCNCC1CC(=O)O1 849be1b03e153899bb235e12a23e934e [0,1,0,1,0,0|0,0,2]=4 13040 B11R1.78 C=CCCOCC1CC(=O)O1 3185fc1807543f581f08fe1098402624 [0,1,0,1,0,0|0,0,2]=4 13041 B11R1.78 CC#CCNCC1CC(=O)O1 d28f7937cb4b13b55ecdbdfdb6fdb8cc [0,1,0,1,0,0|0,0,2]=4 13042 B11R1.78 CC#CCOCC1CC(=O)O1 e9d130b1cccf9598674866d1e45f8f98 [0,1,0,1,0,0|0,0,2]=4 13043 B11R1.78 CC=CCNCC1CC(=O)O1 00e6236a9d1f5d960de50de2c21cdd6d [0,1,0,1,0,0|0,0,2]=4 13044 B11R1.78 CC=CCOCC1CC(=O)O1 8bd51d04c392a313766159ef9768eacc [0,1,0,1,0,0|0,0,2]=4 13045 B11R1.78 CCCCCCN1CC(C1)O 203f3a7957281dfcc6a09702bfe3c0ea [0,1,0,1,0,0|1,0,1]=4 13046 B11R1.78 CCCCCNC1CC(C1)O 0e1240534de42c1f30071216e3d3604d [0,1,0,1,0,0|1,0,1]=4 13047 B11R1.78 CCCCCN[C@H]1C[C@@H](C1)O acc47d780c401a87868905dac9ccb1bf [0,1,0,1,0,0|1,0,1]=4 13048 B11R1.78 CCCCCN[C@H]1C[C@H](C1)O b7cb7976c792e6886a2b06603c52de03 [0,1,0,1,0,0|1,0,1]=4 13049 B11R1.78 CCCCCOC1CC(=O)C1 e9d3a81f5a09313bf9c683828478434a [0,1,0,1,0,0|1,0,0]=3 13050 B11R1.78 CCCCNCC1CC(=O)C1 fc4945dadf89f1811d60ac396a4b9aaf [0,1,0,1,0,0|1,0,0]=3 13051 B11R1.78 CCCCNCC1CC(=O)N1 1ebb7417e5a781a949d800fafb7986b1 [0,1,0,1,0,0|1,0,0]=3 13052 B11R1.78 CCCCNCC1CC(=O)O1 e3a9828b8100c66b7349fbff08f11eda [0,1,0,1,0,0|0,0,0]=2 13053 B11R1.78 CCCCNCC1CC(C1)O a5014d25cdd574b5f8ade28770779c87 [0,1,0,1,0,0|1,0,1]=4 13054 B11R1.78 CCCCNC[C@H]1C[C@@H](C1)O 35e74f8cb664fb86a4ad6e1c7e8416d2 [0,1,0,1,0,0|1,0,1]=4 13055 B11R1.78 CCCCNC[C@H]1C[C@H](C1)O c2931436a7f713c4f8262fbbfe6ef6c1 [0,1,0,1,0,0|1,0,1]=4 13056 B11R1.78 CCCCOCC1CC(=O)C1 b745974591b679b41c4f7048ed0e0090 [0,1,0,1,0,0|1,0,0]=3 13057 B11R1.78 CCCCOCC1CC(=O)N1 d097b400fa6b83e91de2192b2f446f6a [0,1,0,1,0,0|1,0,0]=3 13058 B11R1.78 CCCCOCC1CC(=O)O1 975087ca287ad7024709ba55827da77c [0,1,0,1,0,0|0,0,0]=2 13059 B11R1.78 CCCCOC[C@@H]1CC(=O)N1 6e3c0e34251fe6e3cb370e4e431e6b1c [0,1,0,1,0,0|1,0,0]=3 13060 B11R1.78 CCCCOC[C@H]1CC(=O)N1 a09dbc9d222d76053c19cbc68f6e1d6b [0,1,0,1,0,0|1,0,0]=3 13061 B11R1.78 CCOCCOC1CC(=O)C1 af4b1bbe7363542a02e84d329eb0a42d [0,1,0,1,0,0|2,0,0]=4 13062 B11R1.78 CCOCOCC1CC(=O)N1 28972336bfcb7f6d49ad3cc8ab80df64 [0,1,0,1,0,0|2,0,0]=4 13063 B11R1.78 CCOCOC[C@@H]1CC(=O)N1 172f43e144a15d74eb3cf24411fa21c0 [0,1,0,1,0,0|2,0,0]=4 13064 B11R1.78 CCOCOC[C@H]1CC(=O)N1 013eb6fd50ac1bdeaa28eb4a3681ad2e [0,1,0,1,0,0|2,0,0]=4 13065 B11R1.78 CCSCCOC1CC(=O)C1 93db09f7ccfdc84945952e27f28277a8 [0,1,0,1,0,0|2,0,0]=4 13066 B11R1.78 COCCCOC1CC(=O)C1 2ec4403746931a4fc4f84802e24fb28e [0,1,0,1,0,0|2,0,0]=4 13067 B11R1.78 COCCNCC1CC(=O)C1 34c1bb75a24cadffc16f7bb506327a43 [0,1,0,1,0,0|2,0,0]=4 13068 B11R1.78 COCCNCC1CC(=O)N1 f68b0a175665aff3a77ec91b5471a2ea [0,1,0,1,0,0|2,0,0]=4 13069 B11R1.78 COCCNCC1CC(=O)O1 850a8d41df59d90b8efa604577d5f017 [0,1,0,1,0,0|1,0,0]=3 13070 B11R1.78 COCCOCC1CC(=O)C1 b5b634809c1a4f9d913fb26643f0c856 [0,1,0,1,0,0|2,0,0]=4 13071 B11R1.78 COCCOCC1CC(=O)N1 b0d6ce417707b8df8e7792b899f9e3f8 [0,1,0,1,0,0|2,0,0]=4 13072 B11R1.78 COCCOCC1CC(=O)O1 a4d63697c9e3da20b37fda633d700cd7 [0,1,0,1,0,0|1,0,0]=3 13073 B11R1.78 COCCOC[C@@H]1CC(=O)N1 7272a69d1351ffbb3650b094de7501b7 [0,1,0,1,0,0|2,0,0]=4 13074 B11R1.78 COCCOC[C@H]1CC(=O)N1 d11d8bdf17c2a1ae53ae7c7dccbdc21f [0,1,0,1,0,0|2,0,0]=4 13075 B11R1.78 CSCCCNC1CC(=O)C1 4e18e309ce1283043fb3236545739a9a [0,1,0,1,0,0|2,0,0]=4 13076 B11R1.78 CSCCCOC1CC(=O)C1 392a8966c3fc468c1e3ecc8615be273d [0,1,0,1,0,0|2,0,0]=4 13077 B11R1.78 CSCCNCC1CC(=O)C1 b72d263138733b643be53f8193a84115 [0,1,0,1,0,0|2,0,0]=4 13078 B11R1.78 CSCCNCC1CC(=O)N1 45015d5d4523122d7085593e76b33192 [0,1,0,1,0,0|2,0,0]=4 13079 B11R1.78 CSCCNCC1CC(=O)O1 ff966cde4c83ee54bd1d42ecd81980c1 [0,1,0,1,0,0|1,0,0]=3 13080 B11R1.78 CSCCOCC1CC(=O)C1 5c74cd3e0384157d9bc7d21a2daf3589 [0,1,0,1,0,0|2,0,0]=4 13081 B11R1.78 CSCCOCC1CC(=O)N1 59d2036913bfa5bdf05b24953396a2f3 [0,1,0,1,0,0|2,0,0]=4 13082 B11R1.78 CSCCOCC1CC(=O)O1 82b35f68789d943fe464233714e67753 [0,1,0,1,0,0|1,0,0]=3 13083 B11R1.78 CSCCOC[C@@H]1CC(=O)N1 65743e1120aaeed872fc8da4a473b781 [0,1,0,1,0,0|2,0,0]=4 13084 B11R1.78 CSCCOC[C@H]1CC(=O)N1 60f3bd23d65f00e9878bc5f32f82c22c [0,1,0,1,0,0|2,0,0]=4 13085 B11R1.78 N#CCCNCC1CC(=O)O1 0f010b27109c771657131173f967dcaf [0,1,0,1,0,0|1,0,1]=4 13086 B11R1.78 N#CCCOCC1CC(=O)O1 994ac8038be8f542a5ff6481648074e7 [0,1,0,1,0,0|1,0,1]=4 13087 B11R1.78 NOCCNCC1CC(=O)O1 847025f64ae23b84bf47759a5b3c2fd3 [0,1,0,1,0,0|2,0,0]=4 13088 B11R1.78 O=C1CC(C1)CNCCCCl 3c7fb6e91864db27586d1d611903f706 [0,1,0,1,0,0|2,0,0]=4 13089 B11R1.78 O=C1CC(C1)CNCCCO 01eb29e405cb1c32515fb0526ed255da [0,1,0,1,0,0|2,0,0]=4 13090 B11R1.78 O=C1CC(C1)COCCCF 61598a30d8fa6ff80050f33478a2ee34 [0,1,0,1,0,0|2,0,0]=4 13091 B11R1.78 O=C1CC(C1)COCCCS dd6cc90d4bc4c35e4bcd4152f15ab924 [0,1,0,1,0,0|2,0,0]=4 13092 B11R1.78 O=C1CC(C1)OCCCCF 5cc151e86f032781d0be03cd809b21d8 [0,1,0,1,0,0|2,0,0]=4 13093 B11R1.78 O=C1CC(N1)CNCCCCl 685f35a81d377bc58ed3816cf526dd95 [0,1,0,1,0,0|2,0,0]=4 13094 B11R1.78 O=C1CC(N1)CNCCCO e2b02fe8ac914e19b839adcc4ca0905b [0,1,0,1,0,0|2,0,0]=4 13095 B11R1.78 O=C1CC(N1)COCCCF d6c11694d537a5be50c887c1496cca95 [0,1,0,1,0,0|2,0,0]=4 13096 B11R1.78 O=C1CC(N1)COCCCS d4b763dd2f953a25837c4abad30b5fa2 [0,1,0,1,0,0|2,0,0]=4 13097 B11R1.78 O=C1CC(O1)CNCCCCl b4d0339b38568b213ddddb64e201bda2 [0,1,0,1,0,0|1,0,0]=3 13098 B11R1.78 O=C1CC(O1)CNCCCO 0bba0dedb8654a85af1233bcfab7f6f9 [0,1,0,1,0,0|1,0,0]=3 13099 B11R1.78 O=C1CC(O1)COCCCF e49dbaca1d219fcc1d39e0d2c9d89b78 [0,1,0,1,0,0|1,0,0]=3 13100 B11R1.78 O=C1CC(O1)COCCCS 9dda27cb8e14d45b1dba7e7fad2d6e18 [0,1,0,1,0,0|1,0,0]=3 13101 B11R1.78 O=C1C[C@@H](N1)COCCCF d708ea9c7194222def4f06b80800373c [0,1,0,1,0,0|2,0,0]=4 13102 B11R1.78 O=C1C[C@@H](N1)COCCCS 77b9326c423c2d751cea481f49f41d1c [0,1,0,1,0,0|2,0,0]=4 13103 B11R1.78 O=C1C[C@H](N1)COCCCF 82de9c8e14fbe6e9326791f73dbbf468 [0,1,0,1,0,0|2,0,0]=4 13104 B11R1.78 O=C1C[C@H](N1)COCCCS 121043a864b91597c953493b71da4101 [0,1,0,1,0,0|2,0,0]=4 13105 B11R1.78 O=CCCOCC1CC(=O)O1 f4104505826f528b66276936755bbaf0 [0,1,0,1,0,0|1,0,1]=4 13106 B11R1.86 C=C(Br)CN1CCCCC1C 687d55264b18f194b09084c7a5cbdc7c [0,1,0,1,0,0|2,0,0]=4 13107 B11R1.86 C=C(Br)CN1CCCC[C@@H]1C d2b4dfe7b3fd8d291097f069bb1de89a [0,1,0,1,0,0|2,0,0]=4 13108 B11R1.86 C=C(Br)CN1CCCC[C@H]1C 83d1384da9a57b18adf224048db8dd5b [0,1,0,1,0,0|2,0,0]=4 13109 B11R1.86 C=C(C)CN1CCCCC1C 2b9a4d60846c7533824d8512764a8aa8 [0,1,0,1,0,0|2,0,0]=4 13110 B11R1.86 C=C(C)CN1CCCC[C@@H]1C 9960852f7ad3179dd6b5a2e5c37abacc [0,1,0,1,0,0|2,0,0]=4 13111 B11R1.86 C=C(C)CN1CCCC[C@H]1C b55597b529b076ffcb7c65844af6822a [0,1,0,1,0,0|2,0,0]=4 13112 B11R1.86 C=C(Cl)CN1CCCCC1C d8c576706e3df9c34a83e0b7c6336ed7 [0,1,0,1,0,0|2,0,0]=4 13113 B11R1.86 C=C(Cl)CN1CCCC[C@@H]1C 6d0b74b87e846c07ae51ebd855253518 [0,1,0,1,0,0|2,0,0]=4 13114 B11R1.86 C=C(Cl)CN1CCCC[C@H]1C 2e53f05521aabd8ae6835bfdeadddd9d [0,1,0,1,0,0|2,0,0]=4 13115 B11R1.86 C=C(F)CN1CCCCC1C cdc0971e8566a6b1e177b6cf34456c3e [0,1,0,1,0,0|2,0,0]=4 13116 B11R1.86 C=C(F)CN1CCCC[C@@H]1C 4d1512d800b31646f60fd7970e28bce0 [0,1,0,1,0,0|2,0,0]=4 13117 B11R1.86 C=C(F)CN1CCCC[C@H]1C 089145f8a665584e80db933b15455359 [0,1,0,1,0,0|2,0,0]=4 13118 B11R1.86 CC(=O)NC1CCCCC1C 670701ef37830c881dfd98f284b6eaef [0,1,0,1,0,0|1,0,0]=3 13119 B11R1.86 CC(=O)NC1CCCCC1O bc79a4a57827afa3a4fa640017043055 [0,1,0,1,0,0|2,0,0]=4 13120 B11R1.86 CC(=O)NC1CCOCC1C edce8fbaf211b854c7f2ed742fd852ac [0,1,0,1,0,0|2,0,0]=4 13121 B11R1.86 CC(=O)N[C@@H]1CCCC[C@@H]1C 2bac565059009b92e61af1d1f0ba1ffd [0,1,0,1,0,0|1,0,0]=3 13122 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1C 479fb6aae9438e2010ab8b66de7f20cf [0,1,0,1,0,0|1,0,0]=3 13123 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1O db67c1bdd3ca05ff8229e30fa13e50d9 [0,1,0,1,0,0|2,0,0]=4 13124 B11R1.86 CC(=O)N[C@@H]1CCOC[C@@H]1C 248ac71d47aadfd8f2eeffdc90582804 [0,1,0,1,0,0|2,0,0]=4 13125 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1C 18a83c7bce0c6708eeacbe02f36aa7ad [0,1,0,1,0,0|1,0,0]=3 13126 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1O cd06a0c7fdec32c28b7b1670c804df5a [0,1,0,1,0,0|2,0,0]=4 13127 B11R1.86 CC(=O)N[C@H]1CCCC[C@H]1C c4b6727756a1c9df9d0de80b9b0690de [0,1,0,1,0,0|1,0,0]=3 13128 B11R1.86 CC(=O)N[C@H]1CCCC[C@H]1O 3d7a6b45c93e0f7c67e70ae3e747c43c [0,1,0,1,0,0|2,0,0]=4 13129 B11R1.86 CC(=O)N[C@H]1CCOC[C@H]1C 32b6893bb7f4f962fa7d51cc42867b19 [0,1,0,1,0,0|2,0,0]=4 13130 B11R1.86 CC(O)CN1CCCCC1C 9d1a770d8c6ffc9de988cc511348705e [0,1,0,1,0,0|1,0,1]=4 13131 B11R1.86 CC(O)CN1CCCC[C@@H]1C 9c8cfb57d89cf66010f3efcebc7fe58c [0,1,0,1,0,0|1,0,1]=4 13132 B11R1.86 CC(O)CN1CCCC[C@H]1C 02a958dfbac6e1d310ffb64db6fb82bf [0,1,0,1,0,0|1,0,1]=4 13133 B11R1.86 CC1CCCCN1CC(=O)N 95d8db6234d5d946df75a0454d896ca4 [0,1,0,1,0,0|1,0,0]=3 13134 B11R1.86 CC1CCCCN1CC(=O)O ae84160ac6931f8f66d20194a2549691 [0,1,0,1,0,0|0,0,0]=2 13135 B11R1.86 CC1CCCCN1C[C@@H](C)O 1d631de616b3f66a4c20cc8d16f043a6 [0,1,0,1,0,0|1,0,1]=4 13136 B11R1.86 CC1CCCCN1C[C@H](C)O fdcf1f4aa6cf52991110da7e3f59d550 [0,1,0,1,0,0|1,0,1]=4 13137 B11R1.86 CC1CCCCN1C[N+](=O)[O-] 379acaa8ddd12102673a6e1aca831e10 [0,1,0,1,0,0|1,0,1]=4 13138 B11R1.86 CC1COCCN1CC(=O)N b3fa16e4d8828e2f11f87430b2189155 [0,1,0,1,0,0|2,0,0]=4 13139 B11R1.86 CC1COCCN1CC(=O)O 04398f858992d0a5d48457bf72a5c847 [0,1,0,1,0,0|1,0,0]=3 13140 B11R1.86 C[C@@H](O)CN1CCCC[C@@H]1C 6533e1fd1ce09c7b87ce64552cb60745 [0,1,0,1,0,0|1,0,1]=4 13141 B11R1.86 C[C@@H]1CCCCN1CC(=O)N 224870232655bdf8beec7ae59fbf7936 [0,1,0,1,0,0|1,0,0]=3 13142 B11R1.86 C[C@@H]1CCCCN1CC(=O)O e977167422de3a18af9f7c21c4b88fdb [0,1,0,1,0,0|0,0,0]=2 13143 B11R1.86 C[C@@H]1CCCCN1C[C@@H](C)O b1f6ca06f1750494bca4672f61144d55 [0,1,0,1,0,0|1,0,1]=4 13144 B11R1.86 C[C@@H]1CCCCN1C[N+](=O)[O-] 56ea5f0d67a7ec977941705329978094 [0,1,0,1,0,0|1,0,1]=4 13145 B11R1.86 C[C@@H]1COCCN1CC(=O)N c3543748f7528468d47cd1ec053fc63c [0,1,0,1,0,0|2,0,0]=4 13146 B11R1.86 C[C@@H]1COCCN1CC(=O)O f9d4dbd75edeb208df3b04501111d275 [0,1,0,1,0,0|1,0,0]=3 13147 B11R1.86 C[C@H](O)CN1CCCC[C@@H]1C c9267625a00653d10cc5b362431a7302 [0,1,0,1,0,0|1,0,1]=4 13148 B11R1.86 C[C@H](O)CN1CCCC[C@H]1C 52f856f74c0a46ea90e1bd35af995aec [0,1,0,1,0,0|1,0,1]=4 13149 B11R1.86 C[C@H]1CCCCN1CC(=O)N eeecbfc2e69926c3df9a2ea739e8e528 [0,1,0,1,0,0|1,0,0]=3 13150 B11R1.86 C[C@H]1CCCCN1CC(=O)O b00078cb16b191d42880e0e45b0eac26 [0,1,0,1,0,0|0,0,0]=2 13151 B11R1.86 C[C@H]1CCCCN1C[N+](=O)[O-] cb4b8d942887b73fd6b95b9adebfe197 [0,1,0,1,0,0|1,0,1]=4 13152 B11R1.86 C[C@H]1COCCN1CC(=O)N 6bf9971be860e1bf08bf87f8a3001386 [0,1,0,1,0,0|2,0,0]=4 13153 B11R1.86 C[C@H]1COCCN1CC(=O)O f65b20d8f871f5dda28ee23351f4bc9f [0,1,0,1,0,0|1,0,0]=3 13154 B11R1.91 C=C(Br)CNC1CCCCC1 20c58ced94c95fd156376955cd3fd9fb [0,1,0,1,0,0|2,0,0]=4 13155 B11R1.91 C=C(Br)COC1CCCCC1 4834c4be1a7a994be3cd4c57d39da00a [0,1,0,1,0,0|2,0,0]=4 13156 B11R1.91 C=C(C)CNC1CCCCC1 6e13273d2f70189265915afc32701c47 [0,1,0,1,0,0|2,0,0]=4 13157 B11R1.91 C=C(C)COC1CCCCC1 50c8ef2211e3be911595ca55ab0d0453 [0,1,0,1,0,0|2,0,0]=4 13158 B11R1.91 C=C(Cl)COC1CCCCC1 85797ac0f62fa9a575b998f3a2cafd13 [0,1,0,1,0,0|2,0,0]=4 13159 B11R1.91 C=C(F)COC1CCCCC1 be5d809b154714d00f34c1201d024aea [0,1,0,1,0,0|2,0,0]=4 13160 B11R1.91 C=C(I)COC1CCCCC1 79ca0476ce049479bd4e23516532418e [0,1,0,1,0,0|2,0,0]=4 13161 B11R1.91 CC(=O)CCN1CCCOC1 8ee6fb3dcc39cce30e50adee130f6e9a [0,1,0,1,0,0|2,0,0]=4 13162 B11R1.91 CC(=O)CCN1CCCSC1 a87dc535e12f37824484044a718b50b8 [0,1,0,1,0,0|2,0,0]=4 13163 B11R1.91 CC(=O)CCN1CCOCC1 a5955e1ec3a3417a782b7f2bb56deb27 [0,1,0,1,0,0|2,0,0]=4 13164 B11R1.91 CC(=O)CCN1CCSCC1 9448e6734717c7e3d874439fe93fd765 [0,1,0,1,0,0|2,0,0]=4 13165 B11R1.91 CC(=O)CNC1CCCCC1 41f3bbc8aa0b0ee4d56e1bb353997307 [0,1,0,1,0,0|1,0,0]=3 13166 B11R1.91 CC(=O)CNC1CCCCO1 640e2d5dd77a8849aa1935cd7a9aaaec [0,1,0,1,0,0|2,0,0]=4 13167 B11R1.91 CC(=O)CNC1CCOCC1 10b3387bc43639e331178a4c69daffef [0,1,0,1,0,0|2,0,0]=4 13168 B11R1.91 CC(=O)CNC1CCSCC1 75f6cddad8f4560df686e2d799a50eba [0,1,0,1,0,0|2,0,0]=4 13169 B11R1.91 CC(=O)COC1CCCCC1 763ec2b1245af52120f0b3066af09e15 [0,1,0,1,0,0|1,0,0]=3 13170 B11R1.91 CC(=O)COC1CCCCO1 3d4068b55a8ce6af68b0e3cc3b7d2997 [0,1,0,1,0,0|2,0,0]=4 13171 B11R1.91 CC(=O)COC1CCOCC1 78d69c5167fb6b3f9b2e72f96bf7e4f6 [0,1,0,1,0,0|2,0,0]=4 13172 B11R1.91 CC(=O)COC1CCSCC1 d4fa1c6f9f23997dc550dd796644a359 [0,1,0,1,0,0|2,0,0]=4 13173 B11R1.91 CC(=O)NCC1CCCCC1 13ef8179cc48c409da15977c5ecf76d3 [0,1,0,1,0,0|1,0,0]=3 13174 B11R1.91 CC(=O)NCC1CCCCO1 d41d6bb17f3dbf038f44a0f16313e24b [0,1,0,1,0,0|2,0,0]=4 13175 B11R1.91 CC(=O)NCC1CCCOC1 c162092dc9bd16e0593256fa1f9ecc04 [0,1,0,1,0,0|2,0,0]=4 13176 B11R1.91 CC(=O)NCC1CCOCC1 a250d52d0d92eb3951169ce5ef31c600 [0,1,0,1,0,0|2,0,0]=4 13177 B11R1.91 CC(=O)NCC1CCSCC1 1a220d480c47a704f778fa097ef9e650 [0,1,0,1,0,0|2,0,0]=4 13178 B11R1.91 CC(=O)NC[C@@H]1CCCOC1 7aa7e3d46556da04f95282ed5cd2d18d [0,1,0,1,0,0|2,0,0]=4 13179 B11R1.91 CC(=O)NC[C@H]1CCCOC1 084cc7a58a2d167832e33c785a7b8e6f [0,1,0,1,0,0|2,0,0]=4 13180 B11R1.91 CC(O)CNC1CCCCC1 cd24f4a1c32e632345ce0698292b8646 [0,1,0,1,0,0|1,0,1]=4 13181 B11R1.91 C[C@@H](O)CNC1CCCCC1 91e9a88b20b24b38b0d78b488a0fe9c0 [0,1,0,1,0,0|1,0,1]=4 13182 B11R1.91 C[C@H](O)CNC1CCCCC1 2b10c0e5471b4cfd1de8bc851a4f8b1e [0,1,0,1,0,0|1,0,1]=4 13183 B11R1.91 NC(=O)CCN1CCCOC1 b5e9ba3369afaa445fac72ab4e547201 [0,1,0,1,0,0|2,0,0]=4 13184 B11R1.91 NC(=O)CCN1CCCSC1 9635588f71cb804ddb5f72990b327992 [0,1,0,1,0,0|2,0,0]=4 13185 B11R1.91 NC(=O)CCN1CCOCC1 47453e6e78fbe77b82053d48d9b294e4 [0,1,0,1,0,0|2,0,0]=4 13186 B11R1.91 NC(=O)CCN1CCSCC1 94b055c1e38e983da40e2579fcc685c1 [0,1,0,1,0,0|2,0,0]=4 13187 B11R1.91 NC(=O)CNC1CCCCC1 49e5840c39ba3b16bc013cd4a010e6e2 [0,1,0,1,0,0|1,0,0]=3 13188 B11R1.91 NC(=O)CNC1CCCCO1 77547d4c4aa5b337cc9f58bc45131765 [0,1,0,1,0,0|2,0,0]=4 13189 B11R1.91 NC(=O)CNC1CCCOC1 1007f91d868311dbb54465e7a6fcf67e [0,1,0,1,0,0|2,0,0]=4 13190 B11R1.91 NC(=O)CNC1CCOCC1 757770f7ab41f826c5d7d3c04b8e6998 [0,1,0,1,0,0|2,0,0]=4 13191 B11R1.91 NC(=O)CNC1CCSCC1 684cdd657024777f9fde6a50615fc77c [0,1,0,1,0,0|2,0,0]=4 13192 B11R1.91 NC(=O)CN[C@@H]1CCCOC1 2b3531d9c6e9cb00b997e4b5b96e0a39 [0,1,0,1,0,0|2,0,0]=4 13193 B11R1.91 NC(=O)CN[C@H]1CCCOC1 06c11d9089c484f923d9961e6c1bde57 [0,1,0,1,0,0|2,0,0]=4 13194 B11R1.91 NC(=O)COC1CCCCC1 0342972a414d125c2c7187722ddbb7ed [0,1,0,1,0,0|1,0,0]=3 13195 B11R1.91 NC(=O)COC1CCCCO1 b743e037b96fdfe795d73b2a6b3d677d [0,1,0,1,0,0|2,0,0]=4 13196 B11R1.91 NC(=O)COC1CCCOC1 3ce477607b16c3f723d795213b697118 [0,1,0,1,0,0|2,0,0]=4 13197 B11R1.91 NC(=O)COC1CCCSC1 114cee36eff1bbe73b442d1dcfd9e4d4 [0,1,0,1,0,0|2,0,0]=4 13198 B11R1.91 NC(=O)COC1CCOCC1 f5152c979e641dc0b61c7c82b273a315 [0,1,0,1,0,0|2,0,0]=4 13199 B11R1.91 NC(=O)COC1CCSCC1 171546b24ae9b4c03a058eedb55be2f5 [0,1,0,1,0,0|2,0,0]=4 13200 B11R1.91 NC(=O)CO[C@@H]1CCCOC1 f62eb70c2ae44d9967537ee070112b1b [0,1,0,1,0,0|2,0,0]=4 13201 B11R1.91 NC(=O)CO[C@H]1CCCOC1 c717b8751a6e62c85fba2d8d08c918e4 [0,1,0,1,0,0|2,0,0]=4 13202 B11R1.91 NC(=S)COC1CCCCC1 a9342e76e82f7be88546e871ebb9b1ee [0,1,0,1,0,0|1,1,0]=4 13203 B11R1.91 O=C(O)CCN1CC=CCC1 8d78b3247e0692baa075ed610514765c [0,1,0,1,0,0|0,0,2]=4 13204 B11R1.91 O=C(O)CCN1CCCOC1 2c17ea5f32ddb1647043c100ffb608e3 [0,1,0,1,0,0|1,0,0]=3 13205 B11R1.91 O=C(O)CCN1CCCSC1 c769cfe6c5544540390fe81e6cea18cf [0,1,0,1,0,0|1,0,0]=3 13206 B11R1.91 O=C(O)CCN1CCOCC1 72ea8d5d0c05c51cc00423634b0f0699 [0,1,0,1,0,0|1,0,0]=3 13207 B11R1.91 O=C(O)CCN1CCSCC1 6445c5c6f6b70584cd912a2ab36153ad [0,1,0,1,0,0|1,0,0]=3 13208 B11R1.91 O=C(O)CNC1C=CCCC1 147d1e75bf7adad4c08e083c7ce404a0 [0,1,0,1,0,0|0,0,2]=4 13209 B11R1.91 O=C(O)CNC1CCCCC1 6170fa39da854f2ae539e4442d25e354 [0,1,0,1,0,0|0,0,0]=2 13210 B11R1.91 O=C(O)CNC1CCCCO1 0601744de8bfaeac3efa0eaae34b0e2a [0,1,0,1,0,0|1,0,0]=3 13211 B11R1.91 O=C(O)CNC1CCCOC1 de8c0d47483c3f100833bbc04551e425 [0,1,0,1,0,0|1,0,0]=3 13212 B11R1.91 O=C(O)CNC1CCOCC1 de1a366c5915b7b602ff6be02564e839 [0,1,0,1,0,0|1,0,0]=3 13213 B11R1.91 O=C(O)CNC1CCSCC1 a1d4dcc34b9d978a9aada4af63ce44d5 [0,1,0,1,0,0|1,0,0]=3 13214 B11R1.91 O=C(O)CNC1CSCSC1 c0d638477a79ae205cb9ffb12198f2ee [0,1,0,1,0,0|2,0,0]=4 13215 B11R1.91 O=C(O)CN[C@@H]1CCCOC1 a4936671de955a660a8b95906cfcf3fe [0,1,0,1,0,0|1,0,0]=3 13216 B11R1.91 O=C(O)CN[C@H]1CCCOC1 c38b7aafbfb095786d36e5a2e6d14252 [0,1,0,1,0,0|1,0,0]=3 13217 B11R1.91 O=C(O)COC1C=CCCC1 c3f7e6b0d0e179c5212602af0da237e3 [0,1,0,1,0,0|0,0,2]=4 13218 B11R1.91 O=C(O)COC1CC=CCC1 ca0b2885f3d3dd592d4501c37019d1e7 [0,1,0,1,0,0|0,0,2]=4 13219 B11R1.91 O=C(O)COC1CCCCC1 c56b55e54d9cc9b734edcd0ed0978f43 [0,1,0,1,0,0|0,0,0]=2 13220 B11R1.91 O=C(O)COC1CCCCO1 927e1af2807bd3dd35f5b1bd3c90f17b [0,1,0,1,0,0|1,0,0]=3 13221 B11R1.91 O=C(O)COC1CCCOC1 f10d417684ae0b4f2fe8858293490ec1 [0,1,0,1,0,0|1,0,0]=3 13222 B11R1.91 O=C(O)COC1CCCSC1 7272dae6ecc3c9c2a4ea28deac73fb75 [0,1,0,1,0,0|1,0,0]=3 13223 B11R1.91 O=C(O)COC1CCOCC1 d35c7985939bbbbf7d929dd6cf8e4d91 [0,1,0,1,0,0|1,0,0]=3 13224 B11R1.91 O=C(O)COC1CCSCC1 b2cb64231e512bfba5c6f77887ea953d [0,1,0,1,0,0|1,0,0]=3 13225 B11R1.91 O=C(O)CO[C@@H]1CCCOC1 0436b7ec633e33f771801ad9b698da19 [0,1,0,1,0,0|1,0,0]=3 13226 B11R1.91 O=C(O)CO[C@H]1CCCOC1 654ae1e30203a17364d5c0aea2fe9d02 [0,1,0,1,0,0|1,0,0]=3 13227 B11R1.91 O=S(O)COC1CCCCC1 ce98fa7fea4abd576b51cca8386c298a [0,1,0,1,0,0|1,0,0]=3 13228 B11R1.91 O=S(O)COC1CCCCO1 549820d26c23b99b83b069a8adf3da02 [0,1,0,1,0,0|2,0,0]=4 13229 B11R1.91 O=S(O)COC1CCOCC1 892c83c01b6eb95c32c547205fe7dac8 [0,1,0,1,0,0|2,0,0]=4 13230 B11R1.91 O=S(O)COC1CCSCC1 7a7ac83b887c8a8c22db976a1d24067d [0,1,0,1,0,0|2,0,0]=4 13231 B11R1.91 O=[N+]([O-])COC1CCCCC1 adeab912c75b92900c0bf5ab8a6cf0fc [0,1,0,1,0,0|1,0,1]=4 13232 B11R1.102 C=C(C)CCCNC1CC1C 66339d48c38a610658fe451fa9f325cb [0,1,0,1,0,0|2,0,0]=4 13233 B11R1.102 C=C(C)CCOCC1CC1C 05fffd6f4c9a4225c1f451dd9ae68529 [0,1,0,1,0,0|2,0,0]=4 13234 B11R1.102 C=C(C)CCOC[C@@H]1C[C@@H]1C a52e821a34f4ab8e46c367af671a157b [0,1,0,1,0,0|2,0,0]=4 13235 B11R1.102 C=C(C)CCOC[C@@H]1C[C@H]1C 856e3ae6b705c462e07781af7944c8b1 [0,1,0,1,0,0|2,0,0]=4 13236 B11R1.102 C=C(C)CCOC[C@H]1C[C@@H]1C 4debefd18f425d02c539ab330f7cb2a5 [0,1,0,1,0,0|2,0,0]=4 13237 B11R1.102 C=C1CC1COCCC(=O)O 797320bf812ba56d825763d33e9df874 [0,1,0,1,0,0|0,0,2]=4 13238 B11R1.102 CC(=O)CCCNC1CC1C 0670fe2bddcd2938a45ee49893d3d27a [0,1,0,1,0,0|1,0,0]=3 13239 B11R1.102 CC(=O)CCCN[C@@H]1C[C@H]1F 0c2cb86d46c5230a2cf50114574a054e [0,1,0,1,0,0|2,0,0]=4 13240 B11R1.102 CC(=O)CCCN[C@H]1C[C@@H]1F 1a7c0121e52cb8b68b9e1a0a8ebc1ea2 [0,1,0,1,0,0|2,0,0]=4 13241 B11R1.102 CC(=O)CCCN[C@H]1C[C@H]1F bd0644c58e9264b9b07f10fbdb62053b [0,1,0,1,0,0|2,0,0]=4 13242 B11R1.102 CC(=O)CCOCC1CC1C f9350af0e4e840a06002445ec930aba7 [0,1,0,1,0,0|1,0,0]=3 13243 B11R1.102 CC(=O)CCOC[C@@H]1C[C@@H]1C 77d77b31202dc6950f336ea588c9adf8 [0,1,0,1,0,0|1,0,0]=3 13244 B11R1.102 CC(=O)CCOC[C@@H]1C[C@@H]1F c0633efa748574ad7e7ef11b606f7614 [0,1,0,1,0,0|2,0,0]=4 13245 B11R1.102 CC(=O)CCOC[C@@H]1C[C@H]1C 70b2d7758f1bf3bb001c97fc6fa8b800 [0,1,0,1,0,0|1,0,0]=3 13246 B11R1.102 CC(=O)CCOC[C@@H]1C[C@H]1F d0b4ef49843082e37720cd77fbc37149 [0,1,0,1,0,0|2,0,0]=4 13247 B11R1.102 CC(=O)CCOC[C@H]1C[C@@H]1C d9cdfc5465f50206efe8548e9d726b9a [0,1,0,1,0,0|1,0,0]=3 13248 B11R1.102 CC(=O)CCOC[C@H]1C[C@@H]1F 32dc54c408613ca9434966d7f06fd535 [0,1,0,1,0,0|2,0,0]=4 13249 B11R1.102 CC(=O)CCOC[C@H]1C[C@H]1F c0213f033bb2ad6354ddbbf424fe7271 [0,1,0,1,0,0|2,0,0]=4 13250 B11R1.102 CC(=O)NCCNC1CC1C c66d68f743c96dc4279fccbe983564d1 [0,1,0,1,0,0|2,0,0]=4 13251 B11R1.102 CC(=O)OCCNC1CC1C d72c9c4bdd7f8603d1aee8173675d35c [0,1,0,1,0,0|2,0,0]=4 13252 B11R1.102 CC(=O)OCOCC1CC1C 633e36b079d8ceb075293921a12ba113 [0,1,0,1,0,0|2,0,0]=4 13253 B11R1.102 CC(=O)OCOC[C@@H]1C[C@@H]1C 32bc356e19843cee45a65ca195daf236 [0,1,0,1,0,0|2,0,0]=4 13254 B11R1.102 CC(=O)OCOC[C@@H]1C[C@H]1C d544375dd48561fa63e8f439c5f3a153 [0,1,0,1,0,0|2,0,0]=4 13255 B11R1.102 CC(=O)OCOC[C@H]1C[C@@H]1C 05737e157b2ffe2c4a8393ffe87d216f [0,1,0,1,0,0|2,0,0]=4 13256 B11R1.102 CC(=O)SCCNC1CC1C bb3b9e724e8c8cc9eeb1964bb6751f11 [0,1,0,1,0,0|2,0,0]=4 13257 B11R1.102 CC(O)CCCNC1CC1C da46f5a577c985a8aab6993bf8d404d7 [0,1,0,1,0,0|1,0,1]=4 13258 B11R1.102 CC1CC1COCCC(=O)N 3d773e19e986a55104ea7cc08aa0ffb8 [0,1,0,1,0,0|1,0,0]=3 13259 B11R1.102 CC1CC1COCCC(=O)O 773712793f8aef5614fac0ce57ff0614 [0,1,0,1,0,0|0,0,0]=2 13260 B11R1.102 CC1CC1COCCS(=O)C 40a8f8c94a721d5aef7c38d99277fcdc [0,1,0,1,0,0|2,0,0]=4 13261 B11R1.102 CC1CC1COCSC(=O)N 1ac8dbb6e690d2dd818a1ec96e3e7ee9 [0,1,0,1,0,0|2,0,0]=4 13262 B11R1.102 CC1CC1NC/C=C/C(=O)O 8074935ca92cab8b0a61a569ff537f39 [0,1,0,1,0,0|0,0,2]=4 13263 B11R1.102 CC1CC1NCC=CC(=O)O 51f0aa27a68549ff6dc569b531f3943f [0,1,0,1,0,0|0,0,2]=4 13264 B11R1.102 CC1CC1NCCCC(=O)N e14d220fd66afdf5eed2e8968197298f [0,1,0,1,0,0|1,0,0]=3 13265 B11R1.102 CC1CC1NCCCC(=O)O 37df332ae5d4d4f9c451847d09793c25 [0,1,0,1,0,0|0,0,0]=2 13266 B11R1.102 CC1CC1NCCC[N+](=O)[O-] 417c49385b61b04c6829ef44f584ee2a [0,1,0,1,0,0|1,0,1]=4 13267 B11R1.102 CC1CC1NCCNC(=O)N 7e081c9dedd2a539daaf46737f8f5b19 [0,1,0,1,0,0|2,0,0]=4 13268 B11R1.102 C[C@@H]1C[C@H]1COCCC(=O)N 8d92f33ff218082cebab11c010e1157d [0,1,0,1,0,0|1,0,0]=3 13269 B11R1.102 C[C@@H]1C[C@H]1COCCC(=O)O b04546ed4019019678c03576307d9df4 [0,1,0,1,0,0|0,0,0]=2 13270 B11R1.102 C[C@@H]1C[C@H]1COCCS(=O)C 5cd81022add26e722ec32b5a2dd14c5d [0,1,0,1,0,0|2,0,0]=4 13271 B11R1.102 C[C@@H]1C[C@H]1COCSC(=O)N 9c872bda67e5dc3b19ab2c1a854c511a [0,1,0,1,0,0|2,0,0]=4 13272 B11R1.102 C[C@H]1C[C@@H]1COCCC(=O)N 203d6c1bf3d8df4bc22f7cf65b4d93d4 [0,1,0,1,0,0|1,0,0]=3 13273 B11R1.102 C[C@H]1C[C@@H]1COCCC(=O)O 8d43531bace86502c95a01dd267efeb3 [0,1,0,1,0,0|0,0,0]=2 13274 B11R1.102 C[C@H]1C[C@@H]1COCCS(=O)C d84f603a1389e4b93c99aa86392096b9 [0,1,0,1,0,0|2,0,0]=4 13275 B11R1.102 C[C@H]1C[C@@H]1COCSC(=O)N e2e2730f4e3135b682e4242c29b30ba9 [0,1,0,1,0,0|2,0,0]=4 13276 B11R1.102 C[C@H]1C[C@H]1COCCC(=O)N 96bcfa5558b597c2fae8c26daeb658f9 [0,1,0,1,0,0|1,0,0]=3 13277 B11R1.102 C[C@H]1C[C@H]1COCCC(=O)O 45bb13f4739bfb28c1dc01c4211d6306 [0,1,0,1,0,0|0,0,0]=2 13278 B11R1.102 C[C@H]1C[C@H]1COCCS(=O)C 19b201a1e88cb7aff3cbaebf4b3642e5 [0,1,0,1,0,0|2,0,0]=4 13279 B11R1.102 C[C@H]1C[C@H]1COCSC(=O)N 79402f623f1bd98469c18be77c02ccaa [0,1,0,1,0,0|2,0,0]=4 13280 B11R1.102 NC(=O)CCCN[C@@H]1C[C@H]1F d3225b764b84c5f434d3dd95d6ea2320 [0,1,0,1,0,0|2,0,0]=4 13281 B11R1.102 NC(=O)CCCN[C@H]1C[C@@H]1F 181958ffe786a71cf328d1b4a81a0d8b [0,1,0,1,0,0|2,0,0]=4 13282 B11R1.102 NC(=O)CCCN[C@H]1C[C@H]1F 4995241c9ad05a5aeaefedc7b690d374 [0,1,0,1,0,0|2,0,0]=4 13283 B11R1.102 NC(=O)CCOC[C@@H]1C[C@@H]1F 107d7b25966031fa792d9c0675986d8c [0,1,0,1,0,0|2,0,0]=4 13284 B11R1.102 NC(=O)CCOC[C@@H]1C[C@H]1F 388514ef8dd18152f208be424933d405 [0,1,0,1,0,0|2,0,0]=4 13285 B11R1.102 NC(=O)CCOC[C@H]1C[C@@H]1F 63a98c953a016f8c96a774e17f3a7ffd [0,1,0,1,0,0|2,0,0]=4 13286 B11R1.102 NC(=O)CCOC[C@H]1C[C@H]1F 6d726cdf9bb23dfe6d544683ed6f4162 [0,1,0,1,0,0|2,0,0]=4 13287 B11R1.102 O=C(O)CCCN[C@@H]1C[C@H]1F ed86a609fdcc7a669998dbad81cac887 [0,1,0,1,0,0|1,0,0]=3 13288 B11R1.102 O=C(O)CCCN[C@H]1C[C@@H]1F dd584ee64dbea50e944425ca726170d1 [0,1,0,1,0,0|1,0,0]=3 13289 B11R1.102 O=C(O)CCCN[C@H]1C[C@H]1F 00a4991f651cdbee366fd2c1ea68a241 [0,1,0,1,0,0|1,0,0]=3 13290 B11R1.102 O=C(O)CCOC[C@@H]1C[C@@H]1F a891c75a20948e3157a539936d15ae73 [0,1,0,1,0,0|1,0,0]=3 13291 B11R1.102 O=C(O)CCOC[C@@H]1C[C@H]1F c9111355f45015e1d0f12022a9368b07 [0,1,0,1,0,0|1,0,0]=3 13292 B11R1.102 O=C(O)CCOC[C@H]1C[C@@H]1F bd9a3a02c1dbf93b83616e83a45d9520 [0,1,0,1,0,0|1,0,0]=3 13293 B11R1.102 O=C(O)CCOC[C@H]1C[C@H]1F c9d53cc0e1838f24c82efffa61ff69a5 [0,1,0,1,0,0|1,0,0]=3 13294 B11R1.110 CCCN1CCCCC(C1)O 2f2cb2c7cbe11e5b7ef88d61c562732e [0,1,0,1,0,0|1,0,1]=4 13295 B11R1.110 CCCN1CCCC[C@H](C1)O 83e8bcc0472a8fbdf816d8033ef8921a [0,1,0,1,0,0|1,0,1]=4 13296 B11R1.110 CCCN1CCCNC(=O)C1 f406ce3053c9c608ac4e8ba7b28a00e2 [0,1,0,1,0,0|2,0,0]=4 13297 B11R1.110 CCOC1CCCNC(=O)C1 826321f04ddcae70bc5b8b57f6c60b43 [0,1,0,1,0,0|2,0,0]=4 13298 B11R1.113 C#CCN1CCC1CC(=O)O 0ee316878645c7ab9e7d3b9610a33087 [0,1,0,1,0,0|0,0,2]=4 13299 B11R1.113 C=CCN1CCC1CC(=O)O ea7bfcdd90a0592bd642e8fbdefbbaf7 [0,1,0,1,0,0|0,0,2]=4 13300 B11R1.113 CCCN1CCC1CC(=O)O eb9847c838c016909ff9e9544b4f5356 [0,1,0,1,0,0|0,0,0]=2 13301 B11R1.113 CCOC1CCC1OC(=O)C 01499f51a32191dbaae4aafa5641c298 [0,1,0,1,0,0|2,0,0]=4 13302 B11R1.113 COCC1CCN1CC(=O)N ed474dc2ccdde5a368d4b9a3cbadf86b [0,1,0,1,0,0|2,0,0]=4 13303 B11R1.113 COCC1CCN1CC(=O)O 17626182c3dc6d51f2d6fceff77f2804 [0,1,0,1,0,0|1,0,0]=3 13304 B11R1.113 COCN1CCC1CC(=O)O 4e01e1a70814c21f6da7561f75a7e025 [0,1,0,1,0,0|1,0,0]=3 13305 B11R1.113 COC[C@@H]1CCN1CC(=O)N eb653e591d2323419deb6a15df44f85e [0,1,0,1,0,0|2,0,0]=4 13306 B11R1.113 COC[C@@H]1CCN1CC(=O)O 76ae1224268bf7d70f6f32c2a43c26f1 [0,1,0,1,0,0|1,0,0]=3 13307 B11R1.113 COC[C@H]1CCN1CC(=O)N 14e3ee489e594a5d4c053eaf199f3231 [0,1,0,1,0,0|2,0,0]=4 13308 B11R1.113 COC[C@H]1CCN1CC(=O)O 95a11670e953c147a954a00bcb1a73a1 [0,1,0,1,0,0|1,0,0]=3 13309 B11R1.113 CSCN1CCC1CC(=O)O 414d299412c33e07418261d75564052c [0,1,0,1,0,0|1,0,0]=3 13310 B11R1.113 N#CCN1CCC1CC(=O)O 176e51881d0172d261290f04fa3b26da [0,1,0,1,0,0|1,0,1]=4 13311 B11R1.113 NC(=O)CN1CCC1CCO 035b0b440889788eccb0a7cb4c6b64f1 [0,1,0,1,0,0|2,0,0]=4 13312 B11R1.113 O=C(O)CC1CCN1CCF 350b881e50ea2024785ef0ed4799be8b [0,1,0,1,0,0|1,0,0]=3 13313 B11R1.113 O=C(O)CC1CCN1CCO b8793d8aa6576585687a7f1b4d889d79 [0,1,0,1,0,0|1,0,0]=3 13314 B11R1.113 O=C(O)CC1CCN1CCS 708e5e4b7cb7ee63e813cf63ba7a1ffe [0,1,0,1,0,0|1,0,0]=3 13315 B11R1.113 O=C(O)CN1CCC1CCO d3131954bccb9b151f58378fff7b4f7f [0,1,0,1,0,0|1,0,0]=3 13316 B11R1.113 O=CCN1CCC1CC(=O)O 7112adb2f146621e62e877496a1ff0d7 [0,1,0,1,0,0|1,0,1]=4 13317 B11R1.143 CC(=O)N1CCCCCC1C 0b0f11c018b77ceb673643adf08c2408 [0,1,0,1,0,0|1,0,0]=3 13318 B11R1.143 CC(=O)N1CCCOCC1C 05dd5ae37e5935dc60472aa5b925d2ab [0,1,0,1,0,0|2,0,0]=4 13319 B11R1.143 CC(=O)N1CCOCCC1C 65c4a5578f87afa21dde7df10cc6e019 [0,1,0,1,0,0|2,0,0]=4 13320 B11R1.143 CC(=O)N1CCSCCC1C ae1671b31186915b7dc88a8230d1612e [0,1,0,1,0,0|2,0,0]=4 13321 B11R1.161 C=C(C)CCN[C@@H]1CC[C@H]1C 7d80ec287e79aa85f111cfca8395ee11 [0,1,0,1,0,0|2,0,0]=4 13322 B11R1.161 C=C(C)CCN[C@H]1CC[C@H]1C a6b3478466940509abd22de9544b120a [0,1,0,1,0,0|2,0,0]=4 13323 B11R1.161 CC(=O)CCNC1CCC1F 1535ade98f985e789f748cb41d97a74f [0,1,0,1,0,0|2,0,0]=4 13324 B11R1.161 CC(=O)CCNC1CCC1O 6000990b2d9aa89d61074a7f32d20329 [0,1,0,1,0,0|2,0,0]=4 13325 B11R1.161 CC(=O)CCNC1COC1C 20536b904daa80bed250c8f49133111f [0,1,0,1,0,0|2,0,0]=4 13326 B11R1.161 CC(=O)CCN[C@@H]1CC[C@@H]1O 33464948838778762e18602cd4b4f454 [0,1,0,1,0,0|2,0,0]=4 13327 B11R1.161 CC(=O)CCN[C@@H]1CC[C@H]1C a6a16483cd313a8fc3617f90b4b7eb46 [0,1,0,1,0,0|1,0,0]=3 13328 B11R1.161 CC(=O)CCN[C@@H]1CC[C@H]1O ff77b476701fb6edb645e6e483ec5811 [0,1,0,1,0,0|2,0,0]=4 13329 B11R1.161 CC(=O)CCN[C@H]1CC[C@@H]1O e5549b0e5a460f191fa77ca209371edd [0,1,0,1,0,0|2,0,0]=4 13330 B11R1.161 CC(=O)CCN[C@H]1CC[C@H]1C 5d10220899885912bf3dc0c5177eed6e [0,1,0,1,0,0|1,0,0]=3 13331 B11R1.161 CC(=O)CCN[C@H]1CC[C@H]1O a42cd0630e108f54c84e67c111f7fd57 [0,1,0,1,0,0|2,0,0]=4 13332 B11R1.161 CC(=O)CCOC1COC1C dc7135022ee7e1f7329f47f19358056e [0,1,0,1,0,0|2,0,0]=4 13333 B11R1.161 CC(=O)OCN[C@@H]1CC[C@H]1C aaf96b2a27cbb6c563cbb394d9aeafa0 [0,1,0,1,0,0|2,0,0]=4 13334 B11R1.161 CC(=O)OCN[C@H]1CC[C@H]1C d6505791e49bdc127c9bd7ddddc65378 [0,1,0,1,0,0|2,0,0]=4 13335 B11R1.161 CC(O)CCN[C@@H]1CC[C@H]1C bda83bfb292724c512b5930ecbc94b90 [0,1,0,1,0,0|1,0,1]=4 13336 B11R1.161 CC(O)CCN[C@H]1CC[C@H]1C b5e11edf941a1be25bfd75536917ad92 [0,1,0,1,0,0|1,0,1]=4 13337 B11R1.161 CC1OCC1NCCC(=O)N e3dcae376ff3a4d78af29b1597192e02 [0,1,0,1,0,0|2,0,0]=4 13338 B11R1.161 CC1OCC1NCCC(=O)O 26d20e63f6ca828a644b2654b68ff858 [0,1,0,1,0,0|1,0,0]=3 13339 B11R1.161 CC1OCC1OCCC(=O)N cc73ba9d7f94739df3fc677601d59b2b [0,1,0,1,0,0|2,0,0]=4 13340 B11R1.161 CC1OCC1OCCC(=O)O c7c0e47d7a25839e12ad9a0acf10dda7 [0,1,0,1,0,0|1,0,0]=3 13341 B11R1.161 CN1CCC1CNCC(=O)N 83e9fce9314652a941c44ba7f119adc6 [0,1,0,1,0,0|2,0,0]=4 13342 B11R1.161 CN1CCC1CNCC(=O)O 0349409589cbeced919e11f49b37bf7d [0,1,0,1,0,0|1,0,0]=3 13343 B11R1.161 CN1CCC1COCC(=O)N bf42b0bc524014445d9de953e51c0ee3 [0,1,0,1,0,0|2,0,0]=4 13344 B11R1.161 CN1CCC1COCC(=O)O 5ba30ff7a20ca060cedfc8499001f2ec [0,1,0,1,0,0|1,0,0]=3 13345 B11R1.161 CN1CC[C@@H]1COCC(=O)N a6172fff1dd90e6a052737d7b32f09e4 [0,1,0,1,0,0|2,0,0]=4 13346 B11R1.161 CN1CC[C@@H]1COCC(=O)O 555f94dc3d716cce9cf4f667679921f1 [0,1,0,1,0,0|1,0,0]=3 13347 B11R1.161 CN1CC[C@H]1COCC(=O)N 3f839e5784fc26e3bfb074d567f5ad44 [0,1,0,1,0,0|2,0,0]=4 13348 B11R1.161 CN1CC[C@H]1COCC(=O)O b33b3cd4ffb4e626e54d37b0dfdc3a75 [0,1,0,1,0,0|1,0,0]=3 13349 B11R1.161 C[C@@H]1CC[C@@H]1NCCC(=O)N 840746f5b0e7feda76fc3d0b64413bbf [0,1,0,1,0,0|1,0,0]=3 13350 B11R1.161 C[C@@H]1CC[C@@H]1NCCC(=O)O aa0e60c33918eed9747e660c027563f0 [0,1,0,1,0,0|0,0,0]=2 13351 B11R1.161 C[C@@H]1CC[C@@H]1NCCS(=O)C 1bfa9cf39fe24425d66adbed7ee2f447 [0,1,0,1,0,0|2,0,0]=4 13352 B11R1.161 C[C@@H]1CC[C@@H]1NCSC(=O)N f16c6901a5d5b96c637b59629a83b8b5 [0,1,0,1,0,0|2,0,0]=4 13353 B11R1.161 C[C@@H]1CC[C@H]1NCCC(=O)N 0b146de1493570bc7df2726442ff2ddc [0,1,0,1,0,0|1,0,0]=3 13354 B11R1.161 C[C@@H]1CC[C@H]1NCCC(=O)O 37869c1af20a843bcf28deb296db7bde [0,1,0,1,0,0|0,0,0]=2 13355 B11R1.161 C[C@@H]1CC[C@H]1NCCS(=O)C 27e756b5790d1843925688f5de3f6adf [0,1,0,1,0,0|2,0,0]=4 13356 B11R1.161 C[C@@H]1CC[C@H]1NCSC(=O)N 6fa5f19a16b749c54d6dedb0f84d59b4 [0,1,0,1,0,0|2,0,0]=4 13357 B11R1.161 NC(=O)CCNC1CCC1F 824c2f43ad5eef41b237cdade2a75e95 [0,1,0,1,0,0|2,0,0]=4 13358 B11R1.161 NC(=O)CCNC1CCC1O dd61995806d66847ba6bce1922280072 [0,1,0,1,0,0|2,0,0]=4 13359 B11R1.161 NC(=O)CCN[C@@H]1CC[C@@H]1O d4bdc192792d068194ee4f9df50667a8 [0,1,0,1,0,0|2,0,0]=4 13360 B11R1.161 NC(=O)CCN[C@@H]1CC[C@H]1O 00caef762f1ce6ccb9ecefd33c1bf642 [0,1,0,1,0,0|2,0,0]=4 13361 B11R1.161 NC(=O)CCN[C@H]1CC[C@@H]1O 44999da39da4aebf0980ea007b0a76ed [0,1,0,1,0,0|2,0,0]=4 13362 B11R1.161 NC(=O)CCN[C@H]1CC[C@H]1O 780bff22a0be7598e6c74b8397117a5d [0,1,0,1,0,0|2,0,0]=4 13363 B11R1.161 NC(=O)COCC1CCC1F 16a62337750bd706250ad020c382fa0d [0,1,0,1,0,0|2,0,0]=4 13364 B11R1.161 O=C(O)CCNC1CCC1F 5f57069ebfa5ab3c48d9665188949a5e [0,1,0,1,0,0|1,0,0]=3 13365 B11R1.161 O=C(O)CCNC1CCC1O b28a61bfa0f85d798abe2f472ec24946 [0,1,0,1,0,0|1,0,0]=3 13366 B11R1.161 O=C(O)CCN[C@@H]1CC[C@@H]1O cdc3f23228a4de76ef5e41d38975aff2 [0,1,0,1,0,0|1,0,0]=3 13367 B11R1.161 O=C(O)CCN[C@@H]1CC[C@H]1O 2b304f1dee31d2bf40059ef45946ae2c [0,1,0,1,0,0|1,0,0]=3 13368 B11R1.161 O=C(O)CCN[C@H]1CC[C@@H]1O d62324818d2937296e31a4fca88a19a3 [0,1,0,1,0,0|1,0,0]=3 13369 B11R1.161 O=C(O)CCN[C@H]1CC[C@H]1O ce935610e0952e1ff53e868d5791027e [0,1,0,1,0,0|1,0,0]=3 13370 B11R1.161 O=C(O)COCC1CCC1=O 52d6482c82de2e2045ef3903ee148b77 [0,1,0,1,0,0|1,0,1]=4 13371 B11R1.161 O=C(O)COCC1CCC1F 3761a1d391388f8fb3ef976d5e887bcd [0,1,0,1,0,0|1,0,0]=3 13372 B11R1.174 C=C(Br)CCOCC1CCC1 f151e3aaabc2d2c899620a570076e116 [0,1,0,1,0,0|2,0,0]=4 13373 B11R1.174 C=C(Br)CNCCC1CCC1 87af859cae9f6f28c4f0556146ec1e2d [0,1,0,1,0,0|2,0,0]=4 13374 B11R1.174 C=C(Br)COCCC1CCC1 06230e79e2d880e23fc6d38fde0097e4 [0,1,0,1,0,0|2,0,0]=4 13375 B11R1.174 C=C(C)CCCNC1CCC1 44305f6b86a450ff0068d5fa14ea083c [0,1,0,1,0,0|2,0,0]=4 13376 B11R1.174 C=C(C)CCCOC1CCC1 1d1db28c6ab5c4a47973b3575ebae224 [0,1,0,1,0,0|2,0,0]=4 13377 B11R1.174 C=C(C)CCNCC1CCC1 3f342189596343ed002999c2dc3c0fdc [0,1,0,1,0,0|2,0,0]=4 13378 B11R1.174 C=C(C)CCOCC1CCC1 a8e0db0985c21144339756b71656283a [0,1,0,1,0,0|2,0,0]=4 13379 B11R1.174 C=C(C)CNCCC1CCC1 b26249b6c3aee42f865439d299b1c421 [0,1,0,1,0,0|2,0,0]=4 13380 B11R1.174 C=C(C)COCCC1CCC1 635011a48bd1376f39732c890cc35ca5 [0,1,0,1,0,0|2,0,0]=4 13381 B11R1.174 C=C(Cl)CNCCC1CCC1 c207aa1c458f75e104721d88852e21ab [0,1,0,1,0,0|2,0,0]=4 13382 B11R1.174 C=C(Cl)COCCC1CCC1 d0c2ecff6cb39e294ab1c3d9b2c1ee2f [0,1,0,1,0,0|2,0,0]=4 13383 B11R1.174 C=C(F)COCCC1CCC1 0b360f26c4036b912fbdbf86f2257866 [0,1,0,1,0,0|2,0,0]=4 13384 B11R1.174 C=C(I)COCCC1CCC1 0e3a6a761d5ad9128632059ff4d8e286 [0,1,0,1,0,0|2,0,0]=4 13385 B11R1.174 CC(=O)CCCCN1CCC1 0895d4685eb8ee6298d78fb83192eef7 [0,1,0,1,0,0|1,0,0]=3 13386 B11R1.174 CC(=O)CCCNC1CCC1 9d5e6a34536cb29e0c4e4aab5779ce3f [0,1,0,1,0,0|1,0,0]=3 13387 B11R1.174 CC(=O)CCCNC1COC1 cc5a0fb8db21c40941fe3a06ddbd09d5 [0,1,0,1,0,0|2,0,0]=4 13388 B11R1.174 CC(=O)CCCOC1CCC1 7ef6b8db9fe814d0e6473ae999d09557 [0,1,0,1,0,0|1,0,0]=3 13389 B11R1.174 CC(=O)CCCOC1COC1 47014277672911dd53aa1a5c220fe20b [0,1,0,1,0,0|2,0,0]=4 13390 B11R1.174 CC(=O)CCCOC1CSC1 6d2d42ca7e5c1fbc991148a484e5130e [0,1,0,1,0,0|2,0,0]=4 13391 B11R1.174 CC(=O)CCNCC1CCC1 46c52fee0c2afa627fde78fb48fb79a2 [0,1,0,1,0,0|1,0,0]=3 13392 B11R1.174 CC(=O)CCNCC1CCO1 0846195639a4ce4a13f638bd19044cc7 [0,1,0,1,0,0|2,0,0]=4 13393 B11R1.174 CC(=O)CCNCC1COC1 137f33b92d29dc90ffe5fb298348b542 [0,1,0,1,0,0|2,0,0]=4 13394 B11R1.174 CC(=O)CCNC[C@@H]1CCO1 cea8c34796e6a62e9dcee355646bd74b [0,1,0,1,0,0|2,0,0]=4 13395 B11R1.174 CC(=O)CCNC[C@H]1CCO1 164a45bc92f32368f2db6d1a8aee2f7c [0,1,0,1,0,0|2,0,0]=4 13396 B11R1.174 CC(=O)CCOCC1CCC1 eb9625984917930ff1284248f8f7a6eb [0,1,0,1,0,0|1,0,0]=3 13397 B11R1.174 CC(=O)CCOCC1CCO1 7867f92d1150f6962e6d3c66c2f80ee3 [0,1,0,1,0,0|2,0,0]=4 13398 B11R1.174 CC(=O)CCOCC1COC1 563fbaad50fab6c7bd11db0faea46d1e [0,1,0,1,0,0|2,0,0]=4 13399 B11R1.174 CC(=O)CCOCC1CSC1 411273286e673989edf5de381d0f1a44 [0,1,0,1,0,0|2,0,0]=4 13400 B11R1.174 CC(=O)CCOC[C@@H]1CCO1 69b0718a1b576aa96c130c6647292809 [0,1,0,1,0,0|2,0,0]=4 13401 B11R1.174 CC(=O)CCOC[C@H]1CCO1 a42df15bf80e12f154f190dd1cdec875 [0,1,0,1,0,0|2,0,0]=4 13402 B11R1.174 CC(=O)CNCCC1CCC1 a6c0b7b56e06a8c8bc7cd1a55bab585e [0,1,0,1,0,0|1,0,0]=3 13403 B11R1.174 CC(=O)CNCCC1CCO1 7e2b6d7cc53e36feb70ad90dcd74813c [0,1,0,1,0,0|2,0,0]=4 13404 B11R1.174 CC(=O)CNCCC1COC1 6dde6f06b71374f1d03591573861d985 [0,1,0,1,0,0|2,0,0]=4 13405 B11R1.174 CC(=O)COCCC1CCC1 4944e2be1bb1a139c0b12602f14dd179 [0,1,0,1,0,0|1,0,0]=3 13406 B11R1.174 CC(=O)COCCC1CCO1 62db078e1adee4ce8de364aa26110053 [0,1,0,1,0,0|2,0,0]=4 13407 B11R1.174 CC(=O)COCCC1COC1 f27500fa44fe25601da30a747c8b427b [0,1,0,1,0,0|2,0,0]=4 13408 B11R1.174 CC(=O)NCCCN1CCC1 af460886f07b5ff5a2980abf76cf53da [0,1,0,1,0,0|2,0,0]=4 13409 B11R1.174 CC(=O)NCCNC1CCC1 79b63850a9852b838b80fa9ae22e824b [0,1,0,1,0,0|2,0,0]=4 13410 B11R1.174 CC(=O)NCCOC1CCC1 3b0ee716030c7af7146c7ea2b129ff90 [0,1,0,1,0,0|2,0,0]=4 13411 B11R1.174 CC(=O)NCOCC1CCC1 e594702d393d02df666c4f85e6ba814b [0,1,0,1,0,0|2,0,0]=4 13412 B11R1.174 CC(=O)OCCCN1CCC1 24a70d4b010abc734853519f5f27a9c5 [0,1,0,1,0,0|2,0,0]=4 13413 B11R1.174 CC(=O)OCCNC1CCC1 843b8900410b6202d6c53f882955c6de [0,1,0,1,0,0|2,0,0]=4 13414 B11R1.174 CC(=O)OCCOC1CCC1 2c6fc8b09f6355c045fe3081ff5f60e8 [0,1,0,1,0,0|2,0,0]=4 13415 B11R1.174 CC(=O)OCNCC1CCC1 ad572eab5d6059d6219be8489e4cac6a [0,1,0,1,0,0|2,0,0]=4 13416 B11R1.174 CC(=O)OCOCC1CCC1 c4249aad3dd49a6377246e85980ed555 [0,1,0,1,0,0|2,0,0]=4 13417 B11R1.174 CC(=O)SCCCN1CCC1 88f05892d8d790bff38303f02ab75aa9 [0,1,0,1,0,0|2,0,0]=4 13418 B11R1.174 CC(=O)SCCNC1CCC1 6ff4437dbe508649c12053df223f5c44 [0,1,0,1,0,0|2,0,0]=4 13419 B11R1.174 CC(=O)SCCOC1CCC1 9de66995bfb48432d15d3f5cfddf7021 [0,1,0,1,0,0|2,0,0]=4 13420 B11R1.174 CC(O)CCCCN1CCC1 8406a558f31bb03b3242ca1b31978a82 [0,1,0,1,0,0|1,0,1]=4 13421 B11R1.174 CC(O)CCCNC1CCC1 224435ed31ecafed414a0a14f16f4db2 [0,1,0,1,0,0|1,0,1]=4 13422 B11R1.174 CC(O)CCNCC1CCC1 180594aa84852a257aec8460d74bb063 [0,1,0,1,0,0|1,0,1]=4 13423 B11R1.174 CC(O)CNCCC1CCC1 899b7380e7204898781d4f1ea9d4dac0 [0,1,0,1,0,0|1,0,1]=4 13424 B11R1.174 CS(=O)CCCNC1CCC1 345c8ab7151c6802890464ec0e8f7041 [0,1,0,1,0,0|2,0,0]=4 13425 B11R1.174 CS(=O)CCNCC1CCC1 57517fd85c88c03d054f5d6a3b8c6dc6 [0,1,0,1,0,0|2,0,0]=4 13426 B11R1.174 CS(=O)CCOCC1CCC1 bf9ee2c9d1a76665c21a607141c546f3 [0,1,0,1,0,0|2,0,0]=4 13427 B11R1.174 C[C@@H](O)CCCCN1CCC1 c82b2c7a02fc4e689992e1520866ba62 [0,1,0,1,0,0|1,0,1]=4 13428 B11R1.174 C[C@@H](O)CCNCC1CCC1 7e2621cc8c9335dff3489fcd83d1ce1f [0,1,0,1,0,0|1,0,1]=4 13429 B11R1.174 C[C@@H](O)CNCCC1CCC1 9b5af2d454111c494f8d310aef7f9039 [0,1,0,1,0,0|1,0,1]=4 13430 B11R1.174 C[C@H](O)CCNCC1CCC1 605840902192f6dbb9aaae8beed5ea18 [0,1,0,1,0,0|1,0,1]=4 13431 B11R1.174 C[C@H](O)CNCCC1CCC1 7944011a523f7249cac362e9d9eccc0c [0,1,0,1,0,0|1,0,1]=4 13432 B11R1.174 NC(=O)CCCCN1CCC1 d11b4539fe519b855f7e3652a2813838 [0,1,0,1,0,0|1,0,0]=3 13433 B11R1.174 NC(=O)CCCNC1CCC1 7cbb9c6f45d123265278cf664ffb1fe2 [0,1,0,1,0,0|1,0,0]=3 13434 B11R1.174 NC(=O)CCCNC1COC1 322926adf82a38a23d59bc6ed8c6c229 [0,1,0,1,0,0|2,0,0]=4 13435 B11R1.174 NC(=O)CCCOC1CCC1 30d40f734523ab1b71d78b1d13a9a716 [0,1,0,1,0,0|1,0,0]=3 13436 B11R1.174 NC(=O)CCCOC1COC1 16100ac21a3aff8738b243e6e6275107 [0,1,0,1,0,0|2,0,0]=4 13437 B11R1.174 NC(=O)CCCOC1CSC1 86dbc732f1432cf5907591987dd19d3f [0,1,0,1,0,0|2,0,0]=4 13438 B11R1.174 NC(=O)CCNCC1CCC1 09f87c7b9256ab6e11e851b5b9cdee5c [0,1,0,1,0,0|1,0,0]=3 13439 B11R1.174 NC(=O)CCNCC1CCO1 4ac0e14f49169b69c2d78932d10c1a34 [0,1,0,1,0,0|2,0,0]=4 13440 B11R1.174 NC(=O)CCNCC1COC1 e39850073fe40ecc7355d8c7184191bd [0,1,0,1,0,0|2,0,0]=4 13441 B11R1.174 NC(=O)CCNC[C@@H]1CCO1 6c76dac2e8c65c8c0f5db3f7765aa020 [0,1,0,1,0,0|2,0,0]=4 13442 B11R1.174 NC(=O)CCNC[C@H]1CCO1 bdb86f12f17657984e74bcb9a7ab8fd9 [0,1,0,1,0,0|2,0,0]=4 13443 B11R1.174 NC(=O)CCOCC1CCC1 745f7a4866c05893a6b2556a97481c7f [0,1,0,1,0,0|1,0,0]=3 13444 B11R1.174 NC(=O)CCOCC1CCO1 522c69cf835346c4879dc57573daca5e [0,1,0,1,0,0|2,0,0]=4 13445 B11R1.174 NC(=O)CCOCC1COC1 3c7480f94c71c6cc376c07b7c0921b4d [0,1,0,1,0,0|2,0,0]=4 13446 B11R1.174 NC(=O)CCOCC1CSC1 3d0e57398ea83f962a42e16b1ead0828 [0,1,0,1,0,0|2,0,0]=4 13447 B11R1.174 NC(=O)CCOC[C@@H]1CCO1 083847b7c5fa12b1d957b36cb3b7f7d6 [0,1,0,1,0,0|2,0,0]=4 13448 B11R1.174 NC(=O)CCOC[C@H]1CCO1 38e30db0bb9d710ec6545d21b7e5d296 [0,1,0,1,0,0|2,0,0]=4 13449 B11R1.174 NC(=O)CNCCC1CCC1 ca676a144539a78812af143cd4d9bf36 [0,1,0,1,0,0|1,0,0]=3 13450 B11R1.174 NC(=O)CNCCC1CCO1 15453ce124378728a0f23c6bc552bbfb [0,1,0,1,0,0|2,0,0]=4 13451 B11R1.174 NC(=O)CNCCC1COC1 a16fd3161ee9fcdd8d743b09e381da8b [0,1,0,1,0,0|2,0,0]=4 13452 B11R1.174 NC(=O)CNCCN1CCC1 d0b897b96f173d643dca242c1e88c58a [0,1,0,1,0,0|2,0,0]=4 13453 B11R1.174 NC(=O)CNCC[C@@H]1CCO1 926f0af5f2a1385f0ae37de25b2b0426 [0,1,0,1,0,0|2,0,0]=4 13454 B11R1.174 NC(=O)COCCC1CCC1 f20c75ec54e8aeeeb919375a77d7800d [0,1,0,1,0,0|1,0,0]=3 13455 B11R1.174 NC(=O)COCCC1CCO1 8c63f4e30da15e97c6ae00284d41f45e [0,1,0,1,0,0|2,0,0]=4 13456 B11R1.174 NC(=O)COCCC1COC1 fe69a13026b80cfb560d24de97b9c609 [0,1,0,1,0,0|2,0,0]=4 13457 B11R1.174 NC(=O)COCCN1CCC1 510db90136fd2da25726abd4d095e7be [0,1,0,1,0,0|2,0,0]=4 13458 B11R1.174 NC(=O)COCC[C@@H]1CCO1 05dd6f32d865f8e6d8891ef03b56829b [0,1,0,1,0,0|2,0,0]=4 13459 B11R1.174 NC(=O)COCC[C@H]1CCO1 c887dd5b2356dfaed5821410b6d3fa79 [0,1,0,1,0,0|2,0,0]=4 13460 B11R1.174 NC(=O)NCCNC1CCC1 23365aa4f57fb0576b45cdb96b70cb2d [0,1,0,1,0,0|2,0,0]=4 13461 B11R1.174 NC(=O)NCCOC1CCC1 a272f6ba699f6d3e02a911d1c2bc68ad [0,1,0,1,0,0|2,0,0]=4 13462 B11R1.174 NC(=O)NCOCC1CCC1 29402eee0f2fd0c4be74bc14234dcdbd [0,1,0,1,0,0|2,0,0]=4 13463 B11R1.174 NC(=O)SCNCC1CCC1 60e010219fb60f59435f157e585090a8 [0,1,0,1,0,0|2,0,0]=4 13464 B11R1.174 NC(=O)SCOCC1CCC1 085141958c575768011d13ef41e6e35e [0,1,0,1,0,0|2,0,0]=4 13465 B11R1.174 NC(=S)CCNCC1CCC1 26ea8970c437fa9fc3119c2f71602664 [0,1,0,1,0,0|1,1,0]=4 13466 B11R1.174 NC(=S)COCCC1CCC1 f6a2c456071687e1b40dc7d927688d2a [0,1,0,1,0,0|1,1,0]=4 13467 B11R1.174 O=C(O)/C=C/CNC1CCC1 a3c37c4af58919d5567657503948b1d6 [0,1,0,1,0,0|0,0,2]=4 13468 B11R1.174 O=C(O)/C=C/COC1CCC1 eba3782a4e4cc66a5bfb29dc81eae30b [0,1,0,1,0,0|0,0,2]=4 13469 B11R1.174 O=C(O)C#CCNC1CCC1 e10e68f3b6c1db2e173b6ce50460a405 [0,1,0,1,0,0|0,0,2]=4 13470 B11R1.174 O=C(O)C#CCOC1CCC1 0e95a8be4bbbeee3aa72cae340562a94 [0,1,0,1,0,0|0,0,2]=4 13471 B11R1.174 O=C(O)C=CCNC1CCC1 59828b30656f6afe7f7831c7b759c254 [0,1,0,1,0,0|0,0,2]=4 13472 B11R1.174 O=C(O)C=CCOC1CCC1 a8981b98cb4b4a8155d006c6c810d681 [0,1,0,1,0,0|0,0,2]=4 13473 B11R1.174 O=C(O)CCCNC1CCC1 5ce983248441f00c611d6f8d5f20c1bf [0,1,0,1,0,0|0,0,0]=2 13474 B11R1.174 O=C(O)CCCNC1COC1 64c9e5d1eccdf103bb0f82695262529d [0,1,0,1,0,0|1,0,0]=3 13475 B11R1.174 O=C(O)CCCOC1CCC1 768c3041fc41550e6af0ddd7c673718a [0,1,0,1,0,0|0,0,0]=2 13476 B11R1.174 O=C(O)CCNCC1CCC1 82ce057190ac501fe24bca309fd6e48c [0,1,0,1,0,0|0,0,0]=2 13477 B11R1.174 O=C(O)CCNCC1CCO1 01b9658ec0f96c1db3f9c61d088436e0 [0,1,0,1,0,0|1,0,0]=3 13478 B11R1.174 O=C(O)CCNCC1COC1 db6f65d84336cd12d5a0fefca42c85df [0,1,0,1,0,0|1,0,0]=3 13479 B11R1.174 O=C(O)CCNC[C@@H]1CCO1 2f3a9c3778993c9563995eb428878ce2 [0,1,0,1,0,0|1,0,0]=3 13480 B11R1.174 O=C(O)CCNC[C@H]1CCO1 03ec36e7e9657cdd22f627076644519c [0,1,0,1,0,0|1,0,0]=3 13481 B11R1.174 O=C(O)CCOCC1CCC1 538308fdd78afb9ed4902348844ff826 [0,1,0,1,0,0|0,0,0]=2 13482 B11R1.174 O=C(O)CCOCC1CCO1 033bb595f522940a9a71a47d10ba3f8d [0,1,0,1,0,0|1,0,0]=3 13483 B11R1.174 O=C(O)CCOCC1COC1 7c172a4d19b163624f799d646a36f15f [0,1,0,1,0,0|1,0,0]=3 13484 B11R1.174 O=C(O)CCOCC1CSC1 58c758a3de35712ed1074ab6146a557e [0,1,0,1,0,0|1,0,0]=3 13485 B11R1.174 O=C(O)CCOC[C@@H]1CCO1 c2f0b83c9f00c33123af7de76c9d4aeb [0,1,0,1,0,0|1,0,0]=3 13486 B11R1.174 O=C(O)CCOC[C@H]1CCO1 4f78575a34da887b459d807983e2c6ad [0,1,0,1,0,0|1,0,0]=3 13487 B11R1.174 O=C(O)CNCCC1CCC1 84612f195dec18bf1f89fbacb630f1f5 [0,1,0,1,0,0|0,0,0]=2 13488 B11R1.174 O=C(O)CNCCC1CCO1 10c99e5b0ca9d4d9819ce9bdccb30510 [0,1,0,1,0,0|1,0,0]=3 13489 B11R1.174 O=C(O)CNCCC1COC1 7e856d19038a9d2bf1f734263460b7e3 [0,1,0,1,0,0|1,0,0]=3 13490 B11R1.174 O=C(O)CNCCN1CCC1 afbfa7a4cdb9df7226aa4a1dc71683ad [0,1,0,1,0,0|1,0,0]=3 13491 B11R1.174 O=C(O)CNCC[C@@H]1CCO1 920a32388327409a0234dd6b00d02dd4 [0,1,0,1,0,0|1,0,0]=3 13492 B11R1.174 O=C(O)COCCC1CCC1 21d3e323d3716ddd98978256d1ef52c5 [0,1,0,1,0,0|0,0,0]=2 13493 B11R1.174 O=C(O)COCCC1CCO1 f07fdc42d269db765ffff6302325a1ce [0,1,0,1,0,0|1,0,0]=3 13494 B11R1.174 O=C(O)COCCC1COC1 2b318057465ba43f129bd9805dc42ff4 [0,1,0,1,0,0|1,0,0]=3 13495 B11R1.174 O=C(O)COCCN1CCC1 276d9dae8c00650d90721ca47acfe52e [0,1,0,1,0,0|1,0,0]=3 13496 B11R1.174 O=C(O)COCC[C@@H]1CCO1 8265b1cb1777419d042caeb7ba25ef45 [0,1,0,1,0,0|1,0,0]=3 13497 B11R1.174 O=C(O)COCC[C@H]1CCO1 e309b2fc7d6f135b78ef32154f96eaec [0,1,0,1,0,0|1,0,0]=3 13498 B11R1.174 O=S(O)CCNCC1CCC1 035ed238bc653597d64f1e2cb9077cda [0,1,0,1,0,0|1,0,0]=3 13499 B11R1.174 O=S(O)CCNCC1CCO1 3d99be1a86914dfbf7f2a737bde876a8 [0,1,0,1,0,0|2,0,0]=4 13500 B11R1.174 O=S(O)CCNCC1COC1 d1cc77ff0fe236119a3f610212124bb0 [0,1,0,1,0,0|2,0,0]=4 13501 B11R1.174 O=S(O)CCNC[C@@H]1CCO1 9959b868188decb4e78795a22fca3927 [0,1,0,1,0,0|2,0,0]=4 13502 B11R1.174 O=S(O)CCNC[C@H]1CCO1 6210ab919425d1268c69e799e0f9cc77 [0,1,0,1,0,0|2,0,0]=4 13503 B11R1.174 O=S(O)COCCC1CCC1 920e43becd7002024ae8f853dd790a54 [0,1,0,1,0,0|1,0,0]=3 13504 B11R1.174 O=S(O)COCCC1CCO1 7f7bf85d567a7e4f32e8009e4dc99450 [0,1,0,1,0,0|2,0,0]=4 13505 B11R1.174 O=S(O)COCCC1COC1 62591f1541122a819d37c3aeb610e7e7 [0,1,0,1,0,0|2,0,0]=4 13506 B11R1.174 O=[N+]([O-])CCCNC1CCC1 62dc687fbf281b1a99cce06e9bfe2b0e [0,1,0,1,0,0|1,0,1]=4 13507 B11R1.174 O=[N+]([O-])CCCOC1CCC1 72a8599a8c350753b0202ba1ab06d93a [0,1,0,1,0,0|1,0,1]=4 13508 B11R1.174 O=[N+]([O-])CCOCC1CCC1 08726ffe4a44d8210ea309ebbf2cc534 [0,1,0,1,0,0|1,0,1]=4 13509 B11R1.174 O=[N+]([O-])CNCCC1CCC1 381ebec2436d3e36af6f1e8908c83d4a [0,1,0,1,0,0|1,0,1]=4 13510 B11R1.174 O=[N+]([O-])COCCC1CCC1 24ad8ac786e9e55274b528e0e327a96d [0,1,0,1,0,0|1,0,1]=4 13511 B11R1.176 C=C(Br)CCOCCC1CC1 116f02b75b80de18ce04445490a237ba [0,1,0,1,0,0|2,0,0]=4 13512 B11R1.176 C=C(Br)COCCCC1CC1 fe224831bb73287895ee8198d3c9b606 [0,1,0,1,0,0|2,0,0]=4 13513 B11R1.176 C=C(C)CCCNCC1CC1 7f6f577bda9bab7889b39cc78fe95f2b [0,1,0,1,0,0|2,0,0]=4 13514 B11R1.176 C=C(C)CCCOCC1CC1 b34f0734cf473ded148ee42de2b253af [0,1,0,1,0,0|2,0,0]=4 13515 B11R1.176 C=C(C)CCNCCC1CC1 5419e8fdc21854564f97ed8b49456a6a [0,1,0,1,0,0|2,0,0]=4 13516 B11R1.176 C=C(C)CCOCCC1CC1 5c5f24f025ef1d038a687446525f55e9 [0,1,0,1,0,0|2,0,0]=4 13517 B11R1.176 C=C(C)COCCCC1CC1 8d1aca94831cd3239b65234e8c489b4a [0,1,0,1,0,0|2,0,0]=4 13518 B11R1.176 C=C(Cl)COCCCC1CC1 6185acbb56d01b9fc019cb4bebaa2fb3 [0,1,0,1,0,0|2,0,0]=4 13519 B11R1.176 C=C(F)COCCCC1CC1 9fd6029eedf1b90404ed641103bac202 [0,1,0,1,0,0|2,0,0]=4 13520 B11R1.176 CC(=O)CCCCNC1CC1 b58fe0e44be0083fb2839a8e56a0d8f7 [0,1,0,1,0,0|1,0,0]=3 13521 B11R1.176 CC(=O)CCCCOC1CC1 99e6c12be5a36dfbfe96007ce226b069 [0,1,0,1,0,0|1,0,0]=3 13522 B11R1.176 CC(=O)CCCNCC1CC1 43a727b6564ec5256398658d22fc4abb [0,1,0,1,0,0|1,0,0]=3 13523 B11R1.176 CC(=O)CCCOCC1CC1 e5c1da2ade8ff6b054607a722b11b8b1 [0,1,0,1,0,0|1,0,0]=3 13524 B11R1.176 CC(=O)CCNCCC1CC1 80ae1950672890ad568c5e47b7b78c34 [0,1,0,1,0,0|1,0,0]=3 13525 B11R1.176 CC(=O)CCNCCN1CC1 6f1122d2b5ab8d86d4cd64ea69117b1b [0,1,0,1,0,0|2,0,0]=4 13526 B11R1.176 CC(=O)CCOCCC1CC1 474fb5143caabd1a98a14e5579938754 [0,1,0,1,0,0|1,0,0]=3 13527 B11R1.176 CC(=O)CCOCCN1CC1 0a11277029c5251b74d5f5144076b3ec [0,1,0,1,0,0|2,0,0]=4 13528 B11R1.176 CC(=O)CNCCOC1CC1 1cc6b993da75f7aebee6b118db400f57 [0,1,0,1,0,0|2,0,0]=4 13529 B11R1.176 CC(=O)COCCOC1CC1 b500efd2a93384e11e83d0e9821be7b4 [0,1,0,1,0,0|2,0,0]=4 13530 B11R1.176 CC(=O)NCCCNC1CC1 ae56ef80e535e149dbcdc038ab0f2c12 [0,1,0,1,0,0|2,0,0]=4 13531 B11R1.176 CC(=O)NCCCOC1CC1 ff7b4ae74c1127f90728b201a190b4e2 [0,1,0,1,0,0|2,0,0]=4 13532 B11R1.176 CC(=O)NCCNCC1CC1 fe2d4707cb7d3f54ce511ac3b86c395d [0,1,0,1,0,0|2,0,0]=4 13533 B11R1.176 CC(=O)NCCOCC1CC1 de05525fc398e45e8a7c1f52cdac9bd5 [0,1,0,1,0,0|2,0,0]=4 13534 B11R1.176 CC(=O)NCCSCC1CC1 5f0534b08ab4199a662fb4cf7f92e651 [0,1,0,1,0,0|2,0,0]=4 13535 B11R1.176 CC(=O)NCOCCC1CC1 64b872083dcfd193a5a542d39d6f7b40 [0,1,0,1,0,0|2,0,0]=4 13536 B11R1.176 CC(=O)OCCCNC1CC1 6cf7882084557ea9c1dfc24a92b5fb72 [0,1,0,1,0,0|2,0,0]=4 13537 B11R1.176 CC(=O)OCCCOC1CC1 b4b7f39de9625ec9001e67fa98bf2a25 [0,1,0,1,0,0|2,0,0]=4 13538 B11R1.176 CC(=O)OCCNCC1CC1 7a139d32a9fa46ade667e963c0bbd9b1 [0,1,0,1,0,0|2,0,0]=4 13539 B11R1.176 CC(=O)OCCOCC1CC1 f1e011cc42c24c07d94140a6b7c421ca [0,1,0,1,0,0|2,0,0]=4 13540 B11R1.176 CC(=O)OCNCCC1CC1 3173a816155c24721c71cbb63ad85c57 [0,1,0,1,0,0|2,0,0]=4 13541 B11R1.176 CC(=O)OCOCCC1CC1 9f00f4fac04a071bde6b5170296a78a3 [0,1,0,1,0,0|2,0,0]=4 13542 B11R1.176 CC(=O)SCCCNC1CC1 bbd510ff24eb958cd5ef3a8b52e48634 [0,1,0,1,0,0|2,0,0]=4 13543 B11R1.176 CC(=O)SCCCOC1CC1 7b2afe48ab5f5cbf8c7d3ab12d8ee817 [0,1,0,1,0,0|2,0,0]=4 13544 B11R1.176 CC(=O)SCCNCC1CC1 49ca77cc772903245eb02e49b16ce2cc [0,1,0,1,0,0|2,0,0]=4 13545 B11R1.176 CC(=O)SCCOCC1CC1 e5766ad0b954b85627e8d8cb3c28b536 [0,1,0,1,0,0|2,0,0]=4 13546 B11R1.176 CC(O)CCCCNC1CC1 7232d250576ddf41e7e3b2b70f58bcf1 [0,1,0,1,0,0|1,0,1]=4 13547 B11R1.176 CC(O)CCCNCC1CC1 095af535a104f12bc99dd024a5f3fab5 [0,1,0,1,0,0|1,0,1]=4 13548 B11R1.176 CC(O)CCNCCC1CC1 a4a51dbb830c2ee40ec5fe97e9062fd1 [0,1,0,1,0,0|1,0,1]=4 13549 B11R1.176 CS(=O)CCCNCC1CC1 af91a45c466000cbc9d1f4f2b8107232 [0,1,0,1,0,0|2,0,0]=4 13550 B11R1.176 CS(=O)CCNCCC1CC1 843aa0f28b51d9737a5cc73501d64be2 [0,1,0,1,0,0|2,0,0]=4 13551 B11R1.176 CS(=O)CCOCCC1CC1 2f2a8318f70240dd6df59ae0d519ea7a [0,1,0,1,0,0|2,0,0]=4 13552 B11R1.176 C[C@@H](O)CCCCNC1CC1 8624d841da30243b268a44d4d1d6d1ee [0,1,0,1,0,0|1,0,1]=4 13553 B11R1.176 C[C@@H](O)CCNCCC1CC1 228ef128c4627c7673cacc70bdefaff8 [0,1,0,1,0,0|1,0,1]=4 13554 B11R1.176 C[C@H](O)CCNCCC1CC1 96de328720fa3323f2ae5d1d75017e03 [0,1,0,1,0,0|1,0,1]=4 13555 B11R1.176 NC(=O)CCCCNC1CC1 995821b282c0928a24744fd129904599 [0,1,0,1,0,0|1,0,0]=3 13556 B11R1.176 NC(=O)CCCCOC1CC1 74fa2797cabfdd6ca5f61d1eb5d1e064 [0,1,0,1,0,0|1,0,0]=3 13557 B11R1.176 NC(=O)CCCNCC1CC1 f1315da3830f8a0cea58b397318afd28 [0,1,0,1,0,0|1,0,0]=3 13558 B11R1.176 NC(=O)CCCOCC1CC1 5ba90454edbb90a95bbeef36d482662c [0,1,0,1,0,0|1,0,0]=3 13559 B11R1.176 NC(=O)CCNCCC1CC1 3f0c20a16c7bee5e4821fe37c08f16f8 [0,1,0,1,0,0|1,0,0]=3 13560 B11R1.176 NC(=O)CCNCCN1CC1 7e6a74b3d4f59a552e160a2d7ac31e70 [0,1,0,1,0,0|2,0,0]=4 13561 B11R1.176 NC(=O)CCOCCC1CC1 d3ecaeef41085c9559520165bd4a9908 [0,1,0,1,0,0|1,0,0]=3 13562 B11R1.176 NC(=O)CCOCCN1CC1 eab31cd6f13bf9aab8ac25a90540f5d2 [0,1,0,1,0,0|2,0,0]=4 13563 B11R1.176 NC(=O)CNCCOC1CC1 bcae741599c8cad8780867711534f679 [0,1,0,1,0,0|2,0,0]=4 13564 B11R1.176 NC(=O)COCCCC1CC1 603bdf6c7d367ec52e5fe6b5242de53a [0,1,0,1,0,0|1,0,0]=3 13565 B11R1.176 NC(=O)COCCNC1CC1 af90229373d34bfaab2f1bf66af20643 [0,1,0,1,0,0|2,0,0]=4 13566 B11R1.176 NC(=O)COCCOC1CC1 f8ac6928a621bdd0e58f4725c03fe20e [0,1,0,1,0,0|2,0,0]=4 13567 B11R1.176 NC(=O)CSCCOC1CC1 e5836365fae3393ba65420b08279a2d2 [0,1,0,1,0,0|2,0,0]=4 13568 B11R1.176 NC(=O)NCCNCC1CC1 35832dce3aaf1fe689b7395568084667 [0,1,0,1,0,0|2,0,0]=4 13569 B11R1.176 NC(=O)NCCOCC1CC1 4291e99222add0a7ccb553db2b9980df [0,1,0,1,0,0|2,0,0]=4 13570 B11R1.176 NC(=O)NCOCCC1CC1 ef316bbe39bc1497035a504de2f86e96 [0,1,0,1,0,0|2,0,0]=4 13571 B11R1.176 NC(=O)SCNCCC1CC1 cf75f04b001996ec82ce1ea7245bef7e [0,1,0,1,0,0|2,0,0]=4 13572 B11R1.176 NC(=O)SCOCCC1CC1 5bb65c0ba044dda6cd08b2b2329c7a8a [0,1,0,1,0,0|2,0,0]=4 13573 B11R1.176 NC(=S)CCNCCC1CC1 809ccc8470326aad10455b61c4dde177 [0,1,0,1,0,0|1,1,0]=4 13574 B11R1.176 O=C(O)/C=C/CNCC1CC1 5809f6053394f5d2e14f65e9b148c738 [0,1,0,1,0,0|0,0,2]=4 13575 B11R1.176 O=C(O)/C=C/COCC1CC1 6a90aff4a4691358b10059906d4ee908 [0,1,0,1,0,0|0,0,2]=4 13576 B11R1.176 O=C(O)C#CCCOC1CC1 2c6f8431d7df1b41a5e5f5cce28d4a8a [0,1,0,1,0,0|0,0,2]=4 13577 B11R1.176 O=C(O)C#CCNCC1CC1 26d83a4b6f027f1ecd819b1c5197d95e [0,1,0,1,0,0|0,0,2]=4 13578 B11R1.176 O=C(O)C#CCOCC1CC1 e74a290d3c678938e2560dbb5b1f4d71 [0,1,0,1,0,0|0,0,2]=4 13579 B11R1.176 O=C(O)C=CCNCC1CC1 46988aaf59e617e7d6a68f9b414e55e6 [0,1,0,1,0,0|0,0,2]=4 13580 B11R1.176 O=C(O)C=CCOCC1CC1 157d4798fdcecff16644b75d8f00ca28 [0,1,0,1,0,0|0,0,2]=4 13581 B11R1.176 O=C(O)CCCCNC1CC1 8e77bc3df99a4dc09f67f8ea40340ff9 [0,1,0,1,0,0|0,0,0]=2 13582 B11R1.176 O=C(O)CCCCOC1CC1 8e0cdb33192fffe0accc6ff088fe2214 [0,1,0,1,0,0|0,0,0]=2 13583 B11R1.176 O=C(O)CCCNCC1CC1 a0ceb4980a80bcc8b85c45b81d00b29f [0,1,0,1,0,0|0,0,0]=2 13584 B11R1.176 O=C(O)CCNCCC1CC1 5226fae948a459ec4c75482c0489cd8f [0,1,0,1,0,0|0,0,0]=2 13585 B11R1.176 O=C(O)CCNCCN1CC1 d87773b7177ee9271e2d0a665878a9dc [0,1,0,1,0,0|1,0,0]=3 13586 B11R1.176 O=C(O)CCOCCC1CC1 2cd73a23cd9c696299470b6ca4a30071 [0,1,0,1,0,0|0,0,0]=2 13587 B11R1.176 O=C(O)CCOCCN1CC1 ef3e6bbb759363cf0c2687095930d8e1 [0,1,0,1,0,0|1,0,0]=3 13588 B11R1.176 O=C(O)CNCCOC1CC1 8b455f7378cd4f0389903bf3fcd5db12 [0,1,0,1,0,0|1,0,0]=3 13589 B11R1.176 O=C(O)COC/C=C/C1CC1 e1071d141f938cbee5f9f9653eb90473 [0,1,0,1,0,0|0,0,2]=4 13590 B11R1.176 O=C(O)COCC#CC1CC1 743ba377d1e2442bd9d4a3268290eca3 [0,1,0,1,0,0|0,0,2]=4 13591 B11R1.176 O=C(O)COCCCC1CC1 811bc90ad70ebad21f64225f344212bf [0,1,0,1,0,0|0,0,0]=2 13592 B11R1.176 O=C(O)COCCNC1CC1 75b89d23beaa4791d69a9b324238800c [0,1,0,1,0,0|1,0,0]=3 13593 B11R1.176 O=C(O)COCCOC1CC1 5b1ec1157d574bc0727b7e672e282d1b [0,1,0,1,0,0|1,0,0]=3 13594 B11R1.176 O=C(O)CSCCNC1CC1 bbf390f978699b81d7df6fce0b85ad8f [0,1,0,1,0,0|1,0,0]=3 13595 B11R1.176 O=S(O)CCNCCC1CC1 0144c05234224f9595b3853a219833b7 [0,1,0,1,0,0|1,0,0]=3 13596 B11R1.176 O=S(O)COCCOC1CC1 0c158b0fd1e72e5f88dbcf47673bf93c [0,1,0,1,0,0|2,0,0]=4 13597 B11R1.176 O=[N+]([O-])CCCCOC1CC1 c1c5753446b3da5034ab950daa3fee3e [0,1,0,1,0,0|1,0,1]=4 13598 B11R1.176 O=[N+]([O-])CCCNCC1CC1 bfcc4dd356948405a22c76719c377c43 [0,1,0,1,0,0|1,0,1]=4 13599 B11R1.176 O=[N+]([O-])CCCOCC1CC1 83525184dde117f8f5ab71938624a63b [0,1,0,1,0,0|1,0,1]=4 13600 B11R1.176 O=[N+]([O-])CCOCCC1CC1 69ab4cb585a410d30969a13e3d559150 [0,1,0,1,0,0|1,0,1]=4 13601 B11R1.176 O=[N+]([O-])COCCCC1CC1 dcd4f3c3dff9aa33700a0e9338523f6c [0,1,0,1,0,0|1,0,1]=4 13602 B11R1.191 CCNC1CCCCC1(C)O ae26b29892fb3bcfdbf94dd008ae79f6 [0,1,0,1,0,0|1,0,1]=4 13603 B11R1.193 C#CCN1CCCC1C(=O)O 02ad21d74d0d2538ee738596dec986da [0,1,0,1,0,0|0,0,2]=4 13604 B11R1.193 C#CCN1CCC[C@@H]1C(=O)O 8e4d829fb062075b807138c9f693e157 [0,1,0,1,0,0|0,0,2]=4 13605 B11R1.193 C#CCN1CCC[C@H]1C(=O)O 968104265a0cb674b84c847e9cbd65ee [0,1,0,1,0,0|0,0,2]=4 13606 B11R1.193 C=CCN1CCCC1C(=O)O 04e02c6cf42fb3a0ef3180882cc21851 [0,1,0,1,0,0|0,0,2]=4 13607 B11R1.193 C=CCN1CCC[C@@H]1C(=O)O 4ac14934ed8ea443d1866bbf3a869a70 [0,1,0,1,0,0|0,0,2]=4 13608 B11R1.193 C=CCN1CCC[C@H]1C(=O)O cb5dcba16b257c03e0ef374644209d4d [0,1,0,1,0,0|0,0,2]=4 13609 B11R1.193 CC(=O)N1CCCC1CCO 3012c5631b659808eb0b1bbb485470e0 [0,1,0,1,0,0|2,0,0]=4 13610 B11R1.193 CC(=O)N1CCC[C@@H]1CCO f2afe1a8bb4e088cfac0dceb2854f076 [0,1,0,1,0,0|2,0,0]=4 13611 B11R1.193 CCCC1SCCN1C(=O)C 3b7be28ad8fa800c8763215e27f5ee4a [0,1,0,1,0,0|2,0,0]=4 13612 B11R1.193 CCCN1CC=CC1C(=O)O 83b234cf95cd102544ae8ea4347db897 [0,1,0,1,0,0|0,0,2]=4 13613 B11R1.193 CCCN1CC=C[C@H]1C(=O)O cf8fb11416353100381269c114cc9eac [0,1,0,1,0,0|0,0,2]=4 13614 B11R1.193 CCCN1CCCC1C(=O)N aaa74460d602676b8bd29264bd9e93fc [0,1,0,1,0,0|1,0,0]=3 13615 B11R1.193 CCCN1CCCC1C(=O)O 4e7638d6e465e449e2846c4f858986b5 [0,1,0,1,0,0|0,0,0]=2 13616 B11R1.193 CCCN1CCCC1C(C)O 06c0ee1d47fb382c8f6fe1ae4d5e49db [0,1,0,1,0,0|1,0,1]=4 13617 B11R1.193 CCCN1CCC[C@@H]1C(=O)N e559f668f68faa8c20d450e622203fae [0,1,0,1,0,0|1,0,0]=3 13618 B11R1.193 CCCN1CCC[C@@H]1C(=O)O a65b32b4a51d2d27a5db27b0d392a38d [0,1,0,1,0,0|0,0,0]=2 13619 B11R1.193 CCCN1CCC[C@@H]1C(C)O 928b3072563b392083179ee68c307cdc [0,1,0,1,0,0|1,0,1]=4 13620 B11R1.193 CCCN1CCC[C@H]1C(=O)N cf657feec0a26af1e6c950bbff97ced5 [0,1,0,1,0,0|1,0,0]=3 13621 B11R1.193 CCCN1CCC[C@H]1C(=O)O 033cfafcfdfb4af6deb3dd8bda7c1f7a [0,1,0,1,0,0|0,0,0]=2 13622 B11R1.193 CCCN1CCC[C@H]1[C@H](C)O 7b67ac5834f2e37048360661ce78ed9d [0,1,0,1,0,0|1,0,1]=4 13623 B11R1.193 CCCN1CCSC1C(=O)O dcccc13ebce68f0da27a0353246611f1 [0,1,0,1,0,0|1,0,0]=3 13624 B11R1.193 CCCN1CSCC1C(=O)O 33526ae8bccf71536cd41e10b08f1bf7 [0,1,0,1,0,0|1,0,0]=3 13625 B11R1.193 CCCN1CSC[C@@H]1C(=O)O 649cf8fae54c1c1088922db51405da49 [0,1,0,1,0,0|1,0,0]=3 13626 B11R1.193 CCCN1CSC[C@H]1C(=O)O 89f722a6ab4caf990426f9742195498f [0,1,0,1,0,0|1,0,0]=3 13627 B11R1.193 CCNC1C=CCC1C(=O)O 99c68a279b8782ced6d2f30b9b1ce53c [0,1,0,1,0,0|0,0,2]=4 13628 B11R1.193 CCNC1COCC1C(=O)N 757feea57d6684ca62be79c0fa9150c7 [0,1,0,1,0,0|2,0,0]=4 13629 B11R1.193 CCN[C@@H]1CCC[C@@H]1C(=O)O b2ead36aea0026ad8ed16725daac4c95 [0,1,0,1,0,0|0,0,0]=2 13630 B11R1.193 CCN[C@@H]1COC[C@@H]1C(=O)N 9908b89cca4b5ee17aa08d715b07e413 [0,1,0,1,0,0|2,0,0]=4 13631 B11R1.193 CCN[C@@H]1COC[C@@H]1C(=O)O 7d81b8e3c741e5dc82a972a47b06950f [0,1,0,1,0,0|1,0,0]=3 13632 B11R1.193 CCN[C@@H]1COC[C@H]1C(=O)N ca55d494368812539af7df2901d5280a [0,1,0,1,0,0|2,0,0]=4 13633 B11R1.193 CCN[C@@H]1COC[C@H]1C(=O)O e4064d0f4b6359ba24feea558387a737 [0,1,0,1,0,0|1,0,0]=3 13634 B11R1.193 CCN[C@H]1CCC[C@@H]1C(=O)O a1d8cdb84c1ab2cc4fea18698e55320b [0,1,0,1,0,0|0,0,0]=2 13635 B11R1.193 CCN[C@H]1CCC[C@H]1C(=O)O 440dea2e0cba6f26d509a31d9785c0da [0,1,0,1,0,0|0,0,0]=2 13636 B11R1.193 CCN[C@H]1COC[C@@H]1C(=O)N 4477f3d7133a2d392efb341ed2a84417 [0,1,0,1,0,0|2,0,0]=4 13637 B11R1.193 CCN[C@H]1COC[C@@H]1C(=O)O fedef230878c22aeb195fbbc677439cb [0,1,0,1,0,0|1,0,0]=3 13638 B11R1.193 CCN[C@H]1COC[C@H]1C(=O)N b149e6052ba1af038548a1ec71b3da16 [0,1,0,1,0,0|2,0,0]=4 13639 B11R1.193 CCN[C@H]1COC[C@H]1C(=O)O 1ca08115f1b21789ab94fb088edb806b [0,1,0,1,0,0|1,0,0]=3 13640 B11R1.193 CCOC1CCCC1C(=O)N fd4361e5f7d2100add3537fe95f410ed [0,1,0,1,0,0|1,0,0]=3 13641 B11R1.193 CCOC1CCCC1C(=O)O 6ad27e553386c0a619230f65cf1d4ee8 [0,1,0,1,0,0|0,0,0]=2 13642 B11R1.193 CCO[C@@H]1CCC[C@@H]1C(=O)O 51717747c2e0db16e69c0bef3ae1669c [0,1,0,1,0,0|0,0,0]=2 13643 B11R1.193 CCO[C@@H]1CCC[C@H]1C(=O)O 2f9295612b88cddd0cfa1365f5a6dac6 [0,1,0,1,0,0|0,0,0]=2 13644 B11R1.193 CCO[C@H]1CCC[C@H]1C(=O)O 6f30227e4b6c0e5ec303f7332c8a25fc [0,1,0,1,0,0|0,0,0]=2 13645 B11R1.193 COCC1CCCN1C(=O)C 7e153f859b4feb64a9692d36ebb9a7ce [0,1,0,1,0,0|2,0,0]=4 13646 B11R1.193 COCN1CCCC1C(=O)N 719c319fa8afa79f414a88b9b227d457 [0,1,0,1,0,0|2,0,0]=4 13647 B11R1.193 COCN1CCCC1C(=O)O d70ccb1f97b1d07fb81e9ccd96855ed1 [0,1,0,1,0,0|1,0,0]=3 13648 B11R1.193 COCN1CCC[C@@H]1C(=O)N 4da518ea97b80741a645f1c558d4b4e5 [0,1,0,1,0,0|2,0,0]=4 13649 B11R1.193 COCN1CCC[C@@H]1C(=O)O 04b355077c321b7ab19f468474bdbc37 [0,1,0,1,0,0|1,0,0]=3 13650 B11R1.193 COCN1CCC[C@H]1C(=O)N ac37229a39fa4b1f7dd2d65ca093f776 [0,1,0,1,0,0|2,0,0]=4 13651 B11R1.193 COCN1CCC[C@H]1C(=O)O 67d34329ad2e305b6818488e23648da5 [0,1,0,1,0,0|1,0,0]=3 13652 B11R1.193 COCN1CCSC1C(=O)O 286be3f4e547e78e0330efb2218921ca [0,1,0,1,0,0|2,0,0]=4 13653 B11R1.193 COCN1CSCC1C(=O)O 1541998206166bf7cbf33ac65f09c163 [0,1,0,1,0,0|2,0,0]=4 13654 B11R1.193 COCN1CSC[C@@H]1C(=O)O 360905969ef6c5dff795aad9a1461a7c [0,1,0,1,0,0|2,0,0]=4 13655 B11R1.193 COCN1CSC[C@H]1C(=O)O a32a8b52b309a0b391f02c10e14fd7e9 [0,1,0,1,0,0|2,0,0]=4 13656 B11R1.193 COC[C@@H]1CCCN1C(=O)C e8718aac3c934cd4ec76c7bc786a90f6 [0,1,0,1,0,0|2,0,0]=4 13657 B11R1.193 COC[C@H]1CCCN1C(=O)C fd08fc828ba86e1f3e0babc83b4b6a12 [0,1,0,1,0,0|2,0,0]=4 13658 B11R1.193 CSCC1CCCN1C(=O)C 57dd4f07173c6dc832c3ab34d3791f30 [0,1,0,1,0,0|2,0,0]=4 13659 B11R1.193 CSCN1CCCC1C(=O)N 16d257820d46e332ed55ad50a8f7b237 [0,1,0,1,0,0|2,0,0]=4 13660 B11R1.193 CSCN1CCCC1C(=O)O a48fc74dbc2a3a5e6bf44b3a61d887f4 [0,1,0,1,0,0|1,0,0]=3 13661 B11R1.193 CSCN1CCC[C@@H]1C(=O)N bcb3b88abb0369f7ce78ae0e47dc672d [0,1,0,1,0,0|2,0,0]=4 13662 B11R1.193 CSCN1CCC[C@@H]1C(=O)O 54d740731b18ede86277f10b9b883a0c [0,1,0,1,0,0|1,0,0]=3 13663 B11R1.193 CSCN1CCC[C@H]1C(=O)N c92bf10dcc8726f45e6ba5f2288e3267 [0,1,0,1,0,0|2,0,0]=4 13664 B11R1.193 CSCN1CCC[C@H]1C(=O)O 059540469c7d88b54cc6f17ab6e84a04 [0,1,0,1,0,0|1,0,0]=3 13665 B11R1.193 CSCN1CCSC1C(=O)O 373a8111904738934370b4b7b452be97 [0,1,0,1,0,0|2,0,0]=4 13666 B11R1.193 CSCN1CSCC1C(=O)O 14301955b3fb48abb5a58b5e2c1adec1 [0,1,0,1,0,0|2,0,0]=4 13667 B11R1.193 CSCN1CSC[C@@H]1C(=O)O 66b3dd873a181c2f2bface64d19a88a3 [0,1,0,1,0,0|2,0,0]=4 13668 B11R1.193 CSCN1CSC[C@H]1C(=O)O f362339f5f6552b37381b6af5e5b2e26 [0,1,0,1,0,0|2,0,0]=4 13669 B11R1.193 N#CCN1CCCC1C(=O)O 1984209d820eb3d6cea1480400ba0182 [0,1,0,1,0,0|1,0,1]=4 13670 B11R1.193 N#CCN1CCC[C@@H]1C(=O)O 0df5e2addba9388a0065e56d831b339e [0,1,0,1,0,0|1,0,1]=4 13671 B11R1.193 N#CCN1CCC[C@H]1C(=O)O c47fc42cd77aa045b2eb820b6738dd59 [0,1,0,1,0,0|1,0,1]=4 13672 B11R1.193 NC(=O)C1CCCC1OCF 3d31c0f1fe25115f1166211339e2ab78 [0,1,0,1,0,0|2,0,0]=4 13673 B11R1.193 NC(=O)C1CCCN1CCF ae02bcfd70ffc7a516f768724a8a3f78 [0,1,0,1,0,0|2,0,0]=4 13674 B11R1.193 NC(=O)C1CCCN1CCO df000aa2b14dc6a3880d5e7f9ec75c9a [0,1,0,1,0,0|2,0,0]=4 13675 B11R1.193 NC(=O)C1CCCN1CCS 3120ab3edd46a3a6b26e63b67dc5a62d [0,1,0,1,0,0|2,0,0]=4 13676 B11R1.193 NC(=O)[C@@H]1CCCN1CCF 80e604f39dcde5314a97c8fd2ba0ca79 [0,1,0,1,0,0|2,0,0]=4 13677 B11R1.193 NC(=O)[C@@H]1CCCN1CCO aae2b8f9195d54ec31a4a2325351d92f [0,1,0,1,0,0|2,0,0]=4 13678 B11R1.193 NC(=O)[C@@H]1CCCN1CCS f350fe78c2c657f8c8c2fcc7547bcd6e [0,1,0,1,0,0|2,0,0]=4 13679 B11R1.193 NC(=O)[C@H]1CCCN1CCF 8eba8db23c4ac56088d9b3223e7dc259 [0,1,0,1,0,0|2,0,0]=4 13680 B11R1.193 NC(=O)[C@H]1CCCN1CCO 0dc52836607be10064d443f300ae1e9d [0,1,0,1,0,0|2,0,0]=4 13681 B11R1.193 NC(=O)[C@H]1CCCN1CCS 4d1b022725377e9191daaac9031ea26c [0,1,0,1,0,0|2,0,0]=4 13682 B11R1.193 O=C(O)C1CCCC1OCF 221b6e44990c505f847e6ea476a5b2bf [0,1,0,1,0,0|1,0,0]=3 13683 B11R1.193 O=C(O)C1CCCN1CCF 0037817eaf90c09486502ddef2cef7ee [0,1,0,1,0,0|1,0,0]=3 13684 B11R1.193 O=C(O)C1CCCN1CCO 02323466b00d5b3db258cac6faa71d97 [0,1,0,1,0,0|1,0,0]=3 13685 B11R1.193 O=C(O)C1CCCN1CCS 367736afa66da1e4285904289c65cdac [0,1,0,1,0,0|1,0,0]=3 13686 B11R1.193 O=C(O)C1CSCN1CCF ebbe0888aca978261659bae3d22bcd15 [0,1,0,1,0,0|2,0,0]=4 13687 B11R1.193 O=C(O)C1CSCN1CCO 90968b4cd76efbbaa1e3ece40709966c [0,1,0,1,0,0|2,0,0]=4 13688 B11R1.193 O=C(O)C1CSCN1CCS 13622d8ed66d78a550eb97a8ad872131 [0,1,0,1,0,0|2,0,0]=4 13689 B11R1.193 O=C(O)C1SCCN1CCF d320ad1ac6a0269be0f2b932a77bc704 [0,1,0,1,0,0|2,0,0]=4 13690 B11R1.193 O=C(O)C1SCCN1CCO e3b2ac4a21d2d090dc5f22cb64447796 [0,1,0,1,0,0|2,0,0]=4 13691 B11R1.193 O=C(O)C1SCCN1CCS 2fa327701ba5d796f28ef40e237b4b55 [0,1,0,1,0,0|2,0,0]=4 13692 B11R1.193 O=C(O)[C@@H]1CCCN1CCF 5a8d7359c0e5bfb9c39a5805e38e909b [0,1,0,1,0,0|1,0,0]=3 13693 B11R1.193 O=C(O)[C@@H]1CCCN1CCO ea4e1f8ddd662905bdf353ccdeefaac3 [0,1,0,1,0,0|1,0,0]=3 13694 B11R1.193 O=C(O)[C@@H]1CCCN1CCS b22e0ff73dc1a6ffaa09ad78da27870c [0,1,0,1,0,0|1,0,0]=3 13695 B11R1.193 O=C(O)[C@@H]1CCC[C@@H]1NCF d2dc954a0af594d319fc00f35b9e6d45 [0,1,0,1,0,0|1,0,0]=3 13696 B11R1.193 O=C(O)[C@@H]1CCC[C@@H]1NCO edbeba536296e5ac2461e823518ccede [0,1,0,1,0,0|1,0,0]=3 13697 B11R1.193 O=C(O)[C@@H]1CCC[C@@H]1OCF 4c78155a0d36b8dfd114079cc3fa4a7a [0,1,0,1,0,0|1,0,0]=3 13698 B11R1.193 O=C(O)[C@@H]1CCC[C@H]1OCF 94b884409436cf3f44ca21e265bc6d44 [0,1,0,1,0,0|1,0,0]=3 13699 B11R1.193 O=C(O)[C@@H]1COC[C@@H]1NCF ba7e6f3f68e0b3ffcf6062a89bd8f024 [0,1,0,1,0,0|2,0,0]=4 13700 B11R1.193 O=C(O)[C@@H]1COC[C@@H]1NCO 1492bf7651f47fa69c6169f9af2adbec [0,1,0,1,0,0|2,0,0]=4 13701 B11R1.193 O=C(O)[C@@H]1COC[C@H]1NCF c76e4e2373e9e3ec3ab774664367d21e [0,1,0,1,0,0|2,0,0]=4 13702 B11R1.193 O=C(O)[C@@H]1COC[C@H]1NCO 03d512ea558210164379c71fdecdf107 [0,1,0,1,0,0|2,0,0]=4 13703 B11R1.193 O=C(O)[C@@H]1CSCN1CCF c4b2a3d595e92f4cacedb26a7b50035d [0,1,0,1,0,0|2,0,0]=4 13704 B11R1.193 O=C(O)[C@@H]1CSCN1CCO db95985949d109a4a3a628b19378a996 [0,1,0,1,0,0|2,0,0]=4 13705 B11R1.193 O=C(O)[C@@H]1CSCN1CCS 2e3a7ed23b37c60b66cb185bd239e193 [0,1,0,1,0,0|2,0,0]=4 13706 B11R1.193 O=C(O)[C@H]1CCCN1CCF f146a1d7287e4f1df93392aeed24f9da [0,1,0,1,0,0|1,0,0]=3 13707 B11R1.193 O=C(O)[C@H]1CCCN1CCO 0dfe3149168fd7335620ca286efb877f [0,1,0,1,0,0|1,0,0]=3 13708 B11R1.193 O=C(O)[C@H]1CCCN1CCS 266421005a3f5018c5d7c473810c7fd7 [0,1,0,1,0,0|1,0,0]=3 13709 B11R1.193 O=C(O)[C@H]1CCC[C@@H]1NCF 382c83b7e8097118f94a1bd03ca17ddb [0,1,0,1,0,0|1,0,0]=3 13710 B11R1.193 O=C(O)[C@H]1CCC[C@@H]1NCO 415db64b2a99e568f980f51c8ccd6689 [0,1,0,1,0,0|1,0,0]=3 13711 B11R1.193 O=C(O)[C@H]1CCC[C@H]1NCF 92ebc06c5a33e08f5f7967cb82455328 [0,1,0,1,0,0|1,0,0]=3 13712 B11R1.193 O=C(O)[C@H]1CCC[C@H]1NCO e10a84110579d44386cb06277e13de1b [0,1,0,1,0,0|1,0,0]=3 13713 B11R1.193 O=C(O)[C@H]1CCC[C@H]1OCF 3c79c23f3d7c54b05c716a7d0956740d [0,1,0,1,0,0|1,0,0]=3 13714 B11R1.193 O=C(O)[C@H]1COC[C@@H]1NCF ecf1679efdb8b47f49f0fbbb534f169f [0,1,0,1,0,0|2,0,0]=4 13715 B11R1.193 O=C(O)[C@H]1COC[C@@H]1NCO a137e762b1e8b356af1456588d903e98 [0,1,0,1,0,0|2,0,0]=4 13716 B11R1.193 O=C(O)[C@H]1COC[C@H]1NCF b403d3b07a730100616f928f8ae94817 [0,1,0,1,0,0|2,0,0]=4 13717 B11R1.193 O=C(O)[C@H]1COC[C@H]1NCO 367fa115668dacb4fb466b39f14aedeb [0,1,0,1,0,0|2,0,0]=4 13718 B11R1.193 O=C(O)[C@H]1CSCN1CCF e55289cb29c54cdd19d56016d7ab3a9f [0,1,0,1,0,0|2,0,0]=4 13719 B11R1.193 O=C(O)[C@H]1CSCN1CCO 8caf698b8e2705469220c5fd42495e9c [0,1,0,1,0,0|2,0,0]=4 13720 B11R1.193 O=C(O)[C@H]1CSCN1CCS b31b10bfbeac1bba3896b8a23a272a36 [0,1,0,1,0,0|2,0,0]=4 13721 B11R1.193 O=CCN1CCCC1C(=O)O 7de9ca13b3da089b68cd97bac03df69b [0,1,0,1,0,0|1,0,1]=4 13722 B11R1.193 O=CCN1CCC[C@@H]1C(=O)O 016b18246e7228612d1cd9dfd9642256 [0,1,0,1,0,0|1,0,1]=4 13723 B11R1.193 O=CCN1CCC[C@H]1C(=O)O dd8db14c04d73065d388215a908b56f8 [0,1,0,1,0,0|1,0,1]=4 13724 B11R1.204 C#CCCN1CCC1C(=O)O a01f37e9b9f1fab1045fbae0a5796897 [0,1,0,1,0,0|0,0,2]=4 13725 B11R1.204 C#CCCN1CC[C@@H]1C(=O)O e5e57f5f23898ddf63f9333761a64df9 [0,1,0,1,0,0|0,0,2]=4 13726 B11R1.204 C#CCCN1CC[C@H]1C(=O)O 116a3a8e172d3fd1dac9ccbbb44fc2b6 [0,1,0,1,0,0|0,0,2]=4 13727 B11R1.204 C#CCN[C@H]1CC[C@H]1C(=O)O 9857066dcef80aed4b40d783690fccc4 [0,1,0,1,0,0|0,0,2]=4 13728 B11R1.204 C#CCOC1CCC1C(=O)O df40add306c6f32e84d64317dc73e9cc [0,1,0,1,0,0|0,0,2]=4 13729 B11R1.204 C#CCO[C@H]1CC[C@@H]1C(=O)O f0430d6bce3d7b22a3d32c19355fe8f9 [0,1,0,1,0,0|0,0,2]=4 13730 B11R1.204 C/C=C/CN1CCC1C(=O)O b036779879d9b5c622fb521a33af7f10 [0,1,0,1,0,0|0,0,2]=4 13731 B11R1.204 C/C=C/CN1CC[C@@H]1C(=O)O 4adbee9af18f31265ba91e436bf252f9 [0,1,0,1,0,0|0,0,2]=4 13732 B11R1.204 C/C=C/CN1CC[C@H]1C(=O)O 5c037ca39649e98797be54d5c968f8fe [0,1,0,1,0,0|0,0,2]=4 13733 B11R1.204 C/C=C\CN1CCC1C(=O)O 5ac54434cef31f8ee4770d72cd65d73c [0,1,0,1,0,0|0,0,2]=4 13734 B11R1.204 C/C=C\CN1CC[C@@H]1C(=O)O 83addb0d1f60908364bf25722946a7aa [0,1,0,1,0,0|0,0,2]=4 13735 B11R1.204 C/C=C\CN1CC[C@H]1C(=O)O 7eef6fe23c13350ea278348df9e14d82 [0,1,0,1,0,0|0,0,2]=4 13736 B11R1.204 C=CCCN1CCC1C(=O)O 1d34230b6274f4b4df12e6b909c2a3ee [0,1,0,1,0,0|0,0,2]=4 13737 B11R1.204 C=CCCN1CC[C@@H]1C(=O)O cc12471f3a7b983c2095798cf10725f3 [0,1,0,1,0,0|0,0,2]=4 13738 B11R1.204 C=CCCN1CC[C@H]1C(=O)O b824ccb712c0dd483d1835d9785d53c6 [0,1,0,1,0,0|0,0,2]=4 13739 B11R1.204 C=CCN[C@H]1CC[C@H]1C(=O)O 8f5a4dfe70cb453f3cd215bc3b6f95fc [0,1,0,1,0,0|0,0,2]=4 13740 B11R1.204 C=CCOC1CCC1C(=O)O f1210f669823cfa5232670161cd9f884 [0,1,0,1,0,0|0,0,2]=4 13741 B11R1.204 C=CCO[C@H]1CC[C@@H]1C(=O)O 48f9497300149ef9047ffe8c76ded960 [0,1,0,1,0,0|0,0,2]=4 13742 B11R1.204 CCCCN1CCC1C(=O)N 877ac2bccbf172ba801d482f60930910 [0,1,0,1,0,0|1,0,0]=3 13743 B11R1.204 CCCCN1CCC1C(=O)O 8298e08b6554f3fe7f1b8d755279c31e [0,1,0,1,0,0|0,0,0]=2 13744 B11R1.204 CCCCN1CC[C@@H]1C(=O)N 698612b63b467f62d6160e592acb5d0d [0,1,0,1,0,0|1,0,0]=3 13745 B11R1.204 CCCCN1CC[C@@H]1C(=O)O 7dd5a4d96c5dcd3d04108d2107d57ba8 [0,1,0,1,0,0|0,0,0]=2 13746 B11R1.204 CCCCN1CC[C@H]1C(=O)N cfb37d0d4e40d97136aac0b0c233ad5e [0,1,0,1,0,0|1,0,0]=3 13747 B11R1.204 CCCCN1CC[C@H]1C(=O)O b7bbf6011c4c86be157fa03063191389 [0,1,0,1,0,0|0,0,0]=2 13748 B11R1.204 CCCN[C@H]1CC[C@H]1C(=O)O e4c0c939806a7fd20a2d3b482bededef [0,1,0,1,0,0|0,0,0]=2 13749 B11R1.204 CCCOC1CCC1C(=O)O 00da8a733746f7d0f18d57eb19dd8dae [0,1,0,1,0,0|0,0,0]=2 13750 B11R1.204 CCCO[C@H]1CC[C@@H]1C(=O)O 465aae9b3e97cc4fb1e524e0e4f66fde [0,1,0,1,0,0|0,0,0]=2 13751 B11R1.204 CCOCC1CCN1C(=O)C 01a89ac32b4fcee27e8db9e3d6f40692 [0,1,0,1,0,0|2,0,0]=4 13752 B11R1.204 CCOCN1CCC1C(=O)N abd3197abd8cf909b150a1d051bd620d [0,1,0,1,0,0|2,0,0]=4 13753 B11R1.204 CCOCN1CCC1C(=O)O 1082aae0c80b04ed01c2e8e11ee2099e [0,1,0,1,0,0|1,0,0]=3 13754 B11R1.204 CCOCN1CC[C@@H]1C(=O)N b2ce1dd24825b382c25c772b961cca1e [0,1,0,1,0,0|2,0,0]=4 13755 B11R1.204 CCOCN1CC[C@@H]1C(=O)O 1a5808a5bd29b3511a14abf6ee30c58f [0,1,0,1,0,0|1,0,0]=3 13756 B11R1.204 CCOCN1CC[C@H]1C(=O)N 7f929c1c3d8d39b06f21f863f88c089a [0,1,0,1,0,0|2,0,0]=4 13757 B11R1.204 CCOCN1CC[C@H]1C(=O)O 88a54b5a680f30a6259ea166d8497aba [0,1,0,1,0,0|1,0,0]=3 13758 B11R1.204 COCCN1CCC1C(=O)N 676fda069bbd57a4a5b3224afc1f46dd [0,1,0,1,0,0|2,0,0]=4 13759 B11R1.204 COCCN1CCC1C(=O)O 56675e5814972a2b0d0da18af4af4462 [0,1,0,1,0,0|1,0,0]=3 13760 B11R1.204 COCCN1CC[C@@H]1C(=O)N e785ed8550524fcc2b5e46a3d09fd67b [0,1,0,1,0,0|2,0,0]=4 13761 B11R1.204 COCCN1CC[C@@H]1C(=O)O 0dbffcbf24fd1586d18424c150ea729f [0,1,0,1,0,0|1,0,0]=3 13762 B11R1.204 COCCN1CC[C@H]1C(=O)N fdf9e89d997a9212cf01a1efaa155134 [0,1,0,1,0,0|2,0,0]=4 13763 B11R1.204 COCCN1CC[C@H]1C(=O)O ca0ff058d612df76c282b60ae15ee576 [0,1,0,1,0,0|1,0,0]=3 13764 B11R1.204 COCN[C@H]1CC[C@H]1C(=O)O 24c84c1d9d0b38103c48fb7577512e26 [0,1,0,1,0,0|1,0,0]=3 13765 B11R1.204 COCOC1CCC1C(=O)O 7e43d31a45af1556e5229ea5b7eccf77 [0,1,0,1,0,0|1,0,0]=3 13766 B11R1.204 COCO[C@H]1CC[C@@H]1C(=O)O 4a01439e82e68762e89a4a3a3734ea3e [0,1,0,1,0,0|1,0,0]=3 13767 B11R1.204 CSCCN1CCC1C(=O)N 5e9778eed016d70cbf34638c3fbe2c4a [0,1,0,1,0,0|2,0,0]=4 13768 B11R1.204 CSCCN1CCC1C(=O)O 24a328aab7f0acda4694e92de8fcc9fa [0,1,0,1,0,0|1,0,0]=3 13769 B11R1.204 CSCCN1CC[C@@H]1C(=O)N e0381cd3d3ca0ca755cbb11f97708946 [0,1,0,1,0,0|2,0,0]=4 13770 B11R1.204 CSCCN1CC[C@@H]1C(=O)O d49edfb710d3a14b178e6dcde8378cfd [0,1,0,1,0,0|1,0,0]=3 13771 B11R1.204 CSCCN1CC[C@H]1C(=O)N f8638d302fd432ad8a11ef2e919afbb1 [0,1,0,1,0,0|2,0,0]=4 13772 B11R1.204 CSCCN1CC[C@H]1C(=O)O 40bc2c45cc79a5cd402770dbcfca85a4 [0,1,0,1,0,0|1,0,0]=3 13773 B11R1.204 CSCN[C@H]1CC[C@H]1C(=O)O f26a0e641c5312f177e8d592147df5a6 [0,1,0,1,0,0|1,0,0]=3 13774 B11R1.204 CSCOC1CCC1C(=O)O 4a3596f56659070cc249c9b3ffb95538 [0,1,0,1,0,0|1,0,0]=3 13775 B11R1.204 CSCO[C@H]1CC[C@@H]1C(=O)O efda73396f8b5f4ef03e75bec5ec0e69 [0,1,0,1,0,0|1,0,0]=3 13776 B11R1.204 N#CCCN1CCC1C(=O)O b4fb83f4d07cddfa9a08653ed0a68008 [0,1,0,1,0,0|1,0,1]=4 13777 B11R1.204 N#CCCN1CC[C@@H]1C(=O)O 37fcea4550b3b8ad13ad09edf494941f [0,1,0,1,0,0|1,0,1]=4 13778 B11R1.204 N#CCCN1CC[C@H]1C(=O)O 2d7702338c4c13827de27c9f8aaa1b74 [0,1,0,1,0,0|1,0,1]=4 13779 B11R1.204 N#CCN[C@H]1CC[C@H]1C(=O)O 4a080d5cf51589eb865494eac3a93ce3 [0,1,0,1,0,0|1,0,1]=4 13780 B11R1.204 N#CCOC1CCC1C(=O)O e66c9efaf3838ce465f05ce67337abec [0,1,0,1,0,0|1,0,1]=4 13781 B11R1.204 N#CCO[C@H]1CC[C@@H]1C(=O)O a95aeb51ac0bdf1e8b85a1de7a2eedf9 [0,1,0,1,0,0|1,0,1]=4 13782 B11R1.204 NC(=O)C1CCN1CCCF 29c76ec62803d7e8a738a0f5ce885324 [0,1,0,1,0,0|2,0,0]=4 13783 B11R1.204 NC(=O)C1CCN1CCCO 8cdcda7f2564a8cdbfcbb29b7d20aedd [0,1,0,1,0,0|2,0,0]=4 13784 B11R1.204 NC(=O)C1CCN1CCCS 33e22647a5d991c76b7d966877d2f6ee [0,1,0,1,0,0|2,0,0]=4 13785 B11R1.204 NC(=O)[C@@H]1CCN1CCCF 6ce29c97cf946e56597997a30a784ec4 [0,1,0,1,0,0|2,0,0]=4 13786 B11R1.204 NC(=O)[C@@H]1CCN1CCCO dc690e5ac68fb91c24592939398e3d8d [0,1,0,1,0,0|2,0,0]=4 13787 B11R1.204 NC(=O)[C@@H]1CCN1CCCS 514479b5135863b0ff387f55958bda00 [0,1,0,1,0,0|2,0,0]=4 13788 B11R1.204 NC(=O)[C@H]1CCN1CCCF 8bb218e54fb177dc4cac8dddba9299b4 [0,1,0,1,0,0|2,0,0]=4 13789 B11R1.204 NC(=O)[C@H]1CCN1CCCO ade2382e631a9265309937f8958954b7 [0,1,0,1,0,0|2,0,0]=4 13790 B11R1.204 NC(=O)[C@H]1CCN1CCCS 5e5cff7902765e1d0c5a70e8fcd63897 [0,1,0,1,0,0|2,0,0]=4 13791 B11R1.204 O=C(O)C1CCC1OCCF 6e49fc4f6d909158676d8d0e4af11484 [0,1,0,1,0,0|1,0,0]=3 13792 B11R1.204 O=C(O)C1CCC1OCCS 67b0593f569b8a7f366dc7714de420f3 [0,1,0,1,0,0|1,0,0]=3 13793 B11R1.204 O=C(O)C1CCN1CCCF 4ac2b68dcdb0bc7b8337bcf1271174d7 [0,1,0,1,0,0|1,0,0]=3 13794 B11R1.204 O=C(O)C1CCN1CCCO 8ab43805cb260b789eac396b2be4c346 [0,1,0,1,0,0|1,0,0]=3 13795 B11R1.204 O=C(O)C1CCN1CCCS dc3a33800184bdff4f9a34d8a473ab63 [0,1,0,1,0,0|1,0,0]=3 13796 B11R1.204 O=C(O)[C@@H]1CCN1CCCF 64813008ddf3a84f2a100959df402bfb [0,1,0,1,0,0|1,0,0]=3 13797 B11R1.204 O=C(O)[C@@H]1CCN1CCCO 79f7864e57e0122c81d71b3ae96f24ad [0,1,0,1,0,0|1,0,0]=3 13798 B11R1.204 O=C(O)[C@@H]1CCN1CCCS f91321534c17abdfc2e3e64859713cc0 [0,1,0,1,0,0|1,0,0]=3 13799 B11R1.204 O=C(O)[C@@H]1CC[C@@H]1NCCF 8dd71a99c1f8db750de649e7fa44294b [0,1,0,1,0,0|1,0,0]=3 13800 B11R1.204 O=C(O)[C@@H]1CC[C@@H]1NCCO 368174207c83a8cd03c05cf6ac29c1ce [0,1,0,1,0,0|1,0,0]=3 13801 B11R1.204 O=C(O)[C@@H]1CC[C@@H]1NCCS e0b833a28c1a0f8db0bfd58408f055e1 [0,1,0,1,0,0|1,0,0]=3 13802 B11R1.204 O=C(O)[C@H]1CCN1CCCF 07b70b85d8c145c1e6de616d4dbbead0 [0,1,0,1,0,0|1,0,0]=3 13803 B11R1.204 O=C(O)[C@H]1CCN1CCCO 1850db7d506395b58e97215892097e17 [0,1,0,1,0,0|1,0,0]=3 13804 B11R1.204 O=C(O)[C@H]1CCN1CCCS 9d215c744a1baf1f9f8cebc6889c92c9 [0,1,0,1,0,0|1,0,0]=3 13805 B11R1.204 O=C(O)[C@H]1CC[C@@H]1OCCF 273ca64d1a4c67ba8ca725f93fb9f403 [0,1,0,1,0,0|1,0,0]=3 13806 B11R1.204 O=C(O)[C@H]1CC[C@@H]1OCCS d98a4cf740a6eee3e5adcd6088eb707e [0,1,0,1,0,0|1,0,0]=3 13807 B11R1.204 O=CCCN1CCC1C(=O)O f13b2d3a1f7b49080efcbf9875a4508e [0,1,0,1,0,0|1,0,1]=4 13808 B11R1.204 O=CCCN1CC[C@@H]1C(=O)O 32b7c3da81ebf24c6c3fd69d590d2ced [0,1,0,1,0,0|1,0,1]=4 13809 B11R1.204 O=CCCN1CC[C@H]1C(=O)O 0b8ae54712af811622b0a3d8d47fa8c0 [0,1,0,1,0,0|1,0,1]=4 13810 B11R1.204 O=CCN[C@H]1CC[C@H]1C(=O)O 5888f3519d8b98924780b12c1bd230e8 [0,1,0,1,0,0|1,0,1]=4 13811 B11R1.204 O=CCOC1CCC1C(=O)O 9f6a96aef54a9c716492f04b4ffcb776 [0,1,0,1,0,0|1,0,1]=4 13812 B11R1.204 O=CCO[C@H]1CC[C@@H]1C(=O)O 40d0c38a9bbda3a5c90c5d4d2ebf2d9e [0,1,0,1,0,0|1,0,1]=4 13813 B11R1.233 CCCNC1CCCC1(C)O abfaa72394c628afaf72d4d43012f817 [0,1,0,1,0,0|1,0,1]=4 13814 B11R1.233 CCCN[C@@H]1CCC[C@@]1(C)O f77f495705152282870eef75ccd6d503 [0,1,0,1,0,0|1,0,1]=4 13815 B11R1.233 CCCN[C@H]1CCC[C@]1(C)O ecb4f2c5f4fbf9c549c5b8d3e3cbda1e [0,1,0,1,0,0|1,0,1]=4 13816 B11R1.233 CCOCC1CCCS1(=O)=O 3112f4318fbbe237d9b7adb966c16347 [0,1,0,1,0,0|1,0,1]=4 13817 B11R1.271 C=C(C)CCN1CCC1CC dbb67581fc466057b880620209d14e8c [0,1,0,1,0,0|2,0,0]=4 13818 B11R1.271 CC(=O)CCN1CCC1CO 41b11ac96e47ec7e8591c71ed93bf3b1 [0,1,0,1,0,0|2,0,0]=4 13819 B11R1.271 CC(=O)CCN1CC[C@@H]1CO b83989d0da8da0f865d462c58d5038d0 [0,1,0,1,0,0|2,0,0]=4 13820 B11R1.271 CC(=O)CCN1CC[C@H]1CO 05a02487540a399816548854810da211 [0,1,0,1,0,0|2,0,0]=4 13821 B11R1.271 CCC1CCN1CCC(=O)C 2eb3d64a6424be11c57adb2d9d33c690 [0,1,0,1,0,0|1,0,0]=3 13822 B11R1.271 CCC1CCN1CCC(=O)N b52b1099f53950a8574600ae99fde181 [0,1,0,1,0,0|1,0,0]=3 13823 B11R1.271 CCC1CCN1CCC(=O)O e84f612a7a039741c8f99fcd9bab3ae6 [0,1,0,1,0,0|0,0,0]=2 13824 B11R1.271 CCC1CCN1CCC(C)O 3965e5badc1f26a1ed1c0eee323b10c8 [0,1,0,1,0,0|1,0,1]=4 13825 B11R1.271 CCC1CCN1CCS(=O)C 14bc6923e31177127ed79622eefd9984 [0,1,0,1,0,0|2,0,0]=4 13826 B11R1.271 CCC1CCN1COC(=O)C 2b971004fe7c5c25d205be8dff69feb7 [0,1,0,1,0,0|2,0,0]=4 13827 B11R1.271 CCC1CCN1CSC(=O)N b4bc81484e4de70290468d77bfc22005 [0,1,0,1,0,0|2,0,0]=4 13828 B11R1.271 COC1CCC1NCC(=O)N 9c055807e310d9281920fef12fcd5fbd [0,1,0,1,0,0|2,0,0]=4 13829 B11R1.271 COC1CCC1NCC(=O)O 4933db14ea229d028f10490c9c7c72ac [0,1,0,1,0,0|1,0,0]=3 13830 B11R1.271 CO[C@@H]1CC[C@@H]1NCC(=O)N 8bcd48852b443293ed632d773f5f7719 [0,1,0,1,0,0|2,0,0]=4 13831 B11R1.271 CO[C@@H]1CC[C@@H]1NCC(=O)O 0a353a67a7eed681fcba98cb46f6b1d9 [0,1,0,1,0,0|1,0,0]=3 13832 B11R1.271 CO[C@@H]1CC[C@H]1NCC(=O)N e82bd28e7d6386ed399411994b02e98d [0,1,0,1,0,0|2,0,0]=4 13833 B11R1.271 CO[C@@H]1CC[C@H]1NCC(=O)O bb6af8ede02f35a5a29edacb5314e245 [0,1,0,1,0,0|1,0,0]=3 13834 B11R1.271 CO[C@H]1CC[C@@H]1NCC(=O)N 9691c7037feb47ae788964ff9aab517d [0,1,0,1,0,0|2,0,0]=4 13835 B11R1.271 CO[C@H]1CC[C@@H]1NCC(=O)O f5f45b557e940712d10f9916457b51f6 [0,1,0,1,0,0|1,0,0]=3 13836 B11R1.271 CO[C@H]1CC[C@H]1NCC(=O)N afc9931652d3be8c60916d677c366723 [0,1,0,1,0,0|2,0,0]=4 13837 B11R1.271 CO[C@H]1CC[C@H]1NCC(=O)O f0c0c2eb71b3576250aab37a941b06cc [0,1,0,1,0,0|1,0,0]=3 13838 B11R1.271 NC(=O)CCN1CCC1CO ae6579203fe8665940d96e6b0cb273c6 [0,1,0,1,0,0|2,0,0]=4 13839 B11R1.271 NC(=O)CCN1CC[C@@H]1CO 7722b7719151d24e8afdd474dd6b80f7 [0,1,0,1,0,0|2,0,0]=4 13840 B11R1.271 NC(=O)CCN1CC[C@H]1CO 4ad5176b03dc135fc370fb5028aa8f07 [0,1,0,1,0,0|2,0,0]=4 13841 B11R1.271 O=C(O)CCN1CCC1CO ea2463413f834b147c87b16e9134e348 [0,1,0,1,0,0|1,0,0]=3 13842 B11R1.271 O=C(O)CCN1CC[C@@H]1CO 5c165e96e773bde8857c5442fea80352 [0,1,0,1,0,0|1,0,0]=3 13843 B11R1.271 O=C(O)CCN1CC[C@H]1CO 708578ba803e17bd08257a6a6b3f3b69 [0,1,0,1,0,0|1,0,0]=3 13844 B11R1.335 CCCNCC1CCS1(=O)=O 1fe007d38f611e9a9f4b62c811ebdfb2 [0,1,0,1,0,0|1,0,1]=4 13845 B11R1.335 CCCOCC1CCS1(=O)=O b925b744cd92dbe38c458bc01a0c00ac [0,1,0,1,0,0|1,0,1]=4 13846 B11R1.706 CC(=O)N1CCCCCCC1 ff71a082476683b4f8504acf30a24baa [0,1,0,1,0,0|1,0,0]=3 13847 B11R1.742 C=C(Br)CN1CCCCCC1 6b0006f8629093efae0fb07bbec3d455 [0,1,0,1,0,0|2,0,0]=4 13848 B11R1.742 C=C(C)CN1CCCCCC1 3d6c0cf01754decf3759a226cfeac2c0 [0,1,0,1,0,0|2,0,0]=4 13849 B11R1.742 C=C(Cl)CN1CCCCCC1 6e83a9ab769ef396ecd2fc04328e0339 [0,1,0,1,0,0|2,0,0]=4 13850 B11R1.742 C=C(F)CN1CCCCCC1 0fd8a06802a7275c113575f4343f0836 [0,1,0,1,0,0|2,0,0]=4 13851 B11R1.742 CC(=O)NC1CCCCCC1 980c21986259e09356273dbf1a23f9df [0,1,0,1,0,0|1,0,0]=3 13852 B11R1.742 CC(=O)NC1CCCOCC1 faa609e7c510cdc55c5bbc154131a5e7 [0,1,0,1,0,0|2,0,0]=4 13853 B11R1.742 CC(O)CN1CCCCCC1 498903f6d699cdaa1a577d829993a3fc [0,1,0,1,0,0|1,0,1]=4 13854 B11R1.742 C[C@@H](O)CN1CCCCCC1 ba89f8f9782a716134051a422cfdfc47 [0,1,0,1,0,0|1,0,1]=4 13855 B11R1.742 C[C@H](O)CN1CCCCCC1 4c725979e3b71bae8b90837911fd64ef [0,1,0,1,0,0|1,0,1]=4 13856 B11R1.742 NC(=O)CN1CCCCCC1 3c6bdaed56195046700c5f9a02a73e34 [0,1,0,1,0,0|1,0,0]=3 13857 B11R1.742 NC(=O)CN1CCCOCC1 916ad609f21f064a7486c06fea619804 [0,1,0,1,0,0|2,0,0]=4 13858 B11R1.742 O=C(O)CN1CCCCCC1 d9f9edaddb25360088e69733dfba1666 [0,1,0,1,0,0|0,0,0]=2 13859 B11R1.742 O=C(O)CN1CCCOCC1 621646c1635481e8abe6c4a7848bde48 [0,1,0,1,0,0|1,0,0]=3 13860 B11R1.742 O=[N+]([O-])CN1CCCCCC1 dd86900d3a245fd05818761ea9faca87 [0,1,0,1,0,0|1,0,1]=4 13861 B11R1.753 C#CCCN[C@@H]1C[C@@H]1C(=O)O 1753f1bf6ec6ce09efdc6b29dc862c74 [0,1,0,1,0,0|0,0,2]=4 13862 B11R1.753 C#CCCN[C@H]1C[C@@H]1C(=O)O 8d71de2d3490ade59ccb6f8697e67afb [0,1,0,1,0,0|0,0,2]=4 13863 B11R1.753 C#CCCN[C@H]1C[C@H]1C(=O)O 36cde70b22a96db0e5072eeb1914257d [0,1,0,1,0,0|0,0,2]=4 13864 B11R1.753 C#CCCO[C@@H]1C[C@@H]1C(=O)O e8d85f9ee47e66537450224ad9e9ed6d [0,1,0,1,0,0|0,0,2]=4 13865 B11R1.753 C#CCCO[C@H]1C[C@@H]1C(=O)O de6fcc34bbffa5d0a44e32c299e50932 [0,1,0,1,0,0|0,0,2]=4 13866 B11R1.753 C#CCCO[C@H]1C[C@H]1C(=O)O dbdfe104dc5a4ec669ad0e85bc13f794 [0,1,0,1,0,0|0,0,2]=4 13867 B11R1.753 C#CCNCC1CC1C(=O)O 089d054b94d63da25073b02a904485d1 [0,1,0,1,0,0|0,0,2]=4 13868 B11R1.753 C#CCNC[C@@H]1C[C@H]1C(=O)O 36865641ed74a87c70b3f139d3cc0046 [0,1,0,1,0,0|0,0,2]=4 13869 B11R1.753 C#CCOCC1CC1C(=O)O 5ab66e3ac57d2ec2758af98ac5bb921d [0,1,0,1,0,0|0,0,2]=4 13870 B11R1.753 C#CCOC[C@@H]1C[C@H]1C(=O)O d8aaf297772e82197c9ef48546761a4c [0,1,0,1,0,0|0,0,2]=4 13871 B11R1.753 C#CCOC[C@H]1C[C@@H]1C(=O)O 964f5ecca2dd8d5cd51ed6bf9bf88de8 [0,1,0,1,0,0|0,0,2]=4 13872 B11R1.753 C#CCOC[C@H]1C[C@H]1C(=O)O cbd5c27e5007e568652e093cfad514e6 [0,1,0,1,0,0|0,0,2]=4 13873 B11R1.753 C/C=C/CO[C@@H]1C[C@@H]1C(=O)O a12e671392bc02772ab87f6225cb5a7c [0,1,0,1,0,0|0,0,2]=4 13874 B11R1.753 C/C=C/CO[C@H]1C[C@@H]1C(=O)O dc9c29324d7e2077f599a88fb7aa7fdd [0,1,0,1,0,0|0,0,2]=4 13875 B11R1.753 C/C=C/CO[C@H]1C[C@H]1C(=O)O 4111e0765b87433cf96eea8cf983ba3a [0,1,0,1,0,0|0,0,2]=4 13876 B11R1.753 C/C=C\CO[C@@H]1C[C@@H]1C(=O)O bb5011b94f1c9adedd848271d3b8d51a [0,1,0,1,0,0|0,0,2]=4 13877 B11R1.753 C/C=C\CO[C@H]1C[C@@H]1C(=O)O 721563e0bce8db17a5db3fb4e5212049 [0,1,0,1,0,0|0,0,2]=4 13878 B11R1.753 C/C=C\CO[C@H]1C[C@H]1C(=O)O 592296f0694e8fd884e44b23e1b36505 [0,1,0,1,0,0|0,0,2]=4 13879 B11R1.753 C=CCCN[C@@H]1C[C@@H]1C(=O)O d160567879bdb65c2938f901e5790c6e [0,1,0,1,0,0|0,0,2]=4 13880 B11R1.753 C=CCCN[C@H]1C[C@@H]1C(=O)O 6bd2f0c6e8ab983874b172535d88560e [0,1,0,1,0,0|0,0,2]=4 13881 B11R1.753 C=CCCN[C@H]1C[C@H]1C(=O)O 9b747fa44f7c51ec180166a3ba700c8d [0,1,0,1,0,0|0,0,2]=4 13882 B11R1.753 C=CCCO[C@@H]1C[C@@H]1C(=O)O 8a37be7d713a6b22a9272ace1c2d1064 [0,1,0,1,0,0|0,0,2]=4 13883 B11R1.753 C=CCCO[C@H]1C[C@@H]1C(=O)O 7431400137e95c475c5ec0a176ab5516 [0,1,0,1,0,0|0,0,2]=4 13884 B11R1.753 C=CCCO[C@H]1C[C@H]1C(=O)O f52ebc6fbc8b06c6195c0b4822f375b0 [0,1,0,1,0,0|0,0,2]=4 13885 B11R1.753 C=CCNC[C@@H]1C[C@H]1C(=O)O ee7ed553fba326c0918d4aa0d0d31968 [0,1,0,1,0,0|0,0,2]=4 13886 B11R1.753 C=CCOCC1CC1C(=O)O a86cd3991de6350ab6407520f2674b2a [0,1,0,1,0,0|0,0,2]=4 13887 B11R1.753 C=CCOC[C@@H]1C[C@H]1C(=O)O 210fccbcd2b9a92b54af183b757a9f00 [0,1,0,1,0,0|0,0,2]=4 13888 B11R1.753 C=CCOC[C@H]1C[C@@H]1C(=O)O 819349af3658b85209beb2a987606b96 [0,1,0,1,0,0|0,0,2]=4 13889 B11R1.753 C=CCOC[C@H]1C[C@H]1C(=O)O 85397cc3cb29dc2a73dd968976888551 [0,1,0,1,0,0|0,0,2]=4 13890 B11R1.753 CC#CCN[C@@H]1C[C@@H]1C(=O)O ecf886c251b402dd4bae58e5ce38752c [0,1,0,1,0,0|0,0,2]=4 13891 B11R1.753 CC#CCN[C@H]1C[C@@H]1C(=O)O 907b5cf784fdc18d6941febf235b5486 [0,1,0,1,0,0|0,0,2]=4 13892 B11R1.753 CC#CCN[C@H]1C[C@H]1C(=O)O f123b554381e30a9e3815a5072efe340 [0,1,0,1,0,0|0,0,2]=4 13893 B11R1.753 CC#CCO[C@@H]1C[C@@H]1C(=O)O 7786ac598e09c954fc83a92cdbf99b8a [0,1,0,1,0,0|0,0,2]=4 13894 B11R1.753 CC#CCO[C@H]1C[C@@H]1C(=O)O 7d1a037c71a6a88070eb949180bcf4e4 [0,1,0,1,0,0|0,0,2]=4 13895 B11R1.753 CC#CCO[C@H]1C[C@H]1C(=O)O 114ff5e36a715d12156b735e9d7be1bb [0,1,0,1,0,0|0,0,2]=4 13896 B11R1.753 CC=CCN[C@@H]1C[C@@H]1C(=O)O 664e90404fdc064031891ca3a110fd93 [0,1,0,1,0,0|0,0,2]=4 13897 B11R1.753 CC=CCN[C@H]1C[C@@H]1C(=O)O 6f85c400fff874c53fec87b6e667c0e1 [0,1,0,1,0,0|0,0,2]=4 13898 B11R1.753 CC=CCN[C@H]1C[C@H]1C(=O)O 5f068d53eb3c748c7d880b34dea4d14e [0,1,0,1,0,0|0,0,2]=4 13899 B11R1.753 CC=CCO[C@@H]1C[C@@H]1C(=O)O 71f4defe805cf8052217200377b6ab91 [0,1,0,1,0,0|0,0,2]=4 13900 B11R1.753 CC=CCO[C@H]1C[C@@H]1C(=O)O 3a76313e4286f1e530bc1e419a688128 [0,1,0,1,0,0|0,0,2]=4 13901 B11R1.753 CC=CCO[C@H]1C[C@H]1C(=O)O 5694b5637e2af21c2ac0623d88a33e07 [0,1,0,1,0,0|0,0,2]=4 13902 B11R1.753 CCCCN[C@@H]1C[C@@H]1C(=O)O db3c084c35ab74f1c14ea8442c64b333 [0,1,0,1,0,0|0,0,0]=2 13903 B11R1.753 CCCCN[C@H]1C[C@@H]1C(=O)O 229a9cd64fffff7130c10356433822e8 [0,1,0,1,0,0|0,0,0]=2 13904 B11R1.753 CCCCN[C@H]1C[C@H]1C(=O)O e24af68b59d7b0b94e24db2eac361e86 [0,1,0,1,0,0|0,0,0]=2 13905 B11R1.753 CCCCO[C@@H]1C[C@@H]1C(=O)O 662037177b8dfc58b8c695dacf12fa4f [0,1,0,1,0,0|0,0,0]=2 13906 B11R1.753 CCCCO[C@H]1C[C@@H]1C(=O)O bdee004caa1db9cfdd5e5cca38f9113c [0,1,0,1,0,0|0,0,0]=2 13907 B11R1.753 CCCCO[C@H]1C[C@H]1C(=O)O 2c0fe3d19e438fbe43fd102329f11d10 [0,1,0,1,0,0|0,0,0]=2 13908 B11R1.753 CCCNCC1CC1C(=O)O d2495a7fe19530b2321a1e958134dcbc [0,1,0,1,0,0|0,0,0]=2 13909 B11R1.753 CCCNC[C@@H]1C[C@H]1C(=O)O 8f0cc9b122b98a3c1d47d4bf21d609f6 [0,1,0,1,0,0|0,0,0]=2 13910 B11R1.753 CCCOCC1CC1C(=O)O 44bbc672bbd400411d06d5b51e247fdc [0,1,0,1,0,0|0,0,0]=2 13911 B11R1.753 CCCOC[C@@H]1C[C@H]1C(=O)O cdedbc42167dbb206eeb61876a11f8a1 [0,1,0,1,0,0|0,0,0]=2 13912 B11R1.753 CCCOC[C@H]1C[C@@H]1C(=O)O 4772a80891634c38abd65d32a4492dc1 [0,1,0,1,0,0|0,0,0]=2 13913 B11R1.753 CCCOC[C@H]1C[C@H]1C(=O)O 8514432f931e742bb262b00483aa1702 [0,1,0,1,0,0|0,0,0]=2 13914 B11R1.753 COCCN[C@@H]1C[C@@H]1C(=O)O 3375097ee748b0a04ef2c05f4dc1c146 [0,1,0,1,0,0|1,0,0]=3 13915 B11R1.753 COCCN[C@H]1C[C@@H]1C(=O)O eb35997e1e34f8043f282b11ebd9a16e [0,1,0,1,0,0|1,0,0]=3 13916 B11R1.753 COCCN[C@H]1C[C@H]1C(=O)O fcabf3c81e35103660f0267baaeeed59 [0,1,0,1,0,0|1,0,0]=3 13917 B11R1.753 COCCO[C@@H]1C[C@@H]1C(=O)O 8e032448725a96730bfb23a1fb0dea59 [0,1,0,1,0,0|1,0,0]=3 13918 B11R1.753 COCCO[C@H]1C[C@@H]1C(=O)O 252cd8e1dc4de528bc597e47169be548 [0,1,0,1,0,0|1,0,0]=3 13919 B11R1.753 COCCO[C@H]1C[C@H]1C(=O)O ebe335c2030b723e435cdc6f006a9c96 [0,1,0,1,0,0|1,0,0]=3 13920 B11R1.753 COCNC[C@@H]1C[C@H]1C(=O)O 71ba7e828e644dc3051e732c8925b85c [0,1,0,1,0,0|1,0,0]=3 13921 B11R1.753 COCOCC1CC1C(=O)O ef536e948927ce9af960c8b40a3e1102 [0,1,0,1,0,0|1,0,0]=3 13922 B11R1.753 COCOC[C@@H]1C[C@H]1C(=O)O 23394443416bd88b94e69c034d102fd9 [0,1,0,1,0,0|1,0,0]=3 13923 B11R1.753 COCOC[C@H]1C[C@@H]1C(=O)O a83b950046f89cbd20213be372cb2e20 [0,1,0,1,0,0|1,0,0]=3 13924 B11R1.753 COCOC[C@H]1C[C@H]1C(=O)O 82f2b22439f20240e1af5e6c16454545 [0,1,0,1,0,0|1,0,0]=3 13925 B11R1.753 CSCCN[C@@H]1C[C@@H]1C(=O)O 83634238939b1cd77741e474493bb706 [0,1,0,1,0,0|1,0,0]=3 13926 B11R1.753 CSCCN[C@H]1C[C@@H]1C(=O)O b16e3d70f28960314006d270fb6360fb [0,1,0,1,0,0|1,0,0]=3 13927 B11R1.753 CSCCN[C@H]1C[C@H]1C(=O)O 4f9187824a7f8acc7e0ef587e8c6101d [0,1,0,1,0,0|1,0,0]=3 13928 B11R1.753 CSCCO[C@@H]1C[C@@H]1C(=O)O 0e89f4cfacacd8ef363e250fafced47a [0,1,0,1,0,0|1,0,0]=3 13929 B11R1.753 CSCCO[C@H]1C[C@@H]1C(=O)O 407cef3d22276f218796e3c7b494635c [0,1,0,1,0,0|1,0,0]=3 13930 B11R1.753 CSCCO[C@H]1C[C@H]1C(=O)O 73efd78aae10fb9ce81b4fedfd140537 [0,1,0,1,0,0|1,0,0]=3 13931 B11R1.753 CSCNC[C@@H]1C[C@H]1C(=O)O d3471c69fd5cc2cd5de211c7c9febdbe [0,1,0,1,0,0|1,0,0]=3 13932 B11R1.753 CSCOCC1CC1C(=O)O e7a970f08a22fb11b92cb4beff9880db [0,1,0,1,0,0|1,0,0]=3 13933 B11R1.753 CSCOC[C@@H]1C[C@H]1C(=O)O 765e25e57b31335aadc2fd942582d69e [0,1,0,1,0,0|1,0,0]=3 13934 B11R1.753 CSCOC[C@H]1C[C@@H]1C(=O)O 1a3482a8406439713d3e564c3edffbec [0,1,0,1,0,0|1,0,0]=3 13935 B11R1.753 CSCOC[C@H]1C[C@H]1C(=O)O 97500ec278d1d8f9ac999f4ec2b1af9e [0,1,0,1,0,0|1,0,0]=3 13936 B11R1.753 N#CCCN[C@@H]1C[C@@H]1C(=O)O 2cbbd76ca630a5d6081bf3befe181e7a [0,1,0,1,0,0|1,0,1]=4 13937 B11R1.753 N#CCCN[C@H]1C[C@@H]1C(=O)O 0eb2370efcce0a4979084bcc232a2a04 [0,1,0,1,0,0|1,0,1]=4 13938 B11R1.753 N#CCCN[C@H]1C[C@H]1C(=O)O 177476bfc0bfc1d54829f9ad3147efbc [0,1,0,1,0,0|1,0,1]=4 13939 B11R1.753 N#CCCO[C@@H]1C[C@@H]1C(=O)O cbce54ce91863064cdfdf1f019271e95 [0,1,0,1,0,0|1,0,1]=4 13940 B11R1.753 N#CCCO[C@H]1C[C@@H]1C(=O)O a55b30b38501d632ddfdf99ef8442607 [0,1,0,1,0,0|1,0,1]=4 13941 B11R1.753 N#CCCO[C@H]1C[C@H]1C(=O)O 8138b30622d176e170909122c32ebed1 [0,1,0,1,0,0|1,0,1]=4 13942 B11R1.753 N#CCNCC1CC1C(=O)O 3d7658fd72600933a61d3cf1d2adf515 [0,1,0,1,0,0|1,0,1]=4 13943 B11R1.753 N#CCNC[C@@H]1C[C@H]1C(=O)O 41d75e55d83786cd85354f8ebb2c337e [0,1,0,1,0,0|1,0,1]=4 13944 B11R1.753 N#CCOCC1CC1C(=O)O dc63a4ab51c62edddc089d14348f894e [0,1,0,1,0,0|1,0,1]=4 13945 B11R1.753 N#CCOC[C@@H]1C[C@H]1C(=O)O fc741802fa3b216dbd591975930c4c95 [0,1,0,1,0,0|1,0,1]=4 13946 B11R1.753 N#CCOC[C@H]1C[C@@H]1C(=O)O b429a3e2e290c256b8cb99f6573d8c45 [0,1,0,1,0,0|1,0,1]=4 13947 B11R1.753 N#CCOC[C@H]1C[C@H]1C(=O)O dd2b6e57176cdff25e781572874bae46 [0,1,0,1,0,0|1,0,1]=4 13948 B11R1.753 NOCCN[C@@H]1C[C@@H]1C(=O)O fef7d9e87982e4699b43175c012fe0bf [0,1,0,1,0,0|2,0,0]=4 13949 B11R1.753 NOCCN[C@H]1C[C@@H]1C(=O)O e2a6d96a1fcd665c27279a6b01f30489 [0,1,0,1,0,0|2,0,0]=4 13950 B11R1.753 NOCCN[C@H]1C[C@H]1C(=O)O dad3c6965184621259dd4fdc750d6750 [0,1,0,1,0,0|2,0,0]=4 13951 B11R1.753 O=C(O)C1CC1CNCCBr 613c4a8584ad6bbd1e5231310444fa42 [0,1,0,1,0,0|1,0,0]=3 13952 B11R1.753 O=C(O)C1CC1CNCCF 554cd49e83439a72cd1511a1f8c2ac19 [0,1,0,1,0,0|1,0,0]=3 13953 B11R1.753 O=C(O)C1CC1CNCCI 70be7a545c447595172fbc79067560a7 [0,1,0,1,0,0|1,0,0]=3 13954 B11R1.753 O=C(O)C1CC1CNCCO 525e008d87b39ce55e0d657c7952d880 [0,1,0,1,0,0|1,0,0]=3 13955 B11R1.753 O=C(O)C1CC1CNCCS 16500a356c40049df1932af2fd4048a3 [0,1,0,1,0,0|1,0,0]=3 13956 B11R1.753 O=C(O)C1CC1COCCF d3a41741021e6893d4e0f983e696ff70 [0,1,0,1,0,0|1,0,0]=3 13957 B11R1.753 O=C(O)C1CC1COCCS 0afa142753d0ccd4544f2eb7095c21d2 [0,1,0,1,0,0|1,0,0]=3 13958 B11R1.753 O=C(O)[C@@H]1C[C@@H]1COCCF 929754616224ab97e44cf24c188fe649 [0,1,0,1,0,0|1,0,0]=3 13959 B11R1.753 O=C(O)[C@@H]1C[C@@H]1COCCS 9eb244d4fe36a32c810ad3759446ad86 [0,1,0,1,0,0|1,0,0]=3 13960 B11R1.753 O=C(O)[C@@H]1C[C@@H]1NCCCCl f190241a04090b3106533a044e998f65 [0,1,0,1,0,0|1,0,0]=3 13961 B11R1.753 O=C(O)[C@@H]1C[C@@H]1NCCCO da5afe448b2a198f041e26256e8efaa7 [0,1,0,1,0,0|1,0,0]=3 13962 B11R1.753 O=C(O)[C@@H]1C[C@@H]1OCCCF ec995c9ecef4fae4eddb328c9afb8c0f [0,1,0,1,0,0|1,0,0]=3 13963 B11R1.753 O=C(O)[C@@H]1C[C@@H]1OCCCS 5056ce99893e42628a325a6eee85129f [0,1,0,1,0,0|1,0,0]=3 13964 B11R1.753 O=C(O)[C@@H]1C[C@H]1CNCCBr c3f98165e0e8a8641f6ebe808543c258 [0,1,0,1,0,0|1,0,0]=3 13965 B11R1.753 O=C(O)[C@@H]1C[C@H]1CNCCF 649715748e2db98c4cb33905769f272b [0,1,0,1,0,0|1,0,0]=3 13966 B11R1.753 O=C(O)[C@@H]1C[C@H]1CNCCI 0ea2f810e18075672db67c7caec165fe [0,1,0,1,0,0|1,0,0]=3 13967 B11R1.753 O=C(O)[C@@H]1C[C@H]1CNCCO 70a2d1b020bb3b7602ad398b6e0d7dd2 [0,1,0,1,0,0|1,0,0]=3 13968 B11R1.753 O=C(O)[C@@H]1C[C@H]1CNCCS 493f836e7f6eff3c24ad8b102910918f [0,1,0,1,0,0|1,0,0]=3 13969 B11R1.753 O=C(O)[C@@H]1C[C@H]1COCCF 760dc26324fc0bf0799d9f3946c64472 [0,1,0,1,0,0|1,0,0]=3 13970 B11R1.753 O=C(O)[C@@H]1C[C@H]1COCCS c206dd22bb7ba70bc99445b9f543394d [0,1,0,1,0,0|1,0,0]=3 13971 B11R1.753 O=C(O)[C@H]1C[C@@H]1COCCF 4082c663467576536de83d092d98beda [0,1,0,1,0,0|1,0,0]=3 13972 B11R1.753 O=C(O)[C@H]1C[C@@H]1COCCS a9cb079712abf0e83a2ede8c9e12d83e [0,1,0,1,0,0|1,0,0]=3 13973 B11R1.753 O=C(O)[C@H]1C[C@@H]1NCCCCl a9d1173c23dc9ff3e0ec23279d398002 [0,1,0,1,0,0|1,0,0]=3 13974 B11R1.753 O=C(O)[C@H]1C[C@@H]1NCCCO 394f72307ed8fb2721529fc2a1ceb3d9 [0,1,0,1,0,0|1,0,0]=3 13975 B11R1.753 O=C(O)[C@H]1C[C@@H]1OCCCF 2c57e9e91e045042d408a014240d7edc [0,1,0,1,0,0|1,0,0]=3 13976 B11R1.753 O=C(O)[C@H]1C[C@@H]1OCCCS 3e236bd5088b4c3e09400cd43c117e3a [0,1,0,1,0,0|1,0,0]=3 13977 B11R1.753 O=C(O)[C@H]1C[C@H]1NCCCCl 44f2df3643321d007f38c53ed4b9899a [0,1,0,1,0,0|1,0,0]=3 13978 B11R1.753 O=C(O)[C@H]1C[C@H]1NCCCO 18c344d89701607359391ddf125ba880 [0,1,0,1,0,0|1,0,0]=3 13979 B11R1.753 O=C(O)[C@H]1C[C@H]1OCCCF f6e181008117a723d60ac9f6957b2670 [0,1,0,1,0,0|1,0,0]=3 13980 B11R1.753 O=C(O)[C@H]1C[C@H]1OCCCS b19b83554c58d8ba8674bb45cdfb5b95 [0,1,0,1,0,0|1,0,0]=3 13981 B11R1.753 O=CCCO[C@@H]1C[C@@H]1C(=O)O bf2e51971acdab52de07a982899a7cd8 [0,1,0,1,0,0|1,0,1]=4 13982 B11R1.753 O=CCCO[C@H]1C[C@@H]1C(=O)O 956a844f556218d05658e4e5e52712a2 [0,1,0,1,0,0|1,0,1]=4 13983 B11R1.753 O=CCCO[C@H]1C[C@H]1C(=O)O 42176a6e5af3333b07cf16b4a452dcc6 [0,1,0,1,0,0|1,0,1]=4 13984 B11R1.753 O=CCNC[C@@H]1C[C@H]1C(=O)O 4b36fe03117475d68ec2f27bedca7562 [0,1,0,1,0,0|1,0,1]=4 13985 B11R1.753 O=CCOCC1CC1C(=O)O 5ddee8d4dfeaf58b6ae62a4a3a7f7b01 [0,1,0,1,0,0|1,0,1]=4 13986 B11R1.753 O=CCOC[C@@H]1C[C@H]1C(=O)O a6c29f21c80883d282704f46f790a0d9 [0,1,0,1,0,0|1,0,1]=4 13987 B11R1.753 O=CCOC[C@H]1C[C@@H]1C(=O)O 7b4e7155aa0ffd87f6880a79dfabe992 [0,1,0,1,0,0|1,0,1]=4 13988 B11R1.753 O=CCOC[C@H]1C[C@H]1C(=O)O 3e062b43b3545592c846c4c4811d720c [0,1,0,1,0,0|1,0,1]=4 13989 B11R1.43 CCC1CCN(C1)CC(=O)N cab0f9c61b28805da68407bb288596ed [0,1,0,1,0,0|2,0,0]=4 13990 B11R1.43 CCC1CCN(C1)CC(=O)O 9690f2dfaca85f7a0ce56b7e044c5b8a [0,1,0,1,0,0|1,0,0]=3 13991 B11R1.43 CCN1CCC(C1)CC(=O)N 0e96a6e0b498f58561bc8286c7ffbdc7 [0,1,0,1,0,0|2,0,0]=4 13992 B11R1.43 CCN1CCC(C1)CC(=O)O 9a4d6f974fcf43de59c2b3a87bc735a1 [0,1,0,1,0,0|1,0,0]=3 13993 B11R1.43 CCN1CC[C@@H](C1)CC(=O)N 765c981839ffd6257d0e0ec31b5d6a20 [0,1,0,1,0,0|2,0,0]=4 13994 B11R1.43 CCN1CC[C@@H](C1)CC(=O)O ca371da52f8bca25131a8bfd61221ea4 [0,1,0,1,0,0|1,0,0]=3 13995 B11R1.43 CCN1CC[C@H](C1)CC(=O)N 51a84c5b248f6d78a5fae86fcd0bb5cd [0,1,0,1,0,0|2,0,0]=4 13996 B11R1.43 CCN1CC[C@H](C1)CC(=O)O 2395fde41491f3d276fac5e643a60c83 [0,1,0,1,0,0|1,0,0]=3 13997 B11R1.43 COC1CCN(C1)CC(=O)O 6083ce7a0b9522f109b6d8f919900128 [0,1,0,1,0,0|2,0,0]=4 13998 B11R1.43 CO[C@@H]1CCN(C1)CC(=O)O b1391ea6e3d1dd537bd89583f97b73b6 [0,1,0,1,0,0|2,0,0]=4 13999 B11R1.43 CO[C@H]1CCN(C1)CC(=O)O 0ca1691839d3e46ac2e3839c60693c12 [0,1,0,1,0,0|2,0,0]=4 14000 B11R1.43 O=C(O)CC1CCN(C1)CF fe231ed13461e08b2902edfbf36d0c32 [0,1,0,1,0,0|2,0,0]=4 14001 B11R1.43 O=C(O)CC1CCN(C1)CO f31a0e4253eab7b45ed40735f7768c93 [0,1,0,1,0,0|2,0,0]=4 14002 B11R1.43 O=C(O)CN1CCC(C1)CO 36dd509de7954fe1cf0c2c128435caf0 [0,1,0,1,0,0|2,0,0]=4 14003 B11R1.43 O=C(O)CN1CC[C@@H](C1)CO 30613f725558b003d2be78c9f250f22c [0,1,0,1,0,0|2,0,0]=4 14004 B11R1.43 O=C(O)CN1CC[C@H](C1)CO cfad40c8aed35facc8af44b375b5cdd5 [0,1,0,1,0,0|2,0,0]=4 14005 B11R1.43 O=C(O)C[C@@H]1CCN(C1)CF c009fae5e7986accff111add336cb888 [0,1,0,1,0,0|2,0,0]=4 14006 B11R1.43 O=C(O)C[C@@H]1CCN(C1)CO d84441fe358f54853b1ea97dcd34b178 [0,1,0,1,0,0|2,0,0]=4 14007 B11R1.43 O=C(O)C[C@H]1CCN(C1)CF 28dbb91f638fc0fae76189f87c0064d1 [0,1,0,1,0,0|2,0,0]=4 14008 B11R1.43 O=C(O)C[C@H]1CCN(C1)CO 8d5fdbb959aecd0f4edc23345aa2aa30 [0,1,0,1,0,0|2,0,0]=4 14009 B11R1.77 CC(=O)NC(C)C1CCCC1 c960b6f043c3790824ae164342defbdd [0,1,0,1,0,0|2,0,0]=4 14010 B11R1.77 CC(CC(=O)O)N1CCSC1 f937cc4e2b92f9cb77dfd8bde78c357a [0,1,0,1,0,0|2,0,0]=4 14011 B11R1.77 CN(CC(=O)N)C1CCCC1 45dcf04e25274ab0f2344274456b7037 [0,1,0,1,0,0|2,0,0]=4 14012 B11R1.77 CN(CC(=O)O)C1CCCC1 3caf3c0d85c03498aceefe853579f88a [0,1,0,1,0,0|1,0,0]=3 14013 B11R1.77 CN(CC(=O)O)C1CCOC1 1bd39c84b99b17c690390e709d047c35 [0,1,0,1,0,0|2,0,0]=4 14014 B11R1.77 CN(CC(=O)O)[C@@H]1CCOC1 25edcafa5028006b2758f818056eac09 [0,1,0,1,0,0|2,0,0]=4 14015 B11R1.77 CN(CC(=O)O)[C@H]1CCOC1 45d327ca4596353aca2007cc1acb6124 [0,1,0,1,0,0|2,0,0]=4 14016 B11R1.106 CC(CC(=O)O)NC1CC1C 35e76af452290b0da44be4a678c5f8fe [0,1,0,1,0,0|1,0,0]=3 14017 B11R1.106 CC(CC(=O)O)N[C@@H]1C[C@H]1F fdb4956f145aae37c3b1abc51d28c805 [0,1,0,1,0,0|2,0,0]=4 14018 B11R1.106 CC(CC(=O)O)N[C@H]1C[C@@H]1F d0de022cefb445ecb8d3a3c6af694379 [0,1,0,1,0,0|2,0,0]=4 14019 B11R1.106 CC(CC(=O)O)N[C@H]1C[C@H]1F e507bece508dbde3311b7dd8df8442bd [0,1,0,1,0,0|2,0,0]=4 14020 B11R1.156 CC(=O)N1C(CCCC1C)C e3ddc20fca7abf930df37197e912209e [0,1,0,1,0,0|2,0,0]=4 14021 B11R1.156 CC(=O)N1[C@@H](CCC[C@@H]1C)C 8fbb1fc2a2805f8807161bd12d817e35 [0,1,0,1,0,0|2,0,0]=4 14022 B11R1.156 CC(=O)N1[C@@H](CCC[C@H]1C)C 4c766700d5d155de540a0e0357e2c58f [0,1,0,1,0,0|2,0,0]=4 14023 B11R1.156 CC(=O)N1[C@H](CCC[C@@H]1C)C 8a7b81d6235806aa04678caf329dc652 [0,1,0,1,0,0|2,0,0]=4 14024 B11R1.230 CC1CC(=O)OC1OCCF 6d88b68cc75b62f1c1069eff46319bd4 [0,1,0,1,0,0|2,0,0]=4 14025 B11R1.230 CC1CC(=O)OC1OCCS 4a28be4c52a241bcb511c33869eb53c8 [0,1,0,1,0,0|2,0,0]=4 14026 B11R1.230 CCCOC1OC(=O)CC1C f8b98e79aad2fd39ea3dc6c840dbd841 [0,1,0,1,0,0|1,0,0]=3 14027 B11R1.230 COCOC1OC(=O)CC1C 8939c8aa6aadfb3f4dad144b67803300 [0,1,0,1,0,0|2,0,0]=4 14028 B11R1.230 CSCOC1OC(=O)CC1C d07771cbf061d1ff45aafaf14f23160f [0,1,0,1,0,0|2,0,0]=4 14029 B11R1.471 CCN1CCC(C1C(=O)O)O b5306d3a9dd1fbfa677739816206b6c0 [0,1,0,1,0,0|1,0,0]=3 14030 B11R1.471 CCN1CC[C@@H]([C@@H]1C(=O)O)F 712b216f100f6dff8cb2340acbbadb3a [0,1,0,1,0,0|1,0,0]=3 14031 B11R1.471 CCN1CC[C@@H]([C@@H]1C(=O)O)O 903e1b97194c67789b3f53248d5c86c9 [0,1,0,1,0,0|1,0,0]=3 14032 B11R1.471 CCN1CC[C@@H]([C@H]1C(=O)N)O 972a0f9efc524a8fe5d3afe42b935bdd [0,1,0,1,0,0|2,0,0]=4 14033 B11R1.471 CCN1CC[C@@H]([C@H]1C(=O)O)C 4c7d5fe1a9c02bf6718ced526a6d8c5f [0,1,0,1,0,0|1,0,0]=3 14034 B11R1.471 CCN1CC[C@@H]([C@H]1C(=O)O)O b4264395e1ed292f688c5d6214d088f5 [0,1,0,1,0,0|1,0,0]=3 14035 B11R1.471 CCN1CC[C@H]([C@@H]1C(=O)O)O 1ce074ebf1b97b1b94473395b5c89119 [0,1,0,1,0,0|1,0,0]=3 14036 B11R1.471 CCN1CC[C@H]([C@H]1C(=O)O)F a69791ff660973614ab93a334a49424c [0,1,0,1,0,0|1,0,0]=3 14037 B11R1.471 CCN1CC[C@H]([C@H]1C(=O)O)O ab7ac0db3889e4f92e513d0338572d91 [0,1,0,1,0,0|1,0,0]=3 14038 B11R1.471 C[C@H]1CCN([C@@H]1C(=O)O)CF 0e13e3ac52ceeba6de721b16460929a7 [0,1,0,1,0,0|2,0,0]=4 14039 B11R1.471 C[C@H]1CCN([C@@H]1C(=O)O)CO a9fb8bc6716565541786da607d253625 [0,1,0,1,0,0|2,0,0]=4 14040 B11R1.471 O=C(O)C1C(CCN1CF)O e7900b613bc808f85c22808b1ae67588 [0,1,0,1,0,0|2,0,0]=4 14041 B11R1.471 O=C(O)C1C(CCN1CO)O 7f2e27ec9464b0eadc394466c58f8bc9 [0,1,0,1,0,0|2,0,0]=4 14042 B11R1.471 O=C(O)[C@@H]1[C@@H](CCN1CF)F c21c6be4a1a355386c80a6517aa3838a [0,1,0,1,0,0|2,0,0]=4 14043 B11R1.471 O=C(O)[C@@H]1[C@@H](CCN1CF)O f64868f72f7e06b05289099823f01aad [0,1,0,1,0,0|2,0,0]=4 14044 B11R1.471 O=C(O)[C@@H]1[C@@H](CCN1CO)F bb829133eea6583f95ce6a5fd4267209 [0,1,0,1,0,0|2,0,0]=4 14045 B11R1.471 O=C(O)[C@@H]1[C@@H](CCN1CO)O 9e248af9a7a0521e2c7ad48f71a65f0b [0,1,0,1,0,0|2,0,0]=4 14046 B11R1.471 O=C(O)[C@@H]1[C@H](CCN1CF)O 6d5aec549ef90acece3218af8723004b [0,1,0,1,0,0|2,0,0]=4 14047 B11R1.471 O=C(O)[C@@H]1[C@H](CCN1CO)O e5729cf892af3e32fb73a86891b76ed0 [0,1,0,1,0,0|2,0,0]=4 14048 B11R1.471 O=C(O)[C@H]1[C@@H](CCN1CF)O 639b58c05db65101eb76cb1b45952c6a [0,1,0,1,0,0|2,0,0]=4 14049 B11R1.471 O=C(O)[C@H]1[C@@H](CCN1CO)O 0ff96fa99b909e6957606415c1863782 [0,1,0,1,0,0|2,0,0]=4 14050 B11R1.471 O=C(O)[C@H]1[C@H](CCN1CF)F 3adb0f2bad5ed01f8d5ba8c1cc800bee [0,1,0,1,0,0|2,0,0]=4 14051 B11R1.471 O=C(O)[C@H]1[C@H](CCN1CF)O ed2f0c85d50ad2d7ec32bad327347828 [0,1,0,1,0,0|2,0,0]=4 14052 B11R1.471 O=C(O)[C@H]1[C@H](CCN1CO)F 51ffbcc76e1dcc165aea38953a26960c [0,1,0,1,0,0|2,0,0]=4 14053 B11R1.471 O=C(O)[C@H]1[C@H](CCN1CO)O 6035535635e4be4d820f94fc2ae00a31 [0,1,0,1,0,0|2,0,0]=4 14054 B11R1.475 CCCN1C[C@H]([C@H]1C(=O)O)C ce010efa90305e56cdd4eafaf686b70f [0,1,0,1,0,0|1,0,0]=3 14055 B11R1.475 COCN1C[C@H]([C@H]1C(=O)O)C cf7076a18c44fa33b1412ee79268c46a [0,1,0,1,0,0|2,0,0]=4 14056 B11R1.475 CSCN1C[C@H]([C@H]1C(=O)O)C 46ed5aeb1f8316269909225d15b2540d [0,1,0,1,0,0|2,0,0]=4 14057 B11R1.475 C[C@@H]1CN([C@@H]1C(=O)O)CCF 60f891f13d7b8bc163c253ac371267f3 [0,1,0,1,0,0|2,0,0]=4 14058 B11R1.475 C[C@@H]1CN([C@@H]1C(=O)O)CCO 33e31eeb93f51cfc60f81d7bf66e28e9 [0,1,0,1,0,0|2,0,0]=4 14059 B11R1.475 C[C@@H]1CN([C@@H]1C(=O)O)CCS 10647d8427ea7cce0c1f0dd021f567a9 [0,1,0,1,0,0|2,0,0]=4 14060 B11R1.484 CC(CC(=O)N)OC1CCC1 0537a4eb5ac3262c3696d19913c537de [0,1,0,1,0,0|2,0,0]=4 14061 B11R1.484 CC(CC(=O)O)NC1CCC1 b13cd3efe1d3c12301c1647f2b627128 [0,1,0,1,0,0|1,0,0]=3 14062 B11R1.484 CC(CC(=O)O)NC1COC1 0f2e2ba237d7c2cf84219974c64cd661 [0,1,0,1,0,0|2,0,0]=4 14063 B11R1.484 CN(CC(=O)N)CC1CCC1 8d1b38a18dddbd6044cabcce9335a5a3 [0,1,0,1,0,0|2,0,0]=4 14064 B11R1.484 CN(CC(=O)O)CC1CCC1 35fd2fa827336d46b91ebd5d54bba43c [0,1,0,1,0,0|1,0,0]=3 14065 B11R1.484 CN(CC(=O)O)CC1CCO1 edb3fc85771b9c4408d1afd374dad410 [0,1,0,1,0,0|2,0,0]=4 14066 B11R1.484 CN(CC(=O)O)CC1COC1 a0485759cb3594fd12672558ed65399b [0,1,0,1,0,0|2,0,0]=4 14067 B11R1.484 CN(CC(=O)O)C[C@@H]1CCO1 7ff355d17f9f57aacd126e2b061725c6 [0,1,0,1,0,0|2,0,0]=4 14068 B11R1.484 CN(CC(=O)O)C[C@H]1CCO1 90fa560ad596de83687940e880583a17 [0,1,0,1,0,0|2,0,0]=4 14069 B11R1.484 C[C@@H](CC(=O)O)NC1CCC1 8ec5a3f75af6a9afe0e20ca417ff41b6 [0,1,0,1,0,0|1,0,0]=3 14070 B11R1.484 C[C@@H](CC(=O)O)NC1COC1 8305bab2c52455b19c0e0119b8f516f9 [0,1,0,1,0,0|2,0,0]=4 14071 B11R1.484 C[C@H](CC(=O)O)NC1CCC1 a89cb4076f1b5d6ef0d33b3fa3a476ea [0,1,0,1,0,0|1,0,0]=3 14072 B11R1.484 C[C@H](CC(=O)O)NC1COC1 de5489316425cf15249d8ed3af16e8fe [0,1,0,1,0,0|2,0,0]=4 14073 B11R1.484 O=C(O)CC(=O)CN1CCC1 67078275036c6048da0d28fb85491a9d [0,1,0,1,0,0|1,0,1]=4 14074 B11R1.485 CC(CC(=O)N)OCC1CC1 4f52541727219fba7ef1643bb3f7e2da [0,1,0,1,0,0|2,0,0]=4 14075 B11R1.485 CC(CC(=O)O)NCC1CC1 7a014cf68ddafdc6b2e0ee6622405fcc [0,1,0,1,0,0|1,0,0]=3 14076 B11R1.485 CC(CC(=O)O)OCC1CC1 255340296cd520a4bc3d2a787626970b [0,1,0,1,0,0|1,0,0]=3 14077 B11R1.485 CN(CCC1CC1)CC(=O)N 8e7bf44d58c0b4252f5720616dbaaa45 [0,1,0,1,0,0|2,0,0]=4 14078 B11R1.485 CN(CCC1CC1)CC(=O)O 7529b7e859ee5bc0e55a962ff35566bc [0,1,0,1,0,0|1,0,0]=3 14079 B11R1.485 C[C@@H](CC(=O)O)NCC1CC1 98578961f0cc6529b8b4cda69fbb6e54 [0,1,0,1,0,0|1,0,0]=3 14080 B11R1.485 C[C@@H](CC(=O)O)OCC1CC1 5b3c3b49269a6aa3191b4a86744b405e [0,1,0,1,0,0|1,0,0]=3 14081 B11R1.485 C[C@H](CC(=O)O)NCC1CC1 b5ad4c57d77dbcdb38cdfc6738ad4816 [0,1,0,1,0,0|1,0,0]=3 14082 B11R1.485 C[C@H](CC(=O)O)OCC1CC1 eeebad407c3e8dcec9bf22ce6b8d0d35 [0,1,0,1,0,0|1,0,0]=3 14083 B11R1.485 O=C(O)CC(=O)CNC1CC1 8b4a3392474999c314e97774c35e21fb [0,1,0,1,0,0|1,0,1]=4 14084 B11R1.485 O=C(O)CC(=O)COC1CC1 b030f5c8bec4c5e32f60c1c03f710d5e [0,1,0,1,0,0|1,0,1]=4 14085 B11R1.485 O=C(O)CC(O)CNC1CC1 7b6c3dd9b7c250619609b0b0187541b4 [0,1,0,1,0,0|1,0,0]=3 14086 B11R1.485 O=C(O)C[C@@H](O)CNC1CC1 27f16990c149d545d6e83127812ef692 [0,1,0,1,0,0|1,0,0]=3 14087 B11R1.485 O=C(O)C[C@H](O)CNC1CC1 c67f8dd697e09f176d1e964940241185 [0,1,0,1,0,0|1,0,0]=3 14088 B11R1.989 CCCOCC1(CC(=O)C1)C d6fc361696f81debcb9b3fd273510001 [0,1,0,1,0,0|2,0,0]=4 14089 B11R1.105 CC1CCCN1CS(=O)(=O)O 6445eb3b520915fe274b155644acec2c [0,1,0,1,0,0|2,0,0]=4 14090 B11R1.105 C[C@@H]1CCCN1CS(=O)(=O)O 319e98114710706d456ffd30efe9c17e [0,1,0,1,0,0|2,0,0]=4 14091 B11R1.105 C[C@H]1CCCN1CS(=O)(=O)O a7ff06eb81349738884c7e6bec0152dc [0,1,0,1,0,0|2,0,0]=4 14092 B11R1.148 CC1CC1COCS(=O)(=O)O 5a5c33a44f47b663b4ca969939a9c976 [0,1,0,1,0,0|2,0,0]=4 14093 B11R1.148 CC1CC1NCCS(=O)(=O)O 71162f006c0b30791ea98b27e8ee3ce1 [0,1,0,1,0,0|2,0,0]=4 14094 B11R1.148 C[C@@H]1C[C@H]1COCS(=O)(=O)O 704bd23082baf131fcee8d21fe2a9170 [0,1,0,1,0,0|2,0,0]=4 14095 B11R1.148 C[C@H]1C[C@@H]1COCS(=O)(=O)O bee9ddbc90e6b303ec56d25ddc683664 [0,1,0,1,0,0|2,0,0]=4 14096 B11R1.148 C[C@H]1C[C@H]1COCS(=O)(=O)O fe4ab21ab3f6ffe0dfe9b481e1a2b0d5 [0,1,0,1,0,0|2,0,0]=4 14097 B11R1.160 C[C@@H]1CC[C@@H]1NCS(=O)(=O)O 1b718fee11d7833770abef02877b032d [0,1,0,1,0,0|2,0,0]=4 14098 B11R1.160 C[C@@H]1CC[C@H]1NCS(=O)(=O)O b538b25ed9b37d5fc6c25039cef041ec [0,1,0,1,0,0|2,0,0]=4 14099 B11R1.246 CCC1CCN1CS(=O)(=O)O f60e1bd81301005fbdc03a8bc71526f7 [0,1,0,1,0,0|2,0,0]=4 14100 B11R1.343 O=S(=O)(O)CCCNC1CC1 13c084a0a20502c707152e06680293fc [0,1,0,1,0,0|2,0,0]=4 14101 B11R1.343 O=S(=O)(O)CCCOC1CC1 4bc7664bc9032aed22fa71d1a8d28fc8 [0,1,0,1,0,0|2,0,0]=4 14102 B11R1.343 O=S(=O)(O)CCNCC1CC1 fd18a7036f389a36945f0ca7207880bb [0,1,0,1,0,0|2,0,0]=4 14103 B11R1.343 O=S(=O)(O)CCOCC1CC1 95bbf38980c564289973e86143bb0ab9 [0,1,0,1,0,0|2,0,0]=4 14104 B11R1.343 O=S(=O)(O)CNCCC1CC1 7cf7b331a669d47344a4bbb39e7dca26 [0,1,0,1,0,0|2,0,0]=4 14105 B11R1.344 O=S(=O)(O)CCCN1CCC1 8a8bfd38bbcae0376cfbbadfcd9167af [0,1,0,1,0,0|2,0,0]=4 14106 B11R1.344 O=S(=O)(O)CCNC1CCC1 b47d63f31660acd727c1f48e556b905b [0,1,0,1,0,0|2,0,0]=4 14107 B11R1.344 O=S(=O)(O)CCOC1CCC1 80aa47547d9c89f51fa2c02956275d4f [0,1,0,1,0,0|2,0,0]=4 14108 B11R1.344 O=S(=O)(O)CNCC1CCC1 bbe5e4256aca4e19c39c00ca22bf0886 [0,1,0,1,0,0|2,0,0]=4 14109 B11R1.344 O=S(=O)(O)COCC1CCC1 ffc46b91bccb9324668fc162958d9446 [0,1,0,1,0,0|2,0,0]=4 14110 B11R1.510 O=S(=O)(O)CNC1CCCC1 b4a09c3384d7ea22e13a8cde1b3007d6 [0,1,0,1,0,0|2,0,0]=4 14111 B11R1.510 O=S(=O)(O)COC1CCCC1 9b5a895559c4e7bed75e230ad63fe405 [0,1,0,1,0,0|2,0,0]=4 14112 B11R1.20 CC(=O)NC1CCC(CC1)C d5b9c289f55164a8ef9fd28f678cff26 [0,1,0,1,0,0|2,0,0]=4 14113 B11R1.20 CC(=O)NC1CCC(CC1)Cl 76e885a44d6ff7276ddb2cec71b9bb91 [0,1,0,1,0,0|2,0,0]=4 14114 B11R1.20 CC(=O)NC1CCC(CC1)O 32ccc720dacb2d1a60bef0ac05af6e03 [0,1,0,1,0,0|2,0,0]=4 14115 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C 59946d0e4761e996c325795030cfdc0f [0,1,0,1,0,0|2,0,0]=4 14116 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)Cl d9ee28abd65cc9504067bebafb158071 [0,1,0,1,0,0|2,0,0]=4 14117 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)O de0f4c835ebb4ab00269ab1d23370b55 [0,1,0,1,0,0|2,0,0]=4 14118 B11R1.20 CC(=O)N[C@H]1CC[C@H](CC1)C d5b4032d8a2c96d43aa13ec6b6d114f1 [0,1,0,1,0,0|2,0,0]=4 14119 B11R1.20 CC(=O)N[C@H]1CC[C@H](CC1)Cl 38f4de32edba01e8633a04da61695570 [0,1,0,1,0,0|2,0,0]=4 14120 B11R1.20 CC(=O)N[C@H]1CC[C@H](CC1)O c1dc106a33ee46042df9bb05d205ab58 [0,1,0,1,0,0|2,0,0]=4 14121 B11R1.20 CC1CCN(CC1)CC(=O)N e51773513c259e0ba8166eb692234b4f [0,1,0,1,0,0|2,0,0]=4 14122 B11R1.20 CC1CCN(CC1)CC(=O)O 0cfccb1a2bc1a6f8707bd97ee1053b02 [0,1,0,1,0,0|1,0,0]=3 14123 B11R1.20 CN1CCN(CC1)CC(=O)O fbfc2896ff525f4ad8a2a6f239939d1d [0,1,0,1,0,0|2,0,0]=4 14124 B11R1.20 NC(=O)CN1CCC(CC1)Cl 88e2394a7910768c2ee306ef27210814 [0,1,0,1,0,0|2,0,0]=4 14125 B11R1.20 NC(=O)CN1CCC(CC1)F d29ceb58160371002b103b3001618b83 [0,1,0,1,0,0|2,0,0]=4 14126 B11R1.20 NC(=O)CN1CCC(CC1)I ef73e072e32a0cf9f081458c744c700d [0,1,0,1,0,0|2,0,0]=4 14127 B11R1.20 NC(=O)CN1CCC(CC1)O 3d6eb2ca610cb36c5c6f3b62d024cb77 [0,1,0,1,0,0|2,0,0]=4 14128 B11R1.20 O=C(O)CN1CCC(CC1)Cl 58b5258937731364e0182785d9f081ff [0,1,0,1,0,0|1,0,0]=3 14129 B11R1.20 O=C(O)CN1CCC(CC1)F 50d18fd3934ce11ce38e1169b8b3fe71 [0,1,0,1,0,0|1,0,0]=3 14130 B11R1.20 O=C(O)CN1CCC(CC1)I fe70957de077460daf6d69dd4dce1c41 [0,1,0,1,0,0|1,0,0]=3 14131 B11R1.20 O=C(O)CN1CCC(CC1)O 42e521bd1703ae610f177660fc9f9a05 [0,1,0,1,0,0|1,0,0]=3 14132 B11R1.23 CCC(C)N1CCCC(=O)C1 a49429cc4a31974ebe2fc67346a34d7c [0,1,0,1,0,0|2,0,0]=4 14133 B11R1.39 CCN(C)CC1CCC(=O)N1 0a1e8ee134d5ad3704e4861774dce92b [0,1,0,1,0,0|2,0,0]=4 14134 B11R1.39 CCN(C)C[C@@H]1CCC(=O)N1 ae42878d68f3c317f8032fd81076be6a [0,1,0,1,0,0|2,0,0]=4 14135 B11R1.39 CCN(C)C[C@H]1CCC(=O)N1 8ba042bada62a63b202c6e1baae2cdcc [0,1,0,1,0,0|2,0,0]=4 14136 B11R1.75 CC(=O)CCN1CCC(C1)C 9de9b84272c07e29768e28490a071eaf [0,1,0,1,0,0|2,0,0]=4 14137 B11R1.75 CC(=O)CCN1CCC(C1)F af61089eacf6cd2a2da225a0a83ff0e5 [0,1,0,1,0,0|2,0,0]=4 14138 B11R1.75 CC(=O)CCN1CCC(C1)O 547244eeba014f8aa0a3bdd3fe29accb [0,1,0,1,0,0|2,0,0]=4 14139 B11R1.75 CC(=O)CCN1CC[C@@H](C1)F a44c278f4aab7480fdff25718f1c0071 [0,1,0,1,0,0|2,0,0]=4 14140 B11R1.75 CC(=O)CCN1CC[C@@H](C1)O 4e4c786cbd17f7c429a60fd1dd5af30d [0,1,0,1,0,0|2,0,0]=4 14141 B11R1.75 CC(=O)CCN1CC[C@H](C1)F 9b6cd7deb51d6311a79a209d509ca26c [0,1,0,1,0,0|2,0,0]=4 14142 B11R1.75 CC(=O)CCN1CC[C@H](C1)O 159f189a6ace8db80e74987627777d14 [0,1,0,1,0,0|2,0,0]=4 14143 B11R1.75 CC(=O)NCC1CCC(C1)O a017fd720f27c83b6928197b660f1770 [0,1,0,1,0,0|2,0,0]=4 14144 B11R1.75 CC(C)COC1CCC(=O)C1 0e15cd28d5c7cd441f08b82513f9c77c [0,1,0,1,0,0|2,0,0]=4 14145 B11R1.75 CC(C)NCC1CCC(=O)N1 f6b27936097d5d5adee0b1ec7c036bd4 [0,1,0,1,0,0|2,0,0]=4 14146 B11R1.75 CC(C)NC[C@@H]1CCC(=O)N1 10341de4df7138d11a695298e06c1695 [0,1,0,1,0,0|2,0,0]=4 14147 B11R1.75 CC(C)NC[C@H]1CCC(=O)N1 3d17e19aae960de914d8c639bd7ab014 [0,1,0,1,0,0|2,0,0]=4 14148 B11R1.75 CC(C)OCC1CCC(=O)C1 00334f6e0d25b061f13b111ad8f73579 [0,1,0,1,0,0|2,0,0]=4 14149 B11R1.75 CC(C)OCC1CCC(=O)N1 95cd00901bb82125600de4e029b6f439 [0,1,0,1,0,0|2,0,0]=4 14150 B11R1.75 CC(C)OCC1CCC(=O)O1 2f5bc89e6b3c558415de7b0136010506 [0,1,0,1,0,0|1,0,0]=3 14151 B11R1.75 CC(C)OC[C@@H]1CCC(=O)C1 12237858b0e9a8778c3b0c991829ac20 [0,1,0,1,0,0|2,0,0]=4 14152 B11R1.75 CC(C)OC[C@@H]1CCC(=O)N1 9934cdbe8938c56c3f66440648382f5f [0,1,0,1,0,0|2,0,0]=4 14153 B11R1.75 CC(C)OC[C@@H]1CCC(=O)O1 6755e2e1ab950faeb3923aa4ef5b1253 [0,1,0,1,0,0|1,0,0]=3 14154 B11R1.75 CC(C)OC[C@H]1CCC(=O)N1 7bcdeed72b0137363567dc8a27be6e7d [0,1,0,1,0,0|2,0,0]=4 14155 B11R1.75 CC(C)OC[C@H]1CCC(=O)O1 5321985a2cc97ca828df0b12696fb1e6 [0,1,0,1,0,0|1,0,0]=3 14156 B11R1.75 CC1CC(CO1)NCC(=O)O 9bd320dee77170c27e5d23e270362985 [0,1,0,1,0,0|2,0,0]=4 14157 B11R1.75 CC1CC(CO1)OCC(=O)O 08c159dfae3306b3069d797cb57c0585 [0,1,0,1,0,0|2,0,0]=4 14158 B11R1.75 CC1CCC(C1)NCC(=O)N cf1a1e5a9ca07d21770fa475c185379e [0,1,0,1,0,0|2,0,0]=4 14159 B11R1.75 CC1CCC(C1)NCC(=O)O b91263eb0e68378329124588f3440e20 [0,1,0,1,0,0|1,0,0]=3 14160 B11R1.75 CC1CCC(C1)OCC(=O)N 7830a445d1f16f11b93cf51de334e821 [0,1,0,1,0,0|2,0,0]=4 14161 B11R1.75 CC1CCC(C1)OCC(=O)O 34706f1cb706bb382746d51da5b8e32b [0,1,0,1,0,0|1,0,0]=3 14162 B11R1.75 CC1CCN(C1)CCC(=O)N b8597c68c0ee0faa362ec4f3d9f2543f [0,1,0,1,0,0|2,0,0]=4 14163 B11R1.75 CC1CCN(C1)CCC(=O)O a698f4135c86a32047736204600a83d1 [0,1,0,1,0,0|1,0,0]=3 14164 B11R1.75 CN1CCC(C1)NCC(=O)O 17ab1a7cfa873ebf026183126434ccc0 [0,1,0,1,0,0|2,0,0]=4 14165 B11R1.75 CN1CCC(C1)OCC(=O)O 772cfbcad15d21a97312ebe7f87ca701 [0,1,0,1,0,0|2,0,0]=4 14166 B11R1.75 CN1CCN(C1)CCC(=O)O 2e3c4eb066315c306b22d2c626d63bbd [0,1,0,1,0,0|2,0,0]=4 14167 B11R1.75 CN1CC[C@@H](C1)NCC(=O)O 7a1bc6104b9be82efeb9aa25fc69745c [0,1,0,1,0,0|2,0,0]=4 14168 B11R1.75 CN1CC[C@@H](C1)OCC(=O)O 8e163bf2e61b44c2deb624ca3dd36e8c [0,1,0,1,0,0|2,0,0]=4 14169 B11R1.75 CN1CC[C@H](C1)NCC(=O)O 85c2ac3ca8d99d6924bf5b7e733ca000 [0,1,0,1,0,0|2,0,0]=4 14170 B11R1.75 CN1CC[C@H](C1)OCC(=O)O 7c125c09ceaaedabb3f6e371ead7222b [0,1,0,1,0,0|2,0,0]=4 14171 B11R1.75 NC(=O)CCN1CCC(C1)F a5f7ed8995e40f24ee68e21108beb650 [0,1,0,1,0,0|2,0,0]=4 14172 B11R1.75 NC(=O)CCN1CCC(C1)O 4f7d6b8c0920e0cf0c494fe81c0a58f4 [0,1,0,1,0,0|2,0,0]=4 14173 B11R1.75 NC(=O)CCN1CC[C@@H](C1)F 8a3cbb56d2211f8c1847dc2f135b24eb [0,1,0,1,0,0|2,0,0]=4 14174 B11R1.75 NC(=O)CCN1CC[C@@H](C1)O e52f9a5d19d583dfb5eea1ec8149d342 [0,1,0,1,0,0|2,0,0]=4 14175 B11R1.75 NC(=O)CCN1CC[C@H](C1)F 16bdfd8a7a2ed86febc17fc3971fd430 [0,1,0,1,0,0|2,0,0]=4 14176 B11R1.75 NC(=O)CCN1CC[C@H](C1)O 3d27343b0452cc737ec2e459b6ad92cc [0,1,0,1,0,0|2,0,0]=4 14177 B11R1.75 NC(=O)CNC1CCC(C1)O 1a3c90f15215db8d1486c6c24e919a78 [0,1,0,1,0,0|2,0,0]=4 14178 B11R1.75 NC(=O)CN[C@@H]1CC[C@@H](C1)O 074ee17a9a4a8b13416311c24ce24a03 [0,1,0,1,0,0|2,0,0]=4 14179 B11R1.75 NC(=O)CN[C@@H]1CC[C@H](C1)O 4dbad745ae7cb96fab1aea5e4e37790e [0,1,0,1,0,0|2,0,0]=4 14180 B11R1.75 NC(=O)CN[C@H]1CC[C@@H](C1)O e61011d1d2c2630b1591be23f9c6e223 [0,1,0,1,0,0|2,0,0]=4 14181 B11R1.75 NC(=O)CN[C@H]1CC[C@H](C1)O 7a97f6b06594ceeee1e6579eae40eb98 [0,1,0,1,0,0|2,0,0]=4 14182 B11R1.75 NC(=O)COC1CCC(C1)F 3f8dc11d199ec6afcab2867e5d666c34 [0,1,0,1,0,0|2,0,0]=4 14183 B11R1.75 O=C(O)CCN1CCC(C1)F d4184d80cd13b028c937cb738397aba0 [0,1,0,1,0,0|1,0,0]=3 14184 B11R1.75 O=C(O)CCN1CCC(C1)O a9c7d6f576bf60e2ed5bf0b415e0747d [0,1,0,1,0,0|1,0,0]=3 14185 B11R1.75 O=C(O)CCN1CC[C@@H](C1)F 05fcd2da99dfe6f41ea41ba9444ca9d7 [0,1,0,1,0,0|1,0,0]=3 14186 B11R1.75 O=C(O)CCN1CC[C@@H](C1)O 6b4ee12311ccbbb6d07a42ca8048d5f3 [0,1,0,1,0,0|1,0,0]=3 14187 B11R1.75 O=C(O)CCN1CC[C@H](C1)F f1458e7e85d68d633c9bc8edc445881e [0,1,0,1,0,0|1,0,0]=3 14188 B11R1.75 O=C(O)CCN1CC[C@H](C1)O 54ef94be7fd5a9f3653d10513bf1209f [0,1,0,1,0,0|1,0,0]=3 14189 B11R1.75 O=C(O)CNC1CCC(C1)O 8cbc05d4df0f5d612a13d13b4ef8752c [0,1,0,1,0,0|1,0,0]=3 14190 B11R1.75 O=C(O)CN[C@@H]1CC[C@@H](C1)O e724e00214b84355dcd45c54a7f6c73f [0,1,0,1,0,0|1,0,0]=3 14191 B11R1.75 O=C(O)CN[C@@H]1CC[C@H](C1)O 1e1dac2ef417205d0414a50579662edf [0,1,0,1,0,0|1,0,0]=3 14192 B11R1.75 O=C(O)CN[C@H]1CC[C@@H](C1)O 781dc2a2e1f4d580ab611302f1b51fda [0,1,0,1,0,0|1,0,0]=3 14193 B11R1.75 O=C(O)CN[C@H]1CC[C@H](C1)O f7ad75a5435c628b4f34e818231dd782 [0,1,0,1,0,0|1,0,0]=3 14194 B11R1.75 O=C(O)COC1CCC(=O)C1 65df60cf46282583e499e5764ed99b51 [0,1,0,1,0,0|1,0,1]=4 14195 B11R1.75 O=C(O)COC1CCC(C1)F bcfcf769b205f9612da80a130e4ecbb7 [0,1,0,1,0,0|1,0,0]=3 14196 B11R1.159 CC(=O)N1CCCC(C1C)O 8d2ee74f77a70ff170f0e002cff2fdc1 [0,1,0,1,0,0|2,0,0]=4 14197 B11R1.159 CC(=O)N1CCC[C@@H]([C@H]1C)O 18440be7dd05d0afaba6a2a7958f504e [0,1,0,1,0,0|2,0,0]=4 14198 B11R1.159 CC(=O)N1CCC[C@H]([C@@H]1C)O 68556bd3905dd7b19318a890da5c1f96 [0,1,0,1,0,0|2,0,0]=4 14199 B11R1.224 CC(CF)OCC1CC(=O)O1 538e653be5c2a51141a1742b82ae11a6 [0,1,0,1,0,0|2,0,0]=4 14200 B11R1.224 CC(CO)NCC1CC(=O)O1 b407ad062440fecf47103de73ff77cb9 [0,1,0,1,0,0|2,0,0]=4 14201 B11R1.224 CC(CS)OCC1CC(=O)O1 ac477b91d4b69b7c13c688fd1f121f70 [0,1,0,1,0,0|2,0,0]=4 14202 B11R1.224 CCC(C)COC1CC(=O)C1 e863db4a1a236d9f6031f2a855b6c906 [0,1,0,1,0,0|2,0,0]=4 14203 B11R1.224 CCC(C)NCC1CC(=O)C1 17aece06643127a825f590b1217d063a [0,1,0,1,0,0|2,0,0]=4 14204 B11R1.224 CCC(C)NCC1CC(=O)N1 13a23d47e625edc718912c5ed73584a4 [0,1,0,1,0,0|2,0,0]=4 14205 B11R1.224 CCC(C)NCC1CC(=O)O1 d8df81af469e1110a9586e8c655e6caa [0,1,0,1,0,0|1,0,0]=3 14206 B11R1.224 CCC(C)OCC1CC(=O)C1 bf23691dcee8b47996765818cf7c19d0 [0,1,0,1,0,0|2,0,0]=4 14207 B11R1.224 CCC(C)OCC1CC(=O)N1 aa98f7598f2dce08b89a3499c6962a60 [0,1,0,1,0,0|2,0,0]=4 14208 B11R1.224 CCC(C)OCC1CC(=O)O1 2100475177a81b1cd3dff0b374839e63 [0,1,0,1,0,0|1,0,0]=3 14209 B11R1.224 CCC(C)OC[C@@H]1CC(=O)N1 a4ccd36777b1eaf0c9337bd64a4c76f5 [0,1,0,1,0,0|2,0,0]=4 14210 B11R1.224 CCC(C)OC[C@H]1CC(=O)N1 aa1abf35803d3211197cdb309f8441da [0,1,0,1,0,0|2,0,0]=4 14211 B11R1.224 CC[C@@H](C)COC1CC(=O)C1 5cfc09af475d18990f11bf8441431eec [0,1,0,1,0,0|2,0,0]=4 14212 B11R1.224 CC[C@@H](C)NCC1CC(=O)C1 db6d96a302d0eee85fbe0f5f067ed212 [0,1,0,1,0,0|2,0,0]=4 14213 B11R1.224 CC[C@@H](C)NCC1CC(=O)N1 d0b7efc7539d998790fa52922f18628b [0,1,0,1,0,0|2,0,0]=4 14214 B11R1.224 CC[C@@H](C)NCC1CC(=O)O1 fcb8079d2ea28e39d54991c19f9a5c70 [0,1,0,1,0,0|1,0,0]=3 14215 B11R1.224 CC[C@@H](C)OCC1CC(=O)C1 dac24e74a6ed45550b3f7cea19f270e1 [0,1,0,1,0,0|2,0,0]=4 14216 B11R1.224 CC[C@@H](C)OCC1CC(=O)N1 5ea9849b48e24f3202caeeffcb68a924 [0,1,0,1,0,0|2,0,0]=4 14217 B11R1.224 CC[C@@H](C)OCC1CC(=O)O1 a184ebd5593bf5a41e51745392601f1a [0,1,0,1,0,0|1,0,0]=3 14218 B11R1.224 CC[C@H](C)COC1CC(=O)C1 e07a6e8f79fc14b1798ebe6c2018d788 [0,1,0,1,0,0|2,0,0]=4 14219 B11R1.224 CC[C@H](C)NCC1CC(=O)C1 4a0efe1a48061e2474fcee63319bfd14 [0,1,0,1,0,0|2,0,0]=4 14220 B11R1.224 CC[C@H](C)NCC1CC(=O)N1 767171351ac14f2a96ecf0fa24b4cbd5 [0,1,0,1,0,0|2,0,0]=4 14221 B11R1.224 CC[C@H](C)NCC1CC(=O)O1 68c02596c25f7fe1d9e9fe417c9e1a95 [0,1,0,1,0,0|1,0,0]=3 14222 B11R1.224 CC[C@H](C)OCC1CC(=O)C1 ae1d415a7ec90666281c14a0113e43d9 [0,1,0,1,0,0|2,0,0]=4 14223 B11R1.224 CC[C@H](C)OCC1CC(=O)N1 c69dd998e99d460b814c9177e8a389d2 [0,1,0,1,0,0|2,0,0]=4 14224 B11R1.224 CC[C@H](C)OCC1CC(=O)O1 2f88f06761361be9494563c5540fd6e0 [0,1,0,1,0,0|1,0,0]=3 14225 B11R1.224 C[C@@H](CO)NCC1CC(=O)O1 4c330045e90cc34ec3fdb4f5c2e64102 [0,1,0,1,0,0|2,0,0]=4 14226 B11R1.224 C[C@H](CO)NCC1CC(=O)O1 37a11313c3aeeb403f522a62002a7eda [0,1,0,1,0,0|2,0,0]=4 14227 B11R1.224 C[C@H](CS)OCC1CC(=O)O1 1b6bcf71f4ef28473f80997fca3572c3 [0,1,0,1,0,0|2,0,0]=4 14228 B11R1.235 C=C(COCC1CC1C)OC 1b4e913b00e8a4e5b6b46a71a4326372 [0,1,0,1,0,0|2,0,0]=4 14229 B11R1.235 C=C(COC[C@@H]1C[C@@H]1C)OC 098d1c5bfc545013b74e454a716109dc [0,1,0,1,0,0|2,0,0]=4 14230 B11R1.235 C=C(COC[C@@H]1C[C@H]1C)OC c599e035486b0858ca61eef1bdacf048 [0,1,0,1,0,0|2,0,0]=4 14231 B11R1.235 C=C(COC[C@H]1C[C@@H]1C)OC f859cf0220f7f639029c838fe8c1e113 [0,1,0,1,0,0|2,0,0]=4 14232 B11R1.235 CCC(=O)COCC1CC1C 341fed97651fecaab533caa221b634a9 [0,1,0,1,0,0|2,0,0]=4 14233 B11R1.235 CCC(=O)COC[C@@H]1C[C@@H]1C e2c201c46a0ffc0e11d93636eaf8cf55 [0,1,0,1,0,0|2,0,0]=4 14234 B11R1.235 CCC(=O)COC[C@@H]1C[C@H]1C 5076f695763d741c90399d9af64b3868 [0,1,0,1,0,0|2,0,0]=4 14235 B11R1.235 CCC(=O)COC[C@H]1C[C@@H]1C 613029eceb61cc9d4d3840b704651bd1 [0,1,0,1,0,0|2,0,0]=4 14236 B11R1.235 CNC(=O)CCNC1CC1C 815c4d804c8cbd9a25f04a7a86cf8557 [0,1,0,1,0,0|2,0,0]=4 14237 B11R1.235 CNC(=O)COCC1CC1C 16cf689d627d0566a2897ddc4b5124d7 [0,1,0,1,0,0|2,0,0]=4 14238 B11R1.235 CNC(=O)COC[C@@H]1C[C@@H]1C af2cfc27d38afe12763114788e577deb [0,1,0,1,0,0|2,0,0]=4 14239 B11R1.235 CNC(=O)COC[C@@H]1C[C@H]1C 4a81f9115ce6b0e51160bee62009bec6 [0,1,0,1,0,0|2,0,0]=4 14240 B11R1.235 CNC(=O)COC[C@H]1C[C@@H]1C 096e661f42e24fbe25d9339f47852150 [0,1,0,1,0,0|2,0,0]=4 14241 B11R1.235 COC(=O)CCNC1CC1C 7e2d7925952763426c1fdcb3332cd11c [0,1,0,1,0,0|1,0,0]=3 14242 B11R1.235 COC(=O)CCN[C@@H]1C[C@H]1F 36d52e08cc49dce75dafe0d275869c93 [0,1,0,1,0,0|2,0,0]=4 14243 B11R1.235 COC(=O)CCN[C@H]1C[C@@H]1F eb28dbbd34d3aecbac204e12c92fc381 [0,1,0,1,0,0|2,0,0]=4 14244 B11R1.235 COC(=O)CCN[C@H]1C[C@H]1F 46aaffc5a13960db2a5ab70a9b997822 [0,1,0,1,0,0|2,0,0]=4 14245 B11R1.235 COC(=O)COCC1CC1C 642422785b13dfbc2a58fed7d26da21a [0,1,0,1,0,0|1,0,0]=3 14246 B11R1.235 COC(=O)COC[C@@H]1C[C@@H]1C ac81e2d9e5c9300b8a4f5b0a0b55d590 [0,1,0,1,0,0|1,0,0]=3 14247 B11R1.235 COC(=O)COC[C@@H]1C[C@@H]1F 04eba632d514adebc1fe97b17def00d2 [0,1,0,1,0,0|2,0,0]=4 14248 B11R1.235 COC(=O)COC[C@@H]1C[C@H]1C 0e57680fa8952696ce0012ec8117c7ed [0,1,0,1,0,0|1,0,0]=3 14249 B11R1.235 COC(=O)COC[C@@H]1C[C@H]1F 15cf63f5ba5edbc40d70f816fe5bd57b [0,1,0,1,0,0|2,0,0]=4 14250 B11R1.235 COC(=O)COC[C@H]1C[C@@H]1C f7f3e3103956f375d92f46e823eb60c6 [0,1,0,1,0,0|1,0,0]=3 14251 B11R1.235 COC(=O)COC[C@H]1C[C@@H]1F 83296423a9f7ae138b802a0f36c12641 [0,1,0,1,0,0|2,0,0]=4 14252 B11R1.235 COC(=O)COC[C@H]1C[C@H]1F b1b388e897a1ba04f810a8ec14fcc50b [0,1,0,1,0,0|2,0,0]=4 14253 B11R1.235 COC(=O)OCNC1CC1C 2ad71e09a667bf38156f653e8a8bfb31 [0,1,0,1,0,0|2,0,0]=4 14254 B11R1.237 C=C(CNCCC1CC1)OC 7274aea9cd246ec69a8125965d597a63 [0,1,0,1,0,0|2,0,0]=4 14255 B11R1.237 C=C(CO)CNCCC1CC1 f78e1b3c7650b7a88f40622ca3bd12c8 [0,1,0,1,0,0|2,0,0]=4 14256 B11R1.237 C=C(COCCC1CC1)OC f0398fcddcbc472e9a64a0922bffa3b1 [0,1,0,1,0,0|2,0,0]=4 14257 B11R1.237 C=CC(=O)CCCNC1CC1 756bbd76901cc0b1a3ce0d5b67ad4604 [0,1,0,1,0,0|2,0,0]=4 14258 B11R1.237 C=CC(=O)CCCOC1CC1 a097b055100ac03078bcb1b84215fb91 [0,1,0,1,0,0|2,0,0]=4 14259 B11R1.237 CCC(=O)CNCCC1CC1 a885a7fe4a477980dbdc20e8f12a39e8 [0,1,0,1,0,0|2,0,0]=4 14260 B11R1.237 CCC(=O)COCCC1CC1 83ada89a33409d434e0ff3981e71343e [0,1,0,1,0,0|2,0,0]=4 14261 B11R1.237 CNC(=O)CCCNC1CC1 68b654a12598241423b1995046e8ddb3 [0,1,0,1,0,0|2,0,0]=4 14262 B11R1.237 CNC(=O)CCCOC1CC1 1f685bae77813cf8dbf291a6b8ae6b37 [0,1,0,1,0,0|2,0,0]=4 14263 B11R1.237 CNC(=O)CCNCC1CC1 c4187ceaaa54a107df7b701a3f788981 [0,1,0,1,0,0|2,0,0]=4 14264 B11R1.237 CNC(=O)CCOCC1CC1 c1423c3319f7ce68e274d75751ce68bf [0,1,0,1,0,0|2,0,0]=4 14265 B11R1.237 CNC(=O)CNCCC1CC1 29187b78c0574540a6984da746360111 [0,1,0,1,0,0|2,0,0]=4 14266 B11R1.237 CNC(=O)COCCC1CC1 b061e2d4cfe5789838e3fa67488b6f33 [0,1,0,1,0,0|2,0,0]=4 14267 B11R1.237 COC(=O)CCCNC1CC1 91f122205aef264300272f7c71644f72 [0,1,0,1,0,0|1,0,0]=3 14268 B11R1.237 COC(=O)CCCOC1CC1 ce0aa01a0a22e22e273fc191e24962c2 [0,1,0,1,0,0|1,0,0]=3 14269 B11R1.237 COC(=O)CCNCC1CC1 5637813e47e4a9a39fb2139d614ec349 [0,1,0,1,0,0|1,0,0]=3 14270 B11R1.237 COC(=O)CCOCC1CC1 06fb4c15cedba387b690c0fd3c66e5c6 [0,1,0,1,0,0|1,0,0]=3 14271 B11R1.237 COC(=O)CNCCC1CC1 ad9b2757e698349a4cc88ccd892e85c6 [0,1,0,1,0,0|1,0,0]=3 14272 B11R1.237 COC(=O)CNCCN1CC1 ec0368fa2af01f450146e4e8bfae66a0 [0,1,0,1,0,0|2,0,0]=4 14273 B11R1.237 COC(=O)COCCC1CC1 3f5d9037052dd112f065415a5e13b31e [0,1,0,1,0,0|1,0,0]=3 14274 B11R1.237 COC(=O)COCCN1CC1 3224f7863777b2fbec98b0ff6a542375 [0,1,0,1,0,0|2,0,0]=4 14275 B11R1.237 COC(=O)OCCOC1CC1 dcfcb2cf70b06d0935ce2516c06ad540 [0,1,0,1,0,0|2,0,0]=4 14276 B11R1.237 COC(=O)OCNCC1CC1 0774278246b758d31975d94dc3fac553 [0,1,0,1,0,0|2,0,0]=4 14277 B11R1.237 COC(=O)OCOCC1CC1 6f650c75d4f1bdbe126e93a1dfc77e0a [0,1,0,1,0,0|2,0,0]=4 14278 B11R1.237 O=C(CCNCC1CC1)NO 9aab5ada32542e2b22aa1335093e9090 [0,1,0,1,0,0|1,0,0]=3 14279 B11R1.237 O=C(CNCCC1CC1)NO 84fc1b5135249221f2cf8afafeadfaf0 [0,1,0,1,0,0|1,0,0]=3 14280 B11R1.237 O=C(CO)CNCCC1CC1 b8f19c9e01727926fa644d5ba0e6cf92 [0,1,0,1,0,0|1,0,0]=3 14281 B11R1.237 O=C(CO)CNCCN1CC1 5e9deaa8908b50e6d40e2f8b6fdfed61 [0,1,0,1,0,0|2,0,0]=4 14282 B11R1.237 O=C(CO)NCCOC1CC1 f88743acbd62749f0cf2b710be051bfe [0,1,0,1,0,0|2,0,0]=4 14283 B11R1.262 CCC1CN(C1)CCC(=O)C 8210da71d02294fb7acb23f6dc2a33e1 [0,1,0,1,0,0|2,0,0]=4 14284 B11R1.262 CCC1CN(C1)CCC(=O)N 3abc832d62193fc4ab50ea50e7356c4c [0,1,0,1,0,0|2,0,0]=4 14285 B11R1.262 CCC1CN(C1)CCC(=O)O 64ee6ad127402eadfd0b2c5af4ef7e5c [0,1,0,1,0,0|1,0,0]=3 14286 B11R1.262 CCN1CC(C1)NCC(=O)O 4046e7ae131288a4988c8bb07459665e [0,1,0,1,0,0|2,0,0]=4 14287 B11R1.262 CCN1CC(C1)OCC(=O)O fd64ee69d2db3794736e169283b46bcb [0,1,0,1,0,0|2,0,0]=4 14288 B11R1.262 COC1CC(C1)NCC(=O)O b8a35ddd7ff1ab946c85acdd5db4e908 [0,1,0,1,0,0|2,0,0]=4 14289 B11R1.262 COC1CC(C1)OCC(=O)O 234ea0a05b3f74d1735a3101aee3e7f0 [0,1,0,1,0,0|2,0,0]=4 14290 B11R1.262 COC1CN(C1)CCC(=O)O d27200421617f1d6231b1ede3b721e5c [0,1,0,1,0,0|2,0,0]=4 14291 B11R1.262 CO[C@H]1C[C@@H](C1)NCC(=O)O f32b845a1eba1715487fd48aab72d9b5 [0,1,0,1,0,0|2,0,0]=4 14292 B11R1.262 CO[C@H]1C[C@@H](C1)OCC(=O)O a33352500fe3b68e2ba35e1deb927be4 [0,1,0,1,0,0|2,0,0]=4 14293 B11R1.262 CO[C@H]1C[C@H](C1)NCC(=O)O 1e36757b3a9c88e16436ef6f956242dd [0,1,0,1,0,0|2,0,0]=4 14294 B11R1.262 CO[C@H]1C[C@H](C1)OCC(=O)O 1e87f9be1fa82824da103c23245b19a5 [0,1,0,1,0,0|2,0,0]=4 14295 B11R1.262 CSC1CN(C1)CCC(=O)O 11c94a4e59b8af417207edef782c2dd3 [0,1,0,1,0,0|2,0,0]=4 14296 B11R1.262 O=C(O)CCN1CC(C1)CF 3c7194afa5657b395b55ea47938c2dd1 [0,1,0,1,0,0|2,0,0]=4 14297 B11R1.262 O=C(O)CCN1CC(C1)CO 4218b03d048c30c8e5f0133f8906a623 [0,1,0,1,0,0|2,0,0]=4 14298 B11R1.262 O=C(O)CNC1CC(C1)CO 30b1ee61d8f6438fb3972d86362f2e3c [0,1,0,1,0,0|2,0,0]=4 14299 B11R1.262 O=C(O)CN[C@H]1C[C@@H](C1)CO 77a138c630bd29d86bf4915c8dfb1d68 [0,1,0,1,0,0|2,0,0]=4 14300 B11R1.262 O=C(O)CN[C@H]1C[C@H](C1)CO ce671a66baeb0225cda60241d35468dd [0,1,0,1,0,0|2,0,0]=4 14301 B11R1.262 O=C(O)CO[C@H]1C[C@H](C1)CF 3ed1cb63b087e24407bb0e82f052eb4c [0,1,0,1,0,0|2,0,0]=4 14302 B11R1.266 CCC1CCCN(C1)C(=O)C ca0d6e4dee631bdae567e46ba016b820 [0,1,0,1,0,0|2,0,0]=4 14303 B11R1.266 CCN1CCCC(C1)C(=O)C 7f617dfaecf8f7824e363c0d9143c28b [0,1,0,1,0,0|2,0,0]=4 14304 B11R1.266 CCN1CCCC(C1)C(=O)N daf15f0550ba6cb25300a7e580f13777 [0,1,0,1,0,0|2,0,0]=4 14305 B11R1.266 CCN1CCCC(C1)C(=O)O 28b1470d766111c2957be20a8d45d958 [0,1,0,1,0,0|1,0,0]=3 14306 B11R1.266 CCN1CCC[C@@H](C1)C(=O)N 936b687b6b771ab33dbd6480279f51dd [0,1,0,1,0,0|2,0,0]=4 14307 B11R1.266 CCN1CCC[C@@H](C1)C(=O)O 309277be4e0f7375cc336beae3e6ed94 [0,1,0,1,0,0|1,0,0]=3 14308 B11R1.266 CCN1CCC[C@H](C1)C(=O)N 33cc80d25913d6323816424dd8db6ab9 [0,1,0,1,0,0|2,0,0]=4 14309 B11R1.266 CCN1CCC[C@H](C1)C(=O)O 9b0c0dee0bedc13af0c6f07ce5fca89f [0,1,0,1,0,0|1,0,0]=3 14310 B11R1.266 CCN1CCOC(C1)C(=O)O 34facf27caa98f3dbb050c923a3afb82 [0,1,0,1,0,0|2,0,0]=4 14311 B11R1.266 CCN1CCO[C@@H](C1)C(=O)O 3cd80a8f6f95ce298149e65adb302c64 [0,1,0,1,0,0|2,0,0]=4 14312 B11R1.266 CCN1CCO[C@H](C1)C(=O)O c40e4634821f5b4937ef0c702c4fa2af [0,1,0,1,0,0|2,0,0]=4 14313 B11R1.266 CCN1CCSC(C1)C(=O)O 8c057df49dd6ae347f877cd7db74dcf1 [0,1,0,1,0,0|2,0,0]=4 14314 B11R1.266 O=C(O)C1CCCN(C1)CF ceed25d342cb3fc235399cbd8505d246 [0,1,0,1,0,0|2,0,0]=4 14315 B11R1.266 O=C(O)C1CCCN(C1)CO a381596e32adf8b77f4338b0827e1d91 [0,1,0,1,0,0|2,0,0]=4 14316 B11R1.266 O=C(O)[C@@H]1CCCN(C1)CF 98f4760baa1b091572c917aa1f6bbdfc [0,1,0,1,0,0|2,0,0]=4 14317 B11R1.266 O=C(O)[C@@H]1CCCN(C1)CO 8a48e3e9d2eb67d5157b280cd20198f9 [0,1,0,1,0,0|2,0,0]=4 14318 B11R1.266 O=C(O)[C@H]1CCCN(C1)CF 78111171e5e39d066ef68cc901a73060 [0,1,0,1,0,0|2,0,0]=4 14319 B11R1.266 O=C(O)[C@H]1CCCN(C1)CO a47d0df0535c253180a62abd6b0ecb6a [0,1,0,1,0,0|2,0,0]=4 14320 B11R1.313 CC1C(CCN1CC(=O)N)O dcd3c9958871687da3b23dbb75f47525 [0,1,0,1,0,0|2,0,0]=4 14321 B11R1.313 CC1C(CCN1CC(=O)O)O 027f7a9d3e364d40f593f2ca6063316d [0,1,0,1,0,0|1,0,0]=3 14322 B11R1.313 C[C@@H]1[C@@H](CCN1CC(=O)N)O bf213165fa1bb68166291354b456fe8c [0,1,0,1,0,0|2,0,0]=4 14323 B11R1.313 C[C@@H]1[C@@H](CCN1CC(=O)O)O cc6ac21c98b705816d21ff94a7475db9 [0,1,0,1,0,0|1,0,0]=3 14324 B11R1.313 C[C@H]1[C@H](CCN1CC(=O)N)O 957c9f6eff3f12b9f67f32b6dcfd6ebb [0,1,0,1,0,0|2,0,0]=4 14325 B11R1.313 C[C@H]1[C@H](CCN1CC(=O)O)O bf39d673616a4042c12a9618547d11c0 [0,1,0,1,0,0|1,0,0]=3 14326 B11R1.717 CC(=O)CCCNC1(CC1)C f57ea816d89c520a1aedf886ba726d59 [0,1,0,1,0,0|2,0,0]=4 14327 B11R1.717 CC(=O)CCNCC1(CC1)F 5224e4e7c7e1b0e8dc04da03ec47d03f [0,1,0,1,0,0|2,0,0]=4 14328 B11R1.717 CC(=O)CCNCC1(CC1)O 28db24bcc274eba7457476a97a8a3f79 [0,1,0,1,0,0|2,0,0]=4 14329 B11R1.717 CC(=O)CCOCC1(CC1)Br cb35df09ebbb8214cc83580990d998eb [0,1,0,1,0,0|2,0,0]=4 14330 B11R1.717 CC(=O)CCOCC1(CC1)C 2a73eb20002cb10a9c42725130cc8bca [0,1,0,1,0,0|2,0,0]=4 14331 B11R1.717 CC(=O)CCOCC1(CC1)Cl 1db66f4dafae7cda2863e9f00638ca54 [0,1,0,1,0,0|2,0,0]=4 14332 B11R1.717 CC(=O)CCOCC1(CC1)F f8d3daa1defc03f6c63c6b53bb29312d [0,1,0,1,0,0|2,0,0]=4 14333 B11R1.717 CC1(CC1)CCOCC(=O)N 5c91ef6f107b96f65870471a7878ee6f [0,1,0,1,0,0|2,0,0]=4 14334 B11R1.717 CC1(CC1)CCOCC(=O)O 84d2d064838dc51066d8cc48d84c03d3 [0,1,0,1,0,0|1,0,0]=3 14335 B11R1.717 CC1(CC1)CNCCC(=O)N 91933af0fa1d3e1345816968936a3924 [0,1,0,1,0,0|2,0,0]=4 14336 B11R1.717 CC1(CC1)CNCCC(=O)O d57e65affcb7ee3cf366f8bf8407e010 [0,1,0,1,0,0|1,0,0]=3 14337 B11R1.717 CC1(CC1)CNCCS(=O)O e2a4f0b85da71f7c1c2ad3b76766f070 [0,1,0,1,0,0|2,0,0]=4 14338 B11R1.717 CC1(CC1)COCCC(=O)N df24b352d03009cd2dcd971df51f6340 [0,1,0,1,0,0|2,0,0]=4 14339 B11R1.717 CC1(CC1)COCCC(=O)O bee70d6119a05c3df8f9d41595f92087 [0,1,0,1,0,0|1,0,0]=3 14340 B11R1.717 CC1(CC1)NCCCC(=O)N b64e7bebb6ca6169041ab264a82059f0 [0,1,0,1,0,0|2,0,0]=4 14341 B11R1.717 CC1(CC1)NCCCC(=O)O cac83886a5409521de3b4d9e573375c9 [0,1,0,1,0,0|1,0,0]=3 14342 B11R1.717 NC(=O)CCNCC1(CC1)F 13f5738e7ee61a9bb59015cab196d19d [0,1,0,1,0,0|2,0,0]=4 14343 B11R1.717 NC(=O)CCNCC1(CC1)O cb5128fa65be69f42497ec00e0be76d1 [0,1,0,1,0,0|2,0,0]=4 14344 B11R1.717 NC(=O)CCOCC1(CC1)Br a1372e80ae9ea67bafc39097788efdf5 [0,1,0,1,0,0|2,0,0]=4 14345 B11R1.717 NC(=O)CCOCC1(CC1)Cl a392333f88769142d92e2ee90b7cccd3 [0,1,0,1,0,0|2,0,0]=4 14346 B11R1.717 NC(=O)CCOCC1(CC1)F a1355435a4d3b68e683dc472606a54d3 [0,1,0,1,0,0|2,0,0]=4 14347 B11R1.717 NC(=O)CNCCC1(CC1)O da615df49f233e3f48bca26c84a0fecb [0,1,0,1,0,0|2,0,0]=4 14348 B11R1.717 O=C(O)CCNCC1(CC1)F c55cf54214e0d8d9e3b847d498aaf6e0 [0,1,0,1,0,0|1,0,0]=3 14349 B11R1.717 O=C(O)CCNCC1(CC1)O ba5baa63bd15a0e41e099791a49851da [0,1,0,1,0,0|1,0,0]=3 14350 B11R1.717 O=C(O)CCOCC1(CC1)Br ff502a3d771784031fdef073908010f9 [0,1,0,1,0,0|1,0,0]=3 14351 B11R1.717 O=C(O)CCOCC1(CC1)Cl 6ff1305ad156099efb1657fae8c63604 [0,1,0,1,0,0|1,0,0]=3 14352 B11R1.717 O=C(O)CCOCC1(CC1)F 331b52797d6ecccad06414475a1f86de [0,1,0,1,0,0|1,0,0]=3 14353 B11R1.717 O=C(O)CNCCC1(CC1)O 72d291a3152845217abc0b1d9fed8988 [0,1,0,1,0,0|1,0,0]=3 14354 B11R1.717 O=S(O)CCNCC1(CC1)F 7f17b85653ffcbaecffae53644152252 [0,1,0,1,0,0|2,0,0]=4 14355 B11R1.870 CC(CO)N1CCC1C(=O)O 64a39f58d253c4c56ddbbd764766ff2b [0,1,0,1,0,0|2,0,0]=4 14356 B11R1.870 CC(CO)N1CC[C@@H]1C(=O)O fe1ca87434fa71264590ab7388ded81a [0,1,0,1,0,0|2,0,0]=4 14357 B11R1.870 CC(CO)N1CC[C@H]1C(=O)O 54b522e6a172aef7d7ebe9ad0a6cf235 [0,1,0,1,0,0|2,0,0]=4 14358 B11R1.870 CCC(C)N1CCC1C(=O)N 05f88a1e091f67762a9c0f34a9514566 [0,1,0,1,0,0|2,0,0]=4 14359 B11R1.870 CCC(C)N1CCC1C(=O)O afe65961632cdc12c6a0cac6ccd237b0 [0,1,0,1,0,0|1,0,0]=3 14360 B11R1.870 CCC(C)N1CC[C@@H]1C(=O)N e776da4c92e1230346b041c32c7367d1 [0,1,0,1,0,0|2,0,0]=4 14361 B11R1.870 CCC(C)N1CC[C@@H]1C(=O)O 3b733a3df40699e823ff19c103a33ab0 [0,1,0,1,0,0|1,0,0]=3 14362 B11R1.870 CCC(C)N1CC[C@H]1C(=O)N 587ef76c36c4496bbbbcfba88bd19888 [0,1,0,1,0,0|2,0,0]=4 14363 B11R1.870 CCC(C)N1CC[C@H]1C(=O)O bd2a34fc754cc104b730a89488d36264 [0,1,0,1,0,0|1,0,0]=3 14364 B11R1.870 C[C@@H](CO)N1CCC1C(=O)O f9e8fdb8f19bd61bd458c102b09ff475 [0,1,0,1,0,0|2,0,0]=4 14365 B11R1.870 C[C@@H](CO)N1CC[C@@H]1C(=O)O ea63b04976166a7a3addf128f4cc339c [0,1,0,1,0,0|2,0,0]=4 14366 B11R1.870 C[C@@H](CO)N1CC[C@H]1C(=O)O 9c2846c40af07dca4c89739a70d564a3 [0,1,0,1,0,0|2,0,0]=4 14367 B11R1.870 C[C@H](CO)N1CCC1C(=O)O 362931c0312f4f37d535ce7e0294aa4e [0,1,0,1,0,0|2,0,0]=4 14368 B11R1.870 C[C@H](CO)N1CC[C@@H]1C(=O)O 76e0753b08d8c5d35b83d75e1105b00a [0,1,0,1,0,0|2,0,0]=4 14369 B11R1.870 C[C@H](CO)N1CC[C@H]1C(=O)O e0bda7550b4d5f34c232996b6c0a3160 [0,1,0,1,0,0|2,0,0]=4 14370 B11R1.892 CC(CF)O[C@@H]1C[C@@H]1C(=O)O ee51af714f4707fb01c1e5dbc2d0b2d6 [0,1,0,1,0,0|2,0,0]=4 14371 B11R1.892 CC(CF)O[C@H]1C[C@@H]1C(=O)O b1659e307f6477390bc018cfd32ca4ee [0,1,0,1,0,0|2,0,0]=4 14372 B11R1.892 CC(CF)O[C@H]1C[C@H]1C(=O)O 7cf45c783879403e76bf09165a708a3b [0,1,0,1,0,0|2,0,0]=4 14373 B11R1.892 CC(CO)N[C@@H]1C[C@@H]1C(=O)O c8b1f5c08527fc2287e01fe5ac4cf8c2 [0,1,0,1,0,0|2,0,0]=4 14374 B11R1.892 CC(CO)N[C@H]1C[C@@H]1C(=O)O e5e2b0d8ab7feb14718765ab04a84489 [0,1,0,1,0,0|2,0,0]=4 14375 B11R1.892 CC(CO)N[C@H]1C[C@H]1C(=O)O 45659aac39936fe3f35d779b96660d9e [0,1,0,1,0,0|2,0,0]=4 14376 B11R1.892 CC(CS)O[C@@H]1C[C@@H]1C(=O)O 212fd01d3f60eab1deb9d2b8e6d7bb0c [0,1,0,1,0,0|2,0,0]=4 14377 B11R1.892 CC(CS)O[C@H]1C[C@@H]1C(=O)O f46ea7cdb4343d767a0f1bccaeacddcc [0,1,0,1,0,0|2,0,0]=4 14378 B11R1.892 CC(CS)O[C@H]1C[C@H]1C(=O)O 972dd0d400d9ff73d6806eac3b3cddb5 [0,1,0,1,0,0|2,0,0]=4 14379 B11R1.892 CCC(C)N[C@@H]1C[C@@H]1C(=O)O a8cd8e4ec709a515c04f193a1a719e1d [0,1,0,1,0,0|1,0,0]=3 14380 B11R1.892 CCC(C)N[C@H]1C[C@@H]1C(=O)O f915e01331c46295cd246cc331847cfb [0,1,0,1,0,0|1,0,0]=3 14381 B11R1.892 CCC(C)N[C@H]1C[C@H]1C(=O)O eb5be61641a47376e3045e426296bf18 [0,1,0,1,0,0|1,0,0]=3 14382 B11R1.892 CCC(C)O[C@@H]1C[C@@H]1C(=O)O 82158589920c3bbf57aec45aec55e9bb [0,1,0,1,0,0|1,0,0]=3 14383 B11R1.892 CCC(C)O[C@H]1C[C@@H]1C(=O)O bcf7fb29d3b10f3ee36f553624eaddc7 [0,1,0,1,0,0|1,0,0]=3 14384 B11R1.892 CCC(C)O[C@H]1C[C@H]1C(=O)O 7dd434d5d338eedf924437bb92763db6 [0,1,0,1,0,0|1,0,0]=3 14385 B11R1.892 CCN(C)CC1CC1C(=O)O 6af3c364fc2aa2c4b14494438e07c208 [0,1,0,1,0,0|1,0,0]=3 14386 B11R1.892 CCN(C)C[C@@H]1C[C@H]1C(=O)O f63f7d2d96e335da5e89acba830fe921 [0,1,0,1,0,0|1,0,0]=3 14387 B11R1.892 CC[C@@H](C)N[C@@H]1C[C@@H]1C(=O)O 02e3f132d1b9032cb620960607fd3c07 [0,1,0,1,0,0|1,0,0]=3 14388 B11R1.892 CC[C@@H](C)N[C@H]1C[C@@H]1C(=O)O c8907bcf14c8b362f19ce4fe6eb6d7e0 [0,1,0,1,0,0|1,0,0]=3 14389 B11R1.892 CC[C@@H](C)N[C@H]1C[C@H]1C(=O)O 191d4f00e4cf748148f4c6ecb39740b9 [0,1,0,1,0,0|1,0,0]=3 14390 B11R1.892 CC[C@@H](C)O[C@@H]1C[C@@H]1C(=O)O 2eac9a038a35e45c9d991bfff922c25b [0,1,0,1,0,0|1,0,0]=3 14391 B11R1.892 CC[C@@H](C)O[C@H]1C[C@@H]1C(=O)O b1762d7cf55e79edbe65f796803d70dc [0,1,0,1,0,0|1,0,0]=3 14392 B11R1.892 CC[C@@H](C)O[C@H]1C[C@H]1C(=O)O 4ff5a736a9770d7a855365cda04f3c8b [0,1,0,1,0,0|1,0,0]=3 14393 B11R1.892 CC[C@H](C)N[C@@H]1C[C@@H]1C(=O)O 3d0d55ba8ac519f226e313cc8e124ad6 [0,1,0,1,0,0|1,0,0]=3 14394 B11R1.892 CC[C@H](C)N[C@H]1C[C@@H]1C(=O)O 077993791e438b1911d587c4330cb8cc [0,1,0,1,0,0|1,0,0]=3 14395 B11R1.892 CC[C@H](C)N[C@H]1C[C@H]1C(=O)O d57284929ca554dced024e3c92c8e917 [0,1,0,1,0,0|1,0,0]=3 14396 B11R1.892 CC[C@H](C)O[C@@H]1C[C@@H]1C(=O)O a10e1864d6fdea82c8d817d687316760 [0,1,0,1,0,0|1,0,0]=3 14397 B11R1.892 CC[C@H](C)O[C@H]1C[C@@H]1C(=O)O 2fa34b9180254e2b987a5d76698e05c4 [0,1,0,1,0,0|1,0,0]=3 14398 B11R1.892 CC[C@H](C)O[C@H]1C[C@H]1C(=O)O 7f604a115ea9868fc812ca90894372ca [0,1,0,1,0,0|1,0,0]=3 14399 B11R1.892 C[C@@H](CO)N[C@@H]1C[C@@H]1C(=O)O 5f2b9eff51981af5d5e1a5ccc01b6119 [0,1,0,1,0,0|2,0,0]=4 14400 B11R1.892 C[C@@H](CO)N[C@H]1C[C@@H]1C(=O)O 1d42eea2165722bae0dc3171240bd87d [0,1,0,1,0,0|2,0,0]=4 14401 B11R1.892 C[C@@H](CO)N[C@H]1C[C@H]1C(=O)O b7456896e613a16e5073cea6a7feca10 [0,1,0,1,0,0|2,0,0]=4 14402 B11R1.892 C[C@H](CO)N[C@@H]1C[C@@H]1C(=O)O 69d6a384094c9081b4a15c90182e7107 [0,1,0,1,0,0|2,0,0]=4 14403 B11R1.892 C[C@H](CO)N[C@H]1C[C@@H]1C(=O)O 320dc754516906eeb8ff79966c1e98f8 [0,1,0,1,0,0|2,0,0]=4 14404 B11R1.892 C[C@H](CO)N[C@H]1C[C@H]1C(=O)O 77331fbea62862395d03884f873972ab [0,1,0,1,0,0|2,0,0]=4 14405 B11R1.892 C[C@H](CS)O[C@@H]1C[C@@H]1C(=O)O bb1249a48cbf2eda802c66682547b9b0 [0,1,0,1,0,0|2,0,0]=4 14406 B11R1.892 C[C@H](CS)O[C@H]1C[C@@H]1C(=O)O eedb0670c542a90eeceb6c24b91aa2e8 [0,1,0,1,0,0|2,0,0]=4 14407 B11R1.892 C[C@H](CS)O[C@H]1C[C@H]1C(=O)O 7d9608cf9a153bab90f4baf9e1e42160 [0,1,0,1,0,0|2,0,0]=4 14408 B11R1.1 CCCNC1CCC(=O)NC1 01bca8b88e0ca1be03a17004b6a757eb [0,1,0,1,0,0|2,0,0]=4 14409 B11R1.1 CCCN[C@@H]1CCC(=O)NC1 f6da54c348c4f94d3f0c0f59910a83e9 [0,1,0,1,0,0|2,0,0]=4 14410 B11R1.1 CCCN[C@H]1CCC(=O)NC1 102971ed7a08e614b31cecd45e20f679 [0,1,0,1,0,0|2,0,0]=4 14411 B11R1.1 CCCOC1CCC(=O)CC1 bd2b467d79e74784675ac0fed3b52410 [0,1,0,1,0,0|2,0,0]=4 14412 B11R1.1 CCCOC1CCC(=O)NC1 2c5714f2e0f298f2039432cc852f7bea [0,1,0,1,0,0|2,0,0]=4 14413 B11R1.1 CCCOC1CCC(=O)OC1 14f68677ebd93dd79e6aff031f73ae29 [0,1,0,1,0,0|1,0,0]=3 14414 B11R1.1 CCCO[C@@H]1CCC(=O)NC1 a1b5fbd9589b341d2f02f45d48cf9b8b [0,1,0,1,0,0|2,0,0]=4 14415 B11R1.1 CCCO[C@H]1CCC(=O)NC1 d60f46dfa0faf1fef277b47dbe8465b4 [0,1,0,1,0,0|2,0,0]=4 14416 B11R1.1 CCNCC1CCC(=O)NC1 fb66b35d54ea28109e3418814f1a27c8 [0,1,0,1,0,0|2,0,0]=4 14417 B11R1.1 CCNCC1CNC(=O)CO1 8bc6917dd943e8e0976473a82580cdd6 [0,1,0,1,0,0|2,0,0]=4 14418 B11R1.1 CCOCC1CCC(=O)CC1 173502265d717c3ab544f2cf467f9ed3 [0,1,0,1,0,0|2,0,0]=4 14419 B11R1.1 CCOCC1CCC(=O)NC1 113ad3ff7f74b2a9a0b35565fd73cc87 [0,1,0,1,0,0|2,0,0]=4 14420 B11R1.1 CCOCC1CNC(=O)CO1 a85eae73061a3e8b9dc0e01491b2ceb6 [0,1,0,1,0,0|2,0,0]=4 14421 B11R1.1 CCOC[C@@H]1CNC(=O)CO1 2374c5a21f6a450a09c74849fb793583 [0,1,0,1,0,0|2,0,0]=4 14422 B11R1.1 CCOC[C@H]1CNC(=O)CO1 2cfa68af758497d822b421da04a59f2e [0,1,0,1,0,0|2,0,0]=4 14423 B11R1.1 COCOC1CCC(=O)OC1 7bbb527ea6b8b0aa3dea9ab4b8ad3e42 [0,1,0,1,0,0|2,0,0]=4 14424 B11R1.1 CSCOC1CCC(=O)OC1 2a56f8b9adee39ece1780f4b86a249e9 [0,1,0,1,0,0|2,0,0]=4 14425 B11R1.1 O=C1CCC(CO1)OCCF 2fe856fd4572c2d2c163269a480451cf [0,1,0,1,0,0|2,0,0]=4 14426 B11R1.1 O=C1CCC(CO1)OCCS 52ab2dec8247620d8be01eb74f832e4e [0,1,0,1,0,0|2,0,0]=4 14427 B11R1.25 C#CC(=O)NCC1CCCC1 19e5630ab56a67a623a78fe4eeb47110 [0,1,0,1,0,0|2,0,0]=4 14428 B11R1.25 C=C(C=O)OCC1CCCC1 ca47568c77ec94bb1b0ee5b31920d671 [0,1,0,1,0,0|2,0,0]=4 14429 B11R1.25 C=C(CNC1CCCC1)OC 339907691da6d8a310108d8104bee669 [0,1,0,1,0,0|2,0,0]=4 14430 B11R1.25 C=C(CO)CNC1CCCC1 a6dde972aa7478b23180b1bd9253645c [0,1,0,1,0,0|2,0,0]=4 14431 B11R1.25 C=C(COC1CCCC1)OC 4acd45025d09cd2f0357ccccef7743b9 [0,1,0,1,0,0|2,0,0]=4 14432 B11R1.25 C=CC(=O)NCC1CCCC1 913510e2b5f2915dd764d86236e52066 [0,1,0,1,0,0|2,0,0]=4 14433 B11R1.25 CCC(=O)CNC1CCCC1 76b45c3a0dd534705a0e971da9b0a719 [0,1,0,1,0,0|2,0,0]=4 14434 B11R1.25 CCC(=O)COC1CCCC1 f5592f3105f8177e7a774879be0a01c7 [0,1,0,1,0,0|2,0,0]=4 14435 B11R1.25 CCC(=O)NCC1CCCC1 c4f7a0ef14d38131f5bfe5b834523fe9 [0,1,0,1,0,0|2,0,0]=4 14436 B11R1.25 CNC(=O)CNC1CCCC1 b5948cfc8f68ee9e7ce479dd3670fe33 [0,1,0,1,0,0|2,0,0]=4 14437 B11R1.25 CNC(=O)COC1CCCC1 5d981b3872cdec3b1a66c1fafc01c71b [0,1,0,1,0,0|2,0,0]=4 14438 B11R1.25 COC(=O)CCN1CCSC1 349e9618596cf2bf717aabfc7c3b177f [0,1,0,1,0,0|2,0,0]=4 14439 B11R1.25 COC(=O)CNC1CCCC1 b87ff11671c5cc80045ee4f67f2c7d8b [0,1,0,1,0,0|1,0,0]=3 14440 B11R1.25 COC(=O)CNC1CCOC1 05ab7e9c2ad7cb9e4042e016ccf1f3ed [0,1,0,1,0,0|2,0,0]=4 14441 B11R1.25 COC(=O)CNC1CCSC1 409c493a90b305c7b128bb02eb6c317e [0,1,0,1,0,0|2,0,0]=4 14442 B11R1.25 COC(=O)CN[C@@H]1CCOC1 fd7d583a75c5abab0958beb4a423ccaa [0,1,0,1,0,0|2,0,0]=4 14443 B11R1.25 COC(=O)CN[C@H]1CCOC1 3af15413193f72d20d74ddaaa4c5ab66 [0,1,0,1,0,0|2,0,0]=4 14444 B11R1.25 COC(=O)COC1CCCC1 085020e1b123128ec3ee74cb59ea108d [0,1,0,1,0,0|1,0,0]=3 14445 B11R1.25 COC(=O)COC1CCCO1 488ce1775fb1ab5ed24680c3d56b6b00 [0,1,0,1,0,0|2,0,0]=4 14446 B11R1.25 COC(=O)COC1CCOC1 672fcaec0ea9593ac16e56502a9fdee4 [0,1,0,1,0,0|2,0,0]=4 14447 B11R1.25 COC(=O)COC1CCSC1 6269e081f7ba74969c28e24cbcdfccc8 [0,1,0,1,0,0|2,0,0]=4 14448 B11R1.25 COC(=O)CO[C@@H]1CCOC1 9549e5f170a6076f3f6164dd1fd81c4a [0,1,0,1,0,0|2,0,0]=4 14449 B11R1.25 COC(=O)CO[C@@H]1CCSC1 003732c05206222af2d47eaa8a6da109 [0,1,0,1,0,0|2,0,0]=4 14450 B11R1.25 COC(=O)CO[C@H]1CCOC1 6cc66a8c78e479df54b0253da8b20e51 [0,1,0,1,0,0|2,0,0]=4 14451 B11R1.25 COC(=O)CO[C@H]1CCSC1 903b86673c3a6eeaa29f5727ac5924e8 [0,1,0,1,0,0|2,0,0]=4 14452 B11R1.25 O=C(CF)NCC1CCCC1 99bf786d6f4caaa837fed42ace4d07b6 [0,1,0,1,0,0|2,0,0]=4 14453 B11R1.25 O=C(CNC1CCCC1)NO 89cbd613c50f10b0b8f988b59fa404c3 [0,1,0,1,0,0|1,0,0]=3 14454 B11R1.25 O=C(CNC1CCOC1)NO 24314f1ec909151704e01438677a1eb4 [0,1,0,1,0,0|2,0,0]=4 14455 B11R1.25 O=C(CN[C@@H]1CCOC1)NO 8d5a6a64aa61055c1b090ea434fda32d [0,1,0,1,0,0|2,0,0]=4 14456 B11R1.25 O=C(CN[C@H]1CCOC1)NO db86e0566d18f53f51ae56b3d8aa123e [0,1,0,1,0,0|2,0,0]=4 14457 B11R1.25 O=C(CO)CNC1CCCC1 d04a6ed6af16e8c43144caf464503e98 [0,1,0,1,0,0|1,0,0]=3 14458 B11R1.25 O=C(CO)CNC1CCOC1 c02a47fb75481045c2d72656e00d0188 [0,1,0,1,0,0|2,0,0]=4 14459 B11R1.25 O=C(CO)CNC1CCSC1 f6041398795ea8f61bb9a3dff4ff5934 [0,1,0,1,0,0|2,0,0]=4 14460 B11R1.25 O=C(CO)CN[C@@H]1CCOC1 9a7dbf8921d7439ded5f27772d1af5f8 [0,1,0,1,0,0|2,0,0]=4 14461 B11R1.25 O=C(CO)CN[C@H]1CCOC1 f7ef494985bff5496127fc62382403ae [0,1,0,1,0,0|2,0,0]=4 14462 B11R1.25 O=C(CO)NCC1CCCC1 f7ac91afe6b6e514190cbfb9dcc5af90 [0,1,0,1,0,0|1,0,0]=3 14463 B11R1.25 O=C(CO)NCC1CCCO1 b1a2e6b1ddf82d78b13eefaf2d170353 [0,1,0,1,0,0|2,0,0]=4 14464 B11R1.25 O=C(CO)NCC1CCOC1 eab29b4d8716d6d0f87dc0141843f021 [0,1,0,1,0,0|2,0,0]=4 14465 B11R1.25 O=C(CO)NC[C@@H]1CCCO1 c0a62b388b236d3289ff2f16373b4946 [0,1,0,1,0,0|2,0,0]=4 14466 B11R1.25 O=C(CO)NC[C@@H]1CCOC1 0dbe4b7b463ddf225b4e362a3958e630 [0,1,0,1,0,0|2,0,0]=4 14467 B11R1.25 O=C(CO)NC[C@H]1CCCO1 094ef3167d1e3f0ba1564141941f0a38 [0,1,0,1,0,0|2,0,0]=4 14468 B11R1.25 O=C(CO)NC[C@H]1CCOC1 884dcfcb16e122c8f6658a4974a5da24 [0,1,0,1,0,0|2,0,0]=4 14469 B11R1.25 O=C(CS)NCC1CCCC1 8fb56c7ce7e1ab96cfce8ab70e30d7b0 [0,1,0,1,0,0|1,1,0]=4 14470 B11R1.25 O=CC(=O)NCC1CCCC1 4b289dc4922d113792ba2f006dfe3859 [0,1,0,1,0,0|1,0,1]=4 14471 B11R1.40 C=C(C=O)OC1CCCCC1 83442df048e84ca166f7cbc3e77a387f [0,1,0,1,0,0|2,0,0]=4 14472 B11R1.40 CN(C=O)CC1CCCCC1 a4141b9f309b84a7bbfe4f3281518f11 [0,1,0,1,0,0|2,0,0]=4 14473 B11R1.40 CN(CO)CC1CCCCC1 5e43446878e929501e016365c5799864 [0,1,0,1,0,0|2,0,0]=4 14474 B11R1.40 COC(=O)CN1CCCOC1 d8e7420fe9a714146db85b0954ee2e4b [0,1,0,1,0,0|2,0,0]=4 14475 B11R1.40 COC(=O)CN1CCCSC1 e049b1faac247cc20e11e5987b5e1acb [0,1,0,1,0,0|2,0,0]=4 14476 B11R1.40 COC(=O)CN1CCOCC1 f851450f5eec6a58589079a485b2a7bc [0,1,0,1,0,0|2,0,0]=4 14477 B11R1.40 COC(=O)CN1CCSCC1 ef6db8bdab5c922947380732eb96b345 [0,1,0,1,0,0|2,0,0]=4 14478 B11R1.40 O=C(CO)CN1CCCOC1 e66818b6087e27504363307dbf4443ed [0,1,0,1,0,0|2,0,0]=4 14479 B11R1.40 O=C(CO)CN1CCCSC1 451658789e488def50c7c70399d0ce70 [0,1,0,1,0,0|2,0,0]=4 14480 B11R1.40 O=C(CO)CN1CCOCC1 924d4100eeb76004c201eeacf5a3cc39 [0,1,0,1,0,0|2,0,0]=4 14481 B11R1.40 O=C(CO)CN1CCSCC1 9bdedddf67c4b0cf3753cae67ed3684c [0,1,0,1,0,0|2,0,0]=4 14482 B11R1.40 O=C(CO)NC1CCCOC1 e68fca1be22977985af541802f524cec [0,1,0,1,0,0|2,0,0]=4 14483 B11R1.40 O=C(CO)NC1CCOCC1 8828fb10e6c52a94af755f3aec00b4b8 [0,1,0,1,0,0|2,0,0]=4 14484 B11R1.40 O=C(CO)NC1CCSCC1 3ca7fb15e15b22a706514e8da635d23b [0,1,0,1,0,0|2,0,0]=4 14485 B11R1.40 O=C(CO)N[C@@H]1CCCOC1 53c5ab99580ab667aa55ce860987381b [0,1,0,1,0,0|2,0,0]=4 14486 B11R1.40 O=C(CO)N[C@H]1CCCOC1 982073ebf29b28f3868e25b25930c9a3 [0,1,0,1,0,0|2,0,0]=4 14487 B11R1.59 C#CC(=O)N1CCCC1CC fb538397b576914d28b5e7e9e6dca3c5 [0,1,0,1,0,0|2,0,0]=4 14488 B11R1.59 C#CC(=O)N1CCC[C@H]1CC 3cc1db87c57795b34ced25c07c40b8d3 [0,1,0,1,0,0|2,0,0]=4 14489 B11R1.59 C=CC(=O)N1CCCC1CC 31afd921b77d2cb98e7a5c763493f979 [0,1,0,1,0,0|2,0,0]=4 14490 B11R1.59 C=CC(=O)N1CCC[C@H]1CC 3b37299cc59fceab3a7578c5970cf222 [0,1,0,1,0,0|2,0,0]=4 14491 B11R1.59 CCC(=O)N1CCCC1CC 2ce87378127394d65266906acf474f6e [0,1,0,1,0,0|2,0,0]=4 14492 B11R1.59 CCC(=O)N1CCC[C@H]1CC 6dd4884ad62ec61fc10830857b5556fa [0,1,0,1,0,0|2,0,0]=4 14493 B11R1.59 CCC1CCCN1C(=O)C=O f1df7d15d0a5438d7392311c4ab99a27 [0,1,0,1,0,0|1,0,1]=4 14494 B11R1.59 CCC1CCCN1C(=O)CF f1ec72c708cfe8359aeebefbb83a2bb0 [0,1,0,1,0,0|2,0,0]=4 14495 B11R1.59 CCC1CCCN1C(=O)CO a6fe23a8d97bd8a3bcaaf6c6878f2b20 [0,1,0,1,0,0|1,0,0]=3 14496 B11R1.59 CCC1CCCN1C(=O)CS 2990aaaad8906e7ab767552f7ab9c7d3 [0,1,0,1,0,0|1,1,0]=4 14497 B11R1.59 CCN1CCCC1C(=O)NC 4e0005b1af551fac9bc40da3c0ef3e15 [0,1,0,1,0,0|2,0,0]=4 14498 B11R1.59 CCN1CCCC1C(=O)OC 57fe510e52d7fd74edb8165001a3cb0f [0,1,0,1,0,0|1,0,0]=3 14499 B11R1.59 CCN1CCC[C@@H]1C(=O)NC 50fc31fc10eb1fd66448ab198ab633a3 [0,1,0,1,0,0|2,0,0]=4 14500 B11R1.59 CCN1CCC[C@H]1C(=O)NC 64bddbf68793da4b8296553b56b491f5 [0,1,0,1,0,0|2,0,0]=4 14501 B11R1.59 CCN1CCC[C@H]1C(=O)NO 2a956f6da47996609f8cf5c0a82f63fa [0,1,0,1,0,0|1,0,0]=3 14502 B11R1.59 CCN1CCC[C@H]1C(=O)OC dadddfa392d6d0edd0fd11c46811b3b9 [0,1,0,1,0,0|1,0,0]=3 14503 B11R1.59 CCN1CSCC1C(=O)OC 34bbdd28c55317ef263ed6b67ff014eb [0,1,0,1,0,0|2,0,0]=4 14504 B11R1.59 CCN1CSC[C@H]1C(=O)OC a9513961a2c57182379c47cbc8dd6f3c [0,1,0,1,0,0|2,0,0]=4 14505 B11R1.59 CC[C@@H]1CCCN1C(=O)C=O f0731dc4df7e6debb7f69265ecf30c1c [0,1,0,1,0,0|1,0,1]=4 14506 B11R1.59 CC[C@@H]1CCCN1C(=O)CF c56e06baf84edd593aecc5eb52dee85a [0,1,0,1,0,0|2,0,0]=4 14507 B11R1.59 CC[C@@H]1CCCN1C(=O)CO e9a793273f1ff379a973956361ab8bb9 [0,1,0,1,0,0|1,0,0]=3 14508 B11R1.59 CC[C@@H]1CCCN1C(=O)CS 7efc59165130ee1584e935438064b11b [0,1,0,1,0,0|1,1,0]=4 14509 B11R1.59 COC(=O)C1CCCN1CF 0d71f9d6b0cd7f18b5362fc49b9c812a [0,1,0,1,0,0|2,0,0]=4 14510 B11R1.59 COC(=O)C1CCCN1CO 753ccab52d36892144e40aaad29127ef [0,1,0,1,0,0|2,0,0]=4 14511 B11R1.59 COC(=O)[C@@H]1CCCN1CF 3cf375eef25821e889eca26766fb4f1a [0,1,0,1,0,0|2,0,0]=4 14512 B11R1.59 COC(=O)[C@@H]1CCCN1CO 72a5c73508812c745f7f922f87d07f09 [0,1,0,1,0,0|2,0,0]=4 14513 B11R1.59 COC1CCCN1C(=O)CO 0578a9bf22ccf53053792f0e6fe25128 [0,1,0,1,0,0|2,0,0]=4 14514 B11R1.59 O=C(CO)N1CCCC1CO a40fc2fdc917cc097d2ab870f928554e [0,1,0,1,0,0|2,0,0]=4 14515 B11R1.59 O=C(CO)N1CCC[C@@H]1CF 71a0866b15fb16b7f8298fb826a67eeb [0,1,0,1,0,0|2,0,0]=4 14516 B11R1.59 O=C(CO)N1CCC[C@@H]1CO 3acaa3f7e1f93f8d605791407683f932 [0,1,0,1,0,0|2,0,0]=4 14517 B11R1.59 O=C(CO)N1CCC[C@H]1CF 476f242ce5fa87f3a4621a54ac04727f [0,1,0,1,0,0|2,0,0]=4 14518 B11R1.59 O=C(CO)N1CCC[C@H]1CO 20d8ebe9d8e3712f5febc1fb49a41763 [0,1,0,1,0,0|2,0,0]=4 14519 B11R1.59 O=C(NO)[C@@H]1CCCN1CF f4e86a2c1ab18b8e449df19745392b94 [0,1,0,1,0,0|2,0,0]=4 14520 B11R1.59 O=C(NO)[C@@H]1CCCN1CO 986857c233ca2c018a51093e190ee110 [0,1,0,1,0,0|2,0,0]=4 14521 B11R1.115 CCCN1CC[C@@H]1C(=O)OC c4d0d2b7afd55bcbcd4477409e2cf1ae [0,1,0,1,0,0|1,0,0]=3 14522 B11R1.115 COC(=O)[C@H]1CCN1CCF 83b9dc8bd55ebae718bf72d2411bc315 [0,1,0,1,0,0|2,0,0]=4 14523 B11R1.115 COC(=O)[C@H]1CCN1CCO d92491e1291b13814a1d77666d4faeb6 [0,1,0,1,0,0|2,0,0]=4 14524 B11R1.115 COC(=O)[C@H]1CCN1CCS 6bcd8f37dfcac90acec6d95a0b2b5ea1 [0,1,0,1,0,0|2,0,0]=4 14525 B11R1.115 COC(=O)[C@H]1CCN1CSC a130c08d2a2b5a05b78a6921cf7aeee5 [0,1,0,1,0,0|2,0,0]=4 14526 B11R1.115 COCC1CCN1C(=O)CO 48a24eaf9bfec1485b0c2af49eff6b5b [0,1,0,1,0,0|2,0,0]=4 14527 B11R1.115 COCN1CC[C@@H]1C(=O)OC b54dea898c40f5027e4abf3e62330f0e [0,1,0,1,0,0|2,0,0]=4 14528 B11R1.115 COC[C@@H]1CCN1C(=O)CO df4e9692a508b4a9114f75c4a6bf6eb1 [0,1,0,1,0,0|2,0,0]=4 14529 B11R1.115 COC[C@H]1CCN1C(=O)CO b5a34482aed338d3b8a91d431e129b2f [0,1,0,1,0,0|2,0,0]=4 14530 B11R1.115 O=C(CO)N1CCC1CCO 0b3e4e1066ab23b0bf3d9547da9449f2 [0,1,0,1,0,0|2,0,0]=4 14531 B11R1.131 COC[C@@H]1C[C@@H]1NC(=O)CO 16b54c22644a67713f5de82d6cd2f0a8 [0,1,0,1,0,0|2,0,0]=4 14532 B11R1.131 COC[C@H]1C[C@@H]1NC(=O)CO 641b6992f378799d8505b092f365a383 [0,1,0,1,0,0|2,0,0]=4 14533 B11R1.190 CCCCCN[C@H]1CNC1=O eb9f6d8bd01cb4cde117b126b8643934 [0,1,0,1,0,0|2,0,0]=4 14534 B11R1.190 CCCCCOC1CCC1=O 355911051df85b56020429c0f95056f7 [0,1,0,1,0,0|2,0,0]=4 14535 B11R1.190 CCCCNCC1COC1=O 0b8a3a6c048670a7486ff35a95e20c46 [0,1,0,1,0,0|1,0,0]=3 14536 B11R1.190 CCCCOCC1CCC1=O f257a7edcf4781b415caf68b4efc97ae [0,1,0,1,0,0|2,0,0]=4 14537 B11R1.190 CCCCOCC1COC1=O c6bd5bc4efe8fe9efa0449e654721e6c [0,1,0,1,0,0|1,0,0]=3 14538 B11R1.190 CCCNCCC1CCC1=O 0df107ac77dd6110f0f6944cef3eb9cb [0,1,0,1,0,0|2,0,0]=4 14539 B11R1.190 CCCOCCC1CCC1=O 3983d0cb93d7fc373cd10be3938cd7ef [0,1,0,1,0,0|2,0,0]=4 14540 B11R1.190 COCCNCC1COC1=O a540d759af3f9b58ac933907dd5dde20 [0,1,0,1,0,0|2,0,0]=4 14541 B11R1.190 COCCOCC1COC1=O a346b39c69506212b23dd4c5e0114b5e [0,1,0,1,0,0|2,0,0]=4 14542 B11R1.190 CSCCNCC1COC1=O ef1ae54ffe5653c7155a91c51ff8f83c [0,1,0,1,0,0|2,0,0]=4 14543 B11R1.190 CSCCOCC1COC1=O 62ee7e8a4ab94c9467432c3483c142fd [0,1,0,1,0,0|2,0,0]=4 14544 B11R1.190 O=C1OCC1CNCCCCl d4f576eb92ea89f6734cd62bf0166de1 [0,1,0,1,0,0|2,0,0]=4 14545 B11R1.190 O=C1OCC1CNCCCO 6c2f1e37cfc3dfccaac926f358535f31 [0,1,0,1,0,0|2,0,0]=4 14546 B11R1.190 O=C1OCC1COCCCF eededcbc2f72fefd3d2cd747b4696167 [0,1,0,1,0,0|2,0,0]=4 14547 B11R1.190 O=C1OCC1COCCCS 289c80c8dae9d058ad6d3e55e9e34bf6 [0,1,0,1,0,0|2,0,0]=4 14548 B11R1.212 CCCNC1CCN(C1=O)O d460deba5437d91f8e499287ce8b036a [0,1,0,1,0,0|2,0,0]=4 14549 B11R1.212 CCCN[C@@H]1CCN(C1=O)O 788df8a67716e05c85a33ec2589eeea7 [0,1,0,1,0,0|2,0,0]=4 14550 B11R1.212 CCCOC1CCC(=O)N1C aa96e294f9e3d82238916255ee71dd01 [0,1,0,1,0,0|2,0,0]=4 14551 B11R1.212 CCNCC1CCC(=O)N1C f0e5f74549cfdcb69bc365f7cf0b3627 [0,1,0,1,0,0|2,0,0]=4 14552 B11R1.212 CCNC[C@@H]1CCC(=O)N1C 6ca5b3edf1558166cbb150414f75df6d [0,1,0,1,0,0|2,0,0]=4 14553 B11R1.212 CCNC[C@H]1CCC(=O)N1C dec6539fc292b55c1f444e99fdc8039e [0,1,0,1,0,0|2,0,0]=4 14554 B11R1.212 CCOCC1CCC(=O)N1C db6d2ec1bf2250c467cb4578f3f57710 [0,1,0,1,0,0|2,0,0]=4 14555 B11R1.212 CCOC[C@@H]1CCC(=O)N1C a9c3dd1e4ad4c31084fdf3d1af674d5a [0,1,0,1,0,0|2,0,0]=4 14556 B11R1.212 CCOC[C@H]1CCC(=O)N1C f2b71df2a33a4b9b1133fd62b38f04df [0,1,0,1,0,0|2,0,0]=4 14557 B11R1.218 CCCCN1CC1C(=O)OC 44c7d158c595a9ae51b842328cff690c [0,1,0,1,0,0|1,0,0]=3 14558 B11R1.218 CCCCN1C[C@H]1C(=O)OC f02e02ebaf3226844e1a140d5706d93b [0,1,0,1,0,0|1,0,0]=3 14559 B11R1.218 CCCNC1CC1C(=O)OC 9595ea4e4784e12ebc0f81aca48c0c41 [0,1,0,1,0,0|1,0,0]=3 14560 B11R1.218 CCCOC1CC1C(=O)OC 59b5d33cee1671ee5db2fc6a97a054ed [0,1,0,1,0,0|1,0,0]=3 14561 B11R1.218 CCOCC1CC1C(=O)OC 993cad79d75e436dd18401df44904722 [0,1,0,1,0,0|1,0,0]=3 14562 B11R1.218 CCOCN1CC1C(=O)OC 091f4a77a55b1ea51dff9889dca6b507 [0,1,0,1,0,0|2,0,0]=4 14563 B11R1.218 CCOCN1C[C@H]1C(=O)OC 7edcff214a2d1915279e14a9867d669d [0,1,0,1,0,0|2,0,0]=4 14564 B11R1.218 CCOC[C@@H]1C[C@@H]1C(=O)OC 57b83ee718142465e26e034265afb97d [0,1,0,1,0,0|1,0,0]=3 14565 B11R1.218 CCOC[C@@H]1C[C@H]1C(=O)OC ab694afdbd6926b26b6b10dc47f5a938 [0,1,0,1,0,0|1,0,0]=3 14566 B11R1.218 CCOC[C@H]1C[C@@H]1C(=O)OC 6596fd83b996594c40e13637dbf9de4e [0,1,0,1,0,0|1,0,0]=3 14567 B11R1.218 COC(=O)C1CC1COCF b18fd73aeb444f0bd85d4a826a97a19f [0,1,0,1,0,0|2,0,0]=4 14568 B11R1.218 COC(=O)C1CC1NCCBr f375f914fbc8cda147a9b9d545f2b53c [0,1,0,1,0,0|2,0,0]=4 14569 B11R1.218 COC(=O)C1CC1NCCF 39536b4090b052bdd8006516b6bc0b82 [0,1,0,1,0,0|2,0,0]=4 14570 B11R1.218 COC(=O)C1CC1NCCI b5e7d2fc74a9b3dcbdeb5aafaaaa9842 [0,1,0,1,0,0|2,0,0]=4 14571 B11R1.218 COC(=O)C1CC1NCCO 2b5dcadd3bb9102f52182867126289f8 [0,1,0,1,0,0|2,0,0]=4 14572 B11R1.218 COC(=O)C1CC1NCCS f7e974cde851d5a53fec7b4610a2a572 [0,1,0,1,0,0|2,0,0]=4 14573 B11R1.218 COC(=O)C1CC1OCCF dbc50aba4c396405ef5b8a8952689d09 [0,1,0,1,0,0|2,0,0]=4 14574 B11R1.218 COC(=O)C1CC1OCCS 0cb0aaf8973fd2c950ea57ba6926f471 [0,1,0,1,0,0|2,0,0]=4 14575 B11R1.218 COC(=O)C1CN1CCCF 03f1224fd30876b406f3f2ec74eb24e8 [0,1,0,1,0,0|2,0,0]=4 14576 B11R1.218 COC(=O)C1CN1CCCO 258f6a84622bd3cc098e41fa35d5958d [0,1,0,1,0,0|2,0,0]=4 14577 B11R1.218 COC(=O)C1CN1CCCS 32c4cc6e245751fc4c17f9d21bf6c11c [0,1,0,1,0,0|2,0,0]=4 14578 B11R1.218 COC(=O)C1CN1CCSC ca70f502fe10f6f86c6c07136e156351 [0,1,0,1,0,0|2,0,0]=4 14579 B11R1.218 COC(=O)[C@@H]1CN1CCCF 766cc6b42a561e10b72dd54931a76148 [0,1,0,1,0,0|2,0,0]=4 14580 B11R1.218 COC(=O)[C@@H]1CN1CCCO d74e33a028df4646ef6f33f32aa2f1c6 [0,1,0,1,0,0|2,0,0]=4 14581 B11R1.218 COC(=O)[C@@H]1CN1CCCS f949ea95c6e89807de1e5f53c05f302b [0,1,0,1,0,0|2,0,0]=4 14582 B11R1.218 COC(=O)[C@@H]1CN1CCSC b7dafdb3a7493f85478f498c218c003d [0,1,0,1,0,0|2,0,0]=4 14583 B11R1.218 COC(=O)[C@@H]1C[C@H]1COCF d92bbdd223d0f8c6329c88f24cbedbf8 [0,1,0,1,0,0|2,0,0]=4 14584 B11R1.218 COC(=O)[C@H]1C[C@@H]1COCF ecab1d3d2d121b5bcda0049cc0d3fea5 [0,1,0,1,0,0|2,0,0]=4 14585 B11R1.218 COC(=O)[C@H]1C[C@H]1COCF ce550a599dffe0af1e72528a533f4af4 [0,1,0,1,0,0|2,0,0]=4 14586 B11R1.218 COCCN1CC1C(=O)OC d0f33f6b36a5c652a786488ae72edc4f [0,1,0,1,0,0|2,0,0]=4 14587 B11R1.218 COCCN1C[C@H]1C(=O)OC c5e7e4f40f21bf55bcaf320db8dbdf11 [0,1,0,1,0,0|2,0,0]=4 14588 B11R1.218 COCOC1CC1C(=O)OC ed9ecc0e347cc73256643f6909ce7177 [0,1,0,1,0,0|2,0,0]=4 14589 B11R1.222 C#CC(=O)N1CCCCC1C a0e952fcffe8776b24631779c8a4b3f9 [0,1,0,1,0,0|2,0,0]=4 14590 B11R1.222 C#CC(=O)N1CCCC[C@@H]1C 13fc1a2b4787fdf0e2ba18a355a217fc [0,1,0,1,0,0|2,0,0]=4 14591 B11R1.222 C#CC(=O)N1CCCC[C@H]1C b687cade94be44986634ab336115b5df [0,1,0,1,0,0|2,0,0]=4 14592 B11R1.222 C=CC(=O)N1CCCCC1C 80b64e61fb7c09a8cd93588a60daa8a6 [0,1,0,1,0,0|2,0,0]=4 14593 B11R1.222 C=CC(=O)N1CCCC[C@@H]1C 35da5d1185b9d297a5977b997a4067ff [0,1,0,1,0,0|2,0,0]=4 14594 B11R1.222 C=CC(=O)N1CCCC[C@H]1C 8b0970befa14d5e92855da0092af63d7 [0,1,0,1,0,0|2,0,0]=4 14595 B11R1.222 CC1CCCCN1C(=O)C=O 2892a74f4a16871a90474e06d74388f9 [0,1,0,1,0,0|1,0,1]=4 14596 B11R1.222 CC1CCCCN1C(=O)CF 2a20aad245cc4e1b1043d68e67a10cc7 [0,1,0,1,0,0|2,0,0]=4 14597 B11R1.222 CC1CCCCN1C(=O)CO f2377579275bd5ba13851bbc93dd16bd [0,1,0,1,0,0|1,0,0]=3 14598 B11R1.222 CC1CCCCN1C(=O)CS 68a733d59a5683e65b805d00c889dec6 [0,1,0,1,0,0|1,1,0]=4 14599 B11R1.222 CC1COCCN1C(=O)CO f6f90be4619efd504f44d2beed5d8c3c [0,1,0,1,0,0|2,0,0]=4 14600 B11R1.222 CCC(=O)N1CCCCC1C 9f8997a43a0135743998f58647508ffc [0,1,0,1,0,0|2,0,0]=4 14601 B11R1.222 CCC(=O)N1CCCC[C@@H]1C b83df98c72b4c39c4638f2400442f81a [0,1,0,1,0,0|2,0,0]=4 14602 B11R1.222 CCC(=O)N1CCCC[C@H]1C ea345c17f894328087f191f4cea87dc5 [0,1,0,1,0,0|2,0,0]=4 14603 B11R1.222 C[C@@H]1CCCCN1C(=O)C=O 12cad2dbfc5561d4317760834fa5dd7a [0,1,0,1,0,0|1,0,1]=4 14604 B11R1.222 C[C@@H]1CCCCN1C(=O)CF 0e104784bf225e33e8089450924912a4 [0,1,0,1,0,0|2,0,0]=4 14605 B11R1.222 C[C@@H]1CCCCN1C(=O)CO d453731bdb038659b97a613a0b95de07 [0,1,0,1,0,0|1,0,0]=3 14606 B11R1.222 C[C@@H]1CCCCN1C(=O)CS 483f96e82fc51ff9e9c2d6b4ca146ee9 [0,1,0,1,0,0|1,1,0]=4 14607 B11R1.222 C[C@@H]1COCCN1C(=O)CO da72d4e9470d7f5ff9992b7a93f6c077 [0,1,0,1,0,0|2,0,0]=4 14608 B11R1.222 C[C@H]1CCCCN1C(=O)C=O 27bb5acce87176d3c595dde750caf102 [0,1,0,1,0,0|1,0,1]=4 14609 B11R1.222 C[C@H]1CCCCN1C(=O)CF e6b6a07302c373d4a21429fef19bffdc [0,1,0,1,0,0|2,0,0]=4 14610 B11R1.222 C[C@H]1CCCCN1C(=O)CO 754de7529e354e1000f4a6e493fc95f0 [0,1,0,1,0,0|1,0,0]=3 14611 B11R1.222 C[C@H]1CCCCN1C(=O)CS e939555a2b85d077dd09c59319c1bc1a [0,1,0,1,0,0|1,1,0]=4 14612 B11R1.222 C[C@H]1COCCN1C(=O)CO e95e5d58e2046dd4c45d2926c985dce7 [0,1,0,1,0,0|2,0,0]=4 14613 B11R1.223 C=C(CN[C@@H]1CC[C@H]1C)OC 5597b76b3ed1caf7c6a2ffc34a411b77 [0,1,0,1,0,0|2,0,0]=4 14614 B11R1.223 C=C(CN[C@H]1CC[C@H]1C)OC 5dff096852d92c192ae6225ccffb0966 [0,1,0,1,0,0|2,0,0]=4 14615 B11R1.223 C=C(CO)CN[C@@H]1CC[C@H]1C ffed8f5af6e7258f1cbc12e2e87e426d [0,1,0,1,0,0|2,0,0]=4 14616 B11R1.223 C=C(CO)CN[C@H]1CC[C@H]1C 7cb5ede71acd3f95d105dbd1637a9347 [0,1,0,1,0,0|2,0,0]=4 14617 B11R1.223 CC1OCC1NCC(=O)CO 28ee764fb26d90745d1bb9145890c715 [0,1,0,1,0,0|2,0,0]=4 14618 B11R1.223 CCC(=O)CN[C@@H]1CC[C@H]1C a8bc64d29c0a05022b6529f0429434ad [0,1,0,1,0,0|2,0,0]=4 14619 B11R1.223 CCC(=O)CN[C@H]1CC[C@H]1C aec74fc52f158fa0328dbfb0fd3a9d65 [0,1,0,1,0,0|2,0,0]=4 14620 B11R1.223 CN1CCC1CNC(=O)CO f2690090363a921d22c4afda2a51c0a5 [0,1,0,1,0,0|2,0,0]=4 14621 B11R1.223 CNC(=O)CN[C@@H]1CC[C@H]1C 52db7196085d8e862d04069d7147da00 [0,1,0,1,0,0|2,0,0]=4 14622 B11R1.223 CNC(=O)CN[C@H]1CC[C@H]1C 774be78f9cc934a526b902519a21a6a8 [0,1,0,1,0,0|2,0,0]=4 14623 B11R1.223 COC(=O)CNC1CCC1F cb935f490e031e082e48084400b57a23 [0,1,0,1,0,0|2,0,0]=4 14624 B11R1.223 COC(=O)CNC1CCC1O 1d7d18d085cebf737d710b2e071bad50 [0,1,0,1,0,0|2,0,0]=4 14625 B11R1.223 COC(=O)CNC1COC1C e80dd788651b6d06d001c5e0b2dfad84 [0,1,0,1,0,0|2,0,0]=4 14626 B11R1.223 COC(=O)CN[C@@H]1CC[C@@H]1O a1e4a9c3701989767ba155989ae62c0a [0,1,0,1,0,0|2,0,0]=4 14627 B11R1.223 COC(=O)CN[C@@H]1CC[C@H]1C 8cc1099987a14755bb326b9cf2f92721 [0,1,0,1,0,0|1,0,0]=3 14628 B11R1.223 COC(=O)CN[C@@H]1CC[C@H]1O 755219a1b8f260c08039950679360497 [0,1,0,1,0,0|2,0,0]=4 14629 B11R1.223 COC(=O)CN[C@H]1CC[C@@H]1O ac6e828e04d449027836267d0e9e8e69 [0,1,0,1,0,0|2,0,0]=4 14630 B11R1.223 COC(=O)CN[C@H]1CC[C@H]1C 1fa625a5e83c05d76a7f8e7f14f61158 [0,1,0,1,0,0|1,0,0]=3 14631 B11R1.223 COC(=O)CN[C@H]1CC[C@H]1O bfe794839ed9ff75f084233d2235387a [0,1,0,1,0,0|2,0,0]=4 14632 B11R1.223 COC(=O)COC1COC1C f3b8a2a8f0a93cb6eb1c40500b975de8 [0,1,0,1,0,0|2,0,0]=4 14633 B11R1.223 C[C@@H]1CC[C@@H]1NCC(=O)CO 97a8fc2b760b23a6f737b3dad9b4ae86 [0,1,0,1,0,0|1,0,0]=3 14634 B11R1.223 C[C@@H]1CC[C@H]1NCC(=O)CO 6dd9670028d937b5a034776e5a764383 [0,1,0,1,0,0|1,0,0]=3 14635 B11R1.223 O=C(CO)CNC1CCC1F 2c1a884364b39ba1c74d6f66cb29f2aa [0,1,0,1,0,0|2,0,0]=4 14636 B11R1.223 O=C(CO)CNC1CCC1O 4b55bcdf1283bfe0fd378556648f156e [0,1,0,1,0,0|2,0,0]=4 14637 B11R1.223 O=C(CO)CN[C@@H]1CC[C@@H]1O 968d2931cc085f8bb81d7cad9627846d [0,1,0,1,0,0|2,0,0]=4 14638 B11R1.223 O=C(CO)CN[C@@H]1CC[C@H]1O b97724735fc69a05c316d48e76439b15 [0,1,0,1,0,0|2,0,0]=4 14639 B11R1.223 O=C(CO)CN[C@H]1CC[C@@H]1O c2aee913cb574a54294e653d73afd71f [0,1,0,1,0,0|2,0,0]=4 14640 B11R1.223 O=C(CO)CN[C@H]1CC[C@H]1O 00bba26717c0eef20f25ef58a564126a [0,1,0,1,0,0|2,0,0]=4 14641 B11R1.228 C=C(CN1CCCC1C)OC cf44ba92c47614d303214a1c6b6a0698 [0,1,0,1,0,0|2,0,0]=4 14642 B11R1.228 C=C(CN1CCC[C@@H]1C)OC fc24e3cd52b87dbc096a95b2a2b6131c [0,1,0,1,0,0|2,0,0]=4 14643 B11R1.228 C=C(CN1CCC[C@H]1C)OC f68fd0b7be277da507a7deda91771381 [0,1,0,1,0,0|2,0,0]=4 14644 B11R1.228 C=C(CO)CN1CCCC1C 9207e028e843f8caedd90fb210a2d8dc [0,1,0,1,0,0|2,0,0]=4 14645 B11R1.228 C=C(CO)CN1CCC[C@@H]1C ddb51b4f45df80cd744173451cb60b8e [0,1,0,1,0,0|2,0,0]=4 14646 B11R1.228 C=C(CO)CN1CCC[C@H]1C 71208be375789c58764666ce6fcf5da6 [0,1,0,1,0,0|2,0,0]=4 14647 B11R1.228 CC1CCCN1CC(=O)CO 48c439525fb44bebefe56d5c379aadfe [0,1,0,1,0,0|1,0,0]=3 14648 B11R1.228 CC1SCCN1CC(=O)CO 9c04c56eda36e0dfd2d4297a6f27b0b2 [0,1,0,1,0,0|2,0,0]=4 14649 B11R1.228 CCC(=O)CN1CCCC1C 2d36f414b06a9d1b55e1af6cba137dab [0,1,0,1,0,0|2,0,0]=4 14650 B11R1.228 CCC(=O)CN1CCC[C@@H]1C b7575d72ac60a5bdc9b498426c391697 [0,1,0,1,0,0|2,0,0]=4 14651 B11R1.228 CCC(=O)CN1CCC[C@H]1C fdba0def75e7161dd804c0c5c627099c [0,1,0,1,0,0|2,0,0]=4 14652 B11R1.228 CNC(=O)CN1CCCC1C f6c26cadea50cf0a8128f8355b9861c8 [0,1,0,1,0,0|2,0,0]=4 14653 B11R1.228 CNC(=O)CN1CCC[C@@H]1C 34c7c2b791d4b764272d3626ac53dccc [0,1,0,1,0,0|2,0,0]=4 14654 B11R1.228 CNC(=O)CN1CCC[C@H]1C 47ccbb2cf9fa2dd068112f88225b5f5b [0,1,0,1,0,0|2,0,0]=4 14655 B11R1.228 COC(=O)CN1CCCC1C a42739d97a82c5ae3be363bbad65c1e8 [0,1,0,1,0,0|1,0,0]=3 14656 B11R1.228 COC(=O)CN1CCCC1O fa907e755a468d30410e4565a0942209 [0,1,0,1,0,0|2,0,0]=4 14657 B11R1.228 COC(=O)CN1CCC[C@@H]1C 1192220f15b69db24025cd75b8c5c11e [0,1,0,1,0,0|1,0,0]=3 14658 B11R1.228 COC(=O)CN1CCC[C@H]1C bf37025eab3cd6aff9a0e0a086a3cf6c [0,1,0,1,0,0|1,0,0]=3 14659 B11R1.228 COC(=O)CN1CCSC1C e785d0be9dcecbb6024b6dd89d718961 [0,1,0,1,0,0|2,0,0]=4 14660 B11R1.228 C[C@@H]1CCCN1CC(=O)CO b3ea2f4a068c373e88e44b4411c99427 [0,1,0,1,0,0|1,0,0]=3 14661 B11R1.228 C[C@H]1CCCN1CC(=O)CO 88d749d3da97cb7eb9ddecfd5dc56ee5 [0,1,0,1,0,0|1,0,0]=3 14662 B11R1.228 O=C(CO)CN1CCCC1O e852b80c763f91ffca4d59622a208a4b [0,1,0,1,0,0|2,0,0]=4 14663 B11R1.228 O=C(CO)NC1CCCC1O 3d2ad1b4ad2a16d27056dbbb6e3d3b5e [0,1,0,1,0,0|2,0,0]=4 14664 B11R1.228 O=C(CO)N[C@@H]1CCC[C@@H]1O 868c1908acffbcba416c3c6b11da8069 [0,1,0,1,0,0|2,0,0]=4 14665 B11R1.228 O=C(CO)N[C@@H]1CCC[C@H]1O 9ee9ebc3fffaf4798f23dd437987ac92 [0,1,0,1,0,0|2,0,0]=4 14666 B11R1.228 O=C(CO)N[C@H]1CCC[C@@H]1O 05817198b2d44e9bd8a9263cf26778a5 [0,1,0,1,0,0|2,0,0]=4 14667 B11R1.228 O=C(CO)N[C@H]1CCC[C@H]1O ca1c7806dfc6f7e063219e2d0be8c646 [0,1,0,1,0,0|2,0,0]=4 14668 B11R1.236 C#CC(=O)NCCC1CCC1 7e496233dec92c4f502649cec27bdef7 [0,1,0,1,0,0|2,0,0]=4 14669 B11R1.236 C=C(C=O)OCCC1CCC1 29e286f0acae6331e543f5d91ad349bb [0,1,0,1,0,0|2,0,0]=4 14670 B11R1.236 C=C(CNCC1CCC1)OC dcbc7573f209eda62a4fea8c18672c2a [0,1,0,1,0,0|2,0,0]=4 14671 B11R1.236 C=C(CO)CNCC1CCC1 e0f83b09b198af8bbf30484ef18ff748 [0,1,0,1,0,0|2,0,0]=4 14672 B11R1.236 C=C(COCC1CCC1)OC fc545c6d9c2c4f26e24a2210887023ab [0,1,0,1,0,0|2,0,0]=4 14673 B11R1.236 C=CC(=O)CCCN1CCC1 2e962803dc9cd867a5622b76b3dbe86a [0,1,0,1,0,0|2,0,0]=4 14674 B11R1.236 C=CC(=O)NCCC1CCC1 eb4edde80c9fed3d0b3ed3df0fddff11 [0,1,0,1,0,0|2,0,0]=4 14675 B11R1.236 CCC(=O)CNCC1CCC1 183f4109e6d944e22d20d309357e6d59 [0,1,0,1,0,0|2,0,0]=4 14676 B11R1.236 CCC(=O)COCC1CCC1 5f486bb50acd63102a1f476c945f55d9 [0,1,0,1,0,0|2,0,0]=4 14677 B11R1.236 CCC(=O)NCCC1CCC1 424ecc43df8cb195dcf80d34a2290143 [0,1,0,1,0,0|2,0,0]=4 14678 B11R1.236 CNC(=O)CCCN1CCC1 a42e26165f5cf1d6f38c482c1f257885 [0,1,0,1,0,0|2,0,0]=4 14679 B11R1.236 CNC(=O)CCNC1CCC1 ce6b1f011a4d1cb06acd6b353b15d537 [0,1,0,1,0,0|2,0,0]=4 14680 B11R1.236 CNC(=O)CCOC1CCC1 91ba0a6d32cbc107e6cd1a3cf7f871fe [0,1,0,1,0,0|2,0,0]=4 14681 B11R1.236 CNC(=O)CNCC1CCC1 e909094a6834dbcc16a7f4e5f9ec154e [0,1,0,1,0,0|2,0,0]=4 14682 B11R1.236 CNC(=O)COCC1CCC1 f3fd1c458a7c6007a45597f63fab6c82 [0,1,0,1,0,0|2,0,0]=4 14683 B11R1.236 COC(=O)CCCN1CCC1 74402e37f99601995584ee802ee8d703 [0,1,0,1,0,0|1,0,0]=3 14684 B11R1.236 COC(=O)CCNC1CCC1 c703a29c0eed4e72bf5cc8eeec312367 [0,1,0,1,0,0|1,0,0]=3 14685 B11R1.236 COC(=O)CCNC1COC1 db355baffd64cd834a1bddc55a1784e4 [0,1,0,1,0,0|2,0,0]=4 14686 B11R1.236 COC(=O)CCOC1CCC1 a7f60890365a15910d6ce48e4d80abc2 [0,1,0,1,0,0|1,0,0]=3 14687 B11R1.236 COC(=O)CCOC1COC1 731b8e0ef004c6be724a692cedb50b53 [0,1,0,1,0,0|2,0,0]=4 14688 B11R1.236 COC(=O)CCOC1CSC1 4d08875e2811db5f48f6dc70f4c0eabb [0,1,0,1,0,0|2,0,0]=4 14689 B11R1.236 COC(=O)CNCC1CCC1 09171f32f7240e23e29fdd51fc4c3059 [0,1,0,1,0,0|1,0,0]=3 14690 B11R1.236 COC(=O)CNCC1CCO1 1ca770ebe590b24cbe947e2960432cd6 [0,1,0,1,0,0|2,0,0]=4 14691 B11R1.236 COC(=O)CNCC1COC1 feaa3dfe36e13837eb2c63e87c9239e6 [0,1,0,1,0,0|2,0,0]=4 14692 B11R1.236 COC(=O)CNC[C@@H]1CCO1 9cd1d9cf15135a81625480527bb132ef [0,1,0,1,0,0|2,0,0]=4 14693 B11R1.236 COC(=O)CNC[C@H]1CCO1 fc6fffc2345f414a3ec716db952e0137 [0,1,0,1,0,0|2,0,0]=4 14694 B11R1.236 COC(=O)COCC1CCC1 4ff67b75b106ed4edba88ae986d451f1 [0,1,0,1,0,0|1,0,0]=3 14695 B11R1.236 COC(=O)COCC1CCO1 b204328366f57548de85792f1b865a99 [0,1,0,1,0,0|2,0,0]=4 14696 B11R1.236 COC(=O)COCC1COC1 6595af97035a95ffc9001579c1900405 [0,1,0,1,0,0|2,0,0]=4 14697 B11R1.236 COC(=O)COCC1CSC1 027c803f9a8b11bc0fd638bd5014c54c [0,1,0,1,0,0|2,0,0]=4 14698 B11R1.236 COC(=O)COC[C@@H]1CCO1 74c71981f67be2fca2ab62a5a741dc5f [0,1,0,1,0,0|2,0,0]=4 14699 B11R1.236 COC(=O)COC[C@H]1CCO1 69ce372feb930b07fb3aaaf92d404d43 [0,1,0,1,0,0|2,0,0]=4 14700 B11R1.236 COC(=O)OCNC1CCC1 aff8c84d820034a3388284a9ef90a527 [0,1,0,1,0,0|2,0,0]=4 14701 B11R1.236 COC(=O)OCOC1CCC1 2dc207e9753dd047a880f8af9f9fc760 [0,1,0,1,0,0|2,0,0]=4 14702 B11R1.236 O=C(CCNC1CCC1)NO 3cab30806c6ebdc52b0f1024c1a90555 [0,1,0,1,0,0|1,0,0]=3 14703 B11R1.236 O=C(CCNC1COC1)NO d9f514a52162530722d4416098872172 [0,1,0,1,0,0|2,0,0]=4 14704 B11R1.236 O=C(CF)NCCC1CCC1 93ac7660ba92dd821ffd2cbfdf149f6d [0,1,0,1,0,0|2,0,0]=4 14705 B11R1.236 O=C(CNCC1CCC1)NO 7bcc7514ef25e9e80be0fcfbfc0cbb36 [0,1,0,1,0,0|1,0,0]=3 14706 B11R1.236 O=C(CNCC1CCO1)NO cfe1dbe96617caee527cf5dcd7012671 [0,1,0,1,0,0|2,0,0]=4 14707 B11R1.236 O=C(CNCC1COC1)NO 9af8685abf191a5715e199e81ebc8f6c [0,1,0,1,0,0|2,0,0]=4 14708 B11R1.236 O=C(CNC[C@@H]1CCO1)NO fd04cbb6489b74343149289c9d57cadf [0,1,0,1,0,0|2,0,0]=4 14709 B11R1.236 O=C(CNC[C@H]1CCO1)NO 1b9bb934922fa5f08a357ac7b8eeeb8b [0,1,0,1,0,0|2,0,0]=4 14710 B11R1.236 O=C(CO)CNCC1CCC1 993ba7f452c982512f0f419e9c680224 [0,1,0,1,0,0|1,0,0]=3 14711 B11R1.236 O=C(CO)CNCC1CCO1 c9dee4a7a416bf5262ebf07e205bc6f8 [0,1,0,1,0,0|2,0,0]=4 14712 B11R1.236 O=C(CO)CNCC1COC1 b2e80d4383d4cd2f38ed9fe102aab26b [0,1,0,1,0,0|2,0,0]=4 14713 B11R1.236 O=C(CO)CNC[C@@H]1CCO1 cc354605254bb36bfd7c381a62a4415f [0,1,0,1,0,0|2,0,0]=4 14714 B11R1.236 O=C(CO)CNC[C@H]1CCO1 87de9feb958765e53801f83573c923cf [0,1,0,1,0,0|2,0,0]=4 14715 B11R1.236 O=C(CO)NCCC1CCC1 f59f4eeda3cb1582dbdb1bc5045760ec [0,1,0,1,0,0|1,0,0]=3 14716 B11R1.236 O=C(CO)NCCC1CCO1 71f43463764f666b9cdb64c6ca973e14 [0,1,0,1,0,0|2,0,0]=4 14717 B11R1.236 O=C(CO)NCCC1COC1 67635b40cf1fc42b2c2938164077aab8 [0,1,0,1,0,0|2,0,0]=4 14718 B11R1.236 O=C(CO)NCCN1CCC1 c42ba60f4f3b0d9db029399eb8f67ea5 [0,1,0,1,0,0|2,0,0]=4 14719 B11R1.236 O=C(CO)NCC[C@@H]1CCO1 07ba8230dd152157da0083f2a8415f5b [0,1,0,1,0,0|2,0,0]=4 14720 B11R1.236 O=C(CS)NCCC1CCC1 2a1a335d53f0369faed0802aa31a6611 [0,1,0,1,0,0|1,1,0]=4 14721 B11R1.236 O=CC(=O)NCCC1CCC1 610111044a153b591a858a81b03c8a4e [0,1,0,1,0,0|1,0,1]=4 14722 B11R1.248 O=CN1CCCCCCCC1 aa5653438fc641ddd8a731b0fd752d2f [0,1,0,1,0,0|2,0,0]=4 14723 B11R1.248 OCN1CCCCCCCC1 34093a305ba2dc113fc49a0d96d53af5 [0,1,0,1,0,0|2,0,0]=4 14724 B11R1.255 COC(=O)CN[C@@H]1C[C@@H]1OC 74f96d259c7f9972b2f1d7449946fc8e [0,1,0,1,0,0|2,0,0]=4 14725 B11R1.255 COC(=O)CN[C@@H]1C[C@H]1CO 7728f5f75c768afc99bc377ff9895dca [0,1,0,1,0,0|2,0,0]=4 14726 B11R1.255 COC(=O)CN[C@H]1C[C@@H]1CO 4063e50fdf2671042550266f719ae4e9 [0,1,0,1,0,0|2,0,0]=4 14727 B11R1.255 COC(=O)CN[C@H]1C[C@H]1CO eb2ef9b0cd407959b3dd9e4320bc5465 [0,1,0,1,0,0|2,0,0]=4 14728 B11R1.255 CO[C@H]1C[C@H]1NCC(=O)CO 88dae6899fd4d467f86e2b4c56505d08 [0,1,0,1,0,0|2,0,0]=4 14729 B11R1.255 O=C(CO)CN[C@@H]1C[C@H]1CO f7c55b46aa66dae2d2f0eb006c05bfd6 [0,1,0,1,0,0|2,0,0]=4 14730 B11R1.255 O=C(CO)CN[C@H]1C[C@@H]1CO 1db09f944aa21f94d961917256504f01 [0,1,0,1,0,0|2,0,0]=4 14731 B11R1.255 O=C(CO)CN[C@H]1C[C@H]1CO 949f738a36f9b34ba140514b51ca766b [0,1,0,1,0,0|2,0,0]=4 14732 B11R1.255 O=C(CO)NCC1CC1CO 9fb3ca5c3ceeaf220cee1fad3741f5c5 [0,1,0,1,0,0|2,0,0]=4 14733 B11R1.272 C=C(CN1CCC1CC)OC a9699b4aa544c4571cbb91125ac1395b [0,1,0,1,0,0|2,0,0]=4 14734 B11R1.272 C=C(CO)CN1CCC1CC 0eea455d7458b8995acfaa97b243c1b7 [0,1,0,1,0,0|2,0,0]=4 14735 B11R1.272 CCC(=O)CN1CCC1CC 0df9390c0793c24301319f1b09428d60 [0,1,0,1,0,0|2,0,0]=4 14736 B11R1.272 CCC1CCN1CC(=O)CO 027cf008072f0930a17c769a6ab846d9 [0,1,0,1,0,0|1,0,0]=3 14737 B11R1.272 CCC1CCN1CC(=O)NC bd9eb3d14bef1c3242251b8cdf06fd89 [0,1,0,1,0,0|2,0,0]=4 14738 B11R1.272 CCC1CCN1CC(=O)OC 5734891ca1bd5022570b4186c00e22c2 [0,1,0,1,0,0|1,0,0]=3 14739 B11R1.272 COC(=O)CN1CCC1CO a82d853aa903ad5a91f69cd57d24a277 [0,1,0,1,0,0|2,0,0]=4 14740 B11R1.272 COC(=O)CN1CC[C@@H]1CO 76588f19d7f49cff454953a5dd23a2d5 [0,1,0,1,0,0|2,0,0]=4 14741 B11R1.272 COC(=O)CN1CC[C@H]1CO 0d9d8a3ccfde9a4a03fde821a5584c68 [0,1,0,1,0,0|2,0,0]=4 14742 B11R1.272 COC1CCC1NC(=O)CO 1b17aed343688187b223e591cc0354d6 [0,1,0,1,0,0|2,0,0]=4 14743 B11R1.272 CO[C@@H]1CC[C@@H]1NC(=O)CO 82bc1c2e95ec1f133b3ca922d795780e [0,1,0,1,0,0|2,0,0]=4 14744 B11R1.272 CO[C@@H]1CC[C@H]1NC(=O)CO d46e37f29e5e4172ca6bfe7cb6cbad70 [0,1,0,1,0,0|2,0,0]=4 14745 B11R1.272 CO[C@H]1CC[C@@H]1NC(=O)CO 23b8c1774ee2861a3cc420c460812089 [0,1,0,1,0,0|2,0,0]=4 14746 B11R1.272 CO[C@H]1CC[C@H]1NC(=O)CO e589e896780362d990b6f64f7b60b1aa [0,1,0,1,0,0|2,0,0]=4 14747 B11R1.272 O=C(CO)CN1CCC1CO 39b8f2193d9274ec283ffb828670388e [0,1,0,1,0,0|2,0,0]=4 14748 B11R1.272 O=C(CO)CN1CC[C@@H]1CO f00a81874f378ff7fcbd750d850c4f1a [0,1,0,1,0,0|2,0,0]=4 14749 B11R1.272 O=C(CO)CN1CC[C@H]1CO 9708aab1e28f7e1ab99acdfbd934e70b [0,1,0,1,0,0|2,0,0]=4 14750 B11R1.852 C#CC(=O)N1CCCCCC1 5217ec2866b7af66855d0a8163c54e52 [0,1,0,1,0,0|2,0,0]=4 14751 B11R1.852 C=CC(=O)N1CCCCCC1 e5873e16e8d7ff10334d83ab064926bb [0,1,0,1,0,0|2,0,0]=4 14752 B11R1.852 CCC(=O)N1CCCCCC1 ad10cabe38a2ba06b9fbc202cc4d0017 [0,1,0,1,0,0|2,0,0]=4 14753 B11R1.852 CN(CO)C1CCCCCC1 2065b84ccd5f58a2f110ac8553179087 [0,1,0,1,0,0|2,0,0]=4 14754 B11R1.852 O=C(CF)N1CCCCCC1 1c95e42af8af133957704485dc4da987 [0,1,0,1,0,0|2,0,0]=4 14755 B11R1.852 O=C(CO)N1CCCCCC1 d1c31dd67819daac890df5180aa87f09 [0,1,0,1,0,0|1,0,0]=3 14756 B11R1.852 O=C(CO)N1CCCOCC1 f66135ce179e65849e76fd2d8d4970c8 [0,1,0,1,0,0|2,0,0]=4 14757 B11R1.852 O=C(CS)N1CCCCCC1 14f03e05a0fe91a27efd6a0d4c9ca632 [0,1,0,1,0,0|1,1,0]=4 14758 B11R1.852 O=CC(=O)N1CCCCCC1 7431d7858aca3be4e39cb356c3397529 [0,1,0,1,0,0|1,0,1]=4 14759 B11R1.35 CC(=O)C(C)NC1CCCC1 cdcd12630618af2aac6f455f42308ab1 [0,1,0,1,0,0|2,0,0]=4 14760 B11R1.35 CC(=O)C(C)OC1CCCC1 0b6b60b4a321cc82c2804eaae7a780a8 [0,1,0,1,0,0|2,0,0]=4 14761 B11R1.35 CC(=O)N(C)CC1CCCC1 4331ec178c73bb27884454afbc84991d [0,1,0,1,0,0|2,0,0]=4 14762 B11R1.35 CC(CN1CCSC1)C(=O)O 3f17ec3dd2e768681e5031061e42bdab [0,1,0,1,0,0|2,0,0]=4 14763 B11R1.35 CC(NC1CCCC1)C(=O)N 227397e196e22c771cbf2b906330fc18 [0,1,0,1,0,0|2,0,0]=4 14764 B11R1.35 CC(NC1CCOC1)C(=O)O f3e81c1110a3d3cb97c3dc0550b469de [0,1,0,1,0,0|2,0,0]=4 14765 B11R1.35 CC(NC1CCSC1)C(=O)O 70a40e03f53366588102cc83a0160254 [0,1,0,1,0,0|2,0,0]=4 14766 B11R1.35 CC(N[C@@H]1CCOC1)C(=O)O 73609e64bbb7d3cb0a7d61486c400ffa [0,1,0,1,0,0|2,0,0]=4 14767 B11R1.35 CC(N[C@H]1CCOC1)C(=O)O 1ca159ba7e4f27f69a8ce33962a42316 [0,1,0,1,0,0|2,0,0]=4 14768 B11R1.35 CC(OC1CCCC1)C(=O)N 70a68f74512d361b18fe0a4a4ac4d0bc [0,1,0,1,0,0|2,0,0]=4 14769 B11R1.35 CC(OC1CCCC1)C(=O)O 6f273f844b7ca9d87f77a94af82fb62d [0,1,0,1,0,0|1,0,0]=3 14770 B11R1.35 CC(OC1CCCO1)C(=O)O d1c347d8723e1f2c92b4f5aa0711868f [0,1,0,1,0,0|2,0,0]=4 14771 B11R1.35 CC(OC1CCOC1)C(=O)O b5bae76497e2f484a9bfff0c724a3670 [0,1,0,1,0,0|2,0,0]=4 14772 B11R1.35 CC(O[C@@H]1CCOC1)C(=O)O b929b1c97b25e890e88f5505d2f1f19f [0,1,0,1,0,0|2,0,0]=4 14773 B11R1.35 CC(O[C@H]1CCOC1)C(=O)O 77e140ce5e412cb2a1503e715983970c [0,1,0,1,0,0|2,0,0]=4 14774 B11R1.35 C[C@@H](NC1CCCC1)C(=O)N 20e9d506d10a67629050fe866950447f [0,1,0,1,0,0|2,0,0]=4 14775 B11R1.35 C[C@@H](NC1CCOC1)C(=O)O 79bf15ce5149692e250a3a2be90ac651 [0,1,0,1,0,0|2,0,0]=4 14776 B11R1.35 C[C@@H](NC1CCSC1)C(=O)O b5a0d52feca478ee4a3d0ea4348f69b0 [0,1,0,1,0,0|2,0,0]=4 14777 B11R1.35 C[C@@H](N[C@@H]1CCOC1)C(=O)O dbe2eca173eb1a6dc43ff67a8ea6ffe7 [0,1,0,1,0,0|2,0,0]=4 14778 B11R1.35 C[C@@H](N[C@H]1CCOC1)C(=O)O 4aa0360e8b68a32d67e56db0b2658bba [0,1,0,1,0,0|2,0,0]=4 14779 B11R1.35 C[C@@H](OC1CCCC1)C(=O)N f085ccfaf7339fb9460b64e2feedaaf4 [0,1,0,1,0,0|2,0,0]=4 14780 B11R1.35 C[C@@H](OC1CCCC1)C(=O)O a1fc4e9cba7d40a934438400ad4e6069 [0,1,0,1,0,0|1,0,0]=3 14781 B11R1.35 C[C@@H](OC1CCCO1)C(=O)O 9080a0562444abaf36a2a037d488e68b [0,1,0,1,0,0|2,0,0]=4 14782 B11R1.35 C[C@@H](OC1CCOC1)C(=O)O b0b00b324fd202715f72d9c86a1b3c95 [0,1,0,1,0,0|2,0,0]=4 14783 B11R1.35 C[C@@H](O[C@@H]1CCOC1)C(=O)O 80cdb571b87876404cec272769bd88b3 [0,1,0,1,0,0|2,0,0]=4 14784 B11R1.35 C[C@@H](O[C@H]1CCOC1)C(=O)O ed1fdb4bd90a09abf0295eafe8141ac1 [0,1,0,1,0,0|2,0,0]=4 14785 B11R1.35 C[C@H](NC1CCCC1)C(=O)N 3c1c44803eae6f75dc416834ccf9567f [0,1,0,1,0,0|2,0,0]=4 14786 B11R1.35 C[C@H](NC1CCOC1)C(=O)O a00904df5cd6c90f09eb498a9e3b549c [0,1,0,1,0,0|2,0,0]=4 14787 B11R1.35 C[C@H](NC1CCSC1)C(=O)O a55b9ffe920a09d84c8700b734aa3d94 [0,1,0,1,0,0|2,0,0]=4 14788 B11R1.35 C[C@H](N[C@@H]1CCOC1)C(=O)O 1d2ac5191ca299e5541b8393e35619c6 [0,1,0,1,0,0|2,0,0]=4 14789 B11R1.35 C[C@H](N[C@H]1CCOC1)C(=O)O 318dc934813325acf577deeeb770ec70 [0,1,0,1,0,0|2,0,0]=4 14790 B11R1.35 C[C@H](OC1CCCC1)C(=O)N dacbd96afd068698bc98beaa83fd0b87 [0,1,0,1,0,0|2,0,0]=4 14791 B11R1.35 C[C@H](OC1CCCC1)C(=O)O 37f601e418b7cf2cc26612e5e0309bef [0,1,0,1,0,0|1,0,0]=3 14792 B11R1.35 C[C@H](OC1CCCO1)C(=O)O 033ed381c2612d35826f11162a59aa27 [0,1,0,1,0,0|2,0,0]=4 14793 B11R1.35 C[C@H](OC1CCOC1)C(=O)O e8a3eb56677f1ea9a82be08af753044d [0,1,0,1,0,0|2,0,0]=4 14794 B11R1.35 C[C@H](O[C@@H]1CCOC1)C(=O)O 791d12b71fdcd08bf7089b1d858c4eb6 [0,1,0,1,0,0|2,0,0]=4 14795 B11R1.35 C[C@H](O[C@H]1CCOC1)C(=O)O 228670e725eca8fd1b191671a57a4ac9 [0,1,0,1,0,0|2,0,0]=4 14796 B11R1.35 NC(=O)C(F)NC1CCCC1 6982b5ebcb29f561eda74c63426f4fa9 [0,1,0,1,0,0|2,0,0]=4 14797 B11R1.35 NC(=O)C(F)OC1CCCC1 0fac3018517472fa27d1dfd9ee2831dc [0,1,0,1,0,0|2,0,0]=4 14798 B11R1.35 O=C(O)C(F)NC1CCOC1 8e6d3075c6c7a6ddc4f2087892d2ab09 [0,1,0,1,0,0|2,0,0]=4 14799 B11R1.35 O=C(O)C(F)N[C@@H]1CCOC1 29f10c5178a575003774b559a069670d [0,1,0,1,0,0|2,0,0]=4 14800 B11R1.35 O=C(O)C(F)N[C@H]1CCOC1 74c93b3786322f5a5d38a78ee7ce7fa4 [0,1,0,1,0,0|2,0,0]=4 14801 B11R1.35 O=C(O)C(F)OC1CCCC1 b49cbcec626a1b62673ee05731fa0287 [0,1,0,1,0,0|1,0,0]=3 14802 B11R1.35 O=C(O)C(O)CN1CCSC1 c8c36766f33467c655b92f1e2de0647e [0,1,0,1,0,0|2,0,0]=4 14803 B11R1.35 O=C(O)C(O)NC1CCCC1 d0f1ed9201a502363c89b3db85d4691e [0,1,0,1,0,0|1,0,0]=3 14804 B11R1.35 O=C(O)C(O)NC1CCOC1 756965bd2bb4d66c73781955f2ef9812 [0,1,0,1,0,0|2,0,0]=4 14805 B11R1.35 O=C(O)C(O)N[C@@H]1CCOC1 b00f52b1a10f4b60195432c9df207031 [0,1,0,1,0,0|2,0,0]=4 14806 B11R1.35 O=C(O)C(O)N[C@H]1CCOC1 aace6162919194008ada0ecc9e51c300 [0,1,0,1,0,0|2,0,0]=4 14807 B11R1.35 O=C(O)[C@@H](O)CN1CCSC1 eff668cbf23d3afeafdedc922012e43c [0,1,0,1,0,0|2,0,0]=4 14808 B11R1.35 O=C(O)[C@H](F)NC1CCOC1 caa5c803a91b022558f5a7cea80daedb [0,1,0,1,0,0|2,0,0]=4 14809 B11R1.35 O=C(O)[C@H](F)N[C@@H]1CCOC1 0bbd11d5d4debba150f0d268c584b62e [0,1,0,1,0,0|2,0,0]=4 14810 B11R1.35 O=C(O)[C@H](F)N[C@H]1CCOC1 7e465c12f0556b0df72cb9dbcd579ed7 [0,1,0,1,0,0|2,0,0]=4 14811 B11R1.36 CC(=O)N(C)C1CCCCC1 ee6341c0949dc3b0f1e73cdf394e155f [0,1,0,1,0,0|2,0,0]=4 14812 B11R1.36 CC(C(=O)O)N1CCCOC1 dff6b909f8945419326614a1657938ec [0,1,0,1,0,0|2,0,0]=4 14813 B11R1.36 CC(C(=O)O)N1CCCSC1 0be88a4f0d8af865407f988b91e4414c [0,1,0,1,0,0|2,0,0]=4 14814 B11R1.36 CC(C(=O)O)N1CCOCC1 167b476748a49a3437a4e809264db101 [0,1,0,1,0,0|2,0,0]=4 14815 B11R1.36 CC(C(=O)O)N1CCSCC1 88264b64b2b1900f1827fb099f5f0e35 [0,1,0,1,0,0|2,0,0]=4 14816 B11R1.36 C[C@@H](C(=O)O)N1CCCOC1 f244239a969a8b3042da898c2c8ce4f3 [0,1,0,1,0,0|2,0,0]=4 14817 B11R1.36 C[C@@H](C(=O)O)N1CCCSC1 cfaddb582bdaa1345652ba68434e3a9d [0,1,0,1,0,0|2,0,0]=4 14818 B11R1.36 C[C@@H](C(=O)O)N1CCOCC1 d89745bebb498002d09c650208f443af [0,1,0,1,0,0|2,0,0]=4 14819 B11R1.36 C[C@@H](C(=O)O)N1CCSCC1 231b7956cc4601b2c749258d94dbada6 [0,1,0,1,0,0|2,0,0]=4 14820 B11R1.36 C[C@H](C(=O)O)N1CCCOC1 5e7cdfcbe4d9f604ac1c0ca0e6e9a841 [0,1,0,1,0,0|2,0,0]=4 14821 B11R1.36 C[C@H](C(=O)O)N1CCCSC1 94948b05b6ad84cba8f0fb601f562fb1 [0,1,0,1,0,0|2,0,0]=4 14822 B11R1.36 C[C@H](C(=O)O)N1CCOCC1 50860e42cc45d0edc0891b8b06b7c3b5 [0,1,0,1,0,0|2,0,0]=4 14823 B11R1.36 C[C@H](C(=O)O)N1CCSCC1 06035148fdd181cc0269119fa87b0610 [0,1,0,1,0,0|2,0,0]=4 14824 B11R1.89 CC(=O)C(C)N1CCCC1C f95855c823137d75198b769e14545c7f [0,1,0,1,0,0|2,0,0]=4 14825 B11R1.89 CC(=O)C(C)N1CCC[C@@H]1C 1fced2b0524f2e75d81d11d2064982f4 [0,1,0,1,0,0|2,0,0]=4 14826 B11R1.89 CC(=O)C(C)N1CCC[C@H]1C e1064e2fad225504263ac2cd5c01a803 [0,1,0,1,0,0|2,0,0]=4 14827 B11R1.89 CC(C(=O)N)N1CCC[C@@H]1C 0a589824fb42dd0d2e6119a04c60885a [0,1,0,1,0,0|2,0,0]=4 14828 B11R1.89 CC(C(=O)N)N1CCC[C@H]1C 1342a09260bca10059d282527ea34934 [0,1,0,1,0,0|2,0,0]=4 14829 B11R1.89 CC1CCCN1C(C)C(=O)N cc0cd9a8863c04c220516d4d0f965c51 [0,1,0,1,0,0|2,0,0]=4 14830 B11R1.89 CC1CCCN1C(F)C(=O)N 936322dc1f08c27ab527743b439c06bc [0,1,0,1,0,0|2,0,0]=4 14831 B11R1.89 CC1CCCN1C(F)C(=O)O b7cccfe4684c03e26505ebe1ae2e929a [0,1,0,1,0,0|1,0,0]=3 14832 B11R1.89 CC1CCCN1[C@@H](C)C(=O)N 76b465c9f1f6b2bf34cff70bd1b21f90 [0,1,0,1,0,0|2,0,0]=4 14833 B11R1.89 CC1CCCN1[C@H](C)C(=O)N 03862036d3287b2bb49c415b5682a627 [0,1,0,1,0,0|2,0,0]=4 14834 B11R1.89 C[C@@H]1CCCN1C(F)C(=O)N e7fa3296ed56f12bf4010fad37b0c9cb [0,1,0,1,0,0|2,0,0]=4 14835 B11R1.89 C[C@@H]1CCCN1C(F)C(=O)O 9162c8c7da16295fabbc65b0f61db831 [0,1,0,1,0,0|1,0,0]=3 14836 B11R1.89 C[C@@H]1CCCN1[C@@H](C)C(=O)N ab283eb423c55aff3621c37e0a175712 [0,1,0,1,0,0|2,0,0]=4 14837 B11R1.89 C[C@@H]1CCCN1[C@H](C)C(=O)N e5d73bdd9f86917e748a839f0576bdcc [0,1,0,1,0,0|2,0,0]=4 14838 B11R1.89 C[C@H](C(=O)N)N1CCC[C@@H]1C 05b4832b04781a8072397d529e47f35f [0,1,0,1,0,0|2,0,0]=4 14839 B11R1.89 C[C@H]1CCCN1C(F)C(=O)N 6ab6d0497a9af04b54c5361ef06d896b [0,1,0,1,0,0|2,0,0]=4 14840 B11R1.89 C[C@H]1CCCN1C(F)C(=O)O d8bc16ad09964b3764afbc56a3202130 [0,1,0,1,0,0|1,0,0]=3 14841 B11R1.89 C[C@H]1CCCN1[C@@H](C)C(=O)N 02a7a697b345e68f1e730960afe27710 [0,1,0,1,0,0|2,0,0]=4 14842 B11R1.104 C=C(CNC1CC1C)C(=O)O e6cad2d30d9d3dd7132c09f6cc499a07 [0,1,0,1,0,0|1,0,1]=4 14843 B11R1.104 CC(=O)C(C)OCC1CC1C d95733c0ff11a609eca51a48354b9bb7 [0,1,0,1,0,0|2,0,0]=4 14844 B11R1.104 CC(=O)C(C)OC[C@@H]1C[C@@H]1C c3ee14215dce9f1e02359c59ef165623 [0,1,0,1,0,0|2,0,0]=4 14845 B11R1.104 CC(=O)C(C)OC[C@@H]1C[C@H]1C 7f08a70910818f538cc0352ce21f4928 [0,1,0,1,0,0|2,0,0]=4 14846 B11R1.104 CC(=O)C(C)OC[C@H]1C[C@@H]1C 1e9446e998f226362da2c6d8a287c044 [0,1,0,1,0,0|2,0,0]=4 14847 B11R1.104 CC(CNC1CC1C)C(=O)O f28c7117a67120ce73afd713b035fc28 [0,1,0,1,0,0|1,0,0]=3 14848 B11R1.104 CC(CN[C@@H]1C[C@H]1F)C(=O)O f638c5dfb92598be8e7e8566770b876a [0,1,0,1,0,0|2,0,0]=4 14849 B11R1.104 CC(CN[C@H]1C[C@@H]1F)C(=O)O 21cd34ee6f451361251edea1dae74fb1 [0,1,0,1,0,0|2,0,0]=4 14850 B11R1.104 CC(CN[C@H]1C[C@H]1F)C(=O)O 14542fba0435ed7af148267bc524ac79 [0,1,0,1,0,0|2,0,0]=4 14851 B11R1.104 CC(OCC1CC1C)C(=O)N f2d47695bc3e09a9629bd77ace3f38d1 [0,1,0,1,0,0|2,0,0]=4 14852 B11R1.104 CC(OC[C@@H]1C[C@@H]1C)C(=O)N 60c3e5013fd895286827204146cd1450 [0,1,0,1,0,0|2,0,0]=4 14853 B11R1.104 CC(OC[C@@H]1C[C@H]1C)C(=O)N 2b0f5126986eb234e51edd35fc570f60 [0,1,0,1,0,0|2,0,0]=4 14854 B11R1.104 CC(OC[C@H]1C[C@@H]1C)C(=O)N ba188601ba1b5e4c0c4a1bb5bf6ccfc8 [0,1,0,1,0,0|2,0,0]=4 14855 B11R1.104 CC1CC1COC(F)C(=O)N 5bc67e188cb9963cbe3dc59b5d8db91f [0,1,0,1,0,0|2,0,0]=4 14856 B11R1.104 CC1CC1CO[C@@H](C)C(=O)N 5801e577530749e2b2083513ad881b81 [0,1,0,1,0,0|2,0,0]=4 14857 B11R1.104 CC1CC1CO[C@H](C)C(=O)N fe5dccf8f13e996420dc1ea2d98857f9 [0,1,0,1,0,0|2,0,0]=4 14858 B11R1.104 CC1CC1NCC(=O)C(=O)O 5dd72fa25173bcca3ca3bd58d459469e [0,1,0,1,0,0|1,0,1]=4 14859 B11R1.104 CC1CC1NCC(O)C(=O)O 6b729f4baf592efd5dff1657084bfd87 [0,1,0,1,0,0|1,0,0]=3 14860 B11R1.104 CC1CC1NC[C@H](O)C(=O)O 00206b36d9ae026bbc2ad440acba1171 [0,1,0,1,0,0|1,0,0]=3 14861 B11R1.104 C[C@@H](OC[C@@H]1C[C@@H]1C)C(=O)N c3ca30254345911a6d53602e3c8d91d4 [0,1,0,1,0,0|2,0,0]=4 14862 B11R1.104 C[C@@H](OC[C@H]1C[C@@H]1C)C(=O)N a40ac4ccab2530f59bc03c0eac112130 [0,1,0,1,0,0|2,0,0]=4 14863 B11R1.104 C[C@@H]1C[C@H]1COC(F)C(=O)N 9ddc982e41530d71b7c3031b76e975ee [0,1,0,1,0,0|2,0,0]=4 14864 B11R1.104 C[C@@H]1C[C@H]1CO[C@H](C)C(=O)N fb854c6fc2a9c3def272094327f66d5d [0,1,0,1,0,0|2,0,0]=4 14865 B11R1.104 C[C@H](OC[C@@H]1C[C@@H]1C)C(=O)N e5753c705b6e79525d2c7ee2181b27cd [0,1,0,1,0,0|2,0,0]=4 14866 B11R1.104 C[C@H](OC[C@@H]1C[C@H]1C)C(=O)N fe6d09884b7c9fb357f1c8eff5a3a0b2 [0,1,0,1,0,0|2,0,0]=4 14867 B11R1.104 C[C@H](OC[C@H]1C[C@@H]1C)C(=O)N 2787512aec63802dc5262fe055f55758 [0,1,0,1,0,0|2,0,0]=4 14868 B11R1.104 C[C@H]1C[C@@H]1COC(F)C(=O)N f0a722a6cd8b519c9fa35925489f8eb3 [0,1,0,1,0,0|2,0,0]=4 14869 B11R1.104 C[C@H]1C[C@H]1COC(F)C(=O)N 1846494bb99ebfd631488544fa00174c [0,1,0,1,0,0|2,0,0]=4 14870 B11R1.104 O=C(O)C(O)CN[C@@H]1C[C@H]1F de499138255def446612a9bff0352b59 [0,1,0,1,0,0|2,0,0]=4 14871 B11R1.104 O=C(O)C(O)CN[C@H]1C[C@@H]1F dd86f3b85e8602409e611692a46d8240 [0,1,0,1,0,0|2,0,0]=4 14872 B11R1.104 O=C(O)C(O)CN[C@H]1C[C@H]1F e3883a8c8704be40c8957634d01d2740 [0,1,0,1,0,0|2,0,0]=4 14873 B11R1.104 O=C(O)[C@@H](O)CN[C@@H]1C[C@H]1F 38bbf44277a3a71cdaf3b6aa3fdc9c09 [0,1,0,1,0,0|2,0,0]=4 14874 B11R1.104 O=C(O)[C@@H](O)CN[C@H]1C[C@@H]1F 07a5f9e7a2f327b1566d1a5bedebb677 [0,1,0,1,0,0|2,0,0]=4 14875 B11R1.104 O=C(O)[C@@H](O)CN[C@H]1C[C@H]1F b52ffa4abcbe33a1e42eb02324fb5730 [0,1,0,1,0,0|2,0,0]=4 14876 B11R1.142 CC(=O)C(C)N[C@@H]1CC[C@H]1C 1283457f2769f4ac60822f6c62c773cc [0,1,0,1,0,0|2,0,0]=4 14877 B11R1.142 CC(=O)C(C)N[C@H]1CC[C@H]1C 6b035b0e3dfba44e7c1925fcf90ab303 [0,1,0,1,0,0|2,0,0]=4 14878 B11R1.142 CC(NC1CCC1F)C(=O)O d88551cad8d5dc7ae4ab02c21adcd6ab [0,1,0,1,0,0|2,0,0]=4 14879 B11R1.142 CC(NC1CCC1O)C(=O)O 2cedb5d84542f4c6f6348a742f6cb7fb [0,1,0,1,0,0|2,0,0]=4 14880 B11R1.142 CC(N[C@@H]1CC[C@@H]1O)C(=O)O df2a67888f8555b73731d06212ce7856 [0,1,0,1,0,0|2,0,0]=4 14881 B11R1.142 CC(N[C@@H]1CC[C@H]1C)C(=O)N 86ee2c5b8300c5c8121838e51c6b0479 [0,1,0,1,0,0|2,0,0]=4 14882 B11R1.142 CC(N[C@@H]1CC[C@H]1C)C(=O)O 1ffbb64bdb3ef753e861f8b22d34fee5 [0,1,0,1,0,0|1,0,0]=3 14883 B11R1.142 CC(N[C@@H]1CC[C@H]1O)C(=O)O 7d9bb429a3fb3dab0930494db49c0413 [0,1,0,1,0,0|2,0,0]=4 14884 B11R1.142 CC(N[C@H]1CC[C@@H]1O)C(=O)O 29b8d63ccbf3a702f76b942ddbce4874 [0,1,0,1,0,0|2,0,0]=4 14885 B11R1.142 CC(N[C@H]1CC[C@H]1C)C(=O)N 2c912f4df193fb49c6f4135120a95cda [0,1,0,1,0,0|2,0,0]=4 14886 B11R1.142 CC(N[C@H]1CC[C@H]1C)C(=O)O d1283d9d86337bd53e0300b09e8f53b9 [0,1,0,1,0,0|1,0,0]=3 14887 B11R1.142 CC(N[C@H]1CC[C@H]1O)C(=O)O b94c4751c5e0e6724258651875087e47 [0,1,0,1,0,0|2,0,0]=4 14888 B11R1.142 CC(OC1COC1C)C(=O)O 9b55aab8e40479d3b24c4e556362e1bf [0,1,0,1,0,0|2,0,0]=4 14889 B11R1.142 CC1OCC1NC(F)C(=O)O 8f45441f239b928e62ee408de84103b5 [0,1,0,1,0,0|2,0,0]=4 14890 B11R1.142 CC1OCC1N[C@@H](F)C(=O)O a5eb769a6130350b5d7d29031842915e [0,1,0,1,0,0|2,0,0]=4 14891 B11R1.142 CC1OCC1OC(F)C(=O)O 649b4ae457a00133e8cf9ea60795443d [0,1,0,1,0,0|2,0,0]=4 14892 B11R1.142 CC1OCC1O[C@@H](C)C(=O)O 326e4e2273b86090fe26712550ff282c [0,1,0,1,0,0|2,0,0]=4 14893 B11R1.142 CC1OCC1O[C@@H](F)C(=O)O 8bf12e8080c1737e298ec003269af674 [0,1,0,1,0,0|2,0,0]=4 14894 B11R1.142 CC1OCC1O[C@H](C)C(=O)O dd727dec412eddc9d1ff9fb2112ad2cf [0,1,0,1,0,0|2,0,0]=4 14895 B11R1.142 C[C@@H](NC1CCC1F)C(=O)O 70f908db4a742a17a23fb69afcb9cebe [0,1,0,1,0,0|2,0,0]=4 14896 B11R1.142 C[C@@H](NC1CCC1O)C(=O)O 2bf1ee326573e211dc4ed84c56509a98 [0,1,0,1,0,0|2,0,0]=4 14897 B11R1.142 C[C@@H](N[C@@H]1CC[C@@H]1O)C(=O)O 4d8d3c42b52d1228853c949a813ef530 [0,1,0,1,0,0|2,0,0]=4 14898 B11R1.142 C[C@@H](N[C@@H]1CC[C@H]1O)C(=O)O b8ba7c259be1aa07d2e5d2ef6efa3899 [0,1,0,1,0,0|2,0,0]=4 14899 B11R1.142 C[C@@H](N[C@H]1CC[C@@H]1O)C(=O)O 64ce68b9b5378462ccb401207dcc5342 [0,1,0,1,0,0|2,0,0]=4 14900 B11R1.142 C[C@@H](N[C@H]1CC[C@H]1O)C(=O)O c7220b34ac0c7169c5647ebef6689023 [0,1,0,1,0,0|2,0,0]=4 14901 B11R1.142 C[C@@H]1CC[C@@H]1NC(F)C(=O)N 60b8ddd109a8e86634a8945147006069 [0,1,0,1,0,0|2,0,0]=4 14902 B11R1.142 C[C@@H]1CC[C@@H]1NC(F)C(=O)O 79a0e0e6c84d7b9e204d713cfd3bacea [0,1,0,1,0,0|1,0,0]=3 14903 B11R1.142 C[C@@H]1CC[C@@H]1N[C@@H](F)C(=O)O 9c44f8410cbcfba42dce6f296a22c986 [0,1,0,1,0,0|1,0,0]=3 14904 B11R1.142 C[C@@H]1CC[C@@H]1N[C@H](C)C(=O)N 93bba68ab011edbcbe22925c4c3f0636 [0,1,0,1,0,0|2,0,0]=4 14905 B11R1.142 C[C@@H]1CC[C@@H]1N[C@H](C)C(=O)O 5827295c92c2b2c36971a6377a1abdd4 [0,1,0,1,0,0|1,0,0]=3 14906 B11R1.142 C[C@@H]1CC[C@H]1NC(F)C(=O)N c096c714cda0017c26145d295617711c [0,1,0,1,0,0|2,0,0]=4 14907 B11R1.142 C[C@@H]1CC[C@H]1NC(F)C(=O)O a28fa490aefee2174a9321d9bb98e48b [0,1,0,1,0,0|1,0,0]=3 14908 B11R1.142 C[C@@H]1CC[C@H]1N[C@@H](F)C(=O)O 7bab7e7d3ce0a8b244da76ba5d82533f [0,1,0,1,0,0|1,0,0]=3 14909 B11R1.142 C[C@@H]1CC[C@H]1N[C@H](C)C(=O)N 0deedb936855f1bded2e911099855633 [0,1,0,1,0,0|2,0,0]=4 14910 B11R1.142 C[C@@H]1CC[C@H]1N[C@H](C)C(=O)O 196099e111575c0f2007f15925099382 [0,1,0,1,0,0|1,0,0]=3 14911 B11R1.142 C[C@H](NC1CCC1F)C(=O)O e398ab702381f7e0dfc2af439da39fdb [0,1,0,1,0,0|2,0,0]=4 14912 B11R1.142 C[C@H](NC1CCC1O)C(=O)O ed2445a1599f421bd8b8b6f3aa5ee3d9 [0,1,0,1,0,0|2,0,0]=4 14913 B11R1.142 C[C@H](N[C@@H]1CC[C@@H]1O)C(=O)O 83a26228f4ae97f351e3eaffbe9c4a7e [0,1,0,1,0,0|2,0,0]=4 14914 B11R1.142 C[C@H](N[C@@H]1CC[C@H]1C)C(=O)N 2544d8ea5926f3cd67fec125753ffa7c [0,1,0,1,0,0|2,0,0]=4 14915 B11R1.142 C[C@H](N[C@@H]1CC[C@H]1C)C(=O)O 3a34ff4bf781c16dfa544250ccf51d7a [0,1,0,1,0,0|1,0,0]=3 14916 B11R1.142 C[C@H](N[C@@H]1CC[C@H]1O)C(=O)O a1d26dbb398aab94886973961869be96 [0,1,0,1,0,0|2,0,0]=4 14917 B11R1.142 C[C@H](N[C@H]1CC[C@@H]1O)C(=O)O 015021417a9efb1d5929cf48cd7c8e50 [0,1,0,1,0,0|2,0,0]=4 14918 B11R1.142 C[C@H](N[C@H]1CC[C@H]1C)C(=O)N 789c387e25ec079eb351154b545df3e7 [0,1,0,1,0,0|2,0,0]=4 14919 B11R1.142 C[C@H](N[C@H]1CC[C@H]1C)C(=O)O 23e9de502bae7b21ffcf34343853e5fa [0,1,0,1,0,0|1,0,0]=3 14920 B11R1.142 C[C@H](N[C@H]1CC[C@H]1O)C(=O)O 5be5a7b46471d5c33be2c7f737aaebaa [0,1,0,1,0,0|2,0,0]=4 14921 B11R1.142 O=C(O)C(F)NC1CCC1O 158e5feda3517003385c06833538e368 [0,1,0,1,0,0|2,0,0]=4 14922 B11R1.142 O=C(O)C(F)N[C@@H]1CC[C@@H]1O a00b98c70097f77e76c4f57c2f73a4a9 [0,1,0,1,0,0|2,0,0]=4 14923 B11R1.142 O=C(O)C(F)N[C@@H]1CC[C@H]1O 1b20095e0f527f5f019c3b4d7d77ed2c [0,1,0,1,0,0|2,0,0]=4 14924 B11R1.142 O=C(O)C(F)N[C@H]1CC[C@@H]1O bf578b21ece0fa48cc8792552f919ae0 [0,1,0,1,0,0|2,0,0]=4 14925 B11R1.142 O=C(O)C(F)N[C@H]1CC[C@H]1O 90a3b9b7cc7785fd225ebd9745989d36 [0,1,0,1,0,0|2,0,0]=4 14926 B11R1.211 CCCCN1CC(C1)C(=O)N 50df0c75689aacf8b4e19873fc874e7e [0,1,0,1,0,0|2,0,0]=4 14927 B11R1.211 CCCCN1CC(C1)C(=O)O 73bc4ec6b01038e14488a64800fdbbc3 [0,1,0,1,0,0|1,0,0]=3 14928 B11R1.211 CCCNC1CC(C1)C(=O)N 3d37a30879ab8b50d104ed0f2fbf8f54 [0,1,0,1,0,0|2,0,0]=4 14929 B11R1.211 CCCNC1CC(C1)C(=O)O 29dda0e0bc32fcf3a71b839c9e4aca29 [0,1,0,1,0,0|1,0,0]=3 14930 B11R1.211 CCCN[C@H]1C[C@@H](C1)C(=O)O 3e305c6a67a52de575ed63e03eec3027 [0,1,0,1,0,0|1,0,0]=3 14931 B11R1.211 CCCN[C@H]1C[C@H](C1)C(=O)O afe34fef7a04e44312974a640fbedb0e [0,1,0,1,0,0|1,0,0]=3 14932 B11R1.211 CCCOC1CC(C1)C(=O)C b87ed0fbec2d55a9d4a811ab0735f268 [0,1,0,1,0,0|2,0,0]=4 14933 B11R1.211 CCCOC1CC(C1)C(=O)N 6fd5120d4a3bec655ee956a252ff1e71 [0,1,0,1,0,0|2,0,0]=4 14934 B11R1.211 CCCOC1CC(C1)C(=O)O 308f84b7dbc7ebc370a27427dc6a8bfa [0,1,0,1,0,0|1,0,0]=3 14935 B11R1.211 CCCO[C@H]1C[C@@H](C1)C(=O)O 6dec96a9667b051b3b8963abef3d99d1 [0,1,0,1,0,0|1,0,0]=3 14936 B11R1.211 CCCO[C@H]1C[C@H](C1)C(=O)O 763f122554bd8c2d2d1a951974b1925a [0,1,0,1,0,0|1,0,0]=3 14937 B11R1.211 CCOCC1CC(C1)C(=O)O c36dd1afd899a93982a289ab245a6e1a [0,1,0,1,0,0|1,0,0]=3 14938 B11R1.211 CCOCN1CC(C1)C(=O)O 854ba164d12900a590c9f2169ea8b254 [0,1,0,1,0,0|2,0,0]=4 14939 B11R1.211 CCOC[C@H]1C[C@H](C1)C(=O)O a4b43b882cfc9361c05524cfe6d9bf95 [0,1,0,1,0,0|1,0,0]=3 14940 B11R1.211 COCCN1CC(C1)C(=O)O fc8e2880e527fee300aef617ddc4d2f5 [0,1,0,1,0,0|2,0,0]=4 14941 B11R1.211 COCNC1CC(C1)C(=O)O dda6898fa3e07180c8f1e4f2b8660862 [0,1,0,1,0,0|2,0,0]=4 14942 B11R1.211 COCN[C@H]1C[C@@H](C1)C(=O)O 8feef062a4400f5915f7309fa2ffadb4 [0,1,0,1,0,0|2,0,0]=4 14943 B11R1.211 COCN[C@H]1C[C@H](C1)C(=O)O b7f3c45a8f3e38df68505e1352aa0bf3 [0,1,0,1,0,0|2,0,0]=4 14944 B11R1.211 COCOC1CC(C1)C(=O)O 4969cbba7214c988db69f83e9fc2c0c0 [0,1,0,1,0,0|2,0,0]=4 14945 B11R1.211 COCO[C@H]1C[C@@H](C1)C(=O)O 277f14a6450ace53304936045c76b4d4 [0,1,0,1,0,0|2,0,0]=4 14946 B11R1.211 COCO[C@H]1C[C@H](C1)C(=O)O 64a52bf95ad17cbc8c13ffc3379004ac [0,1,0,1,0,0|2,0,0]=4 14947 B11R1.211 CSCCN1CC(C1)C(=O)O 6ce72d4d675e966cf9da0340429f868f [0,1,0,1,0,0|2,0,0]=4 14948 B11R1.211 CSCNC1CC(C1)C(=O)O 0f26f55c6a222acb41342a8a6dbd1f13 [0,1,0,1,0,0|2,0,0]=4 14949 B11R1.211 CSCN[C@H]1C[C@@H](C1)C(=O)O bd0033ea09e667ce95d17dd695d95948 [0,1,0,1,0,0|2,0,0]=4 14950 B11R1.211 CSCN[C@H]1C[C@H](C1)C(=O)O 2d06942ecb1fe4a7b9f6c9f78ca12940 [0,1,0,1,0,0|2,0,0]=4 14951 B11R1.211 CSCOC1CC(C1)C(=O)O cf5751a258bb92def456093bf4f14a8a [0,1,0,1,0,0|2,0,0]=4 14952 B11R1.211 CSCO[C@H]1C[C@@H](C1)C(=O)O 98c309145f8faf7798cd2ba2803c63f9 [0,1,0,1,0,0|2,0,0]=4 14953 B11R1.211 CSCO[C@H]1C[C@H](C1)C(=O)O cbf11d2216fbf3ce4fcecd7c9e17b1d2 [0,1,0,1,0,0|2,0,0]=4 14954 B11R1.211 O=C(O)C1CC(C1)COCF ee246bfdf5509dcc7efa9539c7b14f11 [0,1,0,1,0,0|2,0,0]=4 14955 B11R1.211 O=C(O)C1CC(C1)NCCBr 985c856fdb334c07660adbb808ea2229 [0,1,0,1,0,0|2,0,0]=4 14956 B11R1.211 O=C(O)C1CC(C1)NCCF b9cd634c776009be541c1e6465aa27db [0,1,0,1,0,0|2,0,0]=4 14957 B11R1.211 O=C(O)C1CC(C1)NCCI f07b848449db4c479f9cc46d97c9cee3 [0,1,0,1,0,0|2,0,0]=4 14958 B11R1.211 O=C(O)C1CC(C1)NCCO 74f53be074e7e23e6049d1ed16199c68 [0,1,0,1,0,0|2,0,0]=4 14959 B11R1.211 O=C(O)C1CC(C1)NCCS cf381c793ed3db1156cebd38663efd8f [0,1,0,1,0,0|2,0,0]=4 14960 B11R1.211 O=C(O)C1CC(C1)OCCF a2ef3f09d35ddc7eadf2528a2ba6aac6 [0,1,0,1,0,0|2,0,0]=4 14961 B11R1.211 O=C(O)C1CC(C1)OCCS 97f793145b0e5dd59cd53366a0b69903 [0,1,0,1,0,0|2,0,0]=4 14962 B11R1.211 O=C(O)C1CN(C1)CCCF 68020955ce55cd632504feaa299d8a69 [0,1,0,1,0,0|2,0,0]=4 14963 B11R1.211 O=C(O)C1CN(C1)CCCO b04ae3aaa22b29ca31dd47cd2546de11 [0,1,0,1,0,0|2,0,0]=4 14964 B11R1.211 O=C(O)C1CN(C1)CCCS 5b4b4e92997f9f38e3e8f053221b2342 [0,1,0,1,0,0|2,0,0]=4 14965 B11R1.211 O=C(O)[C@H]1C[C@@H](C1)NCCBr 79d55eeb34a74382419cb7fc351e8493 [0,1,0,1,0,0|2,0,0]=4 14966 B11R1.211 O=C(O)[C@H]1C[C@@H](C1)NCCF 9606ee877a58540368efe00259d66545 [0,1,0,1,0,0|2,0,0]=4 14967 B11R1.211 O=C(O)[C@H]1C[C@@H](C1)NCCI 0865b593c109cd734572383b5713ee00 [0,1,0,1,0,0|2,0,0]=4 14968 B11R1.211 O=C(O)[C@H]1C[C@@H](C1)NCCO 9074e0d77db9d4ff3c5dcedb8f9070cb [0,1,0,1,0,0|2,0,0]=4 14969 B11R1.211 O=C(O)[C@H]1C[C@@H](C1)NCCS e696648f509a05aaaeb2a5b00207f0f6 [0,1,0,1,0,0|2,0,0]=4 14970 B11R1.211 O=C(O)[C@H]1C[C@@H](C1)OCCF 134555a9199f5b46922e09a00da3a20f [0,1,0,1,0,0|2,0,0]=4 14971 B11R1.211 O=C(O)[C@H]1C[C@@H](C1)OCCS 7bf8d13351398302880b85d06f964ede [0,1,0,1,0,0|2,0,0]=4 14972 B11R1.211 O=C(O)[C@H]1C[C@H](C1)COCF 2b2cf793a8e79f6b0f44bfefcd4a0291 [0,1,0,1,0,0|2,0,0]=4 14973 B11R1.211 O=C(O)[C@H]1C[C@H](C1)NCCBr 60f14f15cd6304ac1cad4c8e9941c3a9 [0,1,0,1,0,0|2,0,0]=4 14974 B11R1.211 O=C(O)[C@H]1C[C@H](C1)NCCF 245e6a3633c6fb3aee5338a99632b5ca [0,1,0,1,0,0|2,0,0]=4 14975 B11R1.211 O=C(O)[C@H]1C[C@H](C1)NCCI a538d33f4afb0ddec68e558babca8e88 [0,1,0,1,0,0|2,0,0]=4 14976 B11R1.211 O=C(O)[C@H]1C[C@H](C1)NCCO 24f890fb80094a786144f3a0416234d8 [0,1,0,1,0,0|2,0,0]=4 14977 B11R1.211 O=C(O)[C@H]1C[C@H](C1)NCCS 781100df809d7733fab864eb94b87c4c [0,1,0,1,0,0|2,0,0]=4 14978 B11R1.211 O=C(O)[C@H]1C[C@H](C1)OCCF 166c35d83f0cda8a2be482c2628b6674 [0,1,0,1,0,0|2,0,0]=4 14979 B11R1.211 O=C(O)[C@H]1C[C@H](C1)OCCS 93ea6604e60f486cf8e8d65e00336e7e [0,1,0,1,0,0|2,0,0]=4 14980 B11R1.270 CCC1CCN1C(C)C(=O)C aade928ec6427bf5a09e100a3652c743 [0,1,0,1,0,0|2,0,0]=4 14981 B11R1.270 CCC1CCN1C(C)C(=O)N f103d71f058b63b8d73e928b17b731ac [0,1,0,1,0,0|2,0,0]=4 14982 B11R1.270 CCC1CCN1C(C)C(=O)O f2cf92c3482e64d9ac87d0694f7a1621 [0,1,0,1,0,0|1,0,0]=3 14983 B11R1.270 CCC1CCN1C(F)C(=O)N 74a591fea8b8000ad66cab34dd3a35d4 [0,1,0,1,0,0|2,0,0]=4 14984 B11R1.270 CCC1CCN1[C@@H](C)C(=O)N bfe749bb2633de809adba81f932b747b [0,1,0,1,0,0|2,0,0]=4 14985 B11R1.270 CCC1CCN1[C@@H](C)C(=O)O c33bf774890dee34b2ff0adc3dbbae15 [0,1,0,1,0,0|1,0,0]=3 14986 B11R1.270 CCC1CCN1[C@H](C)C(=O)N 2f145f5d0c204bf6ad4f5bfc4e10106f [0,1,0,1,0,0|2,0,0]=4 14987 B11R1.270 CCC1CCN1[C@H](C)C(=O)O 92ae2345513636e219ef6f9c83f2c698 [0,1,0,1,0,0|1,0,0]=3 14988 B11R1.332 C=C(CNC1CCC1)C(=O)O 2ce221dd23f609526d53eb15171427d8 [0,1,0,1,0,0|1,0,1]=4 14989 B11R1.332 C=C(COC1CCC1)C(=O)O 43947829e9a0c328c6811ab6efbaa07d [0,1,0,1,0,0|1,0,1]=4 14990 B11R1.332 CC(=O)C(C)COC1CCC1 b20835568f21350e8dba7d3ad92dc835 [0,1,0,1,0,0|2,0,0]=4 14991 B11R1.332 CC(=O)C(C)NCC1CCC1 8f8967a90b62afce3ebbed7d03ec3680 [0,1,0,1,0,0|2,0,0]=4 14992 B11R1.332 CC(=O)C(C)OCC1CCC1 1a68d052384dd23c4e4ca13b8c760bba [0,1,0,1,0,0|2,0,0]=4 14993 B11R1.332 CC(=O)N(C)CCC1CCC1 c5c3f14f0cb3f2dc6617f6c7df54ab20 [0,1,0,1,0,0|2,0,0]=4 14994 B11R1.332 CC(CNC1CCC1)C(=O)O f11fb66daedc474c7a9177e7d093ee16 [0,1,0,1,0,0|1,0,0]=3 14995 B11R1.332 CC(CNC1COC1)C(=O)O adc3fdb1b6aba7351752af086c36db2f [0,1,0,1,0,0|2,0,0]=4 14996 B11R1.332 CC(COC1CCC1)C(=O)O e7522418aafc3d1be2d1ad1df24970ea [0,1,0,1,0,0|1,0,0]=3 14997 B11R1.332 CC(COC1COC1)C(=O)O 26bc96bc540af699d9cec2b0ff3c829f [0,1,0,1,0,0|2,0,0]=4 14998 B11R1.332 CC(COC1CSC1)C(=O)O d4a6bf48ef9c75c6222c8669549a32e5 [0,1,0,1,0,0|2,0,0]=4 14999 B11R1.332 CC(NCC1CCC1)C(=O)N 94e15e21f688a3244132a83232f25712 [0,1,0,1,0,0|2,0,0]=4 15000 B11R1.332 CC(NCC1CCC1)C(=O)O 38f15465e5417a0d616dd56f22e9167a [0,1,0,1,0,0|1,0,0]=3 15001 B11R1.332 CC(NCC1CCO1)C(=O)O 403f7769e07e361a786d87cc8fc451ee [0,1,0,1,0,0|2,0,0]=4 15002 B11R1.332 CC(NCC1COC1)C(=O)O 132d59288c9fc7bf095dbace6ba8e37d [0,1,0,1,0,0|2,0,0]=4 15003 B11R1.332 CC(NC[C@@H]1CCO1)C(=O)O 46ecf45b025ac5ec9172dcf2a00efe68 [0,1,0,1,0,0|2,0,0]=4 15004 B11R1.332 CC(NC[C@H]1CCO1)C(=O)O 55b152552d17fddcb7cbbf2479e1de74 [0,1,0,1,0,0|2,0,0]=4 15005 B11R1.332 CC(OCC1CCC1)C(=O)N e4a40492c5c81bb5dbb7b271437bc2a6 [0,1,0,1,0,0|2,0,0]=4 15006 B11R1.332 CC(OCC1CCC1)C(=O)O b74dd42af23890254e15d6b38e020813 [0,1,0,1,0,0|1,0,0]=3 15007 B11R1.332 CC(OCC1CCO1)C(=O)O 5388f3460c874232bfac19b453b3a870 [0,1,0,1,0,0|2,0,0]=4 15008 B11R1.332 CC(OCC1COC1)C(=O)O dabe3f2b0503ad92255247dc16da12db [0,1,0,1,0,0|2,0,0]=4 15009 B11R1.332 CC(OC[C@@H]1CCO1)C(=O)O f1ff5ee67174ba0dfe95b820167aff7e [0,1,0,1,0,0|2,0,0]=4 15010 B11R1.332 CC(OC[C@H]1CCO1)C(=O)O ad9ed7461d631230ef3a4178dbc86bee [0,1,0,1,0,0|2,0,0]=4 15011 B11R1.332 C[C@@H](CNC1CCC1)C(=O)O 269c86a08fa7083623fc39bc13f6722d [0,1,0,1,0,0|1,0,0]=3 15012 B11R1.332 C[C@@H](CNC1COC1)C(=O)O 518de33549599df75f5e5c92c3df779c [0,1,0,1,0,0|2,0,0]=4 15013 B11R1.332 C[C@@H](COC1CCC1)C(=O)O c063800dc6f0a4c01cd8ac0a9e689e89 [0,1,0,1,0,0|1,0,0]=3 15014 B11R1.332 C[C@@H](COC1COC1)C(=O)O 146b8c39ddc387c02f31787246654f97 [0,1,0,1,0,0|2,0,0]=4 15015 B11R1.332 C[C@@H](NCC1CCC1)C(=O)N f4ba73daf06452e2d0f4489914909fb5 [0,1,0,1,0,0|2,0,0]=4 15016 B11R1.332 C[C@@H](NCC1CCC1)C(=O)O af8b264699f79c8dc38d56dc63b1bdf2 [0,1,0,1,0,0|1,0,0]=3 15017 B11R1.332 C[C@@H](NCC1CCO1)C(=O)O 67abe51a5d13c8e9ae59db71f7f72e4f [0,1,0,1,0,0|2,0,0]=4 15018 B11R1.332 C[C@@H](NCC1COC1)C(=O)O a1bf9cc393a93ef8b035cd678cd9a8bb [0,1,0,1,0,0|2,0,0]=4 15019 B11R1.332 C[C@@H](NC[C@@H]1CCO1)C(=O)O 3694c5dc29042f8decae704a372dd691 [0,1,0,1,0,0|2,0,0]=4 15020 B11R1.332 C[C@@H](NC[C@H]1CCO1)C(=O)O e9e2419c384adedd9efa999ca89e9acb [0,1,0,1,0,0|2,0,0]=4 15021 B11R1.332 C[C@@H](OCC1CCC1)C(=O)N db341e839060e369abe316ae6485aec0 [0,1,0,1,0,0|2,0,0]=4 15022 B11R1.332 C[C@@H](OCC1CCC1)C(=O)O 72771ee34be26400634d1a883d60303b [0,1,0,1,0,0|1,0,0]=3 15023 B11R1.332 C[C@@H](OCC1CCO1)C(=O)O 03059d2293b650cd3d81a857d978c057 [0,1,0,1,0,0|2,0,0]=4 15024 B11R1.332 C[C@@H](OCC1COC1)C(=O)O 2c1e42427eb8fd40119986d1e0b8f874 [0,1,0,1,0,0|2,0,0]=4 15025 B11R1.332 C[C@@H](OC[C@@H]1CCO1)C(=O)O 70c2d415519927fc54918989e9bb9e28 [0,1,0,1,0,0|2,0,0]=4 15026 B11R1.332 C[C@@H](OC[C@H]1CCO1)C(=O)O c05b5e4d17f100df2347dc332a8fd723 [0,1,0,1,0,0|2,0,0]=4 15027 B11R1.332 C[C@H](CNC1CCC1)C(=O)O 0622479da99a1079202c1601d1455602 [0,1,0,1,0,0|1,0,0]=3 15028 B11R1.332 C[C@H](CNC1COC1)C(=O)O 59d9e0d566e0c3c1ddcd54beaf71e360 [0,1,0,1,0,0|2,0,0]=4 15029 B11R1.332 C[C@H](COC1CCC1)C(=O)O 57b498d049ead93d3e5d4b52e1d05adf [0,1,0,1,0,0|1,0,0]=3 15030 B11R1.332 C[C@H](COC1COC1)C(=O)O dcaa3d1a7c31b49de7db5489f6da69fb [0,1,0,1,0,0|2,0,0]=4 15031 B11R1.332 C[C@H](NCC1CCC1)C(=O)N 79fb60c3c90e53d521ddc696e7cd9708 [0,1,0,1,0,0|2,0,0]=4 15032 B11R1.332 C[C@H](NCC1CCC1)C(=O)O e67dd5ad3e452b3c680db7464aa38999 [0,1,0,1,0,0|1,0,0]=3 15033 B11R1.332 C[C@H](NCC1CCO1)C(=O)O 9e99511513c2e8f198be134593bf76cb [0,1,0,1,0,0|2,0,0]=4 15034 B11R1.332 C[C@H](NCC1COC1)C(=O)O 61d2757ea82fe35714819e6d9efc38aa [0,1,0,1,0,0|2,0,0]=4 15035 B11R1.332 C[C@H](NC[C@@H]1CCO1)C(=O)O 1149684f293cd165fafce6f5f9f062a7 [0,1,0,1,0,0|2,0,0]=4 15036 B11R1.332 C[C@H](NC[C@H]1CCO1)C(=O)O 7d2ebda37421639e2b4b2adc5b99d6bc [0,1,0,1,0,0|2,0,0]=4 15037 B11R1.332 C[C@H](OCC1CCC1)C(=O)N 4e9d1202e9d5241b4200f336a9ccbdf1 [0,1,0,1,0,0|2,0,0]=4 15038 B11R1.332 C[C@H](OCC1CCC1)C(=O)O ade2d3b469bb11b558a486c50a5894d9 [0,1,0,1,0,0|1,0,0]=3 15039 B11R1.332 C[C@H](OCC1CCO1)C(=O)O 82de430a3587739865faf86dfd215b90 [0,1,0,1,0,0|2,0,0]=4 15040 B11R1.332 C[C@H](OCC1COC1)C(=O)O 4880e6fdca97bad48b7878385773c9fa [0,1,0,1,0,0|2,0,0]=4 15041 B11R1.332 C[C@H](OC[C@@H]1CCO1)C(=O)O 2c3ea054c00d2a9ae9db27fe0629a071 [0,1,0,1,0,0|2,0,0]=4 15042 B11R1.332 C[C@H](OC[C@H]1CCO1)C(=O)O 7a671cb9902f1fc03fb4aea7e31eb049 [0,1,0,1,0,0|2,0,0]=4 15043 B11R1.332 NC(=O)C(F)NCC1CCC1 71b8062ea9f343ade91a8affbf5579c7 [0,1,0,1,0,0|2,0,0]=4 15044 B11R1.332 NC(=O)C(F)OCC1CCC1 b7db543ec79c99baa9e0dc047befecef [0,1,0,1,0,0|2,0,0]=4 15045 B11R1.332 O=C(O)C(=O)CNC1CCC1 15e9f84f74fa2d58c32d857f0a082b74 [0,1,0,1,0,0|1,0,1]=4 15046 B11R1.332 O=C(O)C(=O)COC1CCC1 e79d7cbef8ddd23bd05a437421546a48 [0,1,0,1,0,0|1,0,1]=4 15047 B11R1.332 O=C(O)C(F)CNC1CCC1 303d8fd110a02468e72f2bfa38c5dde5 [0,1,0,1,0,0|1,0,0]=3 15048 B11R1.332 O=C(O)C(F)CNC1COC1 6200a2fe1c1019f65820ac50d10800a8 [0,1,0,1,0,0|2,0,0]=4 15049 B11R1.332 O=C(O)C(F)NCC1CCO1 f3e616bf8a1c622f49219f57a7c1a478 [0,1,0,1,0,0|2,0,0]=4 15050 B11R1.332 O=C(O)C(F)NCC1COC1 9359674a934b6230620226ad29b928a2 [0,1,0,1,0,0|2,0,0]=4 15051 B11R1.332 O=C(O)C(F)NC[C@@H]1CCO1 38e3beb09f85e5d06abbb68b7767b086 [0,1,0,1,0,0|2,0,0]=4 15052 B11R1.332 O=C(O)C(F)NC[C@H]1CCO1 6809b6a55ffb47c64ea40e57482c5b13 [0,1,0,1,0,0|2,0,0]=4 15053 B11R1.332 O=C(O)C(O)CNC1CCC1 bce79e5bca821c96252aa1ddfacd85b3 [0,1,0,1,0,0|1,0,0]=3 15054 B11R1.332 O=C(O)C(O)CNC1COC1 9b47154eb455a893fcd1a60787d554a5 [0,1,0,1,0,0|2,0,0]=4 15055 B11R1.332 O=C(O)C(O)NCC1CCC1 cce89c36b3815d246082d361ba771dc5 [0,1,0,1,0,0|1,0,0]=3 15056 B11R1.332 O=C(O)C(O)NCC1CCO1 a0ca7b2b2b0cfc951359207209bc7ed3 [0,1,0,1,0,0|2,0,0]=4 15057 B11R1.332 O=C(O)C(O)NCC1COC1 30da6e9138b42e1ca4d3d1f869f5efc4 [0,1,0,1,0,0|2,0,0]=4 15058 B11R1.332 O=C(O)C(O)NC[C@@H]1CCO1 3a7c38bf5b8c8eb03e87ce4ffad814b3 [0,1,0,1,0,0|2,0,0]=4 15059 B11R1.332 O=C(O)C(O)NC[C@H]1CCO1 c0bbb02732ed50bcdc6841e671914c77 [0,1,0,1,0,0|2,0,0]=4 15060 B11R1.332 O=C(O)[C@@H](O)CNC1CCC1 79fe8e9f2963d0c28c5b585843bce43d [0,1,0,1,0,0|1,0,0]=3 15061 B11R1.332 O=C(O)[C@@H](O)CNC1COC1 066a04ed0e4d64bc7be54aa879a42067 [0,1,0,1,0,0|2,0,0]=4 15062 B11R1.332 O=C(O)[C@H](F)NCC1CCO1 a4dcece5bd7f298870da67d70685fb82 [0,1,0,1,0,0|2,0,0]=4 15063 B11R1.332 O=C(O)[C@H](F)NCC1COC1 fb42fd0dde70d94dea8234489daedbf2 [0,1,0,1,0,0|2,0,0]=4 15064 B11R1.332 O=C(O)[C@H](F)NC[C@@H]1CCO1 fb1609c3cbaa9670ae213633192c5d17 [0,1,0,1,0,0|2,0,0]=4 15065 B11R1.332 O=C(O)[C@H](F)NC[C@H]1CCO1 2a52c806fc7876c7eb9e56e45389a0e8 [0,1,0,1,0,0|2,0,0]=4 15066 B11R1.332 O=C(O)[C@H](O)CNC1CCC1 d81789942a6b5303643b5c85236d7633 [0,1,0,1,0,0|1,0,0]=3 15067 B11R1.332 O=C(O)[C@H](O)CNC1COC1 80d4074cc306180c0791456c9b17d65b [0,1,0,1,0,0|2,0,0]=4 15068 B11R1.333 C=C(CNCC1CC1)C(=O)O 14fe9a3aa22d0a28cbd06146a1df1d4c [0,1,0,1,0,0|1,0,1]=4 15069 B11R1.333 C=C(COCC1CC1)C(=O)O c53f78a8795df3a51af83099703782a7 [0,1,0,1,0,0|1,0,1]=4 15070 B11R1.333 CC(=O)C(C)CCNC1CC1 f9b931daa4b2b79488a044a1b71488ea [0,1,0,1,0,0|2,0,0]=4 15071 B11R1.333 CC(=O)C(C)CCOC1CC1 ce0c30f4cfce48d1c1f847b273051bbd [0,1,0,1,0,0|2,0,0]=4 15072 B11R1.333 CC(=O)C(C)COCC1CC1 5bf1b47d47176b74ba3c04e90d8a4004 [0,1,0,1,0,0|2,0,0]=4 15073 B11R1.333 CC(=O)C(C)NCCC1CC1 056442bb7411b5d4255fffef93b5910d [0,1,0,1,0,0|2,0,0]=4 15074 B11R1.333 CC(=O)C(C)OCCC1CC1 d9f031de5bd247f903b85e8c9272fb3f [0,1,0,1,0,0|2,0,0]=4 15075 B11R1.333 CC(CNCC1CC1)C(=O)O d681142e366e30ec9fe7d4f7e6b04642 [0,1,0,1,0,0|1,0,0]=3 15076 B11R1.333 CC(COCC1CC1)C(=O)O 5c9e855e8e8b3cbac4f74ee41cbbf453 [0,1,0,1,0,0|1,0,0]=3 15077 B11R1.333 CC(NCCC1CC1)C(=O)N 5422933f707e097bbee0d55851ab5301 [0,1,0,1,0,0|2,0,0]=4 15078 B11R1.333 CC(NCCC1CC1)C(=O)O 12da03282728c519781565c4331049c6 [0,1,0,1,0,0|1,0,0]=3 15079 B11R1.333 CC(NCCN1CC1)C(=O)O 4db1fbe9cdc3b08c8d19c0d04117cc25 [0,1,0,1,0,0|2,0,0]=4 15080 B11R1.333 CC(OCCC1CC1)C(=O)N a76c47b6ecff9cd07364716f09afd8c9 [0,1,0,1,0,0|2,0,0]=4 15081 B11R1.333 CC(OCCC1CC1)C(=O)O 52c2e6990bc0b5338dee1b1b69b345a9 [0,1,0,1,0,0|1,0,0]=3 15082 B11R1.333 C[C@@H](CNCC1CC1)C(=O)O 4305314843befc813df7d8f719651350 [0,1,0,1,0,0|1,0,0]=3 15083 B11R1.333 C[C@@H](COCC1CC1)C(=O)O 60274e2b7ab4e8c857bc36597fe50888 [0,1,0,1,0,0|1,0,0]=3 15084 B11R1.333 C[C@@H](NCCC1CC1)C(=O)N 5479a86eec53eb5b122a55bd47eac7fc [0,1,0,1,0,0|2,0,0]=4 15085 B11R1.333 C[C@@H](NCCC1CC1)C(=O)O ac4f0b7c9758246c1f4cd075670c8ef4 [0,1,0,1,0,0|1,0,0]=3 15086 B11R1.333 C[C@@H](NCCN1CC1)C(=O)O 495055557bd9b8738d951fc09fa02b24 [0,1,0,1,0,0|2,0,0]=4 15087 B11R1.333 C[C@@H](OCCC1CC1)C(=O)N 5a6873c5fd3c522d1378f9bdffc14312 [0,1,0,1,0,0|2,0,0]=4 15088 B11R1.333 C[C@@H](OCCC1CC1)C(=O)O a5c5dffa01382c9ba150925608aa7940 [0,1,0,1,0,0|1,0,0]=3 15089 B11R1.333 C[C@H](CNCC1CC1)C(=O)O 1a14d6680238cdf68fde8e40976d1172 [0,1,0,1,0,0|1,0,0]=3 15090 B11R1.333 C[C@H](COCC1CC1)C(=O)O 09a4888bbf72341f1bc9d3fd82f55e19 [0,1,0,1,0,0|1,0,0]=3 15091 B11R1.333 C[C@H](NCCC1CC1)C(=O)N 9e85e83bfbc5dc63e18255b8783619f0 [0,1,0,1,0,0|2,0,0]=4 15092 B11R1.333 C[C@H](NCCC1CC1)C(=O)O a4e0316dfdfa2a22587f52c76f81aa9b [0,1,0,1,0,0|1,0,0]=3 15093 B11R1.333 C[C@H](NCCN1CC1)C(=O)O ef84a409dd008b7daa40b8b7d9c183ec [0,1,0,1,0,0|2,0,0]=4 15094 B11R1.333 C[C@H](OCCC1CC1)C(=O)N 9fdcf4ae5aeebdc26ba48e589fd8ee80 [0,1,0,1,0,0|2,0,0]=4 15095 B11R1.333 C[C@H](OCCC1CC1)C(=O)O b166bab51dcc84303125f1e589cf607b [0,1,0,1,0,0|1,0,0]=3 15096 B11R1.333 NC(=O)C(F)NCCC1CC1 46a612acd5a9e59186bdc9b4fbb1c04f [0,1,0,1,0,0|2,0,0]=4 15097 B11R1.333 NC(=O)C(F)OCCC1CC1 45a4896417e1eba44eb644736b6f794c [0,1,0,1,0,0|2,0,0]=4 15098 B11R1.333 O=C(O)C(=O)CNCC1CC1 59a4cc8750b75904234f42c16fca6460 [0,1,0,1,0,0|1,0,1]=4 15099 B11R1.333 O=C(O)C(=O)COCC1CC1 ae51bf24d332f5975e1b7f6e15dd8531 [0,1,0,1,0,0|1,0,1]=4 15100 B11R1.333 O=C(O)C(F)CCNC1CC1 850c7a8e0350952166fb0e7e0704db44 [0,1,0,1,0,0|1,0,0]=3 15101 B11R1.333 O=C(O)C(F)CNCC1CC1 177d04d056331cb1846214dd194b333c [0,1,0,1,0,0|1,0,0]=3 15102 B11R1.333 O=C(O)C(O)CCNC1CC1 20f2089f69cf30915737ddfedeb1ca6c [0,1,0,1,0,0|1,0,0]=3 15103 B11R1.333 O=C(O)C(O)CNCC1CC1 9db8138ae9dccfc5286aae40ee6f0d34 [0,1,0,1,0,0|1,0,0]=3 15104 B11R1.333 O=C(O)C(O)NCCC1CC1 6ff824c1d8550a7200d7b4dd5dfa178d [0,1,0,1,0,0|1,0,0]=3 15105 B11R1.333 O=C(O)[C@@H](O)CCNC1CC1 b724f8e09813ae91e29e26be2dc32b3f [0,1,0,1,0,0|1,0,0]=3 15106 B11R1.333 O=C(O)[C@@H](O)CNCC1CC1 d723f934b650f48ad75879362be6ebe6 [0,1,0,1,0,0|1,0,0]=3 15107 B11R1.333 O=C(O)[C@H](O)CNCC1CC1 a7384c3807623d8512013cc6b9c6c534 [0,1,0,1,0,0|1,0,0]=3 15108 B11R1.421 CC1(CCCN1CF)C(=O)O ae63ac4d34589c4dc9106f235cb9a346 [0,1,0,1,0,0|2,0,0]=4 15109 B11R1.421 CC1(CCCN1CO)C(=O)O 385a7db6fd8dbf2487149bdb9e5f944c [0,1,0,1,0,0|2,0,0]=4 15110 B11R1.421 CCN1CCCC1(C)C(=O)O 4322ebc4e2588bece5fee6b8fcf0245c [0,1,0,1,0,0|1,0,0]=3 15111 B11R1.421 CCN1CCC[C@@]1(C)C(=O)N c755e15d7cfa87c653b8bfbc713caeca [0,1,0,1,0,0|2,0,0]=4 15112 B11R1.421 CCN1CCC[C@@]1(C)C(=O)O 41aa10bfb2e5973c365a924fa121a4db [0,1,0,1,0,0|1,0,0]=3 15113 B11R1.421 CCN1CCC[C@]1(C)C(=O)O b342af4b52817276153fc9dc54709be7 [0,1,0,1,0,0|1,0,0]=3 15114 B11R1.421 CCN1CCSC1(C)C(=O)O d95cacf88b4764e2b55b99c1e28b9975 [0,1,0,1,0,0|2,0,0]=4 15115 B11R1.421 C[C@@]1(CCCN1CF)C(=O)O d45da79b73808048cf02341577df054a [0,1,0,1,0,0|2,0,0]=4 15116 B11R1.421 C[C@@]1(CCCN1CO)C(=O)O bbdb9847a475bbd1dd20c0e0dca54620 [0,1,0,1,0,0|2,0,0]=4 15117 B11R1.421 C[C@]1(CCCN1CF)C(=O)O 9ebe550e988d1d5e96db7a7479d13ef8 [0,1,0,1,0,0|2,0,0]=4 15118 B11R1.421 C[C@]1(CCCN1CO)C(=O)O debd9ec1abf19e8ab5d79c86a041d17b [0,1,0,1,0,0|2,0,0]=4 15119 B11R1.468 CO[C@H]1C[C@H]1NC(C)C(=O)O 3bf6dd8133a756df0056a71a5e232367 [0,1,0,1,0,0|2,0,0]=4 15120 B11R1.468 CO[C@H]1C[C@H]1NC(F)C(=O)O 4d6170c2d54b21cfd9ffe3b0adc0bb68 [0,1,0,1,0,0|2,0,0]=4 15121 B11R1.468 CO[C@H]1C[C@H]1N[C@@H](C)C(=O)O 6f3eaf24ee32c163f72447aa5f39ce16 [0,1,0,1,0,0|2,0,0]=4 15122 B11R1.468 CO[C@H]1C[C@H]1N[C@@H](F)C(=O)O a1bae4f2cfcce30a9547b014126a9356 [0,1,0,1,0,0|2,0,0]=4 15123 B11R1.468 CO[C@H]1C[C@H]1N[C@H](C)C(=O)O 9105223ebdf1360d921177a1f61479ff [0,1,0,1,0,0|2,0,0]=4 15124 B11R1.497 CC(=O)N1CCCCC(C1)O 4cd02de1ff6ee31ef2344ef07a2d1192 [0,1,0,1,0,0|2,0,0]=4 15125 B11R1.497 CC(=O)N1CCCC[C@H](C1)O ce4462bec135013b9dda13203379a851 [0,1,0,1,0,0|2,0,0]=4 15126 B11R1.844 CC1(CC1NCCBr)C(=O)O 86cd5cb0238a75895e8c6aee47d86740 [0,1,0,1,0,0|2,0,0]=4 15127 B11R1.844 CC1(CC1NCCF)C(=O)O 70f17802c9444477ac65abe8c8f1bdd3 [0,1,0,1,0,0|2,0,0]=4 15128 B11R1.844 CC1(CC1NCCI)C(=O)O cad7c056b579eb0d054a8ad7213b6ccf [0,1,0,1,0,0|2,0,0]=4 15129 B11R1.844 CC1(CC1NCCO)C(=O)O 3f275be484ecfbb9008883400b99fb9d [0,1,0,1,0,0|2,0,0]=4 15130 B11R1.844 CC1(CC1NCCS)C(=O)O ea29455540830810671a25b8f44715a8 [0,1,0,1,0,0|2,0,0]=4 15131 B11R1.844 CC1(CC1OCCS)C(=O)O 8500e26bc6f63a61a174bb7d81cda876 [0,1,0,1,0,0|2,0,0]=4 15132 B11R1.844 CCCNC1CC1(C)C(=O)O e68e229e974b95545533b5df72a13190 [0,1,0,1,0,0|1,0,0]=3 15133 B11R1.844 CCCOC1CC1(C)C(=O)O eebd4b8d807204b58e9609c30e4e1d96 [0,1,0,1,0,0|1,0,0]=3 15134 B11R1.844 COCOC1CC1(C)C(=O)O 22c70a69ac87b74675b091cd04342668 [0,1,0,1,0,0|2,0,0]=4 15135 B11R1.49 CC1CC(N(C1)CF)C(=O)O ed807f4d5e2c10e9511e12de15427deb [0,1,0,1,0,0|2,0,0]=4 15136 B11R1.49 CC1CC(N(C1)CO)C(=O)O c08087eec317cd391972a69628f3e822 [0,1,0,1,0,0|2,0,0]=4 15137 B11R1.49 CCN1CC(=O)C[C@@H]1C(=O)O 595159ac670d3ac4fb6e555c3d0c5d6e [0,1,0,1,0,0|1,0,1]=4 15138 B11R1.49 CCN1CC(=O)C[C@H]1C(=O)O e93a971333f8c0f03e40ad63c74beec8 [0,1,0,1,0,0|1,0,1]=4 15139 B11R1.49 CCN1CC(CC1C(=O)N)O f47f15db4001af90ed3836abc4cde5d8 [0,1,0,1,0,0|2,0,0]=4 15140 B11R1.49 CCN1CC(CC1C(=O)O)C bb01de55fbeb56537612f7a8bbc2cd94 [0,1,0,1,0,0|1,0,0]=3 15141 B11R1.49 CCN1CC(CC1C(=O)O)F f30e2ba42a43ffd3e580c8aa4989fb9f [0,1,0,1,0,0|1,0,0]=3 15142 B11R1.49 CCN1CC(CC1C(=O)O)O 019c8f069c80e5eb4a5a23fd0e7fc495 [0,1,0,1,0,0|1,0,0]=3 15143 B11R1.49 CCN1C[C@@H](C[C@@H]1C(=O)O)F 087e745286d29729b755eb808a075d7e [0,1,0,1,0,0|1,0,0]=3 15144 B11R1.49 CCN1C[C@@H](C[C@@H]1C(=O)O)O f2af1e03a8d3a059496973ee668b87a6 [0,1,0,1,0,0|1,0,0]=3 15145 B11R1.49 CCN1C[C@@H](C[C@H]1C(=O)N)O e80ed0aea619dfb3bf9b1169555b8bab [0,1,0,1,0,0|2,0,0]=4 15146 B11R1.49 CCN1C[C@@H](C[C@H]1C(=O)O)F 5b20be64730953ac1b4ab7965a4f7425 [0,1,0,1,0,0|1,0,0]=3 15147 B11R1.49 CCN1C[C@@H](C[C@H]1C(=O)O)O 7e4cb7bc191462e3dbd9f5ad0511f76c [0,1,0,1,0,0|1,0,0]=3 15148 B11R1.49 CCN1C[C@H](C[C@@H]1C(=O)O)F 66354419b7a0c5d028f5abe161a04c8f [0,1,0,1,0,0|1,0,0]=3 15149 B11R1.49 CCN1C[C@H](C[C@@H]1C(=O)O)O c5a47a6ff3f43fab4dddd1318646fe82 [0,1,0,1,0,0|1,0,0]=3 15150 B11R1.49 CCN1C[C@H](C[C@H]1C(=O)N)F 8b21878d0c34c09902135993246587f5 [0,1,0,1,0,0|2,0,0]=4 15151 B11R1.49 CCN1C[C@H](C[C@H]1C(=O)O)C b538ec52340da5598fc048f616de605d [0,1,0,1,0,0|1,0,0]=3 15152 B11R1.49 CCN1C[C@H](C[C@H]1C(=O)O)F 61fd5632aa5ab884af2e5cecea6e949e [0,1,0,1,0,0|1,0,0]=3 15153 B11R1.49 CCN1C[C@H](C[C@H]1C(=O)O)O e999d6da7568d74f9ff9770757e40fa4 [0,1,0,1,0,0|1,0,0]=3 15154 B11R1.49 CCN1C[C@H](C[C@H]1C(=O)O)S ebf3dd56d7c23a53361af035214b459d [0,1,0,1,0,0|1,0,0]=3 15155 B11R1.49 C[C@H]1C[C@H](N(C1)CF)C(=O)O 664778f63fd5d9111e187cfe95ee7aa6 [0,1,0,1,0,0|2,0,0]=4 15156 B11R1.49 C[C@H]1C[C@H](N(C1)CO)C(=O)O 6b154a4f914ec3b7dd98e9f25e782b88 [0,1,0,1,0,0|2,0,0]=4 15157 B11R1.49 O=C(O)C1CC(CN1CF)F ef5144dcb77728cbe874600e68f9b374 [0,1,0,1,0,0|2,0,0]=4 15158 B11R1.49 O=C(O)C1CC(CN1CF)O 10b84389add531b8ac4b08b485f3caa2 [0,1,0,1,0,0|2,0,0]=4 15159 B11R1.49 O=C(O)C1CC(CN1CO)F 34fb44c46c144f5805263e4f37b5725d [0,1,0,1,0,0|2,0,0]=4 15160 B11R1.49 O=C(O)C1CC(CN1CO)O fc3e62d02eb0f75a4bbdaab566efc04b [0,1,0,1,0,0|2,0,0]=4 15161 B11R1.49 O=C(O)[C@@H]1C[C@@H](CN1CF)F e94904e9bc69cad3e970592559fb1290 [0,1,0,1,0,0|2,0,0]=4 15162 B11R1.49 O=C(O)[C@@H]1C[C@@H](CN1CF)O 9d44cbef843dc52a595a5aa169adad09 [0,1,0,1,0,0|2,0,0]=4 15163 B11R1.49 O=C(O)[C@@H]1C[C@@H](CN1CF)S 89c24c48a3a454640f12025145ea4d61 [0,1,0,1,0,0|2,0,0]=4 15164 B11R1.49 O=C(O)[C@@H]1C[C@@H](CN1CO)F d3e9bfee802a4d0916d26ded29ee4d44 [0,1,0,1,0,0|2,0,0]=4 15165 B11R1.49 O=C(O)[C@@H]1C[C@@H](CN1CO)O 3cc068e2131fa1a6c0519579ab5fd76f [0,1,0,1,0,0|2,0,0]=4 15166 B11R1.49 O=C(O)[C@@H]1C[C@@H](CN1CO)S edcabcbf4f72ba7a9e7becc5277b74fa [0,1,0,1,0,0|2,0,0]=4 15167 B11R1.49 O=C(O)[C@@H]1C[C@H](CN1CF)F a443e67b0fdb7d9ec668221c73972aed [0,1,0,1,0,0|2,0,0]=4 15168 B11R1.49 O=C(O)[C@@H]1C[C@H](CN1CF)O 7ad8ddf5a5a1435bde27e219577a0853 [0,1,0,1,0,0|2,0,0]=4 15169 B11R1.49 O=C(O)[C@@H]1C[C@H](CN1CO)F 74d37f22444df9757e18c783f057db35 [0,1,0,1,0,0|2,0,0]=4 15170 B11R1.49 O=C(O)[C@@H]1C[C@H](CN1CO)O 7df899de1e4c485e7191a741ec99cdef [0,1,0,1,0,0|2,0,0]=4 15171 B11R1.49 O=C(O)[C@H]1C[C@@H](CN1CF)F 96573a92b48165d50bd783a9064a40be [0,1,0,1,0,0|2,0,0]=4 15172 B11R1.49 O=C(O)[C@H]1C[C@@H](CN1CF)O 872fef9e851458e8918f2a2ab5df65d5 [0,1,0,1,0,0|2,0,0]=4 15173 B11R1.49 O=C(O)[C@H]1C[C@@H](CN1CO)F c398826ead4d278b2caf67191d0e2689 [0,1,0,1,0,0|2,0,0]=4 15174 B11R1.49 O=C(O)[C@H]1C[C@@H](CN1CO)O 344d8d96f09f2ca1b15df1fcafa71544 [0,1,0,1,0,0|2,0,0]=4 15175 B11R1.49 O=C(O)[C@H]1C[C@H](CN1CF)F 88c27d1d83dd75ec49ef1358d94678ca [0,1,0,1,0,0|2,0,0]=4 15176 B11R1.49 O=C(O)[C@H]1C[C@H](CN1CF)O 837926af819e7ff37c4af3165713c2df [0,1,0,1,0,0|2,0,0]=4 15177 B11R1.49 O=C(O)[C@H]1C[C@H](CN1CO)F 793e0c5a80d68b7ac6b37664896af6b2 [0,1,0,1,0,0|2,0,0]=4 15178 B11R1.49 O=C(O)[C@H]1C[C@H](CN1CO)O b00898cdb8e9ed5fed9b8076443a7ee5 [0,1,0,1,0,0|2,0,0]=4 15179 B11R1.167 CC(=O)N1CC(CCC1C)O 7813aca39dc67c9ae3104e81f841267b [0,1,0,1,0,0|2,0,0]=4 15180 B11R1.167 CC(=O)N1C[C@@H](CC[C@H]1C)O d4b77d9b60cc63b76d1e2da8d3eedc2a [0,1,0,1,0,0|2,0,0]=4 15181 B11R1.287 CCCOC(C)C1CC(=O)C1 c351b8ccb1348d632e9de14957b38db2 [0,1,0,1,0,0|2,0,0]=4 15182 B11R1.346 CC(=O)CCN(C)C1CCC1 d3d0fbbda87a196a8b0a8761f564dffb [0,1,0,1,0,0|2,0,0]=4 15183 B11R1.346 CC(CCC(=O)O)N1CCC1 a39da6a40d2393303848d30cb9807414 [0,1,0,1,0,0|1,0,0]=3 15184 B11R1.346 CC(NCC(=O)O)C1COC1 4f6d376575bb86697fa512a622694279 [0,1,0,1,0,0|2,0,0]=4 15185 B11R1.346 CC(OCC(=O)N)C1CCC1 1448e32c1cf479f8b1d13200c77c008e [0,1,0,1,0,0|2,0,0]=4 15186 B11R1.346 CC(OCC(=O)O)C1CCC1 066583baf102524e80d3fb738c8cd291 [0,1,0,1,0,0|1,0,0]=3 15187 B11R1.346 CC(OCC(=O)O)C1COC1 5f1e44eddaf9d925ba504959c238c7a3 [0,1,0,1,0,0|2,0,0]=4 15188 B11R1.346 CN(CCC(=O)N)C1CCC1 2c7886ebe34adf650001089d68be0590 [0,1,0,1,0,0|2,0,0]=4 15189 B11R1.346 CN(CCC(=O)O)C1CCC1 6ef6be795332f04c88b4384e7240321d [0,1,0,1,0,0|1,0,0]=3 15190 B11R1.346 CN(CCC(=O)O)C1COC1 2aacdef06b2aca9776b5b46d00975627 [0,1,0,1,0,0|2,0,0]=4 15191 B11R1.346 C[C@@H](NCC(=O)O)C1COC1 cdc8ba0e1f3e467f3bda3884f8121ac5 [0,1,0,1,0,0|2,0,0]=4 15192 B11R1.346 C[C@@H](OCC(=O)O)C1COC1 aa95b49f595689b7b675cae13aca7f18 [0,1,0,1,0,0|2,0,0]=4 15193 B11R1.346 C[C@H](NCC(=O)O)C1COC1 573a919372de2c478bd4a389d5ce5b42 [0,1,0,1,0,0|2,0,0]=4 15194 B11R1.346 C[C@H](OCC(=O)N)C1CCC1 592a1f2763f2b1875ec55779e1d63da6 [0,1,0,1,0,0|2,0,0]=4 15195 B11R1.346 C[C@H](OCC(=O)O)C1CCC1 371cce56e514d4f447c1b1d51b984e41 [0,1,0,1,0,0|1,0,0]=3 15196 B11R1.346 C[C@H](OCC(=O)O)C1COC1 4a1b86aa8aa99455506ba0cb5ec9990d [0,1,0,1,0,0|2,0,0]=4 15197 B11R1.348 CC(=O)CCN(C)CC1CC1 cffa0b25faed1114d48c260aefeed310 [0,1,0,1,0,0|2,0,0]=4 15198 B11R1.348 CC(CC1CC1)OCC(=O)N c377bc0c5739693658d38f9366a61880 [0,1,0,1,0,0|2,0,0]=4 15199 B11R1.348 CC(CC1CC1)OCC(=O)O 56344f8474d1c6d7aeaf5b9433db0195 [0,1,0,1,0,0|1,0,0]=3 15200 B11R1.348 CC(CCC(=O)O)NC1CC1 ff51874694037094f196227402af33f8 [0,1,0,1,0,0|1,0,0]=3 15201 B11R1.348 CC(CCC(=O)O)OC1CC1 5f6329becacf0035549eb9cf20483303 [0,1,0,1,0,0|1,0,0]=3 15202 B11R1.348 CN(CCC(=O)N)CC1CC1 bc96dbab8337e0494b7531d9c9148130 [0,1,0,1,0,0|2,0,0]=4 15203 B11R1.348 CN(CCC(=O)O)CC1CC1 66695affc9fd23d8bfab5a834a7d551e [0,1,0,1,0,0|1,0,0]=3 15204 B11R1.495 CC1CCC(N1CC(=O)N)C 32ebe3f11f3050d2e806e6b73f8cecb4 [0,1,0,1,0,0|2,0,0]=4 15205 B11R1.495 CC1CCC(N1CC(=O)O)C 82bc7be0c89ef26a48c8a8411ffd3a1d [0,1,0,1,0,0|1,0,0]=3 15206 B11R1.495 C[C@@H]1CC[C@@H](N1CC(=O)N)C edd1457aa065746c067a54b560d6e84c [0,1,0,1,0,0|2,0,0]=4 15207 B11R1.495 C[C@@H]1CC[C@@H](N1CC(=O)O)C 5676d19891f1f809a1f2098b1852797f [0,1,0,1,0,0|1,0,0]=3 15208 B11R1.495 C[C@@H]1CC[C@H](N1CC(=O)N)C fac4f2ade054ba223e5179f1bbe71046 [0,1,0,1,0,0|2,0,0]=4 15209 B11R1.495 C[C@@H]1CC[C@H](N1CC(=O)O)C 43b394afcf902173c0fe5924a5549fea [0,1,0,1,0,0|1,0,0]=3 15210 B11R1.495 C[C@H]1CC[C@@H](N1CC(=O)N)C e773f5175df50cbc1192a3f66a87622c [0,1,0,1,0,0|2,0,0]=4 15211 B11R1.495 C[C@H]1CC[C@@H](N1CC(=O)O)C 7a069bfb7b0f52710893d2913f049174 [0,1,0,1,0,0|1,0,0]=3 15212 B11R1.596 CCCN1[C@@H](C[C@H]1C(=O)O)C e9bf2cd816048fe2d577d41a5c1316c8 [0,1,0,1,0,0|1,0,0]=3 15213 B11R1.596 CCCN1[C@H](C[C@H]1C(=O)O)C fa5846fd21d11da0f874e40ce9c7394d [0,1,0,1,0,0|1,0,0]=3 15214 B11R1.596 COCN1[C@@H](C[C@H]1C(=O)O)C 30f021203d2d51dc1615f87ccab23291 [0,1,0,1,0,0|2,0,0]=4 15215 B11R1.596 COCN1[C@H](C[C@H]1C(=O)O)C 303b410731ff2672a4f4dc5117474575 [0,1,0,1,0,0|2,0,0]=4 15216 B11R1.596 CSCN1[C@@H](C[C@H]1C(=O)O)C e967d89135b59b618868ac5d5fab19ba [0,1,0,1,0,0|2,0,0]=4 15217 B11R1.596 CSCN1[C@H](C[C@H]1C(=O)O)C d78072030d33eb0d5c1ab6f824bb9b99 [0,1,0,1,0,0|2,0,0]=4 15218 B11R1.596 C[C@@H]1C[C@H](N1CCF)C(=O)O 95d99db88ae23a608a6d6e5363e48f2d [0,1,0,1,0,0|2,0,0]=4 15219 B11R1.596 C[C@@H]1C[C@H](N1CCO)C(=O)O 9d574833a29b02074d4c6bf80e030034 [0,1,0,1,0,0|2,0,0]=4 15220 B11R1.596 C[C@@H]1C[C@H](N1CCS)C(=O)O 50e4e270d6a4c9150352fec56ac7d217 [0,1,0,1,0,0|2,0,0]=4 15221 B11R1.596 C[C@H]1C[C@H](N1CCF)C(=O)O 9862afad869e9c675c57b403593b2423 [0,1,0,1,0,0|2,0,0]=4 15222 B11R1.596 C[C@H]1C[C@H](N1CCO)C(=O)O 4de8a7a886f7e87260f0a975790724ba [0,1,0,1,0,0|2,0,0]=4 15223 B11R1.596 C[C@H]1C[C@H](N1CCS)C(=O)O 2485d48d8ab075a6a830e505d9d2e9ec [0,1,0,1,0,0|2,0,0]=4 15224 B11R1.713 CC(=O)NCC1(CCCC1)C 49068df105a1e0093927b3a155969870 [0,1,0,1,0,0|2,0,0]=4 15225 B11R1.713 CC(=O)NCC1(CCCC1)F d70d368862fa97a0d78df4be5956ed5e [0,1,0,1,0,0|2,0,0]=4 15226 B11R1.713 CC(=O)NCC1(CCCC1)O a55896964c7a3e433580ab1c03e4096c [0,1,0,1,0,0|2,0,0]=4 15227 B11R1.713 CC1(CCCC1)NCC(=O)N 188a976641cb74fa33aa33f47b857a55 [0,1,0,1,0,0|2,0,0]=4 15228 B11R1.713 CC1(CCCC1)NCC(=O)O 3d28367f00bcd012127894952d69c332 [0,1,0,1,0,0|1,0,0]=3 15229 B11R1.713 CC1(CCOC1)NCC(=O)O dd7f7fb7a6381790aa5df5e1eb3bf209 [0,1,0,1,0,0|2,0,0]=4 15230 B11R1.914 CCNCC1(CCC(=O)N1)C 85b0298ae72af079ef08db8bb31ac9e0 [0,1,0,1,0,0|2,0,0]=4 15231 B11R1.914 CCOCC1(CCC(=O)N1)C 0eab6de5a033de74da0fd9d37ebf2770 [0,1,0,1,0,0|2,0,0]=4 15232 B11R1.177 CC(=O)N1CCCCC1(C)C 4bb7ecd51e7e872201bf79d16eb886ff [0,1,0,1,0,0|2,0,0]=4 15233 B11R1.178 CC(=O)N1CCCC1C(C)C 4ce209838c647d7d4d498e814ecd2467 [0,1,0,1,0,0|2,0,0]=4 15234 B11R1.178 CC(=O)N1CCCC1C(C)O 9f8e94851b1373bc70952c43a1f4d7dd [0,1,0,1,0,0|2,0,0]=4 15235 B11R1.178 CC(=O)N1CCC[C@@H]1C(C)O b6a441c711cebecc18681a5553488a28 [0,1,0,1,0,0|2,0,0]=4 15236 B11R1.178 CC(=O)N1CCC[C@H]1C(C)C 5225fb80429c973d33f65f26e7a41510 [0,1,0,1,0,0|2,0,0]=4 15237 B11R1.178 CC(=O)N1CCC[C@H]1[C@H](C)O d5e83cec14aa1ac18979f6a5e58e48e1 [0,1,0,1,0,0|2,0,0]=4 15238 B11R1.178 CC(C)N1CCCC1C(=O)N da5c893cbf5ec65ed45873c80ecaf0eb [0,1,0,1,0,0|2,0,0]=4 15239 B11R1.178 CC(C)N1CCCC1C(=O)O dca2facd5d723d340de769a76483186c [0,1,0,1,0,0|1,0,0]=3 15240 B11R1.178 CC(C)N1CCC[C@@H]1C(=O)N b85134dc2aa03e027d6c78f76c18c85a [0,1,0,1,0,0|2,0,0]=4 15241 B11R1.178 CC(C)N1CCC[C@@H]1C(=O)O 5f937897216410dc2051de69b28f3c79 [0,1,0,1,0,0|1,0,0]=3 15242 B11R1.178 CC(C)N1CCC[C@H]1C(=O)N 80e9bf92652771e43f1888ed8bad07e6 [0,1,0,1,0,0|2,0,0]=4 15243 B11R1.178 CC(C)N1CCC[C@H]1C(=O)O 481938a3ddc2dbb397617125e3724a6f [0,1,0,1,0,0|1,0,0]=3 15244 B11R1.178 CC(C)N1CCSC1C(=O)O c9b58fbbfcb11ebdd6af95f22d6de4d4 [0,1,0,1,0,0|2,0,0]=4 15245 B11R1.234 CC(=O)NC1CCCC1(C)C 488c8c4aa656f613bcfbfb94fac6d1ff [0,1,0,1,0,0|2,0,0]=4 15246 B11R1.234 CC(=O)NC1CCCC1(C)O 50eba4a2a50b10ff405e1bfc79290142 [0,1,0,1,0,0|2,0,0]=4 15247 B11R1.234 CC(=O)N[C@@H]1CCC[C@@]1(C)O a4c092125a8d95704297a3706fd2a41b [0,1,0,1,0,0|2,0,0]=4 15248 B11R1.234 CC(=O)N[C@H]1CCC[C@]1(C)O a48953122923c9d75a9ad10e7cea04d4 [0,1,0,1,0,0|2,0,0]=4 15249 B11R1.234 CC1(CCCN1CC(=O)N)C 5c7ceef8acaf0baaa8cec6c043cb0eb5 [0,1,0,1,0,0|2,0,0]=4 15250 B11R1.234 CC1(CCCN1CC(=O)O)C 2223b1f7c6cd4011d8061d50699b946c [0,1,0,1,0,0|1,0,0]=3 15251 B11R1.234 CC1(COCN1CC(=O)O)C b9575f9e3fc9c879153179dd1c246351 [0,1,0,1,0,0|2,0,0]=4 15252 B11R1.234 CC1(OCCN1CC(=O)O)C 259ed4b49b79d20fc782733d28e54ff6 [0,1,0,1,0,0|2,0,0]=4 15253 B11R1.234 CC1(SCCN1CC(=O)O)C 6f53eaf695d0754f3ddc76d5f3f8bba5 [0,1,0,1,0,0|2,0,0]=4 15254 B11R1.708 C=C(C)CN1CCC1C(=O)O 034f9f26068f5b889249a99b3e89f257 [0,1,0,1,0,0|1,0,1]=4 15255 B11R1.708 C=C(C)CN1CC[C@@H]1C(=O)O 1c3c7193a6da58446167cc0709e30311 [0,1,0,1,0,0|1,0,1]=4 15256 B11R1.708 C=C(C)CN1CC[C@H]1C(=O)O 72bd310be37d12e2333244dbcf442eaa [0,1,0,1,0,0|1,0,1]=4 15257 B11R1.708 CC(C)CN1CCC1C(=O)N ac3b2c6a645f3fbb1e12c86a3b09721b [0,1,0,1,0,0|2,0,0]=4 15258 B11R1.708 CC(C)CN1CCC1C(=O)O d5e2c3252568835bf43d6a301602f547 [0,1,0,1,0,0|1,0,0]=3 15259 B11R1.708 CC(C)CN1CC[C@@H]1C(=O)N 502fa12390f274ece32b7f4a06488780 [0,1,0,1,0,0|2,0,0]=4 15260 B11R1.708 CC(C)CN1CC[C@@H]1C(=O)O 88591e1bfac52a7777cf393fc6f380b6 [0,1,0,1,0,0|1,0,0]=3 15261 B11R1.708 CC(C)CN1CC[C@H]1C(=O)N 73ad51ce19627ce9d399bd11826f7459 [0,1,0,1,0,0|2,0,0]=4 15262 B11R1.708 CC(C)CN1CC[C@H]1C(=O)O 5f33c4cf90d1ceefe1c49da96020264d [0,1,0,1,0,0|1,0,0]=3 15263 B11R1.708 CC(C)N1CCC1CC(=O)O 2b5d578f6d9daa8f21c7050d9cc66b12 [0,1,0,1,0,0|1,0,0]=3 15264 B11R1.708 CC(C)N[C@H]1CC[C@H]1C(=O)O 5c111ee86889d3a2d52cf77af5d43d0d [0,1,0,1,0,0|1,0,0]=3 15265 B11R1.708 CC(C)OC1CCC1C(=O)O 8381378c72cffaac4eea9fff69c2c495 [0,1,0,1,0,0|1,0,0]=3 15266 B11R1.708 CC(C)O[C@H]1CC[C@@H]1C(=O)O a8ac8f6126cc6f141ce3bc01e96ee5b6 [0,1,0,1,0,0|1,0,0]=3 15267 B11R1.708 CC(O)CN1CCC1C(=O)N 034a7ee1db06d12cdd4fdd951eeb68ba [0,1,0,1,0,0|2,0,0]=4 15268 B11R1.708 CC(O)CN1CCC1C(=O)O 440a21bcd334d5dec0d76df35166c55e [0,1,0,1,0,0|1,0,0]=3 15269 B11R1.708 CC(O)CN1CC[C@@H]1C(=O)N 91c629a5d0c1ae10f30021b69e72166d [0,1,0,1,0,0|2,0,0]=4 15270 B11R1.708 CC(O)CN1CC[C@@H]1C(=O)O 7339fc3d45fb23adf5e8e2ce87c81631 [0,1,0,1,0,0|1,0,0]=3 15271 B11R1.708 CC(O)CN1CC[C@H]1C(=O)N c906958af573a1fb929e5f00d70a9d94 [0,1,0,1,0,0|2,0,0]=4 15272 B11R1.708 CC(O)CN1CC[C@H]1C(=O)O fc9191891d5b7ebfd044c80b81d33614 [0,1,0,1,0,0|1,0,0]=3 15273 B11R1.708 CN(C)CN1CCC1C(=O)O 6e189379ca87248a5a149c459bca4efb [0,1,0,1,0,0|2,0,0]=4 15274 B11R1.708 CN(C)CN1CC[C@@H]1C(=O)O 1145c1b4d70a8e76c264fbcd2b283ddf [0,1,0,1,0,0|2,0,0]=4 15275 B11R1.708 CN(C)CN1CC[C@H]1C(=O)O 35bd26f5ff9700b2974b505db5114767 [0,1,0,1,0,0|2,0,0]=4 15276 B11R1.708 C[C@@H](O)CN1CCC1C(=O)N 350ddc536949173858ab45bf6ab78b4f [0,1,0,1,0,0|2,0,0]=4 15277 B11R1.708 C[C@@H](O)CN1CCC1C(=O)O c7b03113355e4c0c3c6dfead6229dafb [0,1,0,1,0,0|1,0,0]=3 15278 B11R1.708 C[C@@H](O)CN1CC[C@@H]1C(=O)N e81085f00bf5c35b058f8fbd93c7ed5f [0,1,0,1,0,0|2,0,0]=4 15279 B11R1.708 C[C@@H](O)CN1CC[C@@H]1C(=O)O 38957c60fb6057da48c5f6106505f228 [0,1,0,1,0,0|1,0,0]=3 15280 B11R1.708 C[C@@H](O)CN1CC[C@H]1C(=O)N 414ab2eb9b7d0ba78c1c0ca219577826 [0,1,0,1,0,0|2,0,0]=4 15281 B11R1.708 C[C@@H](O)CN1CC[C@H]1C(=O)O 8c07351d672644abd113d0ffe29e20f7 [0,1,0,1,0,0|1,0,0]=3 15282 B11R1.708 C[C@H](O)CN1CCC1C(=O)N 8a4b7da9b939aebd01498417508b4eea [0,1,0,1,0,0|2,0,0]=4 15283 B11R1.708 C[C@H](O)CN1CCC1C(=O)O 0f2f42e5752d355c1b067df75396ba28 [0,1,0,1,0,0|1,0,0]=3 15284 B11R1.708 C[C@H](O)CN1CC[C@@H]1C(=O)N d6e3f3bc4a0e487ea1892959725c89cb [0,1,0,1,0,0|2,0,0]=4 15285 B11R1.708 C[C@H](O)CN1CC[C@@H]1C(=O)O 1ae714ca719afdddb530d234549f6376 [0,1,0,1,0,0|1,0,0]=3 15286 B11R1.708 C[C@H](O)CN1CC[C@H]1C(=O)N e99b7d31ffc8c60481002a4b620904bf [0,1,0,1,0,0|2,0,0]=4 15287 B11R1.708 C[C@H](O)CN1CC[C@H]1C(=O)O f4cb6fd1d8dc9b51fcab60de38436cc9 [0,1,0,1,0,0|1,0,0]=3 15288 B11R1.708 O=C(O)C1CCN1CC(F)F 2328c47d973a74b8087f9480a285e560 [0,1,0,1,0,0|2,0,0]=4 15289 B11R1.708 O=C(O)[C@@H]1CCN1CC(F)F 29eb701ae88d86893626216399d6ee70 [0,1,0,1,0,0|2,0,0]=4 15290 B11R1.708 O=C(O)[C@H]1CCN1CC(F)F 081b3d57cfd0194c5ac2b7042934b5f4 [0,1,0,1,0,0|2,0,0]=4 15291 B11R1.711 C=C(C)CN[C@@H]1C[C@@H]1C(=O)O ea4f43ef48c64b81603bdc3598586285 [0,1,0,1,0,0|1,0,1]=4 15292 B11R1.711 C=C(C)CN[C@H]1C[C@@H]1C(=O)O cbf62c11a422e9bb24e6a5c056dac4d1 [0,1,0,1,0,0|1,0,1]=4 15293 B11R1.711 C=C(C)CN[C@H]1C[C@H]1C(=O)O 6dec316c910fb6fec3cf01acac7d1863 [0,1,0,1,0,0|1,0,1]=4 15294 B11R1.711 C=C(C)CO[C@@H]1C[C@@H]1C(=O)O 2b14d75cfe446610b7147a48453dce66 [0,1,0,1,0,0|1,0,1]=4 15295 B11R1.711 C=C(C)CO[C@H]1C[C@@H]1C(=O)O d1532ebc87b29caa70a53d9d95013a7c [0,1,0,1,0,0|1,0,1]=4 15296 B11R1.711 C=C(C)CO[C@H]1C[C@H]1C(=O)O c491f4d2c44af4bc24cb103d95208e17 [0,1,0,1,0,0|1,0,1]=4 15297 B11R1.711 CC(=O)CN[C@@H]1C[C@@H]1C(=O)O 5330b3b6f10bb7a9c14d7a45c84e2a8c [0,1,0,1,0,0|1,0,1]=4 15298 B11R1.711 CC(=O)CN[C@H]1C[C@@H]1C(=O)O 6b7e0096f890fb73eb9dc0e8e00d5d95 [0,1,0,1,0,0|1,0,1]=4 15299 B11R1.711 CC(=O)CN[C@H]1C[C@H]1C(=O)O 736b8d9783713792d007b25a149906f4 [0,1,0,1,0,0|1,0,1]=4 15300 B11R1.711 CC(=O)CO[C@@H]1C[C@@H]1C(=O)O 5665de289376f72c9614a368fe18f456 [0,1,0,1,0,0|1,0,1]=4 15301 B11R1.711 CC(=O)CO[C@H]1C[C@@H]1C(=O)O 7f4ef5afa671afab58db7d9c5efcbf3d [0,1,0,1,0,0|1,0,1]=4 15302 B11R1.711 CC(=O)CO[C@H]1C[C@H]1C(=O)O 8c84ed5d20d98a4a2be490f2558a7ccc [0,1,0,1,0,0|1,0,1]=4 15303 B11R1.711 CC(C)CN[C@@H]1C[C@@H]1C(=O)O 50b8b0ce44f207ae609f72b4738044bf [0,1,0,1,0,0|1,0,0]=3 15304 B11R1.711 CC(C)CN[C@H]1C[C@@H]1C(=O)O 64b5ac321d6ff15a902865822a1163b5 [0,1,0,1,0,0|1,0,0]=3 15305 B11R1.711 CC(C)CN[C@H]1C[C@H]1C(=O)O 03493500681fccd9154300e0f90a3afd [0,1,0,1,0,0|1,0,0]=3 15306 B11R1.711 CC(C)CO[C@@H]1C[C@@H]1C(=O)O 7e7d4e768c77b0a2b3195a90dc035db4 [0,1,0,1,0,0|1,0,0]=3 15307 B11R1.711 CC(C)CO[C@H]1C[C@@H]1C(=O)O 3dc310d99d5bf3503e9397063aed4da8 [0,1,0,1,0,0|1,0,0]=3 15308 B11R1.711 CC(C)CO[C@H]1C[C@H]1C(=O)O e2ede8bd5ae73eeff6d8c69922dda558 [0,1,0,1,0,0|1,0,0]=3 15309 B11R1.711 CC(C)NC[C@@H]1C[C@H]1C(=O)O f62453d04b9470d587a0f5aa3b25ab03 [0,1,0,1,0,0|1,0,0]=3 15310 B11R1.711 CC(C)OCC1CC1C(=O)O 04d0ec924eeead2a2c5084b33781201f [0,1,0,1,0,0|1,0,0]=3 15311 B11R1.711 CC(C)OC[C@@H]1C[C@H]1C(=O)O d6456dab925ffda2d5436b67ab43f738 [0,1,0,1,0,0|1,0,0]=3 15312 B11R1.711 CC(C)OC[C@H]1C[C@@H]1C(=O)O b5d5423517f91f5597f5f8786d2cc016 [0,1,0,1,0,0|1,0,0]=3 15313 B11R1.711 CC(C)OC[C@H]1C[C@H]1C(=O)O 10e94095f8bab444d5384eb292b70e46 [0,1,0,1,0,0|1,0,0]=3 15314 B11R1.711 CC(F)CO[C@@H]1C[C@@H]1C(=O)O 8eb56ab2144c9f9db2cf1a7aa8539a84 [0,1,0,1,0,0|1,0,0]=3 15315 B11R1.711 CC(F)CO[C@H]1C[C@@H]1C(=O)O f0d233a348ae18c972a7fdd7c1cda639 [0,1,0,1,0,0|1,0,0]=3 15316 B11R1.711 CC(F)CO[C@H]1C[C@H]1C(=O)O e35d287166b7a4ee7a3a80c8051f5a6b [0,1,0,1,0,0|1,0,0]=3 15317 B11R1.711 CC(O)CN[C@@H]1C[C@@H]1C(=O)O df3cfd880ea48f6252637f46242112e9 [0,1,0,1,0,0|1,0,0]=3 15318 B11R1.711 CC(O)CN[C@H]1C[C@@H]1C(=O)O 8d19102bc2fa704868db0e7826532769 [0,1,0,1,0,0|1,0,0]=3 15319 B11R1.711 CC(O)CN[C@H]1C[C@H]1C(=O)O 5e4188e0a0ea033963265da04bf11c52 [0,1,0,1,0,0|1,0,0]=3 15320 B11R1.711 CC(S)CO[C@@H]1C[C@@H]1C(=O)O 87e029d9060c3c45eb23ce0657e24cd6 [0,1,0,1,0,0|1,0,0]=3 15321 B11R1.711 CC(S)CO[C@H]1C[C@@H]1C(=O)O 27bbf32e490bd00ddea0a0d787cb28c7 [0,1,0,1,0,0|1,0,0]=3 15322 B11R1.711 CC(S)CO[C@H]1C[C@H]1C(=O)O 64f4f72a6f20ec8e6d4505bd24831326 [0,1,0,1,0,0|1,0,0]=3 15323 B11R1.711 C[C@@H](F)CO[C@@H]1C[C@@H]1C(=O)O 56badcca8f2fd8e4d1f52a2f962b7605 [0,1,0,1,0,0|1,0,0]=3 15324 B11R1.711 C[C@@H](F)CO[C@H]1C[C@@H]1C(=O)O cbf4ad45a7cb784f2f4b1d6848a8e74e [0,1,0,1,0,0|1,0,0]=3 15325 B11R1.711 C[C@@H](F)CO[C@H]1C[C@H]1C(=O)O faa80706c4aebb2dbf0f5ffb1810210b [0,1,0,1,0,0|1,0,0]=3 15326 B11R1.711 C[C@@H](O)CN[C@@H]1C[C@@H]1C(=O)O fcaa27cc1076a33129963992b38471af [0,1,0,1,0,0|1,0,0]=3 15327 B11R1.711 C[C@@H](O)CN[C@H]1C[C@@H]1C(=O)O f9a01b12a05423e9d69657125af39331 [0,1,0,1,0,0|1,0,0]=3 15328 B11R1.711 C[C@@H](O)CN[C@H]1C[C@H]1C(=O)O 0ad6c2bf68165c275759933f58bf79f4 [0,1,0,1,0,0|1,0,0]=3 15329 B11R1.711 C[C@H](F)CO[C@@H]1C[C@@H]1C(=O)O bda1ac53413cb54eaaa59423b619ab88 [0,1,0,1,0,0|1,0,0]=3 15330 B11R1.711 C[C@H](F)CO[C@H]1C[C@@H]1C(=O)O bb14cd063cda7f49626facc7922de1b6 [0,1,0,1,0,0|1,0,0]=3 15331 B11R1.711 C[C@H](F)CO[C@H]1C[C@H]1C(=O)O 90d649245d91d99abc2f93b038e375f5 [0,1,0,1,0,0|1,0,0]=3 15332 B11R1.711 C[C@H](O)CN[C@@H]1C[C@@H]1C(=O)O 9dfd0a1ddd2ed1243e10403ecd9d49d1 [0,1,0,1,0,0|1,0,0]=3 15333 B11R1.711 C[C@H](O)CN[C@H]1C[C@@H]1C(=O)O 4720e56e6973b34513c8b04b6a563c37 [0,1,0,1,0,0|1,0,0]=3 15334 B11R1.711 C[C@H](O)CN[C@H]1C[C@H]1C(=O)O 6089d5d76579f5d7431b1442200ca215 [0,1,0,1,0,0|1,0,0]=3 15335 B11R1.711 O=C(O)[C@@H]1C[C@@H]1NCC(F)F 69e6d621ffef57fc4933d19d97a13c57 [0,1,0,1,0,0|2,0,0]=4 15336 B11R1.711 O=C(O)[C@@H]1C[C@@H]1OCC(F)F 2bea07fd88860f59a5d5150e14dc06f4 [0,1,0,1,0,0|2,0,0]=4 15337 B11R1.711 O=C(O)[C@H]1C[C@@H]1NCC(F)F a47da8dad8813cd7cb08b506137902c0 [0,1,0,1,0,0|2,0,0]=4 15338 B11R1.711 O=C(O)[C@H]1C[C@@H]1OCC(F)F 40a88ce75e7214f5c29cc8a077c93e1f [0,1,0,1,0,0|2,0,0]=4 15339 B11R1.711 O=C(O)[C@H]1C[C@H]1NCC(F)F b2fdb2bd3408fb33c5a5c89c8ce70cf5 [0,1,0,1,0,0|2,0,0]=4 15340 B11R1.711 O=C(O)[C@H]1C[C@H]1OCC(F)F 30439062b6fa1907acdc52d7d005e96f [0,1,0,1,0,0|2,0,0]=4 15341 B11R1.922 CC1(CCC1OCC(=O)N)C 7b352c8b0ba38ad559fd4bac892be457 [0,1,0,1,0,0|2,0,0]=4 15342 B11R1.922 CC1(CCC1OCC(=O)O)C 23cb039e8e81ec4a0412527409122c49 [0,1,0,1,0,0|1,0,0]=3 15343 B11R1.922 CC1(OCC1NCC(=O)O)C 59759be4c68a748cd8758c0f885bb8c0 [0,1,0,1,0,0|2,0,0]=4 15344 B11R1.922 CC1(OCC1OCC(=O)O)C 738e1303b66886f2fcef6e177bdf32e4 [0,1,0,1,0,0|2,0,0]=4 15345 B11R1.922 O=C(O)COC1CCC1(F)F 17ed9ecd221229ed80470f9bb4ee2505 [0,1,0,1,0,0|2,0,0]=4 15346 B11R1.923 CC(=O)CCCN1CC1(C)C 3670151c39b3db727756fd52e7c1468f [0,1,0,1,0,0|2,0,0]=4 15347 B11R1.923 CC(=O)CCNC1CC1(C)C f9687f89c11ce63b65a90ff1bfe3ff31 [0,1,0,1,0,0|2,0,0]=4 15348 B11R1.923 CC(=O)CCN[C@@H]1CC1(C)C db54277a6f72066f51288bf59c80580b [0,1,0,1,0,0|2,0,0]=4 15349 B11R1.923 CC(=O)CCN[C@H]1CC1(C)C 139f79aaadaaaa7b5bdd6be5de0de531 [0,1,0,1,0,0|2,0,0]=4 15350 B11R1.923 CC(=O)CCOC1CC1(C)C ae75d2c8cecfa946334f87796e136753 [0,1,0,1,0,0|2,0,0]=4 15351 B11R1.923 CC1(CC1COCC(=O)N)C 58a55930712d2e0c514f28c31fb429f8 [0,1,0,1,0,0|2,0,0]=4 15352 B11R1.923 CC1(CC1COCC(=O)O)C 79fb3ba1c2c2d628e1bb816b76269df7 [0,1,0,1,0,0|1,0,0]=3 15353 B11R1.923 CC1(CC1NCCC(=O)N)C a46e6cf29d71eec2b0f9bcd45c39ce4a [0,1,0,1,0,0|2,0,0]=4 15354 B11R1.923 CC1(CC1NCCC(=O)O)C 6f57f2666e7bb4e2f7d161bcb68ce90c [0,1,0,1,0,0|1,0,0]=3 15355 B11R1.923 CC1(CC1NCCS(=O)O)C 61ce9a697c469f9d07e6a1f8a4f0c969 [0,1,0,1,0,0|2,0,0]=4 15356 B11R1.923 CC1(CC1OCCC(=O)N)C 3f4cd9a2821e42ac9c7f1e983ced5092 [0,1,0,1,0,0|2,0,0]=4 15357 B11R1.923 CC1(CC1OCCC(=O)O)C 7f23f91590c44f8f4b4ff5a1620c9d58 [0,1,0,1,0,0|1,0,0]=3 15358 B11R1.923 CC1(CN1CCCC(=O)N)C dc5912879c644ae4214345925b98ba8b [0,1,0,1,0,0|2,0,0]=4 15359 B11R1.923 CC1(CN1CCCC(=O)O)C 2952daf88b75fd996d55f4ad9fe19746 [0,1,0,1,0,0|1,0,0]=3 15360 B11R1.923 CC1(C[C@@H]1CNCC(=O)N)C c28f0e4d826b2df3f20b37bd2d494c56 [0,1,0,1,0,0|2,0,0]=4 15361 B11R1.923 CC1(C[C@@H]1CNCC(=O)O)C 4392f115b1d40bd4f7fde52b3a661e38 [0,1,0,1,0,0|1,0,0]=3 15362 B11R1.923 CC1(C[C@@H]1COCC(=O)N)C a322de4dbcd4cfb5b6dc293a5303f808 [0,1,0,1,0,0|2,0,0]=4 15363 B11R1.923 CC1(C[C@@H]1COCC(=O)O)C 16c40d84ceddeaf3dbb7228ebc6f18f7 [0,1,0,1,0,0|1,0,0]=3 15364 B11R1.923 CC1(C[C@@H]1NCCC(=O)N)C 36b75745cd028af608cac789ee1a1166 [0,1,0,1,0,0|2,0,0]=4 15365 B11R1.923 CC1(C[C@@H]1NCCC(=O)O)C bd556f83a38d21ca4dc3dd836582f269 [0,1,0,1,0,0|1,0,0]=3 15366 B11R1.923 CC1(C[C@H]1CNCC(=O)N)C f2684236d5ed3feee63a9abd89da3e19 [0,1,0,1,0,0|2,0,0]=4 15367 B11R1.923 CC1(C[C@H]1CNCC(=O)O)C 5c16323b42b56d53d98b9950e21d3160 [0,1,0,1,0,0|1,0,0]=3 15368 B11R1.923 CC1(C[C@H]1COCC(=O)N)C a42c0c19728535184b5ba182e1503492 [0,1,0,1,0,0|2,0,0]=4 15369 B11R1.923 CC1(C[C@H]1COCC(=O)O)C db822f5c2cbb207262d84f6ca4925658 [0,1,0,1,0,0|1,0,0]=3 15370 B11R1.923 CC1(C[C@H]1NCCC(=O)N)C 3effd03dc10c8c24c3ad1d70c25f61bd [0,1,0,1,0,0|2,0,0]=4 15371 B11R1.923 CC1(C[C@H]1NCCC(=O)O)C d8ba759f538a3846ff9cb4f262344a81 [0,1,0,1,0,0|1,0,0]=3 15372 B11R1.923 O=C(O)CCNC1CC1(F)F 9f9a7fc4b31f2c9bd5ab1fe1c8c7d2f1 [0,1,0,1,0,0|2,0,0]=4 15373 B11R1.923 O=C(O)CCOC1CC1(F)F dc6476375fec53296455124d3be27c52 [0,1,0,1,0,0|2,0,0]=4 15374 B11R1.923 O=C(O)CNCC1CC1(F)F 1c6bb07e48fb588e827347801b9784b2 [0,1,0,1,0,0|2,0,0]=4 15375 B11R1.923 O=C(O)CNC[C@H]1CC1(F)F 970305dc28f2d0610b87ad4c0ac9259f [0,1,0,1,0,0|2,0,0]=4 15376 B11R1.923 O=C(O)COCC1CC1(F)F f6ba68f4c22256133f3d9e7ddd8f9c22 [0,1,0,1,0,0|2,0,0]=4 15377 B11R1.923 O=C(O)COC[C@@H]1CC1(F)F d242fa4f5d022f3c1f80fa5de5dbbdaf [0,1,0,1,0,0|2,0,0]=4 15378 B11R1.923 O=C(O)COC[C@H]1CC1(F)F c64f61e84180648ac4927a1889ff428f [0,1,0,1,0,0|2,0,0]=4 15379 B11R2.167 CCN1CC2CC1C(=O)N2 a7169525e771127ccbdc0111139bcb56 [0,0,0,2,0,0|2,0,0]=4 15380 B11R2.167 CCN1C[C@@H]2C[C@H]1C(=O)N2 023d6de4c9c7d0431bb6e6eea8e3d723 [0,0,0,2,0,0|2,0,0]=4 15381 B11R2.167 CCN1C[C@H]2C[C@@H]1C(=O)N2 b4dfae78ac3f1e54fac638f8103aad4f [0,0,0,2,0,0|2,0,0]=4 15382 B11R2.824 CC(=O)N1C2CCC1CC2 03fa0afe35e2b1875ebccdc62e280ee5 [0,0,0,2,0,0|2,0,0]=4 15383 B11R2.824 CC(=O)N1[C@H]2CC[C@@H]1CC2 bb0824b30b24742919f8bc0e3edae056 [0,0,0,2,0,0|2,0,0]=4 15384 B11R2.860 NC(=O)CN1C2C1CCC2 3b47474411ebfdd191410570b68735bf [0,0,0,2,0,0|2,0,0]=4 15385 B11R2.860 O=C(O)CN1C2C1CCC2 c0fc82cf3662ea06a0ff8d5982dd3286 [0,0,0,2,0,0|1,0,0]=3 15386 B11R2.932 NC(=O)CN1CCC2C1C2 3815f2b03e3fb01cf99c2ca22a05e495 [0,0,0,2,0,0|2,0,0]=4 15387 B11R2.932 O=C(O)CN1CCC2C1C2 48ad542dcaee2147e97d4de3ec4b42d0 [0,0,0,2,0,0|1,0,0]=3 15388 B11R2.934 NC(=O)CN1CC2CC2C1 b8287f861652f7008ce866b483810b51 [0,0,0,2,0,0|2,0,0]=4 15389 B11R2.934 O=C(O)CN1CC2CC2C1 3467b00848314b6822feff70d781421a [0,0,0,2,0,0|1,0,0]=3 15390 B11R2.1852 CC(=O)N1C2C1CCCC2 1ac38bd168268a7b023f716d059aa634 [0,0,0,2,0,0|2,0,0]=4 15391 B11R2.138 CC1CC1NC2CC(=O)C2 17202ff4cfc5855b3c7a57d1d902c121 [0,0,0,2,0,0|2,0,0]=4 15392 B11R2.555 O=C1CC(C1)CNC2CC2 dbd9a5a7d37c56467bd4b315200b37ed [0,0,0,2,0,0|2,0,0]=4 15393 B11R2.555 O=C1CC(C1)COC2CC2 842732a2f450360b7900c8e4d2a1563b [0,0,0,2,0,0|2,0,0]=4 15394 B11R2.555 O=C1CC(C1)NCC2CC2 704ab2153f29b525d459954f300293ed [0,0,0,2,0,0|2,0,0]=4 15395 B11R2.555 O=C1CC(C1)OCC2CC2 b73ed7883bfaf2a4bdf799f50757d091 [0,0,0,2,0,0|2,0,0]=4 15396 B11R2.555 O=C1CC(N1)CNC2CC2 17e86cd835e3f1c9967b95f67600a44f [0,0,0,2,0,0|2,0,0]=4 15397 B11R2.555 O=C1CC(N1)COC2CC2 26c23aba69789635286e68529a2df61a [0,0,0,2,0,0|2,0,0]=4 15398 B11R2.555 O=C1CC(O1)CNC2CC2 9a73cf26f8396a7b287974e036b4c578 [0,0,0,2,0,0|1,0,0]=3 15399 B11R2.555 O=C1CC(O1)COC2CC2 4e3ca898c66fdca3defc383189daac76 [0,0,0,2,0,0|1,0,0]=3 15400 B11R2.555 O=C1C[C@@H](N1)COC2CC2 15b1cede922e1fbd02d40ff8879de75e [0,0,0,2,0,0|2,0,0]=4 15401 B11R2.555 O=C1C[C@H](N1)COC2CC2 524a3e5967f0f5f6740bd23088d839fb [0,0,0,2,0,0|2,0,0]=4 15402 B11R2.782 O=C1CC(C1)CN2CCC2 b231eb906e2253bb5bd59e8eb0ddffd8 [0,0,0,2,0,0|2,0,0]=4 15403 B11R2.782 O=C1CC(N1)CN2CCC2 a44c1bc943c37203a50ba1b6bf2399db [0,0,0,2,0,0|2,0,0]=4 15404 B11R2.782 O=C1CC(O1)CN2CCC2 bca70177c1471aac2630b180fa737a42 [0,0,0,2,0,0|1,0,0]=3 15405 B11R2.845 CC(=O)N1CC2CCC1C2 385da044f803c3658eaf6205f7c45b18 [0,0,0,2,0,0|2,0,0]=4 15406 B11R2.845 CC(=O)N1C[C@@H]2CC[C@H]1C2 091d1dc4f2ba9af11a5947aacab8edb2 [0,0,0,2,0,0|2,0,0]=4 15407 B11R2.845 CC(=O)N1C[C@H]2CC[C@@H]1C2 049c179e37bf694487eaee700ba6c76d [0,0,0,2,0,0|2,0,0]=4 15408 B11R2.814 CC(=O)N1CC2C1CCC2 b66cf4cc41f614540ee6f24fdee08dfd [0,0,0,2,0,0|2,0,0]=4 15409 B11R2.814 CC(=O)N1C[C@H]2[C@@H]1CCC2 f5a3d79dc235cd39c2fa6c2c93ea603f [0,0,0,2,0,0|2,0,0]=4 15410 B11R2.855 NC(=O)CN1CC2CC1C2 5a0e95f5c3929d8239fb16181c666e03 [0,0,0,2,0,0|2,0,0]=4 15411 B11R2.855 O=C(O)CN1CC2CC1C2 fc9ddbe94b0e13775ed9b81fbbc1934c [0,0,0,2,0,0|1,0,0]=3 15412 B11R2.839 CC(=O)N1CCC2CC2C1 e08f204b16cf8f8250d1dacf3d1f81a6 [0,0,0,2,0,0|2,0,0]=4 15413 B11R2.842 CC(=O)N1CC2CCC2C1 7eb2171ce43333196f6381ab44e5d4e9 [0,0,0,2,0,0|2,0,0]=4 15414 B11R2.817 O=C(O)[C@@H]1C[C@@H]1NC2CC2 e2afeab770a32f32729c44b06dfe1f2f [0,0,0,2,0,0|1,0,0]=3 15415 B11R2.817 O=C(O)[C@@H]1C[C@@H]1OC2CC2 a2d48bb7464dfdf1b649ec51e2332bec [0,0,0,2,0,0|1,0,0]=3 15416 B11R2.817 O=C(O)[C@H]1C[C@@H]1NC2CC2 8b16a77a7a240edca3b6f6a00f9f9862 [0,0,0,2,0,0|1,0,0]=3 15417 B11R2.817 O=C(O)[C@H]1C[C@@H]1OC2CC2 269783911fd73fcefd4a704eb88dc990 [0,0,0,2,0,0|1,0,0]=3 15418 B11R2.817 O=C(O)[C@H]1C[C@H]1NC2CC2 730d5f9c2ff93f5ea7d8724097f1031e [0,0,0,2,0,0|1,0,0]=3 15419 B11R2.817 O=C(O)[C@H]1C[C@H]1OC2CC2 9b05e555e157a56be5c848a2d7570ca6 [0,0,0,2,0,0|1,0,0]=3 15420 B11R2.1836 O=C(O)[C@@H]1C[C@@H]1N2CCC2 e597dc43a3d8fdf7fcd5b3b0a7b590d4 [0,0,0,2,0,0|1,0,0]=3 15421 B11R2.1836 O=C(O)[C@H]1C[C@@H]1N2CCC2 c8d5484cb9d37eaf3829d85408064405 [0,0,0,2,0,0|1,0,0]=3 15422 B11R2.1836 O=C(O)[C@H]1C[C@H]1N2CCC2 c1f696b6427be941916bf993c0dcd7f2 [0,0,0,2,0,0|1,0,0]=3